data_r5lg1sf
# 
_audit.revision_id     1_0 
_audit.creation_date   2016-12-14 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      5lg1 
_cell.length_a      73.2936 
_cell.length_b      81.9337 
_cell.length_c      103.8835 
_cell.angle_alpha   90.0000 
_cell.angle_beta    90.0000 
_cell.angle_gamma   90.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97625 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   2.700 
_diffrn_reflns.pdbx_d_res_low    64.332 
_diffrn_reflns.limit_h_max       27 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       30 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       38 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            17753 
_diffrn_reflns.pdbx_number_obs   17709 
# 
_entry.id   5lg1 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               5lg1 
_symmetry.space_group_name_H-M   "P 21 21 21" 
_symmetry.Int_Tables_number      19 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 "X,  Y,  Z"           
2 "X+1/2,  -Y+1/2,  -Z" 
3 "-X,  Y+1/2,  -Z+1/2" 
4 "-X+1/2,  -Y,  Z+1/2" 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.intensity_meas 
_refln.intensity_sigma 
_refln.pdbx_I_plus 
_refln.pdbx_I_plus_sigma 
_refln.pdbx_I_minus 
_refln.pdbx_I_minus_sigma 
_refln.pdbx_F_plus 
_refln.pdbx_F_plus_sigma 
_refln.pdbx_F_minus 
_refln.pdbx_F_minus_sigma 
_refln.pdbx_anom_difference 
_refln.pdbx_anom_difference_sigma 
1 1 1 0  0  2  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 0  0  4  o 586.7715 13.86705  229.8954       10.82875      229.8954       10.82875      229.8954       10.82875      586.7715 13.86705  586.7715 13.86705  0.000000       0.000000  
1 1 1 0  0  6  o 631.4697 13.68362  266.1811       11.50182      266.1811       11.50182      266.1811       11.50182      631.4697 13.68362  631.4697 13.68362  0.000000       0.000000  
1 1 1 0  0  8  o 1004.969 18.74588  674.2388       25.08366      674.2388       25.08366      674.2388       25.08366      1004.969 18.74588  1004.969 18.74588  0.000000       0.000000  
1 1 1 0  0  10 o 584.9066 13.40409  228.4104       10.43475      228.4104       10.43475      228.4104       10.43475      584.9066 13.40409  584.9066 13.40409  -0.000000      0.000000  
1 1 1 0  0  12 o 759.6915 16.28020  385.3915       16.46342      385.3915       16.46342      385.3915       16.46342      759.6915 16.28020  759.6915 16.28020  -0.000000      0.000000  
1 1 1 0  0  14 o 525.7753 13.59787  184.7069       9.512348      184.7069       9.512348      184.7069       9.512348      525.7753 13.59787  525.7753 13.59787  0.000000       0.000000  
1 1 1 0  0  16 o 464.5629 13.54047  144.3310       8.365959      144.3310       8.365959      144.3310       8.365959      464.5629 13.54047  464.5629 13.54047  0.000000       0.000000  
1 1 1 0  0  18 o 589.5650 20.33398  233.1334       15.93139      233.1334       15.93139      233.1334       15.93139      589.5650 20.33398  589.5650 20.33398  -0.000000      0.000000  
1 1 1 0  0  20 o 74.52467 13.07189  4.028203       1.178751      4.028203       1.178751      4.028203       1.178751      74.52467 13.07189  74.52467 13.07189  0.000000       0.000000  
1 1 1 0  0  22 f 539.0083 16.49311  194.4711       11.82087      194.4711       11.82087      194.4711       11.82087      539.0083 16.49311  539.0083 16.49311  0.000000       0.000000  
1 1 1 0  0  24 o 182.1851 11.99664  22.42819       2.882977      22.42819       2.882977      22.42819       2.882977      182.1851 11.99664  182.1851 11.99664  -0.000000      0.000000  
1 1 1 0  0  26 o 92.38140 12.45212  6.000129       1.454572      6.000129       1.454572      6.000129       1.454572      92.38140 12.45212  92.38140 12.45212  0.000000       0.000000  
1 1 1 0  0  28 o 273.8414 12.14670  50.43404       4.412416      50.43404       4.412416      50.43404       4.412416      273.8414 12.14670  273.8414 12.14670  -0.000000      0.000000  
1 1 1 0  0  30 o 57.85385 7.554974  2.345629       0.5549678     2.345629       0.5549678     2.345629       0.5549678     57.85385 7.554974  57.85385 7.554974  0.000000       0.000000  
1 1 1 0  0  32 o 53.29641 11.00680  2.127677       0.6901081     2.127677       0.6901081     2.127677       0.6901081     53.29641 11.00680  53.29641 11.00680  -0.000000      0.000000  
1 1 1 0  0  34 o 56.78733 8.895190  2.316435       0.6238386     2.316435       0.6238386     2.316435       0.6238386     56.78733 8.895190  56.78733 8.895190  0.000000       0.000000  
1 1 1 0  0  36 o 66.77489 34.27045  5.363693       3.876001      5.363693       3.876001      5.363693       3.876001      66.77489 34.27045  66.77489 34.27045  -0.000000      0.000000  
1 1 1 0  0  38 o 58.47863 36.65177  4.526596       5.915590      4.526596       5.915590      4.526596       5.915590      58.47863 36.65177  58.47863 36.65177  0.000000       0.000000  
1 1 1 0  1  1  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 0  1  2  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 0  1  3  o 672.4359 23.14334  303.1878       20.68147      303.1878       20.68147      303.1878       20.68147      672.4359 23.14334  672.4359 23.14334  0.000000       0.000000  
1 1 1 0  1  4  o 601.5332 9.011462  241.3476       7.219526      241.3476       7.219526      241.3476       7.219526      601.5332 9.011462  601.5332 9.011462  0.000000       0.000000  
1 1 1 0  1  5  o 12.26784 6.411506  0.1455182      0.1373528     0.1455182      0.1373528     0.1455182      0.1373528     12.26784 6.411506  12.26784 6.411506  0.000000       0.000000  
1 1 1 0  1  6  o 843.5201 11.12666  474.6235       12.50154      474.6235       12.50154      474.6235       12.50154      843.5201 11.12666  843.5201 11.12666  -0.000000      0.000000  
1 1 1 0  1  7  o 962.4924 12.59823  618.0623       16.15150      618.0623       16.15150      618.0623       16.15150      962.4924 12.59823  962.4924 12.59823  -0.000000      0.000000  
1 1 1 0  1  8  o 554.3434 7.593982  204.9185       5.607100      204.9185       5.607100      204.9185       5.607100      554.3434 7.593982  554.3434 7.593982  -0.000000      0.000000  
1 1 1 0  1  9  o 934.2681 10.36024  582.1042       12.89421      582.1042       12.89421      582.1042       12.89421      934.2681 10.36024  934.2681 10.36024  -0.000000      0.000000  
1 1 1 0  1  10 o 80.02188 5.213760  4.321123       0.5504588     4.321123       0.5504588     4.321123       0.5504588     80.02188 5.213760  80.02188 5.213760  -0.000000      0.000000  
1 1 1 0  1  11 o 691.3982 10.58890  318.9347       9.750414      318.9347       9.750414      318.9347       9.750414      691.3982 10.58890  691.3982 10.58890  0.000000       0.000000  
1 1 1 0  1  12 o 238.3024 6.317844  37.92554       2.002998      37.92554       2.002998      37.92554       2.002998      238.3024 6.317844  238.3024 6.317844  0.000000       0.000000  
1 1 1 0  1  13 o 932.4424 14.90129  580.7304       18.50416      580.7304       18.50416      580.7304       18.50416      932.4424 14.90129  932.4424 14.90129  -0.000000      0.000000  
1 1 1 0  1  14 o 239.5168 6.471394  38.32072       2.062006      38.32072       2.062006      38.32072       2.062006      239.5168 6.471394  239.5168 6.471394  0.000000       0.000000  
1 1 1 0  1  15 o 548.2331 9.283110  200.6225       6.777217      200.6225       6.777217      200.6225       6.777217      548.2331 9.283110  548.2331 9.283110  -0.000000      0.000000  
1 1 1 0  1  16 o 424.5745 8.404081  120.3561       4.750437      120.3561       4.750437      120.3561       4.750437      424.5745 8.404081  424.5745 8.404081  -0.000000      0.000000  
1 1 1 0  1  17 o 271.6505 7.937837  49.33694       2.867780      49.33694       2.867780      49.33694       2.867780      271.6505 7.937837  271.6505 7.937837  -0.000000      0.000000  
1 1 1 0  1  18 o 334.6115 8.202020  74.80820       3.652122      74.80820       3.652122      74.80820       3.652122      334.6115 8.202020  334.6115 8.202020  0.000000       0.000000  
1 1 1 0  1  19 o 40.58698 3.982507  1.129140       0.2102917     1.129140       0.2102917     1.129140       0.2102917     40.58698 3.982507  40.58698 3.982507  0.000000       0.000000  
1 1 1 0  1  20 o 545.3514 12.13739  198.8562       8.810271      198.8562       8.810271      198.8562       8.810271      545.3514 12.13739  545.3514 12.13739  -0.000000      0.000000  
1 1 1 0  1  21 o 11.35351 8.267107  -1.631884      0.7238714     -1.631884      0.7238714     -1.631884      0.7238714     11.35351 8.267107  11.35351 8.267107  -0.000000      0.000000  
1 1 1 0  1  22 o 511.1059 12.47130  174.7277       8.482264      174.7277       8.482264      174.7277       8.482264      511.1059 12.47130  511.1059 12.47130  0.000000       0.000000  
1 1 1 0  1  23 o 104.7571 5.745560  7.380921       0.7964750     7.380921       0.7964750     7.380921       0.7964750     104.7571 5.745560  104.7571 5.745560  -0.000000      0.000000  
1 1 1 0  1  24 o 579.5734 17.26110  225.5829       13.30385      225.5829       13.30385      225.5829       13.30385      579.5734 17.26110  579.5734 17.26110  -0.000000      0.000000  
1 1 1 0  1  25 f 24.80914 13.35110  0.5854391      0.6102511     0.5854391      0.6102511     0.5854391      0.6102511     24.80914 13.35110  24.80914 13.35110  -0.000000      0.000000  
1 1 1 0  1  26 o 12.05295 8.364318  -0.4087693     0.4688613     -0.4087693     0.4688613     -0.4087693     0.4688613     12.05295 8.364318  12.05295 8.364318  -0.000000      0.000000  
1 1 1 0  1  27 o 28.26612 11.95611  0.7568419      0.4552113     0.7568419      0.4552113     0.7568419      0.4552113     28.26612 11.95611  28.26612 11.95611  0.000000       0.000000  
1 1 1 0  1  28 o 27.97513 11.55303  0.7347125      0.4271705     0.7347125      0.4271705     0.7347125      0.4271705     27.97513 11.55303  27.97513 11.55303  -0.000000      0.000000  
1 1 1 0  1  29 o 135.0097 10.41641  12.43674       1.847611      12.43674       1.847611      12.43674       1.847611      135.0097 10.41641  135.0097 10.41641  -0.000000      0.000000  
1 1 1 0  1  30 o 127.5967 9.960443  11.11907       1.669132      11.11907       1.669132      11.11907       1.669132      127.5967 9.960443  127.5967 9.960443  0.000000       0.000000  
1 1 1 0  1  31 o 140.1692 10.25239  13.41860       1.890876      13.41860       1.890876      13.41860       1.890876      140.1692 10.25239  140.1692 10.25239  -0.000000      0.000000  
1 1 1 0  1  32 o 42.35514 18.13064  1.748639       1.044846      1.748639       1.044846      1.748639       1.044846      42.35514 18.13064  42.35514 18.13064  -0.000000      0.000000  
1 1 1 0  1  33 o 65.39958 14.34134  3.299149       1.094085      3.299149       1.094085      3.299149       1.094085      65.39958 14.34134  65.39958 14.34134  -0.000000      0.000000  
1 1 1 0  1  34 o 93.18125 9.479252  6.069664       1.146792      6.069664       1.146792      6.069664       1.146792      93.18125 9.479252  93.18125 9.479252  -0.000000      0.000000  
1 1 1 0  1  35 o 70.13229 28.65197  5.340133       2.634707      5.340133       2.634707      5.340133       2.634707      70.13229 28.65197  70.13229 28.65197  -0.000000      0.000000  
1 1 1 0  1  36 o 11.53981 8.476777  -2.354427      0.8810030     -2.354427      0.8810030     -2.354427      0.8810030     11.53981 8.476777  11.53981 8.476777  0.000000       0.000000  
1 1 1 0  1  37 o 64.12153 9.245811  2.994337       0.7423053     2.994337       0.7423053     2.994337       0.7423053     64.12153 9.245811  64.12153 9.245811  0.000000       0.000000  
1 1 1 0  1  38 o 59.84649 9.850044  2.671741       0.7216254     2.671741       0.7216254     2.671741       0.7216254     59.84649 9.850044  59.84649 9.850044  0.000000       0.000000  
1 1 1 0  2  0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 0  2  1  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 0  2  2  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 0  2  3  o 529.3658 11.19150  187.0794       7.886413      187.0794       7.886413      187.0794       7.886413      529.3658 11.19150  529.3658 11.19150  0.000000       0.000000  
1 1 1 0  2  4  o 558.4786 9.030984  208.0587       6.716748      208.0587       6.716748      208.0587       6.716748      558.4786 9.030984  558.4786 9.030984  0.000000       0.000000  
1 1 1 0  2  5  o 1109.605 18.05327  822.3954       26.67711      822.3954       26.67711      822.3954       26.67711      1109.605 18.05327  1109.605 18.05327  0.000000       0.000000  
1 1 1 0  2  6  o 971.8939 16.04030  630.7165       20.76052      630.7165       20.76052      630.7165       20.76052      971.8939 16.04030  971.8939 16.04030  -0.000000      0.000000  
1 1 1 0  2  7  o 762.1073 11.70395  387.5278       11.87931      387.5278       11.87931      387.5278       11.87931      762.1073 11.70395  762.1073 11.70395  -0.000000      0.000000  
1 1 1 0  2  8  o 124.1829 3.680024  10.30245       0.6077452     10.30245       0.6077452     10.30245       0.6077452     124.1829 3.680024  124.1829 3.680024  -0.000000      0.000000  
1 1 1 0  2  9  o 587.7736 8.631042  230.4203       6.756718      230.4203       6.756718      230.4203       6.756718      587.7736 8.631042  587.7736 8.631042  -0.000000      0.000000  
1 1 1 0  2  10 o 578.1055 7.673678  222.8602       5.908969      222.8602       5.908969      222.8602       5.908969      578.1055 7.673678  578.1055 7.673678  0.000000       0.000000  
1 1 1 0  2  11 o 285.0070 5.937445  54.20186       2.252698      54.20186       2.252698      54.20186       2.252698      285.0070 5.937445  285.0070 5.937445  0.000000       0.000000  
1 1 1 0  2  12 o 446.5142 8.515691  133.0473       5.062584      133.0473       5.062584      133.0473       5.062584      446.5142 8.515691  446.5142 8.515691  0.000000       0.000000  
1 1 1 0  2  13 o 272.6132 6.863056  49.62792       2.489520      49.62792       2.489520      49.62792       2.489520      272.6132 6.863056  272.6132 6.863056  -0.000000      0.000000  
1 1 1 0  2  14 o 192.5633 5.943816  24.78424       1.521857      24.78424       1.521857      24.78424       1.521857      192.5633 5.943816  192.5633 5.943816  -0.000000      0.000000  
1 1 1 0  2  15 o 100.2144 7.959605  6.821898       1.047026      6.821898       1.047026      6.821898       1.047026      100.2144 7.959605  100.2144 7.959605  0.000000       0.000000  
1 1 1 0  2  16 o 30.16710 15.36062  0.8915120      0.7749670     0.8915120      0.7749670     0.8915120      0.7749670     30.16710 15.36062  30.16710 15.36062  -0.000000      0.000000  
1 1 1 0  2  17 f 335.1247 9.122355  75.08418       4.066856      75.08418       4.066856      75.08418       4.066856      335.1247 9.122355  335.1247 9.122355  0.000000       0.000000  
1 1 1 0  2  18 o 246.0612 8.169106  40.51322       2.671800      40.51322       2.671800      40.51322       2.671800      246.0612 8.169106  246.0612 8.169106  -0.000000      0.000000  
1 1 1 0  2  19 o 244.7633 10.82953  40.21762       3.516290      40.21762       3.516290      40.21762       3.516290      244.7633 10.82953  244.7633 10.82953  -0.000000      0.000000  
1 1 1 0  2  20 f 470.3555 11.04676  147.8953       6.915018      147.8953       6.915018      147.8953       6.915018      470.3555 11.04676  470.3555 11.04676  -0.000000      0.000000  
1 1 1 0  2  21 o 363.2191 10.53190  88.25121       5.087699      88.25121       5.087699      88.25121       5.087699      363.2191 10.53190  363.2191 10.53190  0.000000       0.000000  
1 1 1 0  2  22 o 124.2827 12.48550  10.62021       2.016142      10.62021       2.016142      10.62021       2.016142      124.2827 12.48550  124.2827 12.48550  0.000000       0.000000  
1 1 1 0  2  23 o 224.1408 11.35647  33.79425       3.371887      33.79425       3.371887      33.79425       3.371887      224.1408 11.35647  224.1408 11.35647  -0.000000      0.000000  
1 1 1 0  2  24 o 61.55577 20.74518  3.271814       1.520552      3.271814       1.520552      3.271814       1.520552      61.55577 20.74518  61.55577 20.74518  -0.000000      0.000000  
1 1 1 0  2  25 o 267.2722 13.53138  48.16098       4.790807      48.16098       4.790807      48.16098       4.790807      267.2722 13.53138  267.2722 13.53138  -0.000000      0.000000  
1 1 1 0  2  26 o 79.70535 21.62406  5.108803       1.984866      5.108803       1.984866      5.108803       1.984866      79.70535 21.62406  79.70535 21.62406  -0.000000      0.000000  
1 1 1 0  2  27 o 133.2840 24.21648  13.16864       3.880467      13.16864       3.880467      13.16864       3.880467      133.2840 24.21648  133.2840 24.21648  0.000000       0.000000  
1 1 1 0  2  28 o 91.81145 25.15798  6.871014       2.660775      6.871014       2.660775      6.871014       2.660775      91.81145 25.15798  91.81145 25.15798  0.000000       0.000000  
1 1 1 0  2  29 o 37.86332 22.37282  1.147093       1.938081      1.147093       1.938081      1.147093       1.938081      37.86332 22.37282  37.86332 22.37282  0.000000       0.000000  
1 1 1 0  2  30 o 15.95110 11.05464  -0.6755291     0.8119378     -0.6755291     0.8119378     -0.6755291     0.8119378     15.95110 11.05464  15.95110 11.05464  -0.000000      0.000000  
1 1 1 0  2  31 o 9.465746 6.968395  -1.827797      0.6216199     -1.827797      0.6216199     -1.827797      0.6216199     9.465746 6.968395  9.465746 6.968395  -0.000000      0.000000  
1 1 1 0  2  32 o 23.27271 14.60147  0.2201640      0.9414657     0.2201640      0.9414657     0.2201640      0.9414657     23.27271 14.60147  23.27271 14.60147  -0.000000      0.000000  
1 1 1 0  2  33 o 198.8777 10.59914  27.05134       2.790524      27.05134       2.790524      27.05134       2.790524      198.8777 10.59914  198.8777 10.59914  -0.000000      0.000000  
1 1 1 0  2  34 o 48.72903 18.26753  2.232947       1.106906      2.232947       1.106906      2.232947       1.106906      48.72903 18.26753  48.72903 18.26753  -0.000000      0.000000  
1 1 1 0  2  35 o 34.84974 23.48198  -0.3180597     3.139315      -0.3180597     3.139315      -0.3180597     3.139315      34.84974 23.48198  34.84974 23.48198  0.000000       0.000000  
1 1 1 0  2  36 o 60.33564 18.14869  3.221810       1.271526      3.221810       1.271526      3.221810       1.271526      60.33564 18.14869  60.33564 18.14869  0.000000       0.000000  
1 1 1 0  2  37 o 17.15563 12.19391  -1.422384      1.195867      -1.422384      1.195867      -1.422384      1.195867      17.15563 12.19391  17.15563 12.19391  -0.000000      0.000000  
1 1 1 0  2  38 o 13.71696 9.964169  -1.976725      1.016275      -1.976725      1.016275      -1.976725      1.016275      13.71696 9.964169  13.71696 9.964169  -0.000000      0.000000  
1 1 1 0  3  1  o 140.4244 2.078650  13.14692       0.3887613     13.14692       0.3887613     13.14692       0.3887613     140.4244 2.078650  140.4244 2.078650  0.000000       0.000000  
1 1 1 0  3  2  o 1875.170 18.32343  2347.599       45.77490      2347.599       45.77490      2347.599       45.77490      1875.170 18.32343  1875.170 18.32343  -0.000000      0.000000  
1 1 1 0  3  3  o 658.0891 15.96386  289.4444       13.98036      289.4444       13.98036      289.4444       13.98036      658.0891 15.96386  658.0891 15.96386  0.000000       0.000000  
1 1 1 0  3  4  o 171.2810 7.107604  19.65221       1.615840      19.65221       1.615840      19.65221       1.615840      171.2810 7.107604  171.2810 7.107604  -0.000000      0.000000  
1 1 1 0  3  5  o 1195.585 22.57869  955.9796       35.94207      955.9796       35.94207      955.9796       35.94207      1195.585 22.57869  1195.585 22.57869  -0.000000      0.000000  
1 1 1 0  3  6  o 364.7465 7.661149  88.78431       3.719854      88.78431       3.719854      88.78431       3.719854      364.7465 7.661149  364.7465 7.661149  -0.000000      0.000000  
1 1 1 0  3  7  o 154.1669 7.115948  15.94057       1.454716      15.94057       1.454716      15.94057       1.454716      154.1669 7.115948  154.1669 7.115948  -0.000000      0.000000  
1 1 1 0  3  8  o 748.5928 11.88717  373.9342       11.85088      373.9342       11.85088      373.9342       11.85088      748.5928 11.88717  748.5928 11.88717  0.000000       0.000000  
1 1 1 0  3  9  o 261.0642 5.558909  45.47801       1.931816      45.47801       1.931816      45.47801       1.931816      261.0642 5.558909  261.0642 5.558909  -0.000000      0.000000  
1 1 1 0  3  10 o 22.49578 11.84836  0.4874914      0.4718373     0.4874914      0.4718373     0.4874914      0.4718373     22.49578 11.84836  22.49578 11.84836  -0.000000      0.000000  
1 1 1 0  3  11 o 97.27421 2.133845  6.313612       0.2762880     6.313612       0.2762880     6.313612       0.2762880     97.27421 2.133845  97.27421 2.133845  -0.000000      0.000000  
1 1 1 0  3  12 o 403.6435 6.811647  108.6817       3.661379      108.6817       3.661379      108.6817       3.661379      403.6435 6.811647  403.6435 6.811647  0.000000       0.000000  
1 1 1 0  3  13 o 343.7783 7.658590  78.89719       3.504402      78.89719       3.504402      78.89719       3.504402      343.7783 7.658590  343.7783 7.658590  0.000000       0.000000  
1 1 1 0  3  14 o 193.4539 6.563997  25.03129       1.687654      25.03129       1.687654      25.03129       1.687654      193.4539 6.563997  193.4539 6.563997  0.000000       0.000000  
1 1 1 0  3  15 o 334.9647 8.355506  74.95865       3.724211      74.95865       3.724211      74.95865       3.724211      334.9647 8.355506  334.9647 8.355506  -0.000000      0.000000  
1 1 1 0  3  16 o 484.0496 10.46825  156.5663       6.744949      156.5663       6.744949      156.5663       6.744949      484.0496 10.46825  484.0496 10.46825  0.000000       0.000000  
1 1 1 0  3  17 o 314.0214 8.226432  65.90068       3.436926      65.90068       3.436926      65.90068       3.436926      314.0214 8.226432  314.0214 8.226432  0.000000       0.000000  
1 1 1 0  3  18 o 312.5853 10.58951  65.43297       4.399319      65.43297       4.399319      65.43297       4.399319      312.5853 10.58951  312.5853 10.58951  -0.000000      0.000000  
1 1 1 0  3  19 o 346.4900 13.66889  80.57726       6.288635      80.57726       6.288635      80.57726       6.288635      346.4900 13.66889  346.4900 13.66889  0.000000       0.000000  
1 1 1 0  3  20 f 770.6282 14.61203  397.2662       14.99259      397.2662       14.99259      397.2662       14.99259      770.6282 14.61203  770.6282 14.61203  0.000000       0.000000  
1 1 1 0  3  21 o 92.95417 23.74790  6.801474       2.542591      6.801474       2.542591      6.801474       2.542591      92.95417 23.74790  92.95417 23.74790  0.000000       0.000000  
1 1 1 0  3  22 o 548.0564 19.23014  201.8832       14.00444      201.8832       14.00444      201.8832       14.00444      548.0564 19.23014  548.0564 19.23014  -0.000000      0.000000  
1 1 1 0  3  23 o 178.0677 15.55224  21.68223       3.622669      21.68223       3.622669      21.68223       3.622669      178.0677 15.55224  178.0677 15.55224  -0.000000      0.000000  
1 1 1 0  3  24 o 36.47815 23.74887  -0.2180284     2.790347      -0.2180284     2.790347      -0.2180284     2.790347      36.47815 23.74887  36.47815 23.74887  0.000000       0.000000  
1 1 1 0  3  25 o 233.5524 20.68344  37.55412       6.315526      37.55412       6.315526      37.55412       6.315526      233.5524 20.68344  233.5524 20.68344  -0.000000      0.000000  
1 1 1 0  3  26 o 113.6176 24.91015  9.872747       3.301556      9.872747       3.301556      9.872747       3.301556      113.6176 24.91015  113.6176 24.91015  0.000000       0.000000  
1 1 1 0  3  27 o 44.52400 29.84388  -1.558248      4.949396      -1.558248      4.949396      -1.558248      4.949396      44.52400 29.84388  44.52400 29.84388  -0.000000      0.000000  
1 1 1 0  3  28 o 32.71129 21.59415  -0.4418269     2.429651      -0.4418269     2.429651      -0.4418269     2.429651      32.71129 21.59415  32.71129 21.59415  -0.000000      0.000000  
1 1 1 0  3  29 o 74.42960 27.01923  5.047436       2.462393      5.047436       2.462393      5.047436       2.462393      74.42960 27.01923  74.42960 27.01923  -0.000000      0.000000  
1 1 1 0  3  30 o 137.9353 18.47634  13.63178       3.225259      13.63178       3.225259      13.63178       3.225259      137.9353 18.47634  137.9353 18.47634  -0.000000      0.000000  
1 1 1 0  3  31 o 76.79596 26.03092  5.279255       2.384670      5.279255       2.384670      5.279255       2.384670      76.79596 26.03092  76.79596 26.03092  0.000000       0.000000  
1 1 1 0  3  32 o 33.09879 20.96293  0.4327870      1.991754      0.4327870      1.991754      0.4327870      1.991754      33.09879 20.96293  33.09879 20.96293  0.000000       0.000000  
1 1 1 0  3  33 o 70.48267 18.13515  4.036824       1.471991      4.036824       1.471991      4.036824       1.471991      70.48267 18.13515  70.48267 18.13515  0.000000       0.000000  
1 1 1 0  3  34 o 45.68385 21.02823  2.195781       1.403943      2.195781       1.403943      2.195781       1.403943      45.68385 21.02823  45.68385 21.02823  0.000000       0.000000  
1 1 1 0  3  35 o 28.92341 19.90394  -1.133821      2.520855      -1.133821      2.520855      -1.133821      2.520855      28.92341 19.90394  28.92341 19.90394  -0.000000      0.000000  
1 1 1 0  3  36 o 25.07204 15.44944  0.4538655      1.007328      0.4538655      1.007328      0.4538655      1.007328      25.07204 15.44944  25.07204 15.44944  0.000000       0.000000  
1 1 1 0  3  37 o 45.45252 16.86680  1.996588       0.9484405     1.996588       0.9484405     1.996588       0.9484405     45.45252 16.86680  45.45252 16.86680  0.000000       0.000000  
1 1 1 0  3  38 f 17.36103 11.61483  -0.1671173     0.7433265     -0.1671173     0.7433265     -0.1671173     0.7433265     17.36103 11.61483  17.36103 11.61483  -0.000000      0.000000  
1 1 1 0  4  0  f 224.5187 6.741375  33.68003       2.012736      33.68003       2.012736      33.68003       2.012736      224.5187 6.741375  224.5187 6.741375  0.000000       0.000000  
1 1 1 0  4  1  o 349.9901 4.700533  81.66591       2.191290      81.66591       2.191290      81.66591       2.191290      349.9901 4.700533  349.9901 4.700533  -0.000000      0.000000  
1 1 1 0  4  2  o 551.5764 8.497552  202.9225       6.242242      202.9225       6.242242      202.9225       6.242242      551.5764 8.497552  551.5764 8.497552  -0.000000      0.000000  
1 1 1 0  4  3  o 374.5022 5.076657  93.50849       2.532362      93.50849       2.532362      93.50849       2.532362      374.5022 5.076657  374.5022 5.076657  0.000000       0.000000  
1 1 1 0  4  4  o 658.7617 19.57609  290.4890       17.14977      290.4890       17.14977      290.4890       17.14977      658.7617 19.57609  658.7617 19.57609  0.000000       0.000000  
1 1 1 0  4  5  o 354.0051 9.866832  83.73316       4.646192      83.73316       4.646192      83.73316       4.646192      354.0051 9.866832  354.0051 9.866832  0.000000       0.000000  
1 1 1 0  4  6  o 120.5470 11.58091  9.953785       1.818290      9.953785       1.818290      9.953785       1.818290      120.5470 11.58091  120.5470 11.58091  -0.000000      0.000000  
1 1 1 0  4  7  o 688.6825 10.49747  316.4040       9.628304      316.4040       9.628304      316.4040       9.628304      688.6825 10.49747  688.6825 10.49747  0.000000       0.000000  
1 1 1 0  4  8  o 699.3327 11.36649  326.3318       10.58583      326.3318       10.58583      326.3318       10.58583      699.3327 11.36649  699.3327 11.36649  -0.000000      0.000000  
1 1 1 0  4  9  o 177.3050 6.546249  21.03584       1.541841      21.03584       1.541841      21.03584       1.541841      177.3050 6.546249  177.3050 6.546249  0.000000       0.000000  
1 1 1 0  4  10 o 668.5721 10.64846  298.2442       9.481134      298.2442       9.481134      298.2442       9.481134      668.5721 10.64846  668.5721 10.64846  -0.000000      0.000000  
1 1 1 0  4  11 o 102.6268 5.626980  7.081799       0.7641777     7.081799       0.7641777     7.081799       0.7641777     102.6268 5.626980  102.6268 5.626980  -0.000000      0.000000  
1 1 1 0  4  12 o 37.01745 12.50413  1.179436       0.5515506     1.179436       0.5515506     1.179436       0.5515506     37.01745 12.50413  37.01745 12.50413  0.000000       0.000000  
1 1 1 0  4  13 o 7.338606 5.215260  -0.3014567     0.2184153     -0.3014567     0.2184153     -0.3014567     0.2184153     7.338606 5.215260  7.338606 5.215260  0.000000       0.000000  
1 1 1 0  4  14 o 363.6529 8.690447  88.33279       4.205737      88.33279       4.205737      88.33279       4.205737      363.6529 8.690447  363.6529 8.690447  0.000000       0.000000  
1 1 1 0  4  15 f 665.8369 10.47336  296.0131       9.287205      296.0131       9.287205      296.0131       9.287205      665.8369 10.47336  665.8369 10.47336  -0.000000      0.000000  
1 1 1 0  4  16 o 114.7789 7.791059  8.905650       1.178799      8.905650       1.178799      8.905650       1.178799      114.7789 7.791059  114.7789 7.791059  0.000000       0.000000  
1 1 1 0  4  17 o 16.17770 11.22704  -0.7373797     0.8448642     -0.7373797     0.8448642     -0.7373797     0.8448642     16.17770 11.22704  16.17770 11.22704  0.000000       0.000000  
1 1 1 0  4  18 o 176.4532 8.998907  20.93070       2.103263      20.93070       2.103263      20.93070       2.103263      176.4532 8.998907  176.4532 8.998907  -0.000000      0.000000  
1 1 1 0  4  19 o 295.9575 9.285231  58.60175       3.653639      58.60175       3.653639      58.60175       3.653639      295.9575 9.285231  295.9575 9.285231  -0.000000      0.000000  
1 1 1 0  4  20 o 208.8912 12.47190  29.44308       3.442965      29.44308       3.442965      29.44308       3.442965      208.8912 12.47190  208.8912 12.47190  -0.000000      0.000000  
1 1 1 0  4  21 o 99.66816 19.37537  7.347435       2.294154      7.347435       2.294154      7.347435       2.294154      99.66816 19.37537  99.66816 19.37537  0.000000       0.000000  
1 1 1 0  4  22 o 316.0922 12.23449  67.00740       5.135590      67.00740       5.135590      67.00740       5.135590      316.0922 12.23449  316.0922 12.23449  0.000000       0.000000  
1 1 1 0  4  23 o 742.5558 17.05738  369.6757       16.85765      369.6757       16.85765      369.6757       16.85765      742.5558 17.05738  742.5558 17.05738  0.000000       0.000000  
1 1 1 0  4  24 o 37.18737 23.30283  0.5205848      2.390018      0.5205848      2.390018      0.5205848      2.390018      37.18737 23.30283  37.18737 23.30283  0.000000       0.000000  
1 1 1 0  4  25 o 349.8856 14.09369  82.37392       6.546612      82.37392       6.546612      82.37392       6.546612      349.8856 14.09369  349.8856 14.09369  0.000000       0.000000  
1 1 1 0  4  26 f 61.95045 26.90572  3.724105       2.297189      3.724105       2.297189      3.724105       2.297189      61.95045 26.90572  61.95045 26.90572  -0.000000      0.000000  
1 1 1 0  4  27 o 124.9497 27.73263  12.07437       4.036056      12.07437       4.036056      12.07437       4.036056      124.9497 27.73263  124.9497 27.73263  -0.000000      0.000000  
1 1 1 0  4  28 o 45.56602 24.90183  2.022796       2.155347      2.022796       2.155347      2.022796       2.155347      45.56602 24.90183  45.56602 24.90183  0.000000       0.000000  
1 1 1 0  4  29 o 34.99300 22.06425  0.4549540      2.179055      0.4549540      2.179055      0.4549540      2.179055      34.99300 22.06425  34.99300 22.06425  -0.000000      0.000000  
1 1 1 0  4  30 o 29.71167 19.26666  -0.1964406E-01 1.811242      -0.1964406E-01 1.811242      -0.1964406E-01 1.811242      29.71167 19.26666  29.71167 19.26666  -0.000000      0.000000  
1 1 1 0  4  31 o 78.89376 20.67416  5.040436       1.877801      5.040436       1.877801      5.040436       1.877801      78.89376 20.67416  78.89376 20.67416  -0.000000      0.000000  
1 1 1 0  4  32 o 70.35232 28.60669  4.935756       2.629862      4.935756       2.629862      4.935756       2.629862      70.35232 28.60669  70.35232 28.60669  0.000000       0.000000  
1 1 1 0  4  33 o 46.48362 27.44459  2.171469       2.912272      2.171469       2.912272      2.171469       2.912272      46.48362 27.44459  46.48362 27.44459  0.000000       0.000000  
1 1 1 0  4  34 o 51.81976 27.17146  3.143177       2.472903      3.143177       2.472903      3.143177       2.472903      51.81976 27.17146  51.81976 27.17146  0.000000       0.000000  
1 1 1 0  4  35 o 48.35236 20.63242  2.431669       1.353699      2.431669       1.353699      2.431669       1.353699      48.35236 20.63242  48.35236 20.63242  0.000000       0.000000  
1 1 1 0  4  36 o 35.90878 18.41933  1.434849       1.119298      1.434849       1.119298      1.434849       1.119298      35.90878 18.41933  35.90878 18.41933  -0.000000      0.000000  
1 1 1 0  4  37 o 23.71245 15.28720  0.1992998      1.118335      0.1992998      1.118335      0.1992998      1.118335      23.71245 15.28720  23.71245 15.28720  -0.000000      0.000000  
1 1 1 0  4  38 o 10.45410 7.714392  -2.416866      0.8021078     -2.416866      0.8021078     -2.416866      0.8021078     10.45410 7.714392  10.45410 7.714392  -0.000000      0.000000  
1 1 1 0  5  1  o 390.0014 1.957175  101.3485       1.017056      101.3485       1.017056      101.3485       1.017056      390.0014 1.957175  390.0014 1.957175  0.000000       0.000000  
1 1 1 0  5  2  o 167.9379 4.051010  18.82502       0.9053452     18.82502       0.9053452     18.82502       0.9053452     167.9379 4.051010  167.9379 4.051010  -0.000000      0.000000  
1 1 1 0  5  3  o 391.2709 4.751524  102.0570       2.476508      102.0570       2.476508      102.0570       2.476508      391.2709 4.751524  391.2709 4.751524  -0.000000      0.000000  
1 1 1 0  5  4  o 180.2586 10.07703  21.86277       2.403059      21.86277       2.403059      21.86277       2.403059      180.2586 10.07703  180.2586 10.07703  0.000000       0.000000  
1 1 1 0  5  5  o 154.1451 9.600329  16.02196       1.954189      16.02196       1.954189      16.02196       1.954189      154.1451 9.600329  154.1451 9.600329  -0.000000      0.000000  
1 1 1 0  5  6  o 1187.328 29.23385  945.2695       46.18863      945.2695       46.18863      945.2695       46.18863      1187.328 29.23385  1187.328 29.23385  -0.000000      0.000000  
1 1 1 0  5  7  o 1240.000 24.37755  1028.915       40.24451      1028.915       40.24451      1028.915       40.24451      1240.000 24.37755  1240.000 24.37755  -0.000000      0.000000  
1 1 1 0  5  8  o 196.2329 4.479594  25.69885       1.169965      25.69885       1.169965      25.69885       1.169965      196.2329 4.479594  196.2329 4.479594  -0.000000      0.000000  
1 1 1 0  5  9  o 203.6475 3.921961  27.66460       1.063390      27.66460       1.063390      27.66460       1.063390      203.6475 3.921961  203.6475 3.921961  0.000000       0.000000  
1 1 1 0  5  10 o 220.9190 6.323989  32.60528       1.858199      32.60528       1.858199      32.60528       1.858199      220.9190 6.323989  220.9190 6.323989  -0.000000      0.000000  
1 1 1 0  5  11 o 97.67508 7.380067  6.467072       0.9476284     6.467072       0.9476284     6.467072       0.9476284     97.67508 7.380067  97.67508 7.380067  0.000000       0.000000  
1 1 1 0  5  12 o 606.9465 11.83406  246.0096       9.562797      246.0096       9.562797      246.0096       9.562797      606.9465 11.83406  606.9465 11.83406  0.000000       0.000000  
1 1 1 0  5  13 f 5.687568 4.086546  -0.2550998     0.1494844     -0.2550998     0.1494844     -0.2550998     0.1494844     5.687568 4.086546  5.687568 4.086546  -0.000000      0.000000  
1 1 1 0  5  14 o 1009.799 10.26158  680.4528       13.80452      680.4528       13.80452      680.4528       13.80452      1009.799 10.26158  1009.799 10.26158  -0.000000      0.000000  
1 1 1 0  5  15 o 241.4055 6.256468  38.92616       2.009511      38.92616       2.009511      38.92616       2.009511      241.4055 6.256468  241.4055 6.256468  0.000000       0.000000  
1 1 1 0  5  16 o 36.34952 6.583910  0.9626653      0.2878869     0.9626653      0.2878869     0.9626653      0.2878869     36.34952 6.583910  36.34952 6.583910  -0.000000      0.000000  
1 1 1 0  5  17 f 17.70095 10.58731  0.2156580      0.4439116     0.2156580      0.4439116     0.2156580      0.4439116     17.70095 10.58731  17.70095 10.58731  -0.000000      0.000000  
1 1 1 0  5  18 o 481.6848 11.48845  155.1492       7.364438      155.1492       7.364438      155.1492       7.364438      481.6848 11.48845  481.6848 11.48845  0.000000       0.000000  
1 1 1 0  5  19 o 221.6655 9.499098  32.95793       2.794031      32.95793       2.794031      32.95793       2.794031      221.6655 9.499098  221.6655 9.499098  0.000000       0.000000  
1 1 1 0  5  20 o 405.0730 9.684784  109.6474       5.220782      109.6474       5.220782      109.6474       5.220782      405.0730 9.684784  405.0730 9.684784  0.000000       0.000000  
1 1 1 0  5  21 o 201.1970 8.901368  27.15697       2.375786      27.15697       2.375786      27.15697       2.375786      201.1970 8.901368  201.1970 8.901368  0.000000       0.000000  
1 1 1 0  5  22 o 199.2503 10.06603  26.69163       2.656938      26.69163       2.656938      26.69163       2.656938      199.2503 10.06603  199.2503 10.06603  -0.000000      0.000000  
1 1 1 0  5  23 o 190.3506 15.58145  24.71962       3.889205      24.71962       3.889205      24.71962       3.889205      190.3506 15.58145  190.3506 15.58145  0.000000       0.000000  
1 1 1 0  5  24 o 105.9300 24.56163  8.648798       3.015872      8.648798       3.015872      8.648798       3.015872      105.9300 24.56163  105.9300 24.56163  0.000000       0.000000  
1 1 1 0  5  25 f 82.05028 25.71863  5.692385       2.467423      5.692385       2.467423      5.692385       2.467423      82.05028 25.71863  82.05028 25.71863  0.000000       0.000000  
1 1 1 0  5  26 o 182.0157 12.49300  22.50498       2.996723      22.50498       2.996723      22.50498       2.996723      182.0157 12.49300  182.0157 12.49300  0.000000       0.000000  
1 1 1 0  5  27 o 121.2417 16.11727  10.40449       2.475446      10.40449       2.475446      10.40449       2.475446      121.2417 16.11727  121.2417 16.11727  -0.000000      0.000000  
1 1 1 0  5  28 o 30.54398 20.22667  -0.4636036     2.158571      -0.4636036     2.158571      -0.4636036     2.158571      30.54398 20.22667  30.54398 20.22667  0.000000       0.000000  
1 1 1 0  5  29 o 132.9217 13.72463  12.28318       2.366366      12.28318       2.366366      12.28318       2.366366      132.9217 13.72463  132.9217 13.72463  0.000000       0.000000  
1 1 1 0  5  30 o 30.87394 20.02150  -0.8638701E-02 1.956332      -0.8638701E-02 1.956332      -0.8638701E-02 1.956332      30.87394 20.02150  30.87394 20.02150  -0.000000      0.000000  
1 1 1 0  5  31 o 34.59311 18.83259  1.176677       1.227891      1.176677       1.227891      1.176677       1.227891      34.59311 18.83259  34.59311 18.83259  -0.000000      0.000000  
1 1 1 0  5  32 o 158.8820 11.84022  17.41764       2.473988      17.41764       2.473988      17.41764       2.473988      158.8820 11.84022  158.8820 11.84022  0.000000       0.000000  
1 1 1 0  5  33 o 20.96827 14.16002  -0.4594875     1.153783      -0.4594875     1.153783      -0.4594875     1.153783      20.96827 14.16002  20.96827 14.16002  0.000000       0.000000  
1 1 1 0  5  34 o 19.39523 13.50716  -1.025936      1.251565      -1.025936      1.251565      -1.025936      1.251565      19.39523 13.50716  19.39523 13.50716  0.000000       0.000000  
1 1 1 0  5  35 o 26.36895 16.09852  0.5351961      1.070796      0.5351961      1.070796      0.5351961      1.070796      26.36895 16.09852  26.36895 16.09852  -0.000000      0.000000  
1 1 1 0  5  36 o 76.51463 15.32776  4.620749       1.386334      4.620749       1.386334      4.620749       1.386334      76.51463 15.32776  76.51463 15.32776  -0.000000      0.000000  
1 1 1 0  5  37 o 24.72184 17.26142  -1.290311      2.080776      -1.290311      2.080776      -1.290311      2.080776      24.72184 17.26142  24.72184 17.26142  0.000000       0.000000  
1 1 1 0  6  0  o 901.7147 20.05162  543.1090       24.06617      543.1090       24.06617      543.1090       24.06617      901.7147 20.05162  901.7147 20.05162  0.000000       0.000000  
1 1 1 0  6  1  o 198.5832 4.419720  26.31587       1.168220      26.31587       1.168220      26.31587       1.168220      198.5832 4.419720  198.5832 4.419720  0.000000       0.000000  
1 1 1 0  6  2  o 826.1412 7.956140  455.0079       8.756680      455.0079       8.756680      455.0079       8.756680      826.1412 7.956140  826.1412 7.956140  -0.000000      0.000000  
1 1 1 0  6  3  o 674.2576 10.01882  303.2596       8.997045      303.2596       8.997045      303.2596       8.997045      674.2576 10.01882  674.2576 10.01882  -0.000000      0.000000  
1 1 1 0  6  4  o 260.3118 4.366205  45.18992       1.513547      45.18992       1.513547      45.18992       1.513547      260.3118 4.366205  260.3118 4.366205  0.000000       0.000000  
1 1 1 0  6  5  o 1320.688 3.915771  1162.228       6.891004      1162.228       6.891004      1162.228       6.891004      1320.688 3.915771  1320.688 3.915771  0.000000       0.000000  
1 1 1 0  6  6  o 836.5930 15.44868  467.3829       17.20857      467.3829       17.20857      467.3829       17.20857      836.5930 15.44868  836.5930 15.44868  0.000000       0.000000  
1 1 1 0  6  7  o 740.3660 13.26791  365.9168       13.08001      365.9168       13.08001      365.9168       13.08001      740.3660 13.26791  740.3660 13.26791  0.000000       0.000000  
1 1 1 0  6  8  o 23.27043 14.87666  0.5754833E-01  1.031270      0.5754833E-01  1.031270      0.5754833E-01  1.031270      23.27043 14.87666  23.27043 14.87666  0.000000       0.000000  
1 1 1 0  6  9  o 290.6442 12.14485  56.62910       4.684848      56.62910       4.684848      56.62910       4.684848      290.6442 12.14485  290.6442 12.14485  -0.000000      0.000000  
1 1 1 0  6  10 o 166.3620 9.984982  18.65106       2.195037      18.65106       2.195037      18.65106       2.195037      166.3620 9.984982  166.3620 9.984982  -0.000000      0.000000  
1 1 1 0  6  11 o 626.3480 14.20486  262.2123       11.84190      262.2123       11.84190      262.2123       11.84190      626.3480 14.20486  626.3480 14.20486  -0.000000      0.000000  
1 1 1 0  6  12 o 124.3376 6.276252  10.38258       1.033787      10.38258       1.033787      10.38258       1.033787      124.3376 6.276252  124.3376 6.276252  -0.000000      0.000000  
1 1 1 0  6  13 o 439.6046 9.304177  129.0560       5.444705      129.0560       5.444705      129.0560       5.444705      439.6046 9.304177  439.6046 9.304177  0.000000       0.000000  
1 1 1 0  6  14 o 467.1132 9.407416  145.7166       5.850169      145.7166       5.850169      145.7166       5.850169      467.1132 9.407416  467.1132 9.407416  0.000000       0.000000  
1 1 1 0  6  15 o 207.7124 6.731001  28.85433       1.858577      28.85433       1.858577      28.85433       1.858577      207.7124 6.731001  207.7124 6.731001  0.000000       0.000000  
1 1 1 0  6  16 o 98.77522 9.108141  6.672390       1.174110      6.672390       1.174110      6.672390       1.174110      98.77522 9.108141  98.77522 9.108141  0.000000       0.000000  
1 1 1 0  6  17 o 301.6476 8.389117  60.82722       3.366119      60.82722       3.366119      60.82722       3.366119      301.6476 8.389117  301.6476 8.389117  0.000000       0.000000  
1 1 1 0  6  18 o 216.1588 7.991868  31.28636       2.294793      31.28636       2.294793      31.28636       2.294793      216.1588 7.991868  216.1588 7.991868  -0.000000      0.000000  
1 1 1 0  6  19 o 313.8848 8.377538  65.84498       3.498326      65.84498       3.498326      65.84498       3.498326      313.8848 8.377538  313.8848 8.377538  0.000000       0.000000  
1 1 1 0  6  20 o 859.0140 16.40581  493.9281       18.76351      493.9281       18.76351      493.9281       18.76351      859.0140 16.40581  859.0140 16.40581  0.000000       0.000000  
1 1 1 0  6  21 o 192.3612 9.540977  24.86547       2.431803      24.86547       2.431803      24.86547       2.431803      192.3612 9.540977  192.3612 9.540977  0.000000       0.000000  
1 1 1 0  6  22 o 204.8043 8.716016  28.12998       2.368827      28.12998       2.368827      28.12998       2.368827      204.8043 8.716016  204.8043 8.716016  -0.000000      0.000000  
1 1 1 0  6  23 o 427.3282 9.825679  122.0729       5.588288      122.0729       5.588288      122.0729       5.588288      427.3282 9.825679  427.3282 9.825679  0.000000       0.000000  
1 1 1 0  6  24 o 12.31588 8.803536  -1.011198      0.6575488     -1.011198      0.6575488     -1.011198      0.6575488     12.31588 8.803536  12.31588 8.803536  -0.000000      0.000000  
1 1 1 0  6  25 o ?        ?         -2.052476      0.2496293     -2.052476      0.2496293     -2.052476      0.2496293     ?        ?         ?        ?         -0.000000      0.000000  
1 1 1 0  6  26 o 162.8255 12.53722  18.08139       2.682116      18.08139       2.682116      18.08139       2.682116      162.8255 12.53722  162.8255 12.53722  0.000000       0.000000  
1 1 1 0  6  27 o 81.70389 12.32614  4.769265       1.251777      4.769265       1.251777      4.769265       1.251777      81.70389 12.32614  81.70389 12.32614  0.000000       0.000000  
1 1 1 0  6  28 o 25.48810 17.42928  -1.127786      1.864710      -1.127786      1.864710      -1.127786      1.864710      25.48810 17.42928  25.48810 17.42928  0.000000       0.000000  
1 1 1 0  6  29 o 50.08444 19.49001  2.327165       1.239336      2.327165       1.239336      2.327165       1.239336      50.08444 19.49001  50.08444 19.49001  -0.000000      0.000000  
1 1 1 0  6  30 o 13.72186 9.877458  -1.553198      0.8914264     -1.553198      0.8914264     -1.553198      0.8914264     13.72186 9.877458  13.72186 9.877458  -0.000000      0.000000  
1 1 1 0  6  31 o 114.3204 14.00176  9.268422       2.047446      9.268422       2.047446      9.268422       2.047446      114.3204 14.00176  114.3204 14.00176  0.000000       0.000000  
1 1 1 0  6  32 o 83.86053 13.91018  5.169787       1.425978      5.169787       1.425978      5.169787       1.425978      83.86053 13.91018  83.86053 13.91018  -0.000000      0.000000  
1 1 1 0  6  33 o 23.66773 15.14885  0.1353243      1.073323      0.1353243      1.073323      0.1353243      1.073323      23.66773 15.14885  23.66773 15.14885  -0.000000      0.000000  
1 1 1 0  6  34 o 15.69581 11.05456  -0.9752341     0.9099500     -0.9752341     0.9099500     -0.9752341     0.9099500     15.69581 11.05456  15.69581 11.05456  -0.000000      0.000000  
1 1 1 0  6  35 o 10.40237 7.672081  -2.366841      0.7838312     -2.366841      0.7838312     -2.366841      0.7838312     10.40237 7.672081  10.40237 7.672081  0.000000       0.000000  
1 1 1 0  6  36 o 62.65939 15.89358  3.270014       1.147336      3.270014       1.147336      3.270014       1.147336      62.65939 15.89358  62.65939 15.89358  -0.000000      0.000000  
1 1 1 0  6  37 o 19.62333 14.08305  -2.363116      1.753157      -2.363116      1.753157      -2.363116      1.753157      19.62333 14.08305  19.62333 14.08305  -0.000000      0.000000  
1 1 1 0  7  1  o 53.17723 2.653417  1.898167       0.1869473     1.898167       0.1869473     1.898167       0.1869473     53.17723 2.653417  53.17723 2.653417  0.000000       0.000000  
1 1 1 0  7  2  o 299.4916 4.492507  59.80707       1.791953      59.80707       1.791953      59.80707       1.791953      299.4916 4.492507  299.4916 4.492507  0.000000       0.000000  
1 1 1 0  7  3  o 841.7878 9.511672  472.5248       10.66616      472.5248       10.66616      472.5248       10.66616      841.7878 9.511672  841.7878 9.511672  -0.000000      0.000000  
1 1 1 0  7  4  o 128.7617 4.888447  11.09541       0.8359984     11.09541       0.8359984     11.09541       0.8359984     128.7617 4.888447  128.7617 4.888447  -0.000000      0.000000  
1 1 1 0  7  5  o 168.3674 3.039373  18.90628       0.6813909     18.90628       0.6813909     18.90628       0.6813909     168.3674 3.039373  168.3674 3.039373  -0.000000      0.000000  
1 1 1 0  7  6  o 291.5777 6.761584  56.75000       2.623908      56.75000       2.623908      56.75000       2.623908      291.5777 6.761584  291.5777 6.761584  -0.000000      0.000000  
1 1 1 0  7  7  o 226.8168 8.957588  34.45308       2.697712      34.45308       2.697712      34.45308       2.697712      226.8168 8.957588  226.8168 8.957588  0.000000       0.000000  
1 1 1 0  7  8  o 311.1207 8.314160  64.65844       3.441273      64.65844       3.441273      64.65844       3.441273      311.1207 8.314160  311.1207 8.314160  0.000000       0.000000  
1 1 1 0  7  9  o 140.9579 9.379411  13.42121       1.743559      13.42121       1.743559      13.42121       1.743559      140.9579 9.379411  140.9579 9.379411  -0.000000      0.000000  
1 1 1 0  7  10 o 242.2643 11.70517  39.42010       3.758492      39.42010       3.758492      39.42010       3.758492      242.2643 11.70517  242.2643 11.70517  0.000000       0.000000  
1 1 1 0  7  11 o 210.1751 6.588849  29.52954       1.841179      29.52954       1.841179      29.52954       1.841179      210.1751 6.588849  210.1751 6.588849  0.000000       0.000000  
1 1 1 0  7  12 o 541.0688 11.71974  195.6190       8.440807      195.6190       8.440807      195.6190       8.440807      541.0688 11.71974  541.0688 11.71974  0.000000       0.000000  
1 1 1 0  7  13 o 321.2176 9.469912  69.00079       4.045417      69.00079       4.045417      69.00079       4.045417      321.2176 9.469912  321.2176 9.469912  0.000000       0.000000  
1 1 1 0  7  14 o 436.2206 10.60904  127.2056       6.158502      127.2056       6.158502      127.2056       6.158502      436.2206 10.60904  436.2206 10.60904  -0.000000      0.000000  
1 1 1 0  7  15 o 79.68036 14.68430  4.647263       1.403095      4.647263       1.403095      4.647263       1.403095      79.68036 14.68430  79.68036 14.68430  0.000000       0.000000  
1 1 1 0  7  16 o 271.5702 7.959989  49.30936       2.874898      49.30936       2.874898      49.30936       2.874898      271.5702 7.959989  271.5702 7.959989  0.000000       0.000000  
1 1 1 0  7  17 o 58.78711 12.34895  2.588611       0.8518535     2.588611       0.8518535     2.588611       0.8518535     58.78711 12.34895  58.78711 12.34895  0.000000       0.000000  
1 1 1 0  7  18 o 450.8493 12.98030  136.0770       7.783486      136.0770       7.783486      136.0770       7.783486      450.8493 12.98030  450.8493 12.98030  0.000000       0.000000  
1 1 1 0  7  19 o 192.0469 6.866745  24.68242       1.752140      24.68242       1.752140      24.68242       1.752140      192.0469 6.866745  192.0469 6.866745  -0.000000      0.000000  
1 1 1 0  7  20 o 282.1923 7.589309  53.21161       2.849117      53.21161       2.849117      53.21161       2.849117      282.1923 7.589309  282.1923 7.589309  0.000000       0.000000  
1 1 1 0  7  21 o 585.1755 9.956553  228.6679       7.758632      228.6679       7.758632      228.6679       7.758632      585.1755 9.956553  585.1755 9.956553  0.000000       0.000000  
1 1 1 0  7  22 o 461.0164 9.206081  141.9708       5.650330      141.9708       5.650330      141.9708       5.650330      461.0164 9.206081  461.0164 9.206081  -0.000000      0.000000  
1 1 1 0  7  23 o 87.67409 9.167059  5.295505       1.041689      5.295505       1.041689      5.295505       1.041689      87.67409 9.167059  87.67409 9.167059  0.000000       0.000000  
1 1 1 0  7  24 o ?        ?         -1.996994      0.4563031     -1.996994      0.4563031     -1.996994      0.4563031     ?        ?         ?        ?         0.000000       0.000000  
1 1 1 0  7  25 o 324.9800 10.18780  70.81647       4.401923      70.81647       4.401923      70.81647       4.401923      324.9800 10.18780  324.9800 10.18780  -0.000000      0.000000  
1 1 1 0  7  26 f 22.16947 13.69672  0.2438433      0.7966871     0.2438433      0.7966871     0.2438433      0.7966871     22.16947 13.69672  22.16947 13.69672  0.000000       0.000000  
1 1 1 0  7  27 o 194.6696 10.17897  25.58955       2.623856      25.58955       2.623856      25.58955       2.623856      194.6696 10.17897  194.6696 10.17897  -0.000000      0.000000  
1 1 1 0  7  28 o 123.1423 19.39223  11.02907       2.946422      11.02907       2.946422      11.02907       2.946422      123.1423 19.39223  123.1423 19.39223  -0.000000      0.000000  
1 1 1 0  7  29 o 13.74296 9.607734  -0.6466077     0.6503614     -0.6466077     0.6503614     -0.6466077     0.6503614     13.74296 9.607734  13.74296 9.607734  0.000000       0.000000  
1 1 1 0  7  30 o 292.0103 11.52000  57.77406       4.466660      57.77406       4.466660      57.77406       4.466660      292.0103 11.52000  292.0103 11.52000  -0.000000      0.000000  
1 1 1 0  7  31 o ?        ?         -1.526092      0.2113749     -1.526092      0.2113749     -1.526092      0.2113749     ?        ?         ?        ?         -0.000000      0.000000  
1 1 1 0  7  32 o 27.00581 17.83778  -0.2179615     1.661590      -0.2179615     1.661590      -0.2179615     1.661590      27.00581 17.83778  27.00581 17.83778  0.000000       0.000000  
1 1 1 0  7  33 f 27.65653 18.10332  -0.1527764E-01 1.653327      -0.1527764E-01 1.653327      -0.1527764E-01 1.653327      27.65653 18.10332  27.65653 18.10332  -0.000000      0.000000  
1 1 1 0  7  34 o 25.82886 17.69095  -0.8811234     1.938461      -0.8811234     1.938461      -0.8811234     1.938461      25.82886 17.69095  25.82886 17.69095  0.000000       0.000000  
1 1 1 0  7  35 f 22.49292 15.97121  -2.204921      2.032815      -2.204921      2.032815      -2.204921      2.032815      22.49292 15.97121  22.49292 15.97121  -0.000000      0.000000  
1 1 1 0  7  36 o 27.38704 18.23925  -0.5762415E-01 1.797105      -0.5762415E-01 1.797105      -0.5762415E-01 1.797105      27.38704 18.23925  27.38704 18.23925  0.000000       0.000000  
1 1 1 0  7  37 o 24.04208 16.44664  -0.5632412     1.663816      -0.5632412     1.663816      -0.5632412     1.663816      24.04208 16.44664  24.04208 16.44664  0.000000       0.000000  
1 1 1 0  8  0  o 1547.320 41.33225  1605.967       85.08278      1605.967       85.08278      1605.967       85.08278      1547.320 41.33225  1547.320 41.33225  0.000000       0.000000  
1 1 1 0  8  1  o 554.6559 2.160958  204.9848       1.597088      204.9848       1.597088      204.9848       1.597088      554.6559 2.160958  554.6559 2.160958  0.000000       0.000000  
1 1 1 0  8  2  f 359.9134 5.718683  86.38664       2.741071      86.38664       2.741071      86.38664       2.741071      359.9134 5.718683  359.9134 5.718683  0.000000       0.000000  
1 1 1 0  8  3  o 1101.419 12.56329  809.2911       18.43326      809.2911       18.43326      809.2911       18.43326      1101.419 12.56329  1101.419 12.56329  -0.000000      0.000000  
1 1 1 0  8  4  o 538.5287 2.554440  193.2444       1.832973      193.2444       1.832973      193.2444       1.832973      538.5287 2.554440  538.5287 2.554440  -0.000000      0.000000  
1 1 1 0  8  5  f 479.8829 7.245931  153.5849       4.631053      153.5849       4.631053      153.5849       4.631053      479.8829 7.245931  479.8829 7.245931  -0.000000      0.000000  
1 1 1 0  8  6  f 46.44089 6.587354  1.521549       0.3840078     1.521549       0.3840078     1.521549       0.3840078     46.44089 6.587354  46.44089 6.587354  0.000000       0.000000  
1 1 1 0  8  7  o 619.8736 12.64800  256.6040       10.43735      256.6040       10.43735      256.6040       10.43735      619.8736 12.64800  619.8736 12.64800  0.000000       0.000000  
1 1 1 0  8  8  o 398.0704 10.32065  105.8716       5.466133      105.8716       5.466133      105.8716       5.466133      398.0704 10.32065  398.0704 10.32065  -0.000000      0.000000  
1 1 1 0  8  9  o 31.87486 12.41703  0.9275236      0.5028254     0.9275236      0.5028254     0.9275236      0.5028254     31.87486 12.41703  31.87486 12.41703  0.000000       0.000000  
1 1 1 0  8  10 o 258.3380 9.634709  44.68900       3.306170      44.68900       3.306170      44.68900       3.306170      258.3380 9.634709  258.3380 9.634709  0.000000       0.000000  
1 1 1 0  8  11 o 932.2283 16.90030  581.3979       20.97820      581.3979       20.97820      581.3979       20.97820      932.2283 16.90030  932.2283 16.90030  0.000000       0.000000  
1 1 1 0  8  12 o 593.0808 10.75025  234.9178       8.489539      234.9178       8.489539      234.9178       8.489539      593.0808 10.75025  593.0808 10.75025  -0.000000      0.000000  
1 1 1 0  8  13 o 311.2367 8.265783  64.73635       3.422594      64.73635       3.422594      64.73635       3.422594      311.2367 8.265783  311.2367 8.265783  0.000000       0.000000  
1 1 1 0  8  14 o 19.72763 13.28114  -0.4369813     1.000154      -0.4369813     1.000154      -0.4369813     1.000154      19.72763 13.28114  19.72763 13.28114  -0.000000      0.000000  
1 1 1 0  8  15 o 432.4218 10.04743  124.9692       5.782377      124.9692       5.782377      124.9692       5.782377      432.4218 10.04743  432.4218 10.04743  0.000000       0.000000  
1 1 1 0  8  16 o 115.5406 15.96600  9.419688       2.324510      9.419688       2.324510      9.419688       2.324510      115.5406 15.96600  115.5406 15.96600  0.000000       0.000000  
1 1 1 0  8  17 o 362.5337 8.180340  87.78121       3.947241      87.78121       3.947241      87.78121       3.947241      362.5337 8.180340  362.5337 8.180340  0.000000       0.000000  
1 1 1 0  8  18 o 123.6935 14.22534  10.61747       2.264282      10.61747       2.264282      10.61747       2.264282      123.6935 14.22534  123.6935 14.22534  0.000000       0.000000  
1 1 1 0  8  19 o 420.0968 9.067840  117.8736       5.070722      117.8736       5.070722      117.8736       5.070722      420.0968 9.067840  420.0968 9.067840  0.000000       0.000000  
1 1 1 0  8  20 o 82.01672 9.107627  4.649921       0.9640078     4.649921       0.9640078     4.649921       0.9640078     82.01672 9.107627  82.01672 9.107627  0.000000       0.000000  
1 1 1 0  8  21 o 13.07328 8.833739  -0.2182696     0.4503416     -0.2182696     0.4503416     -0.2182696     0.4503416     13.07328 8.833739  13.07328 8.833739  -0.000000      0.000000  
1 1 1 0  8  22 o 79.72363 4.891809  4.284095       0.5151424     4.284095       0.5151424     4.284095       0.5151424     79.72363 4.891809  79.72363 4.891809  -0.000000      0.000000  
1 1 1 0  8  23 o 22.18349 13.84076  0.1971443      0.8336548     0.1971443      0.8336548     0.1971443      0.8336548     22.18349 13.84076  22.18349 13.84076  -0.000000      0.000000  
1 1 1 0  8  24 f 201.6932 8.171322  27.28939       2.187916      27.28939       2.187916      27.28939       2.187916      201.6932 8.171322  201.6932 8.171322  0.000000       0.000000  
1 1 1 0  8  25 o 236.3796 8.379261  37.46477       2.631772      37.46477       2.631772      37.46477       2.631772      236.3796 8.379261  236.3796 8.379261  0.000000       0.000000  
1 1 1 0  8  26 o 154.2936 10.28751  16.14771       2.093201      16.14771       2.093201      16.14771       2.093201      154.2936 10.28751  154.2936 10.28751  0.000000       0.000000  
1 1 1 0  8  27 o 263.9689 10.07845  46.89132       3.533277      46.89132       3.533277      46.89132       3.533277      263.9689 10.07845  263.9689 10.07845  -0.000000      0.000000  
1 1 1 0  8  28 o 115.7464 10.97469  9.232599       1.655585      9.232599       1.655585      9.232599       1.655585      115.7464 10.97469  115.7464 10.97469  -0.000000      0.000000  
1 1 1 0  8  29 o 192.4461 19.32807  26.11696       4.832909      26.11696       4.832909      26.11696       4.832909      192.4461 19.32807  192.4461 19.32807  -0.000000      0.000000  
1 1 1 0  8  30 o 93.18070 13.64843  6.242887       1.588422      6.242887       1.588422      6.242887       1.588422      93.18070 13.64843  93.18070 13.64843  -0.000000      0.000000  
1 1 1 0  8  31 o 52.54825 21.13087  2.658717       1.439759      2.658717       1.439759      2.658717       1.439759      52.54825 21.13087  52.54825 21.13087  0.000000       0.000000  
1 1 1 0  8  32 o 41.65514 20.38369  1.823714       1.338955      1.823714       1.338955      1.823714       1.338955      41.65514 20.38369  41.65514 20.38369  -0.000000      0.000000  
1 1 1 0  8  33 o 120.9422 12.94100  10.45439       2.025380      10.45439       2.025380      10.45439       2.025380      120.9422 12.94100  120.9422 12.94100  -0.000000      0.000000  
1 1 1 0  8  34 o 104.4959 17.61027  8.467979       2.243011      8.467979       2.243011      8.467979       2.243011      104.4959 17.61027  104.4959 17.61027  -0.000000      0.000000  
1 1 1 0  8  35 o 13.76442 10.18323  -4.785595      1.485842      -4.785595      1.485842      -4.785595      1.485842      13.76442 10.18323  13.76442 10.18323  -0.000000      0.000000  
1 1 1 0  8  36 o 49.05659 22.63930  2.786687       1.627819      2.786687       1.627819      2.786687       1.627819      49.05659 22.63930  49.05659 22.63930  0.000000       0.000000  
1 1 1 0  8  37 o 31.30704 19.14030  0.9873871      1.518440      0.9873871      1.518440      0.9873871      1.518440      31.30704 19.14030  31.30704 19.14030  -0.000000      0.000000  
1 1 1 0  9  1  o 688.7043 8.495965  316.2992       7.794175      316.2992       7.794175      316.2992       7.794175      688.7043 8.495965  688.7043 8.495965  0.000000       0.000000  
1 1 1 0  9  2  o 263.6386 2.441197  46.32220       0.8574354     46.32220       0.8574354     46.32220       0.8574354     263.6386 2.441197  263.6386 2.441197  -0.000000      0.000000  
1 1 1 0  9  3  o 731.7208 8.513883  357.0338       8.298778      357.0338       8.298778      357.0338       8.298778      731.7208 8.513883  731.7208 8.513883  0.000000       0.000000  
1 1 1 0  9  4  o 100.0679 7.395976  6.782676       0.9735360     6.782676       0.9735360     6.782676       0.9735360     100.0679 7.395976  100.0679 7.395976  0.000000       0.000000  
1 1 1 0  9  5  o 934.1112 9.618591  581.9092       11.96961      581.9092       11.96961      581.9092       11.96961      934.1112 9.618591  934.1112 9.618591  0.000000       0.000000  
1 1 1 0  9  6  o 411.3541 8.440422  112.9404       4.622114      112.9404       4.622114      112.9404       4.622114      411.3541 8.440422  411.3541 8.440422  0.000000       0.000000  
1 1 1 0  9  7  o 346.6615 7.202211  80.20388       3.323699      80.20388       3.323699      80.20388       3.323699      346.6615 7.202211  346.6615 7.202211  0.000000       0.000000  
1 1 1 0  9  8  o 679.9097 11.14993  308.5808       10.09564      308.5808       10.09564      308.5808       10.09564      679.9097 11.14993  679.9097 11.14993  -0.000000      0.000000  
1 1 1 0  9  9  o 558.4851 9.049901  208.1419       6.730880      208.1419       6.730880      208.1419       6.730880      558.4851 9.049901  558.4851 9.049901  0.000000       0.000000  
1 1 1 0  9  10 o 1224.704 17.52073  1003.446       28.57962      1003.446       28.57962      1003.446       28.57962      1224.704 17.52073  1224.704 17.52073  0.000000       0.000000  
1 1 1 0  9  11 o 786.1376 4.876356  411.9261       5.107752      411.9261       5.107752      411.9261       5.107752      786.1376 4.876356  786.1376 4.876356  0.000000       0.000000  
1 1 1 0  9  12 o 209.3926 9.986040  29.45088       2.771800      29.45088       2.771800      29.45088       2.771800      209.3926 9.986040  209.3926 9.986040  -0.000000      0.000000  
1 1 1 0  9  13 o 611.7110 8.221617  249.6834       6.698850      249.6834       6.698850      249.6834       6.698850      611.7110 8.221617  611.7110 8.221617  0.000000       0.000000  
1 1 1 0  9  14 o 52.80429 16.04130  2.310694       0.9850269     2.310694       0.9850269     2.310694       0.9850269     52.80429 16.04130  52.80429 16.04130  -0.000000      0.000000  
1 1 1 0  9  15 o 328.1568 7.923959  71.93761       3.460387      71.93761       3.460387      71.93761       3.460387      328.1568 7.923959  328.1568 7.923959  -0.000000      0.000000  
1 1 1 0  9  16 o 267.9051 9.432427  48.05555       3.357792      48.05555       3.357792      48.05555       3.357792      267.9051 9.432427  267.9051 9.432427  0.000000       0.000000  
1 1 1 0  9  17 o 128.0841 9.270179  11.11337       1.562749      11.11337       1.562749      11.11337       1.562749      128.0841 9.270179  128.0841 9.270179  0.000000       0.000000  
1 1 1 0  9  18 o 331.9623 9.677229  73.69720       4.272449      73.69720       4.272449      73.69720       4.272449      331.9623 9.677229  331.9623 9.677229  0.000000       0.000000  
1 1 1 0  9  19 o 136.5093 10.48323  12.65150       1.880378      12.65150       1.880378      12.65150       1.880378      136.5093 10.48323  136.5093 10.48323  0.000000       0.000000  
1 1 1 0  9  20 o 283.6136 9.967167  53.86635       3.756235      53.86635       3.756235      53.86635       3.756235      283.6136 9.967167  283.6136 9.967167  -0.000000      0.000000  
1 1 1 0  9  21 o 39.22788 20.63254  1.495017       1.429266      1.495017       1.429266      1.495017       1.429266      39.22788 20.63254  39.22788 20.63254  -0.000000      0.000000  
1 1 1 0  9  22 f 432.5916 11.12255  125.2453       6.401865      125.2453       6.401865      125.2453       6.401865      432.5916 11.12255  432.5916 11.12255  0.000000       0.000000  
1 1 1 0  9  23 o 155.5354 15.63191  16.69872       3.158890      16.69872       3.158890      16.69872       3.158890      155.5354 15.63191  155.5354 15.63191  -0.000000      0.000000  
1 1 1 0  9  24 o 60.86300 7.707843  2.588791       0.5978506     2.588791       0.5978506     2.588791       0.5978506     60.86300 7.707843  60.86300 7.707843  -0.000000      0.000000  
1 1 1 0  9  25 o 66.68217 13.16863  3.303109       1.040436      3.303109       1.040436      3.303109       1.040436      66.68217 13.16863  66.68217 13.16863  -0.000000      0.000000  
1 1 1 0  9  26 o 8.035135 5.753569  -0.4546556     0.2858020     -0.4546556     0.2858020     -0.4546556     0.2858020     8.035135 5.753569  8.035135 5.753569  -0.000000      0.000000  
1 1 1 0  9  27 o 56.49409 21.99700  2.967340       1.578308      2.967340       1.578308      2.967340       1.578308      56.49409 21.99700  56.49409 21.99700  0.000000       0.000000  
1 1 1 0  9  28 o 158.3042 15.52477  17.44772       3.197491      17.44772       3.197491      17.44772       3.197491      158.3042 15.52477  158.3042 15.52477  -0.000000      0.000000  
1 1 1 0  9  29 o 44.69790 26.11036  1.788879       2.588434      1.788879       2.588434      1.788879       2.588434      44.69790 26.11036  44.69790 26.11036  0.000000       0.000000  
1 1 1 0  9  30 o 85.73354 28.42424  6.637831       2.887730      6.637831       2.887730      6.637831       2.887730      85.73354 28.42424  85.73354 28.42424  0.000000       0.000000  
1 1 1 0  9  31 o 123.2024 28.17596  12.49727       4.029438      12.49727       4.029438      12.49727       4.029438      123.2024 28.17596  123.2024 28.17596  0.000000       0.000000  
1 1 1 0  9  32 o 25.90456 18.48784  -3.646772      2.855712      -3.646772      2.855712      -3.646772      2.855712      25.90456 18.48784  25.90456 18.48784  0.000000       0.000000  
1 1 1 0  9  33 o 38.44362 26.54899  -1.491113      4.581108      -1.491113      4.581108      -1.491113      4.581108      38.44362 26.54899  38.44362 26.54899  -0.000000      0.000000  
1 1 1 0  9  34 o 34.44339 24.10967  -2.103533      4.132344      -2.103533      4.132344      -2.103533      4.132344      34.44339 24.10967  34.44339 24.10967  -0.000000      0.000000  
1 1 1 0  9  35 o 34.84130 23.94870  -0.6554345     3.624928      -0.6554345     3.624928      -0.6554345     3.624928      34.84130 23.94870  34.84130 23.94870  0.000000       0.000000  
1 1 1 0  9  36 o 20.28229 14.81029  -4.792991      2.425222      -4.792991      2.425222      -4.792991      2.425222      20.28229 14.81029  20.28229 14.81029  -0.000000      0.000000  
1 1 1 0  10 0  o 44.59110 14.97172  1.706931       0.7940332     1.706931       0.7940332     1.706931       0.7940332     44.59110 14.97172  44.59110 14.97172  0.000000       0.000000  
1 1 1 0  10 1  f 236.7629 5.395487  37.41415       1.700232      37.41415       1.700232      37.41415       1.700232      236.7629 5.395487  236.7629 5.395487  0.000000       0.000000  
1 1 1 0  10 2  o 665.5742 9.876060  295.5480       8.754637      295.5480       8.754637      295.5480       8.754637      665.5742 9.876060  665.5742 9.876060  -0.000000      0.000000  
1 1 1 0  10 3  o 40.11242 7.515673  1.178602       0.3604515     1.178602       0.3604515     1.178602       0.3604515     40.11242 7.515673  40.11242 7.515673  -0.000000      0.000000  
1 1 1 0  10 4  o 275.3860 5.246184  50.59322       1.923549      50.59322       1.923549      50.59322       1.923549      275.3860 5.246184  275.3860 5.246184  -0.000000      0.000000  
1 1 1 0  10 5  o 1323.025 3.149743  1166.333       5.552788      1166.333       5.552788      1166.333       5.552788      1323.025 3.149743  1323.025 3.149743  0.000000       0.000000  
1 1 1 0  10 6  o 227.0535 5.191394  34.40990       1.568819      34.40990       1.568819      34.40990       1.568819      227.0535 5.191394  227.0535 5.191394  -0.000000      0.000000  
1 1 1 0  10 7  o 231.1217 6.539557  35.68987       2.010368      35.68987       2.010368      35.68987       2.010368      231.1217 6.539557  231.1217 6.539557  0.000000       0.000000  
1 1 1 0  10 8  o 297.0906 6.326406  58.91147       2.501928      58.91147       2.501928      58.91147       2.501928      297.0906 6.326406  297.0906 6.326406  0.000000       0.000000  
1 1 1 0  10 9  o 260.2037 7.164135  45.23961       2.479737      45.23961       2.479737      45.23961       2.479737      260.2037 7.164135  260.2037 7.164135  0.000000       0.000000  
1 1 1 0  10 10 o 415.3725 7.622078  115.1546       4.215555      115.1546       4.215555      115.1546       4.215555      415.3725 7.622078  415.3725 7.622078  0.000000       0.000000  
1 1 1 0  10 11 o 424.4252 7.935356  120.2475       4.484340      120.2475       4.484340      120.2475       4.484340      424.4252 7.935356  424.4252 7.935356  0.000000       0.000000  
1 1 1 0  10 12 o 169.3343 13.46165  19.51213       2.992031      19.51213       2.992031      19.51213       2.992031      169.3343 13.46165  169.3343 13.46165  0.000000       0.000000  
1 1 1 0  10 13 o 252.5201 9.108705  42.70121       3.055910      42.70121       3.055910      42.70121       3.055910      252.5201 9.108705  252.5201 9.108705  -0.000000      0.000000  
1 1 1 0  10 14 o 144.6094 8.840810  14.10364       1.688838      14.10364       1.688838      14.10364       1.688838      144.6094 8.840810  144.6094 8.840810  0.000000       0.000000  
1 1 1 0  10 15 o 625.0258 9.026075  260.7319       7.513915      260.7319       7.513915      260.7319       7.513915      625.0258 9.026075  625.0258 9.026075  0.000000       0.000000  
1 1 1 0  10 16 o 349.7922 8.392602  81.73621       3.906746      81.73621       3.906746      81.73621       3.906746      349.7922 8.392602  349.7922 8.392602  0.000000       0.000000  
1 1 1 0  10 17 o 314.6634 8.476302  66.17274       3.548242      66.17274       3.548242      66.17274       3.548242      314.6634 8.476302  314.6634 8.476302  0.000000       0.000000  
1 1 1 0  10 18 o 538.9601 9.506672  193.9425       6.822663      193.9425       6.822663      193.9425       6.822663      538.9601 9.506672  538.9601 9.506672  -0.000000      0.000000  
1 1 1 0  10 19 o 141.2607 10.03563  13.51345       1.866713      13.51345       1.866713      13.51345       1.866713      141.2607 10.03563  141.2607 10.03563  0.000000       0.000000  
1 1 1 0  10 20 o 502.3409 10.73249  168.6660       7.176703      168.6660       7.176703      168.6660       7.176703      502.3409 10.73249  502.3409 10.73249  -0.000000      0.000000  
1 1 1 0  10 21 o 168.3869 12.56861  19.26085       2.783168      19.26085       2.783168      19.26085       2.783168      168.3869 12.56861  168.3869 12.56861  -0.000000      0.000000  
1 1 1 0  10 22 o 266.5408 11.36174  47.73662       4.018637      47.73662       4.018637      47.73662       4.018637      266.5408 11.36174  266.5408 11.36174  0.000000       0.000000  
1 1 1 0  10 23 o 35.84013 23.20629  -0.5344235E-01 2.614506      -0.5344235E-01 2.614506      -0.5344235E-01 2.614506      35.84013 23.20629  35.84013 23.20629  -0.000000      0.000000  
1 1 1 0  10 24 o 78.60009 4.270546  4.155309       0.4442430     4.155309       0.4442430     4.155309       0.4442430     78.60009 4.270546  78.60009 4.270546  0.000000       0.000000  
1 1 1 0  10 25 o 25.05400 13.65918  0.5925564      0.6468860     0.5925564      0.6468860     0.5925564      0.6468860     25.05400 13.65918  25.05400 13.65918  -0.000000      0.000000  
1 1 1 0  10 26 o 191.3131 15.47465  25.17891       3.883663      25.17891       3.883663      25.17891       3.883663      191.3131 15.47465  191.3131 15.47465  0.000000       0.000000  
1 1 1 0  10 27 o 85.99702 12.18323  5.258099       1.315390      5.258099       1.315390      5.258099       1.315390      85.99702 12.18323  85.99702 12.18323  -0.000000      0.000000  
1 1 1 0  10 28 o 37.45400 17.92193  1.403711       1.027515      1.403711       1.027515      1.403711       1.027515      37.45400 17.92193  37.45400 17.92193  -0.000000      0.000000  
1 1 1 0  10 29 o 127.9205 18.21309  11.86874       2.922836      11.86874       2.922836      11.86874       2.922836      127.9205 18.21309  127.9205 18.21309  0.000000       0.000000  
1 1 1 0  10 30 o 78.41127 31.42603  6.179456       3.187860      6.179456       3.187860      6.179456       3.187860      78.41127 31.42603  78.41127 31.42603  0.000000       0.000000  
1 1 1 0  10 31 o 30.86006 20.85172  -0.8063560     2.508790      -0.8063560     2.508790      -0.8063560     2.508790      30.86006 20.85172  30.86006 20.85172  0.000000       0.000000  
1 1 1 0  10 32 o 24.01575 17.13498  -3.118032      2.446418      -3.118032      2.446418      -3.118032      2.446418      24.01575 17.13498  24.01575 17.13498  0.000000       0.000000  
1 1 1 0  10 33 x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 0  10 34 o 96.99047 34.35307  10.45177       4.037575      10.45177       4.037575      10.45177       4.037575      96.99047 34.35307  96.99047 34.35307  0.000000       0.000000  
1 1 1 0  10 35 o 71.50449 37.60048  8.547688       4.745904      8.547688       4.745904      8.547688       4.745904      71.50449 37.60048  71.50449 37.60048  -0.000000      0.000000  
1 1 1 0  10 36 o 30.54818 21.18103  -0.9172140     2.989906      -0.9172140     2.989906      -0.9172140     2.989906      30.54818 21.18103  30.54818 21.18103  0.000000       0.000000  
1 1 1 0  11 1  o 620.0110 8.731036  256.4410       7.210155      256.4410       7.210155      256.4410       7.210155      620.0110 8.731036  620.0110 8.731036  -0.000000      0.000000  
1 1 1 0  11 2  o 496.4091 2.748991  164.2072       1.818263      164.2072       1.818263      164.2072       1.818263      496.4091 2.748991  496.4091 2.748991  -0.000000      0.000000  
1 1 1 0  11 3  o 499.8766 7.030702  166.6570       4.681030      166.6570       4.681030      166.6570       4.681030      499.8766 7.030702  499.8766 7.030702  0.000000       0.000000  
1 1 1 0  11 4  o 629.8951 3.819627  264.4167       3.205729      264.4167       3.205729      264.4167       3.205729      629.8951 3.819627  629.8951 3.819627  0.000000       0.000000  
1 1 1 0  11 5  o 589.6292 8.739161  231.9689       6.862892      231.9689       6.862892      231.9689       6.862892      589.6292 8.739161  589.6292 8.739161  -0.000000      0.000000  
1 1 1 0  11 6  o 752.6175 8.166588  377.8076       8.187915      377.8076       8.187915      377.8076       8.187915      752.6175 8.166588  752.6175 8.166588  -0.000000      0.000000  
1 1 1 0  11 7  o 193.5253 5.708120  25.02742       1.469088      25.02742       1.469088      25.02742       1.469088      193.5253 5.708120  193.5253 5.708120  -0.000000      0.000000  
1 1 1 0  11 8  o 325.4406 6.298077  70.67906       2.728891      70.67906       2.728891      70.67906       2.728891      325.4406 6.298077  325.4406 6.298077  -0.000000      0.000000  
1 1 1 0  11 9  o 295.1415 2.008107  58.04813       0.7896698     58.04813       0.7896698     58.04813       0.7896698     295.1415 2.008107  295.1415 2.008107  0.000000       0.000000  
1 1 1 0  11 10 o 269.4940 7.675638  48.54553       2.751311      48.54553       2.751311      48.54553       2.751311      269.4940 7.675638  269.4940 7.675638  0.000000       0.000000  
1 1 1 0  11 11 f 467.1964 10.03243  145.8373       6.239169      145.8373       6.239169      145.8373       6.239169      467.1964 10.03243  467.1964 10.03243  0.000000       0.000000  
1 1 1 0  11 12 o 118.0843 11.25928  9.557110       1.732341      9.557110       1.732341      9.557110       1.732341      118.0843 11.25928  118.0843 11.25928  0.000000       0.000000  
1 1 1 0  11 13 o 343.9589 10.35958  79.15646       4.738368      79.15646       4.738368      79.15646       4.738368      343.9589 10.35958  343.9589 10.35958  0.000000       0.000000  
1 1 1 0  11 14 o 158.5109 9.751569  16.95061       2.041662      16.95061       2.041662      16.95061       2.041662      158.5109 9.751569  158.5109 9.751569  -0.000000      0.000000  
1 1 1 0  11 15 o 688.8615 9.157785  316.6734       8.402780      316.6734       8.402780      316.6734       8.402780      688.8615 9.157785  688.8615 9.157785  -0.000000      0.000000  
1 1 1 0  11 16 o 22.00001 14.74380  -0.4627612     1.207045      -0.4627612     1.207045      -0.4627612     1.207045      22.00001 14.74380  22.00001 14.74380  0.000000       0.000000  
1 1 1 0  11 17 f 282.3564 8.664165  53.31877       3.252897      53.31877       3.252897      53.31877       3.252897      282.3564 8.664165  282.3564 8.664165  -0.000000      0.000000  
1 1 1 0  11 18 o 153.2789 11.34222  15.93598       2.286802      15.93598       2.286802      15.93598       2.286802      153.2789 11.34222  153.2789 11.34222  0.000000       0.000000  
1 1 1 0  11 19 o 211.3532 10.62051  30.03803       2.973761      30.03803       2.973761      30.03803       2.973761      211.3532 10.62051  211.3532 10.62051  0.000000       0.000000  
1 1 1 0  11 20 o 22.66534 15.30978  -0.6394869     1.350347      -0.6394869     1.350347      -0.6394869     1.350347      22.66534 15.30978  22.66534 15.30978  0.000000       0.000000  
1 1 1 0  11 21 o 470.4100 12.15717  148.2193       7.608982      148.2193       7.608982      148.2193       7.608982      470.4100 12.15717  470.4100 12.15717  -0.000000      0.000000  
1 1 1 0  11 22 o 552.3006 9.931814  203.9994       7.304000      203.9994       7.304000      203.9994       7.304000      552.3006 9.931814  552.3006 9.931814  -0.000000      0.000000  
1 1 1 0  11 23 o 51.72562 24.29370  2.656380       1.879724      2.656380       1.879724      2.656380       1.879724      51.72562 24.29370  51.72562 24.29370  0.000000       0.000000  
1 1 1 0  11 24 o 130.1292 13.63981  11.73528       2.300116      11.73528       2.300116      11.73528       2.300116      130.1292 13.63981  130.1292 13.63981  0.000000       0.000000  
1 1 1 0  11 25 o 36.04193 23.68841  -0.3705345     2.874306      -0.3705345     2.874306      -0.3705345     2.874306      36.04193 23.68841  36.04193 23.68841  -0.000000      0.000000  
1 1 1 0  11 26 o 112.4441 6.179183  8.519535       0.9194155     8.519535       0.9194155     8.519535       0.9194155     112.4441 6.179183  112.4441 6.179183  -0.000000      0.000000  
1 1 1 0  11 27 o 115.2784 7.781456  9.012486       1.182618      9.012486       1.182618      9.012486       1.182618      115.2784 7.781456  115.2784 7.781456  0.000000       0.000000  
1 1 1 0  11 28 o 63.16811 16.20315  3.176122       1.178778      3.176122       1.178778      3.176122       1.178778      63.16811 16.20315  63.16811 16.20315  -0.000000      0.000000  
1 1 1 0  11 29 o 76.69452 14.27008  4.377062       1.310174      4.377062       1.310174      4.377062       1.310174      76.69452 14.27008  76.69452 14.27008  -0.000000      0.000000  
1 1 1 0  11 30 o 21.81396 14.82516  -0.6350684     1.305585      -0.6350684     1.305585      -0.6350684     1.305585      21.81396 14.82516  21.81396 14.82516  0.000000       0.000000  
1 1 1 0  11 31 o 37.82852 24.60883  0.4068981      2.987880      0.4068981      2.987880      0.4068981      2.987880      37.82852 24.60883  37.82852 24.60883  0.000000       0.000000  
1 1 1 0  11 32 o 43.29992 27.23138  1.665840       3.295627      1.665840       3.295627      1.665840       3.295627      43.29992 27.23138  43.29992 27.23138  0.000000       0.000000  
1 1 1 0  11 33 o 47.62689 31.95413  1.747458       5.698645      1.747458       5.698645      1.747458       5.698645      47.62689 31.95413  47.62689 31.95413  -0.000000      0.000000  
1 1 1 0  11 34 o 35.15434 24.80161  -2.467414      4.643072      -2.467414      4.643072      -2.467414      4.643072      35.15434 24.80161  35.15434 24.80161  -0.000000      0.000000  
1 1 1 0  11 35 o 48.26694 24.82467  2.983971       2.036568      2.983971       2.036568      2.983971       2.036568      48.26694 24.82467  48.26694 24.82467  0.000000       0.000000  
1 1 1 0  12 0  o 392.4796 7.608042  102.7795       3.975531      102.7795       3.975531      102.7795       3.975531      392.4796 7.608042  392.4796 7.608042  -0.000000      0.000000  
1 1 1 0  12 1  o 432.6953 7.107304  124.9120       4.095400      124.9120       4.095400      124.9120       4.095400      432.6953 7.107304  432.6953 7.107304  0.000000       0.000000  
1 1 1 0  12 2  o 137.0465 4.825434  12.56328       0.8787263     12.56328       0.8787263     12.56328       0.8787263     137.0465 4.825434  137.0465 4.825434  0.000000       0.000000  
1 1 1 0  12 3  f 175.3382 3.924482  20.51754       0.9158849     20.51754       0.9158849     20.51754       0.9158849     175.3382 3.924482  175.3382 3.924482  -0.000000      0.000000  
1 1 1 0  12 4  o 62.55261 10.10800  2.805415       0.7765754     2.805415       0.7765754     2.805415       0.7765754     62.55261 10.10800  62.55261 10.10800  0.000000       0.000000  
1 1 1 0  12 5  o 791.4344 9.641675  417.9883       10.16473      417.9883       10.16473      417.9883       10.16473      791.4344 9.641675  791.4344 9.641675  0.000000       0.000000  
1 1 1 0  12 6  f 318.4056 6.219913  67.65794       2.636723      67.65794       2.636723      67.65794       2.636723      318.4056 6.219913  318.4056 6.219913  -0.000000      0.000000  
1 1 1 0  12 7  f 50.36000 1.350390  1.693404       0.9047154E-01 1.693404       0.9047154E-01 1.693404       0.9047154E-01 50.36000 1.350390  50.36000 1.350390  0.000000       0.000000  
1 1 1 0  12 8  o 513.7928 7.980068  176.1621       5.460494      176.1621       5.460494      176.1621       5.460494      513.7928 7.980068  513.7928 7.980068  -0.000000      0.000000  
1 1 1 0  12 9  o 353.0027 8.398737  83.24673       3.945572      83.24673       3.945572      83.24673       3.945572      353.0027 8.398737  353.0027 8.398737  -0.000000      0.000000  
1 1 1 0  12 10 o 39.11295 5.883544  1.086529       0.2861726     1.086529       0.2861726     1.086529       0.2861726     39.11295 5.883544  39.11295 5.883544  -0.000000      0.000000  
1 1 1 0  12 11 o 384.9592 7.277927  98.91424       3.730316      98.91424       3.730316      98.91424       3.730316      384.9592 7.277927  384.9592 7.277927  -0.000000      0.000000  
1 1 1 0  12 12 o 393.0137 8.182970  103.1379       4.281215      103.1379       4.281215      103.1379       4.281215      393.0137 8.182970  393.0137 8.182970  0.000000       0.000000  
1 1 1 0  12 13 o 44.08642 21.20960  1.912952       1.441314      1.912952       1.441314      1.912952       1.441314      44.08642 21.20960  44.08642 21.20960  0.000000       0.000000  
1 1 1 0  12 14 o 329.0579 10.40439  72.45768       4.551740      72.45768       4.551740      72.45768       4.551740      329.0579 10.40439  329.0579 10.40439  -0.000000      0.000000  
1 1 1 0  12 15 o 91.80457 13.87227  5.998501       1.582531      5.998501       1.582531      5.998501       1.582531      91.80457 13.87227  91.80457 13.87227  -0.000000      0.000000  
1 1 1 0  12 16 o 186.9414 10.39254  23.53079       2.570387      23.53079       2.570387      23.53079       2.570387      186.9414 10.39254  186.9414 10.39254  0.000000       0.000000  
1 1 1 0  12 17 o 23.74282 15.91382  -0.5394773     1.407031      -0.5394773     1.407031      -0.5394773     1.407031      23.74282 15.91382  23.74282 15.91382  -0.000000      0.000000  
1 1 1 0  12 18 o 276.7172 9.698152  51.27766       3.566037      51.27766       3.566037      51.27766       3.566037      276.7172 9.698152  276.7172 9.698152  -0.000000      0.000000  
1 1 1 0  12 19 o 22.88986 15.06313  -0.2215704     1.167818      -0.2215704     1.167818      -0.2215704     1.167818      22.88986 15.06313  22.88986 15.06313  -0.000000      0.000000  
1 1 1 0  12 20 o 30.22326 20.27641  -0.8775732     2.293962      -0.8775732     2.293962      -0.8775732     2.293962      30.22326 20.27641  30.22326 20.27641  0.000000       0.000000  
1 1 1 0  12 21 o 119.2530 17.03776  10.10463       2.547614      10.10463       2.547614      10.10463       2.547614      119.2530 17.03776  119.2530 17.03776  0.000000       0.000000  
1 1 1 0  12 22 o 143.1505 13.28813  14.08093       2.481724      14.08093       2.481724      14.08093       2.481724      143.1505 13.28813  143.1505 13.28813  -0.000000      0.000000  
1 1 1 0  12 23 o 336.6855 11.29646  76.17485       5.055101      76.17485       5.055101      76.17485       5.055101      336.6855 11.29646  336.6855 11.29646  0.000000       0.000000  
1 1 1 0  12 24 o 45.60440 24.14931  2.066278       1.968623      2.066278       1.968623      2.066278       1.968623      45.60440 24.14931  45.60440 24.14931  -0.000000      0.000000  
1 1 1 0  12 25 o 240.4133 18.03899  39.86882       5.702311      39.86882       5.702311      39.86882       5.702311      240.4133 18.03899  240.4133 18.03899  0.000000       0.000000  
1 1 1 0  12 26 o 29.65770 20.59975  -2.344985      2.860426      -2.344985      2.860426      -2.344985      2.860426      29.65770 20.59975  29.65770 20.59975  0.000000       0.000000  
1 1 1 0  12 27 o 60.09769 6.210529  2.489743       0.4841152     2.489743       0.4841152     2.489743       0.4841152     60.09769 6.210529  60.09769 6.210529  0.000000       0.000000  
1 1 1 0  12 28 o 84.44154 7.483931  4.888556       0.8261797     4.888556       0.8261797     4.888556       0.8261797     84.44154 7.483931  84.44154 7.483931  -0.000000      0.000000  
1 1 1 0  12 29 o 21.30154 11.75012  0.4282363      0.4847206     0.4282363      0.4847206     0.4282363      0.4847206     21.30154 11.75012  21.30154 11.75012  -0.000000      0.000000  
1 1 1 0  12 30 o 24.62648 14.68762  0.4724037      0.8496857     0.4724037      0.8496857     0.4724037      0.8496857     24.62648 14.68762  24.62648 14.68762  -0.000000      0.000000  
1 1 1 0  12 31 o 40.22478 27.54080  -1.157996      4.688107      -1.157996      4.688107      -1.157996      4.688107      40.22478 27.54080  40.22478 27.54080  -0.000000      0.000000  
1 1 1 0  12 32 o 48.73214 28.07158  2.939640       2.926784      2.939640       2.926784      2.939640       2.926784      48.73214 28.07158  48.73214 28.07158  -0.000000      0.000000  
1 1 1 0  12 33 o 51.42154 33.79571  3.484318       5.849803      3.484318       5.849803      3.484318       5.849803      51.42154 33.79571  51.42154 33.79571  0.000000       0.000000  
1 1 1 0  12 34 o 30.42871 21.06577  -1.092613      2.928678      -1.092613      2.928678      -1.092613      2.928678      30.42871 21.06577  30.42871 21.06577  -0.000000      0.000000  
1 1 1 0  12 35 o 30.15171 20.45355  -0.2204680     2.461583      -0.2204680     2.461583      -0.2204680     2.461583      30.15171 20.45355  30.15171 20.45355  -0.000000      0.000000  
1 1 1 0  13 1  o 314.4617 6.037730  65.98812       2.527864      65.98812       2.527864      65.98812       2.527864      314.4617 6.037730  314.4617 6.037730  0.000000       0.000000  
1 1 1 0  13 2  o 172.5917 5.006585  19.90308       1.149230      19.90308       1.149230      19.90308       1.149230      172.5917 5.006585  172.5917 5.006585  -0.000000      0.000000  
1 1 1 0  13 3  o 540.9905 3.007634  195.0362       2.167993      195.0362       2.167993      195.0362       2.167993      540.9905 3.007634  540.9905 3.007634  -0.000000      0.000000  
1 1 1 0  13 4  o 704.5103 3.847602  330.7829       3.611784      330.7829       3.611784      330.7829       3.611784      704.5103 3.847602  704.5103 3.847602  -0.000000      0.000000  
1 1 1 0  13 5  o 320.5258 6.540099  68.57458       2.790697      68.57458       2.790697      68.57458       2.790697      320.5258 6.540099  320.5258 6.540099  0.000000       0.000000  
1 1 1 0  13 6  o 645.0508 10.13631  277.8248       8.707739      277.8248       8.707739      277.8248       8.707739      645.0508 10.13631  645.0508 10.13631  -0.000000      0.000000  
1 1 1 0  13 7  o 1082.821 13.05957  783.3943       18.83721      783.3943       18.83721      783.3943       18.83721      1082.821 13.05957  1082.821 13.05957  -0.000000      0.000000  
1 1 1 0  13 8  o 413.8622 8.533710  114.3793       4.701651      114.3793       4.701651      114.3793       4.701651      413.8622 8.533710  413.8622 8.533710  -0.000000      0.000000  
1 1 1 0  13 9  o 425.1713 8.650032  120.7139       4.896091      120.7139       4.896091      120.7139       4.896091      425.1713 8.650032  425.1713 8.650032  -0.000000      0.000000  
1 1 1 0  13 10 o 21.91587 13.60211  0.2130370      0.7945372     0.2130370      0.7945372     0.2130370      0.7945372     21.91587 13.60211  21.91587 13.60211  -0.000000      0.000000  
1 1 1 0  13 11 o 354.9675 8.479218  84.17219       4.005510      84.17219       4.005510      84.17219       4.005510      354.9675 8.479218  354.9675 8.479218  -0.000000      0.000000  
1 1 1 0  13 12 o 241.8215 7.721495  39.10991       2.482362      39.10991       2.482362      39.10991       2.482362      241.8215 7.721495  241.8215 7.721495  -0.000000      0.000000  
1 1 1 0  13 13 f 364.5267 7.018270  88.68526       3.406196      88.68526       3.406196      88.68526       3.406196      364.5267 7.018270  364.5267 7.018270  0.000000       0.000000  
1 1 1 0  13 14 o 24.48766 14.94570  0.3438562      0.9223436     0.3438562      0.9223436     0.3438562      0.9223436     24.48766 14.94570  24.48766 14.94570  -0.000000      0.000000  
1 1 1 0  13 15 o 255.7362 7.935803  43.73475       2.698411      43.73475       2.698411      43.73475       2.698411      255.7362 7.935803  255.7362 7.935803  0.000000       0.000000  
1 1 1 0  13 16 o 392.0658 7.952866  102.6294       4.151000      102.6294       4.151000      102.6294       4.151000      392.0658 7.952866  392.0658 7.952866  -0.000000      0.000000  
1 1 1 0  13 17 o 62.79715 27.55692  3.805221       2.407892      3.805221       2.407892      3.805221       2.407892      62.79715 27.55692  62.79715 27.55692  -0.000000      0.000000  
1 1 1 0  13 18 o 462.8791 13.59063  143.5934       8.366275      143.5934       8.366275      143.5934       8.366275      462.8791 13.59063  462.8791 13.59063  0.000000       0.000000  
1 1 1 0  13 19 o 34.83087 22.12051  0.2730336      2.235447      0.2730336      2.235447      0.2730336      2.235447      34.83087 22.12051  34.83087 22.12051  0.000000       0.000000  
1 1 1 0  13 20 o 211.8072 13.51328  30.39721       3.777904      30.39721       3.777904      30.39721       3.777904      211.8072 13.51328  211.8072 13.51328  -0.000000      0.000000  
1 1 1 0  13 21 o 33.17838 20.34729  0.6237961      1.728029      0.6237961      1.728029      0.6237961      1.728029      33.17838 20.34729  33.17838 20.34729  0.000000       0.000000  
1 1 1 0  13 22 o 241.9508 14.02349  39.69543       4.486177      39.69543       4.486177      39.69543       4.486177      241.9508 14.02349  241.9508 14.02349  0.000000       0.000000  
1 1 1 0  13 23 o 25.60722 18.13998  -3.222024      2.569394      -3.222024      2.569394      -3.222024      2.569394      25.60722 18.13998  25.60722 18.13998  -0.000000      0.000000  
1 1 1 0  13 24 o 312.6428 12.74805  66.03875       5.290758      66.03875       5.290758      66.03875       5.290758      312.6428 12.74805  312.6428 12.74805  -0.000000      0.000000  
1 1 1 0  13 25 o 139.8190 22.13964  14.32010       3.815726      14.32010       3.815726      14.32010       3.815726      139.8190 22.13964  139.8190 22.13964  -0.000000      0.000000  
1 1 1 0  13 26 o 48.84695 24.82878  2.448967       2.022730      2.448967       2.022730      2.448967       2.022730      48.84695 24.82878  48.84695 24.82878  -0.000000      0.000000  
1 1 1 0  13 27 o 194.9620 14.81780  26.28440       3.797117      26.28440       3.797117      26.28440       3.797117      194.9620 14.81780  194.9620 14.81780  -0.000000      0.000000  
1 1 1 0  13 28 o 76.86037 5.161562  4.001774       0.5230809     4.001774       0.5230809     4.001774       0.5230809     76.86037 5.161562  76.86037 5.161562  0.000000       0.000000  
1 1 1 0  13 29 o 65.08628 9.612174  3.038430       0.7803551     3.038430       0.7803551     3.038430       0.7803551     65.08628 9.612174  65.08628 9.612174  0.000000       0.000000  
1 1 1 0  13 30 o 14.78000 10.70758  -2.185468      1.132114      -2.185468      1.132114      -2.185468      1.132114      14.78000 10.70758  14.78000 10.70758  0.000000       0.000000  
1 1 1 0  13 31 o 24.89076 17.50363  -2.024778      2.254254      -2.024778      2.254254      -2.024778      2.254254      24.89076 17.50363  24.89076 17.50363  -0.000000      0.000000  
1 1 1 0  13 32 o 15.23213 10.89900  -1.472559      1.017956      -1.472559      1.017956      -1.472559      1.017956      15.23213 10.89900  15.23213 10.89900  -0.000000      0.000000  
1 1 1 0  13 33 o 32.80286 21.52666  0.4054123      2.359964      0.4054123      2.359964      0.4054123      2.359964      32.80286 21.52666  32.80286 21.52666  -0.000000      0.000000  
1 1 1 0  13 34 o 31.90504 20.16872  0.8294293      1.833812      0.8294293      1.833812      0.8294293      1.833812      31.90504 20.16872  31.90504 20.16872  -0.000000      0.000000  
1 1 1 0  14 0  f 745.7900 11.15549  371.1430       11.08051      371.1430       11.08051      371.1430       11.08051      745.7900 11.15549  745.7900 11.15549  0.000000       0.000000  
1 1 1 0  14 1  o 30.95430 17.12953  0.8798569      1.033872      0.8798569      1.033872      0.8798569      1.033872      30.95430 17.12953  30.95430 17.12953  0.000000       0.000000  
1 1 1 0  14 2  o 190.4343 4.677961  24.21307       1.185449      24.21307       1.185449      24.21307       1.185449      190.4343 4.677961  190.4343 4.677961  0.000000       0.000000  
1 1 1 0  14 3  o 26.54339 14.36908  0.6650229      0.7108384     0.6650229      0.7108384     0.6650229      0.7108384     26.54339 14.36908  26.54339 14.36908  0.000000       0.000000  
1 1 1 0  14 4  o 545.3337 8.725540  198.4979       6.336908      198.4979       6.336908      198.4979       6.336908      545.3337 8.725540  545.3337 8.725540  -0.000000      0.000000  
1 1 1 0  14 5  f 60.08222 13.38748  2.738272       0.9364197     2.738272       0.9364197     2.738272       0.9364197     60.08222 13.38748  60.08222 13.38748  -0.000000      0.000000  
1 1 1 0  14 6  o 94.07278 7.226296  6.003998       0.8932317     6.003998       0.8932317     6.003998       0.8932317     94.07278 7.226296  94.07278 7.226296  0.000000       0.000000  
1 1 1 0  14 7  o 239.9150 5.395167  38.42261       1.722819      38.42261       1.722819      38.42261       1.722819      239.9150 5.395167  239.9150 5.395167  -0.000000      0.000000  
1 1 1 0  14 8  o 855.4098 11.70464  488.6736       13.33591      488.6736       13.33591      488.6736       13.33591      855.4098 11.70464  855.4098 11.70464  0.000000       0.000000  
1 1 1 0  14 9  o 224.3678 11.51891  33.86117       3.423029      33.86117       3.423029      33.86117       3.423029      224.3678 11.51891  224.3678 11.51891  0.000000       0.000000  
1 1 1 0  14 10 o 54.85249 21.98274  2.788806       1.559883      2.788806       1.559883      2.788806       1.559883      54.85249 21.98274  54.85249 21.98274  -0.000000      0.000000  
1 1 1 0  14 11 o 311.9962 8.762498  65.06961       3.636431      65.06961       3.636431      65.06961       3.636431      311.9962 8.762498  311.9962 8.762498  -0.000000      0.000000  
1 1 1 0  14 12 o 426.3241 7.505698  121.2906       4.260895      121.2906       4.260895      121.2906       4.260895      426.3241 7.505698  426.3241 7.505698  -0.000000      0.000000  
1 1 1 0  14 13 o 463.7092 7.993520  143.5048       4.935898      143.5048       4.935898      143.5048       4.935898      463.7092 7.993520  463.7092 7.993520  -0.000000      0.000000  
1 1 1 0  14 14 o 208.5426 6.442664  29.07402       1.786461      29.07402       1.786461      29.07402       1.786461      208.5426 6.442664  208.5426 6.442664  0.000000       0.000000  
1 1 1 0  14 15 o 522.7385 8.717374  182.4054       6.068359      182.4054       6.068359      182.4054       6.068359      522.7385 8.717374  522.7385 8.717374  -0.000000      0.000000  
1 1 1 0  14 16 o 72.80494 17.96824  4.127728       1.509015      4.127728       1.509015      4.127728       1.509015      72.80494 17.96824  72.80494 17.96824  -0.000000      0.000000  
1 1 1 0  14 17 o 163.1605 13.80129  18.17500       2.949324      18.17500       2.949324      18.17500       2.949324      163.1605 13.80129  163.1605 13.80129  0.000000       0.000000  
1 1 1 0  14 18 o 79.23374 19.42253  4.890465       1.775891      4.890465       1.775891      4.890465       1.775891      79.23374 19.42253  79.23374 19.42253  0.000000       0.000000  
1 1 1 0  14 19 o 35.68452 21.41226  0.8849691      1.827117      0.8849691      1.827117      0.8849691      1.827117      35.68452 21.41226  35.68452 21.41226  -0.000000      0.000000  
1 1 1 0  14 20 o 106.3599 17.75686  8.204595       2.305976      8.204595       2.305976      8.204595       2.305976      106.3599 17.75686  106.3599 17.75686  0.000000       0.000000  
1 1 1 0  14 21 o 207.3412 11.66531  29.06508       3.199455      29.06508       3.199455      29.06508       3.199455      207.3412 11.66531  207.3412 11.66531  -0.000000      0.000000  
1 1 1 0  14 22 o 235.7157 12.21680  37.57111       3.813580      37.57111       3.813580      37.57111       3.813580      235.7157 12.21680  235.7157 12.21680  -0.000000      0.000000  
1 1 1 0  14 23 o 235.1428 13.21478  37.53428       4.110483      37.53428       4.110483      37.53428       4.110483      235.1428 13.21478  235.1428 13.21478  -0.000000      0.000000  
1 1 1 0  14 24 f 31.12109 21.27459  -1.598033      2.773526      -1.598033      2.773526      -1.598033      2.773526      31.12109 21.27459  31.12109 21.27459  -0.000000      0.000000  
1 1 1 0  14 25 o 91.72430 27.68595  7.182620       2.950292      7.182620       2.950292      7.182620       2.950292      91.72430 27.68595  91.72430 27.68595  -0.000000      0.000000  
1 1 1 0  14 26 o 37.94471 25.63681  -1.348761      3.790977      -1.348761      3.790977      -1.348761      3.790977      37.94471 25.63681  37.94471 25.63681  0.000000       0.000000  
1 1 1 0  14 27 o 37.73566 23.70718  0.7249798      2.490728      0.7249798      2.490728      0.7249798      2.490728      37.73566 23.70718  37.73566 23.70718  -0.000000      0.000000  
1 1 1 0  14 28 o 44.58650 24.80508  2.066277       2.181429      2.066277       2.181429      2.066277       2.181429      44.58650 24.80508  44.58650 24.80508  -0.000000      0.000000  
1 1 1 0  14 29 o 31.76701 20.79082  0.3142596E-01  2.179442      0.3142596E-01  2.179442      0.3142596E-01  2.179442      31.76701 20.79082  31.76701 20.79082  0.000000       0.000000  
1 1 1 0  14 30 o 66.00564 8.327360  3.085358       0.7007847     3.085358       0.7007847     3.085358       0.7007847     66.00564 8.327360  66.00564 8.327360  -0.000000      0.000000  
1 1 1 0  14 31 o 60.62172 32.87698  5.083651       3.727950      5.083651       3.727950      5.083651       3.727950      60.62172 32.87698  60.62172 32.87698  -0.000000      0.000000  
1 1 1 0  14 32 o 16.42161 11.30812  -0.5219219     0.8168362     -0.5219219     0.8168362     -0.5219219     0.8168362     16.42161 11.30812  16.42161 11.30812  -0.000000      0.000000  
1 1 1 0  14 33 o 22.05018 14.88088  -0.3400004     1.270220      -0.3400004     1.270220      -0.3400004     1.270220      22.05018 14.88088  22.05018 14.88088  -0.000000      0.000000  
1 1 1 0  14 34 o 23.91528 16.20867  -0.3822648     1.538981      -0.3822648     1.538981      -0.3822648     1.538981      23.91528 16.20867  23.91528 16.20867  0.000000       0.000000  
1 1 1 0  15 1  o 32.77364 18.97573  0.8822318      1.347864      0.8822318      1.347864      0.8822318      1.347864      32.77364 18.97573  32.77364 18.97573  0.000000       0.000000  
1 1 1 0  15 2  o 35.21237 14.57401  1.162076       0.6794174     1.162076       0.6794174     1.162076       0.6794174     35.21237 14.57401  35.21237 14.57401  -0.000000      0.000000  
1 1 1 0  15 3  o 131.9750 6.538211  11.69622       1.143338      11.69622       1.143338      11.69622       1.143338      131.9750 6.538211  131.9750 6.538211  0.000000       0.000000  
1 1 1 0  15 4  o 680.0612 3.747020  308.2184       3.395298      308.2184       3.395298      308.2184       3.395298      680.0612 3.747020  680.0612 3.747020  0.000000       0.000000  
1 1 1 0  15 5  o 251.1750 7.264844  42.16737       2.426906      42.16737       2.426906      42.16737       2.426906      251.1750 7.264844  251.1750 7.264844  -0.000000      0.000000  
1 1 1 0  15 6  o 97.45009 9.606748  6.516658       1.217662      6.516658       1.217662      6.516658       1.217662      97.45009 9.606748  97.45009 9.606748  0.000000       0.000000  
1 1 1 0  15 7  o 54.16691 7.533003  2.066420       0.5136916     2.066420       0.5136916     2.066420       0.5136916     54.16691 7.533003  54.16691 7.533003  -0.000000      0.000000  
1 1 1 0  15 8  o 605.9219 7.865225  244.9213       6.347993      244.9213       6.347993      244.9213       6.347993      605.9219 7.865225  605.9219 7.865225  0.000000       0.000000  
1 1 1 0  15 9  o 681.7892 12.99933  310.6732       11.80017      310.6732       11.80017      310.6732       11.80017      681.7892 12.99933  681.7892 12.99933  0.000000       0.000000  
1 1 1 0  15 10 o 22.20235 14.99794  -0.6192240     1.296275      -0.6192240     1.296275      -0.6192240     1.296275      22.20235 14.99794  22.20235 14.99794  0.000000       0.000000  
1 1 1 0  15 11 o 145.6366 10.65661  14.37625       2.042067      14.37625       2.042067      14.37625       2.042067      145.6366 10.65661  145.6366 10.65661  -0.000000      0.000000  
1 1 1 0  15 12 f 271.2205 8.743958  49.21039       3.152677      49.21039       3.152677      49.21039       3.152677      271.2205 8.743958  271.2205 8.743958  0.000000       0.000000  
1 1 1 0  15 13 f 164.8153 6.805174  18.20193       1.488744      18.20193       1.488744      18.20193       1.488744      164.8153 6.805174  164.8153 6.805174  -0.000000      0.000000  
1 1 1 0  15 14 o 24.18568 6.972960  0.4753767      0.1948808     0.4753767      0.1948808     0.4753767      0.1948808     24.18568 6.972960  24.18568 6.972960  -0.000000      0.000000  
1 1 1 0  15 15 o 406.1598 10.60586  110.3403       5.731214      110.3403       5.731214      110.3403       5.731214      406.1598 10.60586  406.1598 10.60586  0.000000       0.000000  
1 1 1 0  15 16 o 442.8515 8.612160  131.0027       5.077770      131.0027       5.077770      131.0027       5.077770      442.8515 8.612160  442.8515 8.612160  0.000000       0.000000  
1 1 1 0  15 17 o 732.4598 10.40172  358.5600       10.14764      358.5600       10.14764      358.5600       10.14764      732.4598 10.40172  732.4598 10.40172  0.000000       0.000000  
1 1 1 0  15 18 o 296.4657 9.532807  58.88949       3.757072      58.88949       3.757072      58.88949       3.757072      296.4657 9.532807  296.4657 9.532807  -0.000000      0.000000  
1 1 1 0  15 19 o 29.80450 19.37195  -0.1109875     1.845867      -0.1109875     1.845867      -0.1109875     1.845867      29.80450 19.37195  29.80450 19.37195  0.000000       0.000000  
1 1 1 0  15 20 o 334.3949 10.50066  75.04600       4.668507      75.04600       4.668507      75.04600       4.668507      334.3949 10.50066  334.3949 10.50066  0.000000       0.000000  
1 1 1 0  15 21 o 32.10472 19.83585  0.5388443      1.671113      0.5388443      1.671113      0.5388443      1.671113      32.10472 19.83585  32.10472 19.83585  -0.000000      0.000000  
1 1 1 0  15 22 f 255.0143 12.67874  44.02346       4.283975      44.02346       4.283975      44.02346       4.283975      255.0143 12.67874  255.0143 12.67874  0.000000       0.000000  
1 1 1 0  15 23 o 36.78991 22.28893  0.9258887      2.018940      0.9258887      2.018940      0.9258887      2.018940      36.78991 22.28893  36.78991 22.28893  -0.000000      0.000000  
1 1 1 0  15 24 o 30.51092 20.48296  -0.8107632     2.348029      -0.8107632     2.348029      -0.8107632     2.348029      30.51092 20.48296  30.51092 20.48296  -0.000000      0.000000  
1 1 1 0  15 25 o 306.7301 14.21812  64.19654       5.782747      64.19654       5.782747      64.19654       5.782747      306.7301 14.21812  306.7301 14.21812  -0.000000      0.000000  
1 1 1 0  15 26 o 36.80201 23.46882  0.4565997      2.547182      0.4565997      2.547182      0.4565997      2.547182      36.80201 23.46882  36.80201 23.46882  0.000000       0.000000  
1 1 1 0  15 27 o 23.28622 16.81550  -4.680568      2.681168      -4.680568      2.681168      -4.680568      2.681168      23.28622 16.81550  23.28622 16.81550  0.000000       0.000000  
1 1 1 0  15 28 o 22.16693 15.63739  -1.980038      1.844315      -1.980038      1.844315      -1.980038      1.844315      22.16693 15.63739  22.16693 15.63739  -0.000000      0.000000  
1 1 1 0  15 29 o 53.65437 27.34735  3.349575       2.457825      3.349575       2.457825      3.349575       2.457825      53.65437 27.34735  53.65437 27.34735  0.000000       0.000000  
1 1 1 0  15 30 o 48.44061 25.75164  2.805362       2.245824      2.805362       2.245824      2.805362       2.245824      48.44061 25.75164  48.44061 25.75164  -0.000000      0.000000  
1 1 1 0  15 31 o 48.42266 30.08398  2.960034       3.896410      2.960034       3.896410      2.960034       3.896410      48.42266 30.08398  48.42266 30.08398  -0.000000      0.000000  
1 1 1 0  15 32 o 55.29626 16.89672  2.712073       1.087519      2.712073       1.087519      2.712073       1.087519      55.29626 16.89672  55.29626 16.89672  0.000000       0.000000  
1 1 1 0  15 33 o 26.72262 14.99615  0.7470891      0.8057632     0.7470891      0.8057632     0.7470891      0.8057632     26.72262 14.99615  26.72262 14.99615  0.000000       0.000000  
1 1 1 0  16 0  f 1015.792 14.99728  688.8688       20.28978      688.8688       20.28978      688.8688       20.28978      1015.792 14.99728  1015.792 14.99728  0.000000       0.000000  
1 1 1 0  16 1  o 52.31763 16.23778  2.284845       0.9914663     2.284845       0.9914663     2.284845       0.9914663     52.31763 16.23778  52.31763 16.23778  -0.000000      0.000000  
1 1 1 0  16 2  o 312.5201 5.994764  65.17318       2.494382      65.17318       2.494382      65.17318       2.494382      312.5201 5.994764  312.5201 5.994764  0.000000       0.000000  
1 1 1 0  16 3  o 771.8265 4.281908  397.0269       4.403525      397.0269       4.403525      397.0269       4.403525      771.8265 4.281908  771.8265 4.281908  -0.000000      0.000000  
1 1 1 0  16 4  o 269.7935 10.55309  48.78329       3.780681      48.78329       3.780681      48.78329       3.780681      269.7935 10.55309  269.7935 10.55309  -0.000000      0.000000  
1 1 1 0  16 5  o 146.3612 9.952900  14.48603       1.920167      14.48603       1.920167      14.48603       1.920167      146.3612 9.952900  146.3612 9.952900  0.000000       0.000000  
1 1 1 0  16 6  o 54.63214 22.89402  2.818178       1.672006      2.818178       1.672006      2.818178       1.672006      54.63214 22.89402  54.63214 22.89402  0.000000       0.000000  
1 1 1 0  16 7  o 226.2619 6.450254  34.20880       1.941166      34.20880       1.941166      34.20880       1.941166      226.2619 6.450254  226.2619 6.450254  -0.000000      0.000000  
1 1 1 0  16 8  o 244.0727 6.282340  39.78770       2.040156      39.78770       2.040156      39.78770       2.040156      244.0727 6.282340  244.0727 6.282340  0.000000       0.000000  
1 1 1 0  16 9  o 195.6628 4.889246  25.56222       1.272948      25.56222       1.272948      25.56222       1.272948      195.6628 4.889246  195.6628 4.889246  0.000000       0.000000  
1 1 1 0  16 10 o 208.1618 9.903495  29.10074       2.732800      29.10074       2.732800      29.10074       2.732800      208.1618 9.903495  208.1618 9.903495  -0.000000      0.000000  
1 1 1 0  16 11 o 135.4035 9.660262  12.41564       1.722201      12.41564       1.722201      12.41564       1.722201      135.4035 9.660262  135.4035 9.660262  0.000000       0.000000  
1 1 1 0  16 12 o 104.6042 10.61994  7.524315       1.442467      7.524315       1.442467      7.524315       1.442467      104.6042 10.61994  104.6042 10.61994  0.000000       0.000000  
1 1 1 0  16 13 o 211.4643 7.463511  29.93086       2.097122      29.93086       2.097122      29.93086       2.097122      211.4643 7.463511  211.4643 7.463511  -0.000000      0.000000  
1 1 1 0  16 14 o 555.1162 9.012602  205.7780       6.662688      205.7780       6.662688      205.7780       6.662688      555.1162 9.012602  555.1162 9.012602  0.000000       0.000000  
1 1 1 0  16 15 o 238.5121 4.657965  37.96300       1.479130      37.96300       1.479130      37.96300       1.479130      238.5121 4.657965  238.5121 4.657965  0.000000       0.000000  
1 1 1 0  16 16 f 447.5679 8.435253  133.8441       5.026694      133.8441       5.026694      133.8441       5.026694      447.5679 8.435253  447.5679 8.435253  0.000000       0.000000  
1 1 1 0  16 17 o 70.69181 3.026876  3.348701       0.2839341     3.348701       0.2839341     3.348701       0.2839341     70.69181 3.026876  70.69181 3.026876  0.000000       0.000000  
1 1 1 0  16 18 o 199.0404 9.589993  26.66328       2.529991      26.66328       2.529991      26.66328       2.529991      199.0404 9.589993  199.0404 9.589993  0.000000       0.000000  
1 1 1 0  16 19 o 117.5202 3.225638  9.226380       0.5042677     9.226380       0.5042677     9.226380       0.5042677     117.5202 3.225638  117.5202 3.225638  0.000000       0.000000  
1 1 1 0  16 20 o 30.61169 19.20212  0.3610916      1.627331      0.3610916      1.627331      0.3610916      1.627331      30.61169 19.20212  30.61169 19.20212  0.000000       0.000000  
1 1 1 0  16 21 o 144.3418 12.55606  14.30909       2.371189      14.30909       2.371189      14.30909       2.371189      144.3418 12.55606  144.3418 12.55606  -0.000000      0.000000  
1 1 1 0  16 22 o 119.0865 13.16239  9.884921       2.023612      9.884921       2.023612      9.884921       2.023612      119.0865 13.16239  119.0865 13.16239  -0.000000      0.000000  
1 1 1 0  16 23 o 126.8490 16.63317  11.45471       2.677559      11.45471       2.677559      11.45471       2.677559      126.8490 16.63317  126.8490 16.63317  0.000000       0.000000  
1 1 1 0  16 24 o 141.4812 21.39633  14.68377       3.761131      14.68377       3.761131      14.68377       3.761131      141.4812 21.39633  141.4812 21.39633  0.000000       0.000000  
1 1 1 0  16 25 o 32.07338 21.06372  -0.1933630     2.265951      -0.1933630     2.265951      -0.1933630     2.265951      32.07338 21.06372  32.07338 21.06372  0.000000       0.000000  
1 1 1 0  16 26 o 47.64127 27.84190  2.225325       2.945247      2.225325       2.945247      2.225325       2.945247      47.64127 27.84190  47.64127 27.84190  -0.000000      0.000000  
1 1 1 0  16 27 o 39.71564 25.90398  0.3595112      3.341396      0.3595112      3.341396      0.3595112      3.341396      39.71564 25.90398  39.71564 25.90398  0.000000       0.000000  
1 1 1 0  16 28 o 33.58398 23.00295  -1.276950      3.277562      -1.276950      3.277562      -1.276950      3.277562      33.58398 23.00295  33.58398 23.00295  0.000000       0.000000  
1 1 1 0  16 29 o 27.70804 19.41851  -2.090500      2.704357      -2.090500      2.704357      -2.090500      2.704357      27.70804 19.41851  27.70804 19.41851  -0.000000      0.000000  
1 1 1 0  16 30 o 32.12876 21.18190  0.1684116      2.325794      0.1684116      2.325794      0.1684116      2.325794      32.12876 21.18190  32.12876 21.18190  -0.000000      0.000000  
1 1 1 0  16 31 o 62.84453 40.31795  8.610922       7.657952      8.610922       7.657952      8.610922       7.657952      62.84453 40.31795  62.84453 40.31795  0.000000       0.000000  
1 1 1 0  16 32 o 67.93661 8.493356  3.306648       0.7364191     3.306648       0.7364191     3.306648       0.7364191     67.93661 8.493356  67.93661 8.493356  0.000000       0.000000  
1 1 1 0  17 1  o 532.4850 8.350216  189.2057       5.921584      189.2057       5.921584      189.2057       5.921584      532.4850 8.350216  532.4850 8.350216  -0.000000      0.000000  
1 1 1 0  17 2  o 312.0104 7.618174  65.02096       3.163065      65.02096       3.163065      65.02096       3.163065      312.0104 7.618174  312.0104 7.618174  -0.000000      0.000000  
1 1 1 0  17 3  o 450.1413 8.170053  135.2421       4.896936      135.2421       4.896936      135.2421       4.896936      450.1413 8.170053  450.1413 8.170053  0.000000       0.000000  
1 1 1 0  17 4  o 410.5713 9.236371  112.5943       5.047391      112.5943       5.047391      112.5943       5.047391      410.5713 9.236371  410.5713 9.236371  0.000000       0.000000  
1 1 1 0  17 5  o 692.6589 6.055531  319.8688       5.588181      319.8688       5.588181      319.8688       5.588181      692.6589 6.055531  692.6589 6.055531  0.000000       0.000000  
1 1 1 0  17 6  o 27.48824 17.06851  0.3341709      1.252542      0.3341709      1.252542      0.3341709      1.252542      27.48824 17.06851  27.48824 17.06851  0.000000       0.000000  
1 1 1 0  17 7  o 148.5251 10.75542  14.94804       2.102455      14.94804       2.102455      14.94804       2.102455      148.5251 10.75542  148.5251 10.75542  0.000000       0.000000  
1 1 1 0  17 8  o 10.84383 7.342136  -0.1606248     0.3142139     -0.1606248     0.3142139     -0.1606248     0.3142139     10.84383 7.342136  10.84383 7.342136  0.000000       0.000000  
1 1 1 0  17 9  o 156.1282 5.717090  16.31323       1.185781      16.31323       1.185781      16.31323       1.185781      156.1282 5.717090  156.1282 5.717090  -0.000000      0.000000  
1 1 1 0  17 10 o 773.5359 10.50747  399.5334       10.82609      399.5334       10.82609      399.5334       10.82609      773.5359 10.50747  773.5359 10.50747  0.000000       0.000000  
1 1 1 0  17 11 o 47.86665 20.79497  2.194954       1.372186      2.194954       1.372186      2.194954       1.372186      47.86665 20.79497  47.86665 20.79497  0.000000       0.000000  
1 1 1 0  17 12 o 236.0527 11.40975  37.47072       3.569683      37.47072       3.569683      37.47072       3.569683      236.0527 11.40975  236.0527 11.40975  0.000000       0.000000  
1 1 1 0  17 13 o 105.2337 7.304795  7.492270       1.012789      7.492270       1.012789      7.492270       1.012789      105.2337 7.304795  105.2337 7.304795  0.000000       0.000000  
1 1 1 0  17 14 o 68.83974 12.15359  3.446485       1.011137      3.446485       1.011137      3.446485       1.011137      68.83974 12.15359  68.83974 12.15359  0.000000       0.000000  
1 1 1 0  17 15 o 653.0944 10.21764  285.2139       8.887107      285.2139       8.887107      285.2139       8.887107      653.0944 10.21764  653.0944 10.21764  0.000000       0.000000  
1 1 1 0  17 16 o 146.8695 1.189192  14.37514       0.2326983     14.37514       0.2326983     14.37514       0.2326983     146.8695 1.189192  146.8695 1.189192  0.000000       0.000000  
1 1 1 0  17 17 o 46.59756 2.422812  1.458684       0.1495038     1.458684       0.1495038     1.458684       0.1495038     46.59756 2.422812  46.59756 2.422812  0.000000       0.000000  
1 1 1 0  17 18 o 95.77032 9.997298  6.333016       1.241070      6.333016       1.241070      6.333016       1.241070      95.77032 9.997298  95.77032 9.997298  0.000000       0.000000  
1 1 1 0  17 19 o 20.31646 13.46429  -0.2401559     0.9595222     -0.2401559     0.9595222     -0.2401559     0.9595222     20.31646 13.46429  20.31646 13.46429  0.000000       0.000000  
1 1 1 0  17 20 o 46.11294 17.14001  1.921638       0.9786020     1.921638       0.9786020     1.921638       0.9786020     46.11294 17.14001  46.11294 17.14001  0.000000       0.000000  
1 1 1 0  17 21 o 52.64946 26.09322  2.831126       2.205558      2.831126       2.205558      2.831126       2.205558      52.64946 26.09322  52.64946 26.09322  0.000000       0.000000  
1 1 1 0  17 22 o 269.3730 9.696471  48.86290       3.470253      48.86290       3.470253      48.86290       3.470253      269.3730 9.696471  269.3730 9.696471  0.000000       0.000000  
1 1 1 0  17 23 o 146.0446 15.51892  14.97096       2.934376      14.97096       2.934376      14.97096       2.934376      146.0446 15.51892  146.0446 15.51892  0.000000       0.000000  
1 1 1 0  17 24 o 163.4703 16.87402  18.89250       3.578083      18.89250       3.578083      18.89250       3.578083      163.4703 16.87402  163.4703 16.87402  0.000000       0.000000  
1 1 1 0  17 25 o 114.6982 26.38918  10.67105       3.511212      10.67105       3.511212      10.67105       3.511212      114.6982 26.38918  114.6982 26.38918  0.000000       0.000000  
1 1 1 0  17 26 o 39.44374 26.21177  -0.2059074     3.677640      -0.2059074     3.677640      -0.2059074     3.677640      39.44374 26.21177  39.44374 26.21177  0.000000       0.000000  
1 1 1 0  17 27 o 51.00311 30.29354  2.937726       3.586773      2.937726       3.586773      2.937726       3.586773      51.00311 30.29354  51.00311 30.29354  0.000000       0.000000  
1 1 1 0  17 28 o 65.85925 32.59954  5.475164       3.440726      5.475164       3.440726      5.475164       3.440726      65.85925 32.59954  65.85925 32.59954  0.000000       0.000000  
1 1 1 0  17 29 o 33.76285 23.11271  -0.8735956     3.298757      -0.8735956     3.298757      -0.8735956     3.298757      33.76285 23.11271  33.76285 23.11271  0.000000       0.000000  
1 1 1 0  17 30 o 32.52225 22.56326  -1.368657      3.405941      -1.368657      3.405941      -1.368657      3.405941      32.52225 22.56326  32.52225 22.56326  0.000000       0.000000  
1 1 1 0  17 31 o 46.57147 26.19257  2.896009       2.464993      2.896009       2.464993      2.896009       2.464993      46.57147 26.19257  46.57147 26.19257  0.000000       0.000000  
1 1 1 0  18 0  o 143.6932 8.925095  13.92205       1.693645      13.92205       1.693645      13.92205       1.693645      143.6932 8.925095  143.6932 8.925095  0.000000       0.000000  
1 1 1 0  18 1  o 25.47924 16.06356  0.1878550      1.154589      0.1878550      1.154589      0.1878550      1.154589      25.47924 16.06356  25.47924 16.06356  0.000000       0.000000  
1 1 1 0  18 2  f 461.0060 7.542559  141.8130       4.630593      141.8130       4.630593      141.8130       4.630593      461.0060 7.542559  461.0060 7.542559  0.000000       0.000000  
1 1 1 0  18 3  o 18.28523 12.74553  -1.066192      1.121197      -1.066192      1.121197      -1.066192      1.121197      18.28523 12.74553  18.28523 12.74553  0.000000       0.000000  
1 1 1 0  18 4  o 330.3459 8.305681  72.91077       3.650875      72.91077       3.650875      72.91077       3.650875      330.3459 8.305681  330.3459 8.305681  0.000000       0.000000  
1 1 1 0  18 5  o 615.7885 9.693704  253.1503       7.949727      253.1503       7.949727      253.1503       7.949727      615.7885 9.693704  615.7885 9.693704  0.000000       0.000000  
1 1 1 0  18 6  o 96.19894 3.242131  6.187615       0.4145279     6.187615       0.4145279     6.187615       0.4145279     96.19894 3.242131  96.19894 3.242131  0.000000       0.000000  
1 1 1 0  18 7  o 431.1015 7.446187  124.0356       4.274592      124.0356       4.274592      124.0356       4.274592      431.1015 7.446187  431.1015 7.446187  -0.000000      0.000000  
1 1 1 0  18 8  o 160.8092 10.28142  17.46774       2.182202      17.46774       2.182202      17.46774       2.182202      160.8092 10.28142  160.8092 10.28142  0.000000       0.000000  
1 1 1 0  18 9  o 406.6247 5.729598  110.2895       3.103110      110.2895       3.103110      110.2895       3.103110      406.6247 5.729598  406.6247 5.729598  0.000000       0.000000  
1 1 1 0  18 10 o 440.9426 9.025807  129.9043       5.298231      129.9043       5.298231      129.9043       5.298231      440.9426 9.025807  440.9426 9.025807  0.000000       0.000000  
1 1 1 0  18 11 o 52.75422 17.39287  2.380479       1.085610      2.380479       1.085610      2.380479       1.085610      52.75422 17.39287  52.75422 17.39287  -0.000000      0.000000  
1 1 1 0  18 12 o 213.8677 10.70682  30.78579       3.033727      30.78579       3.033727      30.78579       3.033727      213.8677 10.70682  213.8677 10.70682  0.000000       0.000000  
1 1 1 0  18 13 o 25.16386 10.27538  0.5902228      0.3389053     0.5902228      0.3389053     0.5902228      0.3389053     25.16386 10.27538  25.16386 10.27538  -0.000000      0.000000  
1 1 1 0  18 14 o 318.0570 10.48318  67.84857       4.432003      67.84857       4.432003      67.84857       4.432003      318.0570 10.48318  318.0570 10.48318  0.000000       0.000000  
1 1 1 0  18 15 o 141.7038 18.47597  14.19262       3.324879      14.19262       3.324879      14.19262       3.324879      141.7038 18.47597  141.7038 18.47597  0.000000       0.000000  
1 1 1 0  18 16 o 346.2890 9.743728  80.38889       4.488064      80.38889       4.488064      80.38889       4.488064      346.2890 9.743728  346.2890 9.743728  0.000000       0.000000  
1 1 1 0  18 17 o 22.93081 11.26231  0.5182841      0.4093305     0.5182841      0.4093305     0.5182841      0.4093305     22.93081 11.26231  22.93081 11.26231  -0.000000      0.000000  
1 1 1 0  18 18 o 209.0015 1.327433  29.10949       0.3696547     29.10949       0.3696547     29.10949       0.3696547     209.0015 1.327433  209.0015 1.327433  -0.000000      0.000000  
1 1 1 0  18 19 o 158.0155 7.473798  16.80000       1.565620      16.80000       1.565620      16.80000       1.565620      158.0155 7.473798  158.0155 7.473798  -0.000000      0.000000  
1 1 1 0  18 20 o 85.78610 3.983700  4.939829       0.4531389     4.939829       0.4531389     4.939829       0.4531389     85.78610 3.983700  85.78610 3.983700  0.000000       0.000000  
1 1 1 0  18 21 o 289.4146 9.822474  56.40429       3.778141      56.40429       3.778141      56.40429       3.778141      289.4146 9.822474  289.4146 9.822474  0.000000       0.000000  
1 1 1 0  18 22 o 121.7155 8.216582  10.06430       1.318476      10.06430       1.318476      10.06430       1.318476      121.7155 8.216582  121.7155 8.216582  0.000000       0.000000  
1 1 1 0  18 23 o 71.37715 20.09994  4.222911       1.654887      4.222911       1.654887      4.222911       1.654887      71.37715 20.09994  71.37715 20.09994  -0.000000      0.000000  
1 1 1 0  18 24 o 41.77375 25.46759  1.376813       2.671589      1.376813       2.671589      1.376813       2.671589      41.77375 25.46759  41.77375 25.46759  0.000000       0.000000  
1 1 1 0  18 25 o 34.83815 23.53221  -0.8688565     3.190345      -0.8688565     3.190345      -0.8688565     3.190345      34.83815 23.53221  34.83815 23.53221  -0.000000      0.000000  
1 1 1 0  18 26 o 126.1303 15.01738  11.53260       2.429719      11.53260       2.429719      11.53260       2.429719      126.1303 15.01738  126.1303 15.01738  -0.000000      0.000000  
1 1 1 0  18 27 o 39.46091 26.61877  -0.2130791     4.055618      -0.2130791     4.055618      -0.2130791     4.055618      39.46091 26.61877  39.46091 26.61877  -0.000000      0.000000  
1 1 1 0  18 28 o 28.84581 20.98034  -7.613768      4.585994      -7.613768      4.585994      -7.613768      4.585994      28.84581 20.98034  28.84581 20.98034  -0.000000      0.000000  
1 1 1 0  18 29 o 46.98116 29.17901  2.761214       3.662577      2.761214       3.662577      2.761214       3.662577      46.98116 29.17901  46.98116 29.17901  0.000000       0.000000  
1 1 1 0  18 30 o 20.99218 15.24601  -4.177247      2.372865      -4.177247      2.372865      -4.177247      2.372865      20.99218 15.24601  20.99218 15.24601  -0.000000      0.000000  
1 1 1 0  19 1  o 305.4149 6.600095  62.27569       2.683217      62.27569       2.683217      62.27569       2.683217      305.4149 6.600095  305.4149 6.600095  0.000000       0.000000  
1 1 1 0  19 2  o 367.6208 6.371756  90.17918       3.119166      90.17918       3.119166      90.17918       3.119166      367.6208 6.371756  367.6208 6.371756  0.000000       0.000000  
1 1 1 0  19 3  o 633.7864 8.845879  268.1148       7.467354      268.1148       7.467354      268.1148       7.467354      633.7864 8.845879  633.7864 8.845879  0.000000       0.000000  
1 1 1 0  19 4  o 45.57240 11.94982  1.641286       0.6269609     1.641286       0.6269609     1.641286       0.6269609     45.57240 11.94982  45.57240 11.94982  -0.000000      0.000000  
1 1 1 0  19 5  o 262.4185 9.188732  46.11588       3.204151      46.11588       3.204151      46.11588       3.204151      262.4185 9.188732  262.4185 9.188732  -0.000000      0.000000  
1 1 1 0  19 6  o 144.1939 9.437801  14.05199       1.795319      14.05199       1.795319      14.05199       1.795319      144.1939 9.437801  144.1939 9.437801  0.000000       0.000000  
1 1 1 0  19 7  f 276.9189 8.054596  51.28528       2.966452      51.28528       2.966452      51.28528       2.966452      276.9189 8.054596  276.9189 8.054596  0.000000       0.000000  
1 1 1 0  19 8  o 161.4226 7.061808  17.47842       1.512353      17.47842       1.512353      17.47842       1.512353      161.4226 7.061808  161.4226 7.061808  0.000000       0.000000  
1 1 1 0  19 9  o 125.0507 0.9402300 10.42073       0.1566529     10.42073       0.1566529     10.42073       0.1566529     125.0507 0.9402300 125.0507 0.9402300 -0.000000      0.000000  
1 1 1 0  19 10 o 280.3042 5.764884  52.45897       2.151191      52.45897       2.151191      52.45897       2.151191      280.3042 5.764884  280.3042 5.764884  0.000000       0.000000  
1 1 1 0  19 11 o 363.1742 7.721701  88.14446       3.733001      88.14446       3.733001      88.14446       3.733001      363.1742 7.721701  363.1742 7.721701  0.000000       0.000000  
1 1 1 0  19 12 o 20.25454 13.31114  -0.1578339     0.9073163     -0.1578339     0.9073163     -0.1578339     0.9073163     20.25454 13.31114  20.25454 13.31114  0.000000       0.000000  
1 1 1 0  19 13 o 460.1506 13.58863  142.3576       8.315547      142.3576       8.315547      142.3576       8.315547      460.1506 13.58863  460.1506 13.58863  -0.000000      0.000000  
1 1 1 0  19 14 o 248.5404 12.57177  41.72494       4.139147      41.72494       4.139147      41.72494       4.139147      248.5404 12.57177  248.5404 12.57177  0.000000       0.000000  
1 1 1 0  19 15 f 627.6923 18.47964  267.1225       15.42626      267.1225       15.42626      267.1225       15.42626      627.6923 18.47964  627.6923 18.47964  0.000000       0.000000  
1 1 1 0  19 16 o 37.47299 21.33931  1.255647       1.663466      1.255647       1.663466      1.255647       1.663466      37.47299 21.33931  37.47299 21.33931  -0.000000      0.000000  
1 1 1 0  19 17 o 171.9356 9.578159  19.97553       2.178742      19.97553       2.178742      19.97553       2.178742      171.9356 9.578159  171.9356 9.578159  -0.000000      0.000000  
1 1 1 0  19 18 o 199.7005 6.426567  26.71900       1.706125      26.71900       1.706125      26.71900       1.706125      199.7005 6.426567  199.7005 6.426567  0.000000       0.000000  
1 1 1 0  19 19 o 17.15590 10.24810  0.2078437      0.4148944     0.2078437      0.4148944     0.2078437      0.4148944     17.15590 10.24810  17.15590 10.24810  0.000000       0.000000  
1 1 1 0  19 20 f 115.5629 1.419883  8.903233       0.2185732     8.903233       0.2185732     8.903233       0.2185732     115.5629 1.419883  115.5629 1.419883  -0.000000      0.000000  
1 1 1 0  19 21 o 86.72813 3.083069  5.035004       0.3552782     5.035004       0.3552782     5.035004       0.3552782     86.72813 3.083069  86.72813 3.083069  -0.000000      0.000000  
1 1 1 0  19 22 f 67.64958 4.740692  3.101721       0.4224393     3.101721       0.4224393     3.101721       0.4224393     67.64958 4.740692  67.64958 4.740692  -0.000000      0.000000  
1 1 1 0  19 23 o 41.17575 18.71595  1.707664       1.110879      1.707664       1.110879      1.707664       1.110879      41.17575 18.71595  41.17575 18.71595  0.000000       0.000000  
1 1 1 0  19 24 o 58.97124 20.75306  3.188837       1.479288      3.188837       1.479288      3.188837       1.479288      58.97124 20.75306  58.97124 20.75306  0.000000       0.000000  
1 1 1 0  19 25 o 157.3895 18.17387  18.29916       3.679518      18.29916       3.679518      18.29916       3.679518      157.3895 18.17387  157.3895 18.17387  -0.000000      0.000000  
1 1 1 0  19 26 o 38.21973 24.96468  0.5979936      3.119800      0.5979936      3.119800      0.5979936      3.119800      38.21973 24.96468  38.21973 24.96468  0.000000       0.000000  
1 1 1 0  19 27 o 33.70976 23.97600  -3.994307      4.650845      -3.994307      4.650845      -3.994307      4.650845      33.70976 23.97600  33.70976 23.97600  -0.000000      0.000000  
1 1 1 0  19 28 o 92.32201 31.52830  8.977029       3.480650      8.977029       3.480650      8.977029       3.480650      92.32201 31.52830  92.32201 31.52830  0.000000       0.000000  
1 1 1 0  19 29 o 56.70195 29.91493  4.487449       3.011832      4.487449       3.011832      4.487449       3.011832      56.70195 29.91493  56.70195 29.91493  0.000000       0.000000  
1 1 1 0  19 30 x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 0  20 0  o 636.5818 13.33630  270.8381       11.30142      270.8381       11.30142      270.8381       11.30142      636.5818 13.33630  636.5818 13.33630  -0.000000      0.000000  
1 1 1 0  20 1  o 116.0614 7.621696  9.100780       1.166899      9.100780       1.166899      9.100780       1.166899      116.0614 7.621696  116.0614 7.621696  -0.000000      0.000000  
1 1 1 0  20 2  o 30.81656 16.49199  0.9097551      0.9264510     0.9097551      0.9264510     0.9097551      0.9264510     30.81656 16.49199  30.81656 16.49199  -0.000000      0.000000  
1 1 1 0  20 3  o 51.92543 22.32379  2.579907       1.583131      2.579907       1.583131      2.579907       1.583131      51.92543 22.32379  51.92543 22.32379  -0.000000      0.000000  
1 1 1 0  20 4  o 148.0961 6.441872  14.70894       1.265758      14.70894       1.265758      14.70894       1.265758      148.0961 6.441872  148.0961 6.441872  -0.000000      0.000000  
1 1 1 0  20 5  o 19.05715 13.70127  -2.899474      1.692014      -2.899474      1.692014      -2.899474      1.692014      19.05715 13.70127  19.05715 13.70127  0.000000       0.000000  
1 1 1 0  20 6  o 90.20103 18.10189  6.065818       1.929541      6.065818       1.929541      6.065818       1.929541      90.20103 18.10189  90.20103 18.10189  0.000000       0.000000  
1 1 1 0  20 7  o 193.9941 8.949173  25.28671       2.302120      25.28671       2.302120      25.28671       2.302120      193.9941 8.949173  193.9941 8.949173  -0.000000      0.000000  
1 1 1 0  20 8  o 492.0606 8.669752  161.8139       5.680606      161.8139       5.680606      161.8139       5.680606      492.0606 8.669752  492.0606 8.669752  -0.000000      0.000000  
1 1 1 0  20 9  o 305.5485 6.340471  62.35969       2.579010      62.35969       2.579010      62.35969       2.579010      305.5485 6.340471  305.5485 6.340471  0.000000       0.000000  
1 1 1 0  20 10 f 129.6876 5.446895  11.27607       0.9374995     11.27607       0.9374995     11.27607       0.9374995     129.6876 5.446895  129.6876 5.446895  -0.000000      0.000000  
1 1 1 0  20 11 o 191.2340 2.287959  24.38057       0.5828366     24.38057       0.5828366     24.38057       0.5828366     191.2340 2.287959  191.2340 2.287959  -0.000000      0.000000  
1 1 1 0  20 12 o 173.4719 13.99698  20.59189       3.185482      20.59189       3.185482      20.59189       3.185482      173.4719 13.99698  173.4719 13.99698  0.000000       0.000000  
1 1 1 0  20 13 o 14.42495 10.29686  -1.320611      0.8874180     -1.320611      0.8874180     -1.320611      0.8874180     14.42495 10.29686  14.42495 10.29686  -0.000000      0.000000  
1 1 1 0  20 14 o 389.7241 9.780704  101.8567       5.072038      101.8567       5.072038      101.8567       5.072038      389.7241 9.780704  389.7241 9.780704  -0.000000      0.000000  
1 1 1 0  20 15 o 146.0235 12.27432  14.61540       2.348059      14.61540       2.348059      14.61540       2.348059      146.0235 12.27432  146.0235 12.27432  0.000000       0.000000  
1 1 1 0  20 16 o 143.0854 17.55465  14.47024       3.212297      14.47024       3.212297      14.47024       3.212297      143.0854 17.55465  143.0854 17.55465  0.000000       0.000000  
1 1 1 0  20 17 o 97.02100 15.59345  6.822123       1.859944      6.822123       1.859944      6.822123       1.859944      97.02100 15.59345  97.02100 15.59345  -0.000000      0.000000  
1 1 1 0  20 18 o 72.41243 32.25483  5.344305       3.297326      5.344305       3.297326      5.344305       3.297326      72.41243 32.25483  72.41243 32.25483  -0.000000      0.000000  
1 1 1 0  20 19 o 271.3206 10.80053  49.77695       3.890738      49.77695       3.890738      49.77695       3.890738      271.3206 10.80053  271.3206 10.80053  -0.000000      0.000000  
1 1 1 0  20 20 o 66.70845 6.380066  3.057496       0.5544589     3.057496       0.5544589     3.057496       0.5544589     66.70845 6.380066  66.70845 6.380066  -0.000000      0.000000  
1 1 1 0  20 21 o 25.64081 13.56983  0.6490209      0.6212885     0.6490209      0.6212885     0.6490209      0.6212885     25.64081 13.56983  25.64081 13.56983  0.000000       0.000000  
1 1 1 0  20 22 o 37.03448 14.94595  1.299807       0.7194761     1.299807       0.7194761     1.299807       0.7194761     37.03448 14.94595  37.03448 14.94595  -0.000000      0.000000  
1 1 1 0  20 23 o 23.38080 14.24180  0.3668276      0.8338635     0.3668276      0.8338635     0.3668276      0.8338635     23.38080 14.24180  23.38080 14.24180  -0.000000      0.000000  
1 1 1 0  20 24 o 42.33355 22.49969  1.971158       1.714081      1.971158       1.714081      1.971158       1.714081      42.33355 22.49969  42.33355 22.49969  -0.000000      0.000000  
1 1 1 0  20 25 o 33.59852 20.04178  1.048496       1.582543      1.048496       1.582543      1.048496       1.582543      33.59852 20.04178  33.59852 20.04178  0.000000       0.000000  
1 1 1 0  20 26 o 43.11596 25.21021  2.135900       2.416827      2.135900       2.416827      2.135900       2.416827      43.11596 25.21021  43.11596 25.21021  0.000000       0.000000  
1 1 1 0  20 27 o 39.35003 25.47376  1.169411       3.148227      1.169411       3.148227      1.169411       3.148227      39.35003 25.47376  39.35003 25.47376  0.000000       0.000000  
1 1 1 0  20 28 o 60.09529 32.70155  5.466310       3.700685      5.466310       3.700685      5.466310       3.700685      60.09529 32.70155  60.09529 32.70155  0.000000       0.000000  
1 1 1 0  21 1  o 363.9023 6.177237  88.40160       2.993438      88.40160       2.993438      88.40160       2.993438      363.9023 6.177237  363.9023 6.177237  0.000000       0.000000  
1 1 1 0  21 2  o 161.0841 7.497207  17.42812       1.601290      17.42812       1.601290      17.42812       1.601290      161.0841 7.497207  161.0841 7.497207  -0.000000      0.000000  
1 1 1 0  21 3  o 282.9002 8.479117  53.57914       3.189870      53.57914       3.189870      53.57914       3.189870      282.9002 8.479117  282.9002 8.479117  0.000000       0.000000  
1 1 1 0  21 4  o 401.5432 10.03843  107.9567       5.363616      107.9567       5.363616      107.9567       5.363616      401.5432 10.03843  401.5432 10.03843  -0.000000      0.000000  
1 1 1 0  21 5  o 468.1131 10.65456  146.7520       6.638221      146.7520       6.638221      146.7520       6.638221      468.1131 10.65456  468.1131 10.65456  0.000000       0.000000  
1 1 1 0  21 6  f 54.93438 27.40847  3.030759       2.440982      3.030759       2.440982      3.030759       2.440982      54.93438 27.40847  54.93438 27.40847  0.000000       0.000000  
1 1 1 0  21 7  o 335.9094 10.68670  75.70634       4.772453      75.70634       4.772453      75.70634       4.772453      335.9094 10.68670  335.9094 10.68670  -0.000000      0.000000  
1 1 1 0  21 8  o 35.17065 20.66979  0.9798696      1.638720      0.9798696      1.638720      0.9798696      1.638720      35.17065 20.66979  35.17065 20.66979  0.000000       0.000000  
1 1 1 0  21 9  o 94.76397 8.216908  6.132625       1.018891      6.132625       1.018891      6.132625       1.018891      94.76397 8.216908  94.76397 8.216908  0.000000       0.000000  
1 1 1 0  21 10 o 112.1940 0.9694498 8.388758       0.1449090     8.388758       0.1449090     8.388758       0.1449090     112.1940 0.9694498 112.1940 0.9694498 -0.000000      0.000000  
1 1 1 0  21 11 o 184.5000 9.135634  22.93297       2.233376      22.93297       2.233376      22.93297       2.233376      184.5000 9.135634  184.5000 9.135634  -0.000000      0.000000  
1 1 1 0  21 12 o 63.60948 9.914905  2.896302       0.7795576     2.896302       0.7795576     2.896302       0.7795576     63.60948 9.914905  63.60948 9.914905  -0.000000      0.000000  
1 1 1 0  21 13 o 103.0329 15.09652  7.589950       1.942616      7.589950       1.942616      7.589950       1.942616      103.0329 15.09652  103.0329 15.09652  0.000000       0.000000  
1 1 1 0  21 14 o 22.29945 11.26043  0.4900714      0.4145228     0.4900714      0.4145228     0.4900714      0.4145228     22.29945 11.26043  22.29945 11.26043  0.000000       0.000000  
1 1 1 0  21 15 o 40.37712 17.81908  1.586782       1.006537      1.586782       1.006537      1.586782       1.006537      40.37712 17.81908  40.37712 17.81908  0.000000       0.000000  
1 1 1 0  21 16 o 102.9841 20.55942  8.024117       2.504200      8.024117       2.504200      8.024117       2.504200      102.9841 20.55942  102.9841 20.55942  -0.000000      0.000000  
1 1 1 0  21 17 o 252.0460 11.05720  42.99738       3.697322      42.99738       3.697322      42.99738       3.697322      252.0460 11.05720  252.0460 11.05720  0.000000       0.000000  
1 1 1 0  21 18 o 36.86854 22.95902  0.7443771      2.282681      0.7443771      2.282681      0.7443771      2.282681      36.86854 22.95902  36.86854 22.95902  -0.000000      0.000000  
1 1 1 0  21 19 o 46.32347 20.79800  2.150494       1.371024      2.150494       1.371024      2.150494       1.371024      46.32347 20.79800  46.32347 20.79800  -0.000000      0.000000  
1 1 1 0  21 20 o 99.63010 9.077776  6.849891       1.180966      6.849891       1.180966      6.849891       1.180966      99.63010 9.077776  99.63010 9.077776  0.000000       0.000000  
1 1 1 0  21 21 o 86.71214 6.353849  5.123206       0.7249048     5.123206       0.7249048     5.123206       0.7249048     86.71214 6.353849  86.71214 6.353849  -0.000000      0.000000  
1 1 1 0  21 22 o 14.99648 10.05780  -0.1997647     0.5636265     -0.1997647     0.5636265     -0.1997647     0.5636265     14.99648 10.05780  14.99648 10.05780  -0.000000      0.000000  
1 1 1 0  21 23 o 21.70423 11.85530  0.4601708      0.4882576     0.4601708      0.4882576     0.4601708      0.4882576     21.70423 11.85530  21.70423 11.85530  0.000000       0.000000  
1 1 1 0  21 24 o 14.25691 10.17986  -1.233965      0.8698108     -1.233965      0.8698108     -1.233965      0.8698108     14.25691 10.17986  14.25691 10.17986  -0.000000      0.000000  
1 1 1 0  21 25 o 16.40606 11.48120  -0.8615196     0.9355111     -0.8615196     0.9355111     -0.8615196     0.9355111     16.40606 11.48120  16.40606 11.48120  0.000000       0.000000  
1 1 1 0  21 26 o 40.37271 24.01626  1.851680       2.260704      1.851680       2.260704      1.851680       2.260704      40.37271 24.01626  40.37271 24.01626  0.000000       0.000000  
1 1 1 0  21 27 o 29.25096 18.85750  0.4182718      1.701609      0.4182718      1.701609      0.4182718      1.701609      29.25096 18.85750  29.25096 18.85750  0.000000       0.000000  
1 1 1 0  22 0  o 320.0616 8.793098  68.50388       3.743754      68.50388       3.743754      68.50388       3.743754      320.0616 8.793098  320.0616 8.793098  -0.000000      0.000000  
1 1 1 0  22 1  o 21.76032 13.78177  0.1173704      0.8608761     0.1173704      0.8608761     0.1173704      0.8608761     21.76032 13.78177  21.76032 13.78177  -0.000000      0.000000  
1 1 1 0  22 2  o 320.9458 7.779880  68.90726       3.322778      68.90726       3.322778      68.90726       3.322778      320.9458 7.779880  320.9458 7.779880  0.000000       0.000000  
1 1 1 0  22 3  o 314.2216 9.347071  66.17938       3.905836      66.17938       3.905836      66.17938       3.905836      314.2216 9.347071  314.2216 9.347071  0.000000       0.000000  
1 1 1 0  22 4  o 384.6385 8.892015  99.03853       4.551997      99.03853       4.551997      99.03853       4.551997      384.6385 8.892015  384.6385 8.892015  0.000000       0.000000  
1 1 1 0  22 5  o 25.56553 17.69743  -1.658595      2.065843      -1.658595      2.065843      -1.658595      2.065843      25.56553 17.69743  25.56553 17.69743  0.000000       0.000000  
1 1 1 0  22 6  o 87.15686 23.19524  6.107484       2.327428      6.107484       2.327428      6.107484       2.327428      87.15686 23.19524  87.15686 23.19524  -0.000000      0.000000  
1 1 1 0  22 7  o 60.24324 28.46082  3.655938       2.583058      3.655938       2.583058      3.655938       2.583058      60.24324 28.46082  60.24324 28.46082  -0.000000      0.000000  
1 1 1 0  22 8  o 32.10411 20.35933  0.2792310      1.885721      0.2792310      1.885721      0.2792310      1.885721      32.10411 20.35933  32.10411 20.35933  -0.000000      0.000000  
1 1 1 0  22 9  o 532.0694 10.50734  189.8712       7.443073      189.8712       7.443073      189.8712       7.443073      532.0694 10.50734  532.0694 10.50734  -0.000000      0.000000  
1 1 1 0  22 10 o 128.6745 10.29712  11.30142       1.738754      11.30142       1.738754      11.30142       1.738754      128.6745 10.29712  128.6745 10.29712  0.000000       0.000000  
1 1 1 0  22 11 o 29.15421 19.20459  -0.3188554     1.905557      -0.3188554     1.905557      -0.3188554     1.905557      29.15421 19.20459  29.15421 19.20459  0.000000       0.000000  
1 1 1 0  22 12 o 39.13634 23.38978  1.160579       2.163299      1.160579       2.163299      1.160579       2.163299      39.13634 23.38978  39.13634 23.38978  -0.000000      0.000000  
1 1 1 0  22 13 o 93.56002 8.132212  5.987720       0.9954814     5.987720       0.9954814     5.987720       0.9954814     93.56002 8.132212  93.56002 8.132212  -0.000000      0.000000  
1 1 1 0  22 14 o 242.3418 10.16576  39.63085       3.269613      39.63085       3.269613      39.63085       3.269613      242.3418 10.16576  242.3418 10.16576  -0.000000      0.000000  
1 1 1 0  22 15 o 27.91808 17.18678  0.4415967      1.243832      0.4415967      1.243832      0.4415967      1.243832      27.91808 17.18678  27.91808 17.18678  -0.000000      0.000000  
1 1 1 0  22 16 o 105.6373 28.56618  9.322468       3.474905      9.322468       3.474905      9.322468       3.474905      105.6373 28.56618  105.6373 28.56618  -0.000000      0.000000  
1 1 1 0  22 17 o 135.9777 13.94000  12.95875       2.459853      12.95875       2.459853      12.95875       2.459853      135.9777 13.94000  135.9777 13.94000  0.000000       0.000000  
1 1 1 0  22 18 f 30.79779 20.65676  -0.6663398     2.378161      -0.6663398     2.378161      -0.6663398     2.378161      30.79779 20.65676  30.79779 20.65676  -0.000000      0.000000  
1 1 1 0  22 19 o 52.04480 23.34617  2.785880       1.727528      2.785880       1.727528      2.785880       1.727528      52.04480 23.34617  52.04480 23.34617  -0.000000      0.000000  
1 1 1 0  22 20 o 77.99895 26.12580  5.628744       2.421942      5.628744       2.421942      5.628744       2.421942      77.99895 26.12580  77.99895 26.12580  -0.000000      0.000000  
1 1 1 0  22 21 o 36.66483 22.96340  0.9230531      2.317695      0.9230531      2.317695      0.9230531      2.317695      36.66483 22.96340  36.66483 22.96340  -0.000000      0.000000  
1 1 1 0  22 22 o 56.34630 28.13172  3.759037       2.572324      3.759037       2.572324      3.759037       2.572324      56.34630 28.13172  56.34630 28.13172  0.000000       0.000000  
1 1 1 0  22 23 o 17.67597 11.77931  -0.1834349     0.7515799     -0.1834349     0.7515799     -0.1834349     0.7515799     17.67597 11.77931  17.67597 11.77931  0.000000       0.000000  
1 1 1 0  22 24 o 86.75478 7.326179  5.205548       0.8325025     5.205548       0.8325025     5.205548       0.8325025     86.75478 7.326179  86.75478 7.326179  -0.000000      0.000000  
1 1 1 0  22 25 o 38.60568 25.79842  0.5492152      3.648805      0.5492152      3.648805      0.5492152      3.648805      38.60568 25.79842  38.60568 25.79842  -0.000000      0.000000  
1 1 1 0  22 26 o 17.79727 11.72932  -0.7342378E-01 0.7121888     -0.7342378E-01 0.7121888     -0.7342378E-01 0.7121888     17.79727 11.72932  17.79727 11.72932  0.000000       0.000000  
1 1 1 0  23 1  o 307.8279 8.808494  63.52049       3.606435      63.52049       3.606435      63.52049       3.606435      307.8279 8.808494  307.8279 8.808494  -0.000000      0.000000  
1 1 1 0  23 2  o 129.2943 8.642748  11.32567       1.473534      11.32567       1.473534      11.32567       1.473534      129.2943 8.642748  129.2943 8.642748  -0.000000      0.000000  
1 1 1 0  23 3  o 145.1181 11.76118  14.39707       2.238822      14.39707       2.238822      14.39707       2.238822      145.1181 11.76118  145.1181 11.76118  -0.000000      0.000000  
1 1 1 0  23 4  o 214.5117 9.812314  30.99536       2.791355      30.99536       2.791355      30.99536       2.791355      214.5117 9.812314  214.5117 9.812314  0.000000       0.000000  
1 1 1 0  23 5  o 20.35747 14.82742  -5.207404      2.337934      -5.207404      2.337934      -5.207404      2.337934      20.35747 14.82742  20.35747 14.82742  0.000000       0.000000  
1 1 1 0  23 6  o 58.83692 24.83098  3.339435       1.964240      3.339435       1.964240      3.339435       1.964240      58.83692 24.83098  58.83692 24.83098  -0.000000      0.000000  
1 1 1 0  23 7  o 120.1254 19.86515  10.54307       2.918695      10.54307       2.918695      10.54307       2.918695      120.1254 19.86515  120.1254 19.86515  -0.000000      0.000000  
1 1 1 0  23 8  o 40.65498 24.95161  1.017553       2.603145      1.017553       2.603145      1.017553       2.603145      40.65498 24.95161  40.65498 24.95161  -0.000000      0.000000  
1 1 1 0  23 9  o 372.8571 8.790435  93.21370       4.361951      93.21370       4.361951      93.21370       4.361951      372.8571 8.790435  372.8571 8.790435  -0.000000      0.000000  
1 1 1 0  23 10 o 120.6661 1.133014  9.704333       0.1821411     9.704333       0.1821411     9.704333       0.1821411     120.6661 1.133014  120.6661 1.133014  0.000000       0.000000  
1 1 1 0  23 11 o 139.3972 3.952902  12.99200       0.7329138     12.99200       0.7329138     12.99200       0.7329138     139.3972 3.952902  139.3972 3.952902  0.000000       0.000000  
1 1 1 0  23 12 f 315.6304 10.06888  67.10339       4.225038      67.10339       4.225038      67.10339       4.225038      315.6304 10.06888  315.6304 10.06888  0.000000       0.000000  
1 1 1 0  23 13 o 36.64924 22.30198  0.9254709      2.040441      0.9254709      2.040441      0.9254709      2.040441      36.64924 22.30198  36.64924 22.30198  0.000000       0.000000  
1 1 1 0  23 14 o 118.8158 6.797200  9.540565       1.068039      9.540565       1.068039      9.540565       1.068039      118.8158 6.797200  118.8158 6.797200  -0.000000      0.000000  
1 1 1 0  23 15 o 265.3060 17.76049  49.18217       6.213221      49.18217       6.213221      49.18217       6.213221      265.3060 17.76049  265.3060 17.76049  -0.000000      0.000000  
1 1 1 0  23 16 o 41.36312 21.47738  1.776196       1.534113      1.776196       1.534113      1.776196       1.534113      41.36312 21.47738  41.36312 21.47738  0.000000       0.000000  
1 1 1 0  23 17 f 79.57393 19.20350  5.066717       1.765243      5.066717       1.765243      5.066717       1.765243      79.57393 19.20350  79.57393 19.20350  -0.000000      0.000000  
1 1 1 0  23 18 o 57.01264 29.10001  3.697303       2.785286      3.697303       2.785286      3.697303       2.785286      57.01264 29.10001  57.01264 29.10001  -0.000000      0.000000  
1 1 1 0  23 19 o 42.08766 22.54002  1.922645       1.731658      1.922645       1.731658      1.922645       1.731658      42.08766 22.54002  42.08766 22.54002  -0.000000      0.000000  
1 1 1 0  23 20 o 35.38192 21.53575  1.067078       1.903593      1.067078       1.903593      1.067078       1.903593      35.38192 21.53575  35.38192 21.53575  0.000000       0.000000  
1 1 1 0  23 21 o 71.78047 31.11714  5.884907       3.073141      5.884907       3.073141      5.884907       3.073141      71.78047 31.11714  71.78047 31.11714  -0.000000      0.000000  
1 1 1 0  23 22 o 33.17286 21.57786  0.3944058      2.296344      0.3944058      2.296344      0.3944058      2.296344      33.17286 21.57786  33.17286 21.57786  0.000000       0.000000  
1 1 1 0  23 23 o 47.15291 17.24355  2.102396       0.9989022     2.102396       0.9989022     2.102396       0.9989022     47.15291 17.24355  47.15291 17.24355  -0.000000      0.000000  
1 1 1 0  23 24 o 17.85676 11.85512  -0.1342302     0.7493054     -0.1342302     0.7493054     -0.1342302     0.7493054     17.85676 11.85512  17.85676 11.85512  -0.000000      0.000000  
1 1 1 0  23 25 o 32.93435 21.72356  0.3803219      2.450923      0.3803219      2.450923      0.3803219      2.450923      32.93435 21.72356  32.93435 21.72356  0.000000       0.000000  
1 1 1 0  24 0  o 244.1090 11.38490  40.10913       3.684868      40.10913       3.684868      40.10913       3.684868      244.1090 11.38490  244.1090 11.38490  -0.000000      0.000000  
1 1 1 0  24 1  o 303.6909 8.072953  61.81203       3.261697      61.81203       3.261697      61.81203       3.261697      303.6909 8.072953  303.6909 8.072953  -0.000000      0.000000  
1 1 1 0  24 2  o 490.7689 9.547921  161.5174       6.238618      161.5174       6.238618      161.5174       6.238618      490.7689 9.547921  490.7689 9.547921  -0.000000      0.000000  
1 1 1 0  24 3  o 184.1505 8.439143  22.83190       2.060896      22.83190       2.060896      22.83190       2.060896      184.1505 8.439143  184.1505 8.439143  0.000000       0.000000  
1 1 1 0  24 4  o 144.3616 11.32038  14.24639       2.145972      14.24639       2.145972      14.24639       2.145972      144.3616 11.32038  144.3616 11.32038  0.000000       0.000000  
1 1 1 0  24 5  o 45.77801 28.12087  1.355398       3.313214      1.355398       3.313214      1.355398       3.313214      45.77801 28.12087  45.77801 28.12087  0.000000       0.000000  
1 1 1 0  24 6  o 52.18048 30.58554  2.420978       3.572015      2.420978       3.572015      2.420978       3.572015      52.18048 30.58554  52.18048 30.58554  -0.000000      0.000000  
1 1 1 0  24 7  o 56.58879 29.29645  3.324405       2.848672      3.324405       2.848672      3.324405       2.848672      56.58879 29.29645  56.58879 29.29645  -0.000000      0.000000  
1 1 1 0  24 8  o 192.4051 14.74664  25.49036       3.728403      25.49036       3.728403      25.49036       3.728403      192.4051 14.74664  192.4051 14.74664  -0.000000      0.000000  
1 1 1 0  24 9  o 52.06162 26.87139  2.809683       2.391737      2.809683       2.391737      2.809683       2.391737      52.06162 26.87139  52.06162 26.87139  -0.000000      0.000000  
1 1 1 0  24 10 o 39.55999 8.873981  1.192507       0.4083723     1.192507       0.4083723     1.192507       0.4083723     39.55999 8.873981  39.55999 8.873981  -0.000000      0.000000  
1 1 1 0  24 11 o 237.5557 8.478048  38.00555       2.675942      38.00555       2.675942      38.00555       2.675942      237.5557 8.478048  237.5557 8.478048  0.000000       0.000000  
1 1 1 0  24 12 o 93.07225 10.84964  6.071912       1.297884      6.071912       1.297884      6.071912       1.297884      93.07225 10.84964  93.07225 10.84964  0.000000       0.000000  
1 1 1 0  24 13 o 76.18299 20.58919  4.770144       1.806198      4.770144       1.806198      4.770144       1.806198      76.18299 20.58919  76.18299 20.58919  0.000000       0.000000  
1 1 1 0  24 14 o 155.7209 13.84127  16.94989       2.817468      16.94989       2.817468      16.94989       2.817468      155.7209 13.84127  155.7209 13.84127  -0.000000      0.000000  
1 1 1 0  24 15 o 41.85288 23.28033  1.804277       1.921107      1.804277       1.921107      1.804277       1.921107      41.85288 23.28033  41.85288 23.28033  -0.000000      0.000000  
1 1 1 0  24 16 o 85.34682 25.58576  6.435212       2.534481      6.435212       2.534481      6.435212       2.534481      85.34682 25.58576  85.34682 25.58576  0.000000       0.000000  
1 1 1 0  24 17 o 69.63647 18.13479  3.986281       1.453972      3.986281       1.453972      3.986281       1.453972      69.63647 18.13479  69.63647 18.13479  0.000000       0.000000  
1 1 1 0  24 18 o 54.95984 31.50039  3.747869       3.658227      3.747869       3.658227      3.747869       3.658227      54.95984 31.50039  54.95984 31.50039  0.000000       0.000000  
1 1 1 0  24 19 o 34.30545 20.87956  1.009560       1.789177      1.009560       1.789177      1.009560       1.789177      34.30545 20.87956  34.30545 20.87956  0.000000       0.000000  
1 1 1 0  24 20 o 33.03260 22.33847  -0.5251172     2.891176      -0.5251172     2.891176      -0.5251172     2.891176      33.03260 22.33847  33.03260 22.33847  -0.000000      0.000000  
1 1 1 0  24 21 o 26.78546 18.26101  -0.7261374     2.013653      -0.7261374     2.013653      -0.7261374     2.013653      26.78546 18.26101  26.78546 18.26101  0.000000       0.000000  
1 1 1 0  24 22 o 25.24320 17.84103  -2.232526      2.437824      -2.232526      2.437824      -2.232526      2.437824      25.24320 17.84103  25.24320 17.84103  -0.000000      0.000000  
1 1 1 0  24 23 o 29.10996 19.09073  0.1970031      1.851535      0.1970031      1.851535      0.1970031      1.851535      29.10996 19.09073  29.10996 19.09073  0.000000       0.000000  
1 1 1 0  25 1  o 215.7230 9.534319  31.40746       2.728471      31.40746       2.728471      31.40746       2.728471      215.7230 9.534319  215.7230 9.534319  0.000000       0.000000  
1 1 1 0  25 2  o 29.87692 16.92337  0.8088994      1.038665      0.8088994      1.038665      0.8088994      1.038665      29.87692 16.92337  29.87692 16.92337  -0.000000      0.000000  
1 1 1 0  25 3  o 156.4220 8.647460  16.54961       1.789753      16.54961       1.789753      16.54961       1.789753      156.4220 8.647460  156.4220 8.647460  -0.000000      0.000000  
1 1 1 0  25 4  o 58.99329 23.79177  3.326396       1.823532      3.326396       1.823532      3.326396       1.823532      58.99329 23.79177  58.99329 23.79177  -0.000000      0.000000  
1 1 1 0  25 5  o 69.81026 29.66128  4.865382       2.799546      4.865382       2.799546      4.865382       2.799546      69.81026 29.66128  69.81026 29.66128  -0.000000      0.000000  
1 1 1 0  25 6  o 30.47746 20.25360  -0.4832177     2.195854      -0.4832177     2.195854      -0.4832177     2.195854      30.47746 20.25360  30.47746 20.25360  0.000000       0.000000  
1 1 1 0  25 7  f 37.20554 24.23140  0.1882625E-01  2.908683      0.1882625E-01  2.908683      0.1882625E-01  2.908683      37.20554 24.23140  37.20554 24.23140  -0.000000      0.000000  
1 1 1 0  25 8  f 123.6807 18.72721  11.19759       2.877177      11.19759       2.877177      11.19759       2.877177      123.6807 18.72721  123.6807 18.72721  0.000000       0.000000  
1 1 1 0  25 9  f 114.4109 18.58428  9.674414       2.609038      9.674414       2.609038      9.674414       2.609038      114.4109 18.58428  114.4109 18.58428  -0.000000      0.000000  
1 1 1 0  25 10 f 233.7304 8.137285  36.83078       2.527387      36.83078       2.527387      36.83078       2.527387      233.7304 8.137285  233.7304 8.137285  -0.000000      0.000000  
1 1 1 0  25 11 o ?        ?         -1.808079      0.3040570     -1.808079      0.3040570     -1.808079      0.3040570     ?        ?         ?        ?         0.000000       0.000000  
1 1 1 0  25 12 o 169.5690 9.429452  19.59243       2.115448      19.59243       2.115448      19.59243       2.115448      169.5690 9.429452  169.5690 9.429452  -0.000000      0.000000  
1 1 1 0  25 13 o 24.41891 17.54943  -4.249040      2.764242      -4.249040      2.764242      -4.249040      2.764242      24.41891 17.54943  24.41891 17.54943  -0.000000      0.000000  
1 1 1 0  25 14 o 37.29515 23.98875  0.5565242      2.733412      0.5565242      2.733412      0.5565242      2.733412      37.29515 23.98875  37.29515 23.98875  -0.000000      0.000000  
1 1 1 0  25 15 o 140.4317 16.90844  14.45733       3.042525      14.45733       3.042525      14.45733       3.042525      140.4317 16.90844  140.4317 16.90844  -0.000000      0.000000  
1 1 1 0  25 16 o 162.8052 16.13149  19.23665       3.414978      19.23665       3.414978      19.23665       3.414978      162.8052 16.13149  162.8052 16.13149  0.000000       0.000000  
1 1 1 0  25 17 o 14.33840 10.37078  -1.924262      1.040236      -1.924262      1.040236      -1.924262      1.040236      14.33840 10.37078  14.33840 10.37078  0.000000       0.000000  
1 1 1 0  25 18 o 62.17506 27.57914  4.334665       2.410777      4.334665       2.410777      4.334665       2.410777      62.17506 27.57914  62.17506 27.57914  0.000000       0.000000  
1 1 1 0  25 19 o 6.788492 4.973002  -0.7414592     0.2884800     -0.7414592     0.2884800     -0.7414592     0.2884800     6.788492 4.973002  6.788492 4.973002  0.000000       0.000000  
1 1 1 0  25 20 o 35.59792 21.89871  1.175227       2.015916      1.175227       2.015916      1.175227       2.015916      35.59792 21.89871  35.59792 21.89871  -0.000000      0.000000  
1 1 1 0  25 21 f 25.60812 18.07172  -2.128215      2.470693      -2.128215      2.470693      -2.128215      2.470693      25.60812 18.07172  25.60812 18.07172  -0.000000      0.000000  
1 1 1 0  26 0  o 18.74085 13.65619  -4.500220      1.996723      -4.500220      1.996723      -4.500220      1.996723      18.74085 13.65619  18.74085 13.65619  -0.000000      0.000000  
1 1 1 0  26 1  o 33.19630 19.18736  0.9811401      1.374434      0.9811401      1.374434      0.9811401      1.374434      33.19630 19.18736  33.19630 19.18736  0.000000       0.000000  
1 1 1 0  26 2  o 255.8097 11.74650  44.55336       3.984755      44.55336       3.984755      44.55336       3.984755      255.8097 11.74650  255.8097 11.74650  0.000000       0.000000  
1 1 1 0  26 3  o 110.3797 9.506964  8.379434       1.373476      8.379434       1.373476      8.379434       1.373476      110.3797 9.506964  110.3797 9.506964  -0.000000      0.000000  
1 1 1 0  26 4  o 35.71684 21.75916  0.9109634      1.947102      0.9109634      1.947102      0.9109634      1.947102      35.71684 21.75916  35.71684 21.75916  -0.000000      0.000000  
1 1 1 0  26 5  o 169.5030 13.24111  19.90285       2.947575      19.90285       2.947575      19.90285       2.947575      169.5030 13.24111  169.5030 13.24111  0.000000       0.000000  
1 1 1 0  26 6  o 28.07358 19.74129  -2.833510      2.866849      -2.833510      2.866849      -2.833510      2.866849      28.07358 19.74129  28.07358 19.74129  0.000000       0.000000  
1 1 1 0  26 7  o 30.43161 17.01097  0.8859699      1.031818      0.8859699      1.031818      0.8859699      1.031818      30.43161 17.01097  30.43161 17.01097  -0.000000      0.000000  
1 1 1 0  26 8  o 135.9423 25.59655  14.52399       4.156789      14.52399       4.156789      14.52399       4.156789      135.9423 25.59655  135.9423 25.59655  -0.000000      0.000000  
1 1 1 0  26 9  o 32.50846 21.62787  -0.3892249     2.515951      -0.3892249     2.515951      -0.3892249     2.515951      32.50846 21.62787  32.50846 21.62787  0.000000       0.000000  
1 1 1 0  26 10 o 9.229509 6.621598  -0.6303585     0.3862475     -0.6303585     0.3862475     -0.6303585     0.3862475     9.229509 6.621598  9.229509 6.621598  0.000000       0.000000  
1 1 1 0  26 11 o 27.09972 11.19586  0.6981982      0.4011280     0.6981982      0.4011280     0.6981982      0.4011280     27.09972 11.19586  27.09972 11.19586  0.000000       0.000000  
1 1 1 0  26 12 o 131.1267 11.56978  12.03617       1.983743      12.03617       1.983743      12.03617       1.983743      131.1267 11.56978  131.1267 11.56978  -0.000000      0.000000  
1 1 1 0  26 13 o 107.6486 31.87534  10.87951       3.976265      10.87951       3.976265      10.87951       3.976265      107.6486 31.87534  107.6486 31.87534  0.000000       0.000000  
1 1 1 0  26 14 f 54.93187 31.93168  3.806794       3.840652      3.806794       3.840652      3.806794       3.840652      54.93187 31.93168  54.93187 31.93168  -0.000000      0.000000  
1 1 1 0  26 15 o 39.21855 25.29618  0.8915068      3.067047      0.8915068      3.067047      0.8915068      3.067047      39.21855 25.29618  39.21855 25.29618  -0.000000      0.000000  
1 1 1 0  26 16 o 27.60601 19.28386  -1.862735      2.605100      -1.862735      2.605100      -1.862735      2.605100      27.60601 19.28386  27.60601 19.28386  -0.000000      0.000000  
1 1 1 0  26 17 o 33.67848 21.03522  0.8676745      1.930897      0.8676745      1.930897      0.8676745      1.930897      33.67848 21.03522  33.67848 21.03522  -0.000000      0.000000  
1 1 1 0  26 18 o 30.21075 16.69352  0.9583612      0.9802759     0.9583612      0.9802759     0.9583612      0.9802759     30.21075 16.69352  30.21075 16.69352  0.000000       0.000000  
1 1 1 0  26 19 o 52.64922 18.45905  2.609590       1.173034      2.609590       1.173034      2.609590       1.173034      52.64922 18.45905  52.64922 18.45905  -0.000000      0.000000  
1 1 1 0  27 1  o 40.72999 23.48104  1.626315       2.050312      1.626315       2.050312      1.626315       2.050312      40.72999 23.48104  40.72999 23.48104  -0.000000      0.000000  
1 1 1 0  27 2  o 27.42561 18.35038  -0.4751347     1.856400      -0.4751347     1.856400      -0.4751347     1.856400      27.42561 18.35038  27.42561 18.35038  -0.000000      0.000000  
1 1 1 0  27 3  o 140.1330 11.27406  13.60737       2.072882      13.60737       2.072882      13.60737       2.072882      140.1330 11.27406  140.1330 11.27406  0.000000       0.000000  
1 1 1 0  27 4  o 20.92385 15.06146  -3.388844      2.072292      -3.388844      2.072292      -3.388844      2.072292      20.92385 15.06146  20.92385 15.06146  0.000000       0.000000  
1 1 1 0  27 5  o 41.38316 24.18209  1.676020       2.221452      1.676020       2.221452      1.676020       2.221452      41.38316 24.18209  41.38316 24.18209  -0.000000      0.000000  
1 1 1 0  27 6  o 53.96591 32.53350  3.166408       4.257589      3.166408       4.257589      3.166408       4.257589      53.96591 32.53350  53.96591 32.53350  0.000000       0.000000  
1 1 1 0  27 7  o 34.16129 19.46754  1.143072       1.385840      1.143072       1.385840      1.143072       1.385840      34.16129 19.46754  34.16129 19.46754  -0.000000      0.000000  
1 1 1 0  27 8  o 69.15665 35.29648  6.000746       4.097620      6.000746       4.097620      6.000746       4.097620      69.15665 35.29648  69.15665 35.29648  -0.000000      0.000000  
1 1 1 0  27 9  o 37.85714 25.05072  0.8658645E-01  3.300938      0.8658645E-01  3.300938      0.8658645E-01  3.300938      37.85714 25.05072  37.85714 25.05072  0.000000       0.000000  
1 1 1 0  27 10 o 169.4364 17.53712  21.06437       3.853759      21.06437       3.853759      21.06437       3.853759      169.4364 17.53712  169.4364 17.53712  0.000000       0.000000  
1 1 1 0  27 11 o 121.3847 1.811420  9.831455       0.2928455     9.831455       0.2928455     9.831455       0.2928455     121.3847 1.811420  121.3847 1.811420  0.000000       0.000000  
1 1 1 0  27 12 o 9.791306 7.186717  -1.668354      0.6239327     -1.668354      0.6239327     -1.668354      0.6239327     9.791306 7.186717  9.791306 7.186717  0.000000       0.000000  
1 1 1 0  27 13 o 88.76270 21.20342  6.561518       2.175832      6.561518       2.175832      6.561518       2.175832      88.76270 21.20342  88.76270 21.20342  0.000000       0.000000  
1 1 1 0  27 14 o 27.82088 19.16190  -1.150529      2.348457      -1.150529      2.348457      -1.150529      2.348457      27.82088 19.16190  27.82088 19.16190  -0.000000      0.000000  
1 1 1 0  27 15 f 39.93240 26.67945  0.4631881      3.898712      0.4631881      3.898712      0.4631881      3.898712      39.93240 26.67945  39.93240 26.67945  -0.000000      0.000000  
1 1 1 0  27 16 o 36.53215 25.14407  -0.8809444     4.026778      -0.8809444     4.026778      -0.8809444     4.026778      36.53215 25.14407  36.53215 25.14407  -0.000000      0.000000  
1 1 1 0  27 17 o 48.66803 24.11659  2.807212       1.883943      2.807212       1.883943      2.807212       1.883943      48.66803 24.11659  48.66803 24.11659  0.000000       0.000000  
1 1 1 0  28 0  o 44.23634 28.71198  0.3976878      4.035315      0.3976878      4.035315      0.3976878      4.035315      44.23634 28.71198  44.23634 28.71198  -0.000000      0.000000  
1 1 1 0  28 1  o 56.99156 22.53374  3.210094       1.646665      3.210094       1.646665      3.210094       1.646665      56.99156 22.53374  56.99156 22.53374  -0.000000      0.000000  
1 1 1 0  28 2  o 42.82621 23.44772  2.012797       1.914675      2.012797       1.914675      2.012797       1.914675      42.82621 23.44772  42.82621 23.44772  0.000000       0.000000  
1 1 1 0  28 3  o 46.35182 21.68881  2.287441       1.497175      2.287441       1.497175      2.287441       1.497175      46.35182 21.68881  46.35182 21.68881  0.000000       0.000000  
1 1 1 0  28 4  o 32.71393 22.16798  -0.7760845     2.876059      -0.7760845     2.876059      -0.7760845     2.876059      32.71393 22.16798  32.71393 22.16798  -0.000000      0.000000  
1 1 1 0  28 5  o 111.6496 19.59049  9.664156       2.646419      9.664156       2.646419      9.664156       2.646419      111.6496 19.59049  111.6496 19.59049  0.000000       0.000000  
1 1 1 0  28 6  o 47.37369 27.87958  2.521811       2.988322      2.521811       2.988322      2.521811       2.988322      47.37369 27.87958  47.37369 27.87958  0.000000       0.000000  
1 1 1 0  28 7  o 29.48333 19.02191  0.2508311      1.735773      0.2508311      1.735773      0.2508311      1.735773      29.48333 19.02191  29.48333 19.02191  -0.000000      0.000000  
1 1 1 0  28 8  o 44.13702 29.43945  0.5957772      4.712732      0.5957772      4.712732      0.5957772      4.712732      44.13702 29.43945  44.13702 29.43945  0.000000       0.000000  
1 1 1 0  28 9  o 47.05030 30.35731  1.906657       4.421685      1.906657       4.421685      1.906657       4.421685      47.05030 30.35731  47.05030 30.35731  0.000000       0.000000  
1 1 1 0  28 10 o 33.45847 23.67987  -3.528862      4.344205      -3.528862      4.344205      -3.528862      4.344205      33.45847 23.67987  33.45847 23.67987  0.000000       0.000000  
1 1 1 0  28 11 o 84.32623 1.346071  4.743922       0.1511662     4.743922       0.1511662     4.743922       0.1511662     84.32623 1.346071  84.32623 1.346071  -0.000000      0.000000  
1 1 1 0  28 12 o 13.62022 9.657067  -0.9053099     0.7338026     -0.9053099     0.7338026     -0.9053099     0.7338026     13.62022 9.657067  13.62022 9.657067  0.000000       0.000000  
1 1 1 0  28 13 o 81.47700 28.73064  6.826206       2.831702      6.826206       2.831702      6.826206       2.831702      81.47700 28.73064  81.47700 28.73064  0.000000       0.000000  
1 1 1 0  28 14 o 44.85642 24.83765  2.460692       2.175179      2.460692       2.175179      2.460692       2.175179      44.85642 24.83765  44.85642 24.83765  0.000000       0.000000  
1 1 1 0  29 1  o 36.29914 20.61436  1.382502       1.546528      1.382502       1.546528      1.382502       1.546528      36.29914 20.61436  36.29914 20.61436  0.000000       0.000000  
1 1 1 0  29 2  o 54.47571 29.23755  3.690413       2.919326      3.690413       2.919326      3.690413       2.919326      54.47571 29.23755  54.47571 29.23755  -0.000000      0.000000  
1 1 1 0  29 3  o 63.49589 18.62686  3.489346       1.369082      3.489346       1.369082      3.489346       1.369082      63.49589 18.62686  63.49589 18.62686  0.000000       0.000000  
1 1 1 0  29 4  o 37.33770 24.18535  0.7054324      2.843499      0.7054324      2.843499      0.7054324      2.843499      37.33770 24.18535  37.33770 24.18535  -0.000000      0.000000  
1 1 1 0  29 5  o 50.63990 26.67764  3.090357       2.392474      3.090357       2.392474      3.090357       2.392474      50.63990 26.67764  50.63990 26.67764  -0.000000      0.000000  
1 1 1 0  29 6  o 32.26921 21.92598  -0.6798819     2.852586      -0.6798819     2.852586      -0.6798819     2.852586      32.26921 21.92598  32.26921 21.92598  -0.000000      0.000000  
1 1 1 0  29 7  o 56.74352 22.75914  3.297258       1.671573      3.297258       1.671573      3.297258       1.671573      56.74352 22.75914  56.74352 22.75914  -0.000000      0.000000  
1 1 1 0  29 8  o 44.28312 29.10282  1.457749       4.337235      1.457749       4.337235      1.457749       4.337235      44.28312 29.10282  44.28312 29.10282  -0.000000      0.000000  
1 1 1 0  29 9  o 25.88349 18.99313  -9.446983      4.336339      -9.446983      4.336339      -9.446983      4.336339      25.88349 18.99313  25.88349 18.99313  -0.000000      0.000000  
1 1 1 0  29 10 o 74.14001 36.85052  7.868205       4.404678      7.868205       4.404678      7.868205       4.404678      74.14001 36.85052  74.14001 36.85052  -0.000000      0.000000  
1 1 1 0  29 11 o 52.45550 5.356105  1.907363       0.3646908     1.907363       0.3646908     1.907363       0.3646908     52.45550 5.356105  52.45550 5.356105  0.000000       0.000000  
1 1 1 0  30 0  o 88.58810 29.11608  7.251740       3.049209      7.251740       3.049209      7.251740       3.049209      88.58810 29.11608  88.58810 29.11608  -0.000000      0.000000  
1 1 1 0  30 1  o 167.5267 11.88145  19.82780       2.621098      19.82780       2.621098      19.82780       2.621098      167.5267 11.88145  167.5267 11.88145  0.000000       0.000000  
1 1 1 0  30 2  o 36.10675 23.10761  0.8856237      2.496352      0.8856237      2.496352      0.8856237      2.496352      36.10675 23.10761  36.10675 23.10761  -0.000000      0.000000  
1 1 1 0  30 3  o 115.1369 11.30938  9.443739       1.693977      9.443739       1.693977      9.443739       1.693977      115.1369 11.30938  115.1369 11.30938  -0.000000      0.000000  
1 1 1 0  30 4  o 68.44799 35.56282  6.775301       4.207985      6.775301       4.207985      6.775301       4.207985      68.44799 35.56282  68.44799 35.56282  -0.000000      0.000000  
1 1 1 0  30 5  o 36.44504 23.88693  0.6036876      2.892287      0.6036876      2.892287      0.6036876      2.892287      36.44504 23.88693  36.44504 23.88693  0.000000       0.000000  
1 1 1 1  0  1  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 1  0  2  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 1  0  3  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 1  0  4  o 131.4806 6.706434  11.61013       1.167957      11.61013       1.167957      11.61013       1.167957      131.4806 6.706434  131.4806 6.706434  0.000000       0.000000  
1 1 1 1  0  5  o 9.088735 5.741651  0.2122285E-01  0.1483428     0.2122285E-01  0.1483428     0.2122285E-01  0.1483428     9.088735 5.741651  9.088735 5.741651  0.000000       0.000000  
1 1 1 1  0  6  o 332.8211 6.815307  73.91267       3.019664      73.91267       3.019664      73.91267       3.019664      332.8211 6.815307  332.8211 6.815307  0.000000       0.000000  
1 1 1 1  0  7  o 1208.366 19.65408  975.6323       31.62755      975.6323       31.62755      975.6323       31.62755      1208.366 19.65408  1208.366 19.65408  -0.000000      0.000000  
1 1 1 1  0  8  o 754.9507 13.29558  380.4514       13.36582      380.4514       13.36582      380.4514       13.36582      754.9507 13.29558  754.9507 13.29558  -0.000000      0.000000  
1 1 1 1  0  9  o 111.1838 8.459309  8.381469       1.236184      8.381469       1.236184      8.381469       1.236184      111.1838 8.459309  111.1838 8.459309  0.000000       0.000000  
1 1 1 1  0  10 o 271.1011 8.199337  49.11990       2.955853      49.11990       2.955853      49.11990       2.955853      271.1011 8.199337  271.1011 8.199337  -0.000000      0.000000  
1 1 1 1  0  11 o 284.5614 10.84145  54.22358       4.097332      54.22358       4.097332      54.22358       4.097332      284.5614 10.84145  284.5614 10.84145  0.000000       0.000000  
1 1 1 1  0  12 o 278.6583 4.319551  51.77919       1.603056      51.77919       1.603056      51.77919       1.603056      278.6583 4.319551  278.6583 4.319551  -0.000000      0.000000  
1 1 1 1  0  13 o 272.9510 6.506227  49.73888       2.363359      49.73888       2.363359      49.73888       2.363359      272.9510 6.506227  272.9510 6.506227  -0.000000      0.000000  
1 1 1 1  0  14 o 269.0770 7.541402  48.37798       2.699168      48.37798       2.699168      48.37798       2.699168      269.0770 7.541402  269.0770 7.541402  0.000000       0.000000  
1 1 1 1  0  15 o 462.3870 8.408244  142.7056       5.176789      142.7056       5.176789      142.7056       5.176789      462.3870 8.408244  462.3870 8.408244  -0.000000      0.000000  
1 1 1 1  0  16 o 283.8694 6.449149  53.80122       2.436622      53.80122       2.436622      53.80122       2.436622      283.8694 6.449149  283.8694 6.449149  0.000000       0.000000  
1 1 1 1  0  17 o 126.3689 4.597087  10.68502       0.7717716     10.68502       0.7717716     10.68502       0.7717716     126.3689 4.597087  126.3689 4.597087  -0.000000      0.000000  
1 1 1 1  0  18 o 521.7496 10.53550  181.8983       7.317977      181.8983       7.317977      181.8983       7.317977      521.7496 10.53550  521.7496 10.53550  -0.000000      0.000000  
1 1 1 1  0  19 o 164.1758 9.751869  18.17263       2.115995      18.17263       2.115995      18.17263       2.115995      164.1758 9.751869  164.1758 9.751869  -0.000000      0.000000  
1 1 1 1  0  20 o 55.08881 5.761985  2.088374       0.4113983     2.088374       0.4113983     2.088374       0.4113983     55.08881 5.761985  55.08881 5.761985  -0.000000      0.000000  
1 1 1 1  0  21 o 587.5508 9.971715  230.5115       7.802012      230.5115       7.802012      230.5115       7.802012      587.5508 9.971715  587.5508 9.971715  -0.000000      0.000000  
1 1 1 1  0  22 o 117.8739 5.558049  9.322674       0.8685603     9.322674       0.8685603     9.322674       0.8685603     117.8739 5.558049  117.8739 5.558049  0.000000       0.000000  
1 1 1 1  0  23 o 344.4030 7.654477  79.21389       3.508904      79.21389       3.508904      79.21389       3.508904      344.4030 7.654477  344.4030 7.654477  0.000000       0.000000  
1 1 1 1  0  24 o 155.8977 11.05562  16.47049       2.269623      16.47049       2.269623      16.47049       2.269623      155.8977 11.05562  155.8977 11.05562  -0.000000      0.000000  
1 1 1 1  0  25 o 86.22169 19.85236  5.706025       1.985499      5.706025       1.985499      5.706025       1.985499      86.22169 19.85236  86.22169 19.85236  0.000000       0.000000  
1 1 1 1  0  26 o 38.80148 21.46703  1.404049       1.623322      1.404049       1.623322      1.404049       1.623322      38.80148 21.46703  38.80148 21.46703  -0.000000      0.000000  
1 1 1 1  0  27 o 115.6958 15.20870  9.442909       2.232281      9.442909       2.232281      9.442909       2.232281      115.6958 15.20870  115.6958 15.20870  0.000000       0.000000  
1 1 1 1  0  28 o 155.6797 11.20403  16.49383       2.296017      16.49383       2.296017      16.49383       2.296017      155.6797 11.20403  155.6797 11.20403  0.000000       0.000000  
1 1 1 1  0  29 o 189.3209 9.894773  24.21427       2.480533      24.21427       2.480533      24.21427       2.480533      189.3209 9.894773  189.3209 9.894773  -0.000000      0.000000  
1 1 1 1  0  30 o 129.0070 10.44094  11.38862       1.766933      11.38862       1.766933      11.38862       1.766933      129.0070 10.44094  129.0070 10.44094  -0.000000      0.000000  
1 1 1 1  0  31 o 50.79174 18.15797  2.312136       1.121838      2.312136       1.121838      2.312136       1.121838      50.79174 18.15797  50.79174 18.15797  0.000000       0.000000  
1 1 1 1  0  32 o 201.5762 11.02296  27.69725       2.940438      27.69725       2.940438      27.69725       2.940438      201.5762 11.02296  201.5762 11.02296  0.000000       0.000000  
1 1 1 1  0  33 o 130.2402 12.00216  11.83545       2.040084      11.83545       2.040084      11.83545       2.040084      130.2402 12.00216  130.2402 12.00216  -0.000000      0.000000  
1 1 1 1  0  34 o 28.53119 19.52507  -1.092812      2.349975      -1.092812      2.349975      -1.092812      2.349975      28.53119 19.52507  28.53119 19.52507  -0.000000      0.000000  
1 1 1 1  0  35 o 37.33669 22.79519  1.294929       2.147104      1.294929       2.147104      1.294929       2.147104      37.33669 22.79519  37.33669 22.79519  -0.000000      0.000000  
1 1 1 1  0  36 o 31.16360 16.12399  1.044608       0.8625454     1.044608       0.8625454     1.044608       0.8625454     31.16360 16.12399  31.16360 16.12399  0.000000       0.000000  
1 1 1 1  0  37 o 38.81295 15.82304  1.505194       0.8040053     1.505194       0.8040053     1.505194       0.8040053     38.81295 15.82304  38.81295 15.82304  -0.000000      0.000000  
1 1 1 1  0  38 o 11.50662 8.328927  -1.256215      0.6774198     -1.256215      0.6774198     -1.256215      0.6774198     11.50662 8.328927  11.50662 8.328927  -0.000000      0.000000  
1 1 1 1  1  0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 1  1  1  o 1964.488 130.9525  3046.516       340.8395      0.000000       0.000000      3046.516       340.8395      ?        ?         1964.488 130.9525  0.000000       130.9525  
1 1 1 1  1  2  o 524.2744 39.90302  187.2500       27.66709      0.000000       0.000000      187.2500       27.66709      ?        ?         524.2744 39.90302  0.000000       39.90302  
1 1 1 1  1  3  o 1733.893 24.27169  2015.614       56.07843      1986.016       84.72421      2038.691       74.81138      1713.984 37.09600  1739.626 32.27292  -25.64148      49.16965  
1 1 1 1  1  4  o 815.2779 13.90055  443.7621       15.10119      463.4711       25.05189      432.5132       18.92630      831.4711 22.63205  804.3703 17.65778  27.10077       28.70552  
1 1 1 1  1  5  o 779.2999 17.30202  405.9218       17.96698      420.5498       25.59117      391.7026       25.23094      791.6261 24.28905  763.8448 24.82172  27.78131       34.72861  
1 1 1 1  1  6  o 1074.032 25.69800  774.0094       36.77815      784.7201       65.29910      769.0331       44.50928      1072.342 45.80386  1068.314 31.30017  4.027588       55.47697  
1 1 1 1  1  7  o 1311.573 15.34863  1149.026       26.82475      1213.424       39.05725      1091.528       36.90593      1346.101 21.77463  1276.723 21.69331  69.37720       30.73653  
1 1 1 1  1  8  o 510.3036 8.885545  173.6489       6.042076      176.4120       7.439300      168.2939       10.35662      514.2392 10.85659  501.6970 15.51048  12.54221       18.93252  
1 1 1 1  1  9  o 664.6277 11.82748  294.7562       10.47476      294.3557       13.33079      295.4024       16.93480      663.8607 15.06973  664.2627 19.15227  -0.4019775     24.37019  
1 1 1 1  1  10 o 357.3400 6.088995  85.11148       2.899351      83.64256       4.154441      86.50625       4.048225      354.1624 8.803120  360.1871 8.434571  -6.024628      12.19167  
1 1 1 1  1  11 o 193.9434 4.367303  25.06659       1.128657      26.84344       1.629273      23.42718       1.564990      200.5845 6.102790  187.3656 6.277138  13.21887       8.754800  
1 1 1 1  1  12 o 493.2468 6.722576  162.1965       4.418486      164.2458       5.719617      159.1635       6.958275      496.2521 8.649502  488.3816 10.69224  7.870514       13.75274  
1 1 1 1  1  13 o 715.1401 7.979473  341.0866       7.603943      346.2929       11.92237      337.5167       9.872530      720.0594 12.42570  711.1348 10.41845  8.924622       16.21549  
1 1 1 1  1  14 o 361.8956 4.670970  87.29500       2.252496      88.83611       3.057083      85.46468       3.331613      365.0151 6.285255  357.9903 6.984089  7.024780       9.395846  
1 1 1 1  1  15 o 144.3867 4.802965  13.91276       0.9227952     14.91307       1.342916      13.01788       1.270178      149.3773 6.764241  139.5364 6.852262  9.840958       9.628523  
1 1 1 1  1  16 o 220.5029 4.537428  32.41249       1.333207      33.31712       1.928795      31.58486       1.844882      223.4006 6.486169  217.5181 6.371889  5.882523       9.092379  
1 1 1 1  1  17 o 240.9757 5.128195  38.71906       1.646688      39.16601       2.055475      37.91824       2.751359      242.2283 6.373697  238.1422 8.684912  4.086060       10.77273  
1 1 1 1  1  18 o 243.7991 4.920610  39.63022       1.598544      39.08075       2.066701      40.44851       2.522057      241.9562 6.415800  246.0525 7.701737  -4.096283      10.02393  
1 1 1 1  1  19 o 701.5180 8.173484  328.5370       7.640460      331.9073       11.76380      326.0780       10.04833      704.1622 12.53723  698.3714 10.79777  5.790771       16.54611  
1 1 1 1  1  20 o 220.8980 5.841393  32.56472       1.717910      30.08905       2.269366      35.88754       2.629127      212.1666 8.041568  231.6929 8.530358  -19.52635      11.72322  
1 1 1 1  1  21 o 650.0670 6.963964  281.9228       6.032372      284.4651       8.181947      278.8951       8.929055      652.6381 9.408291  646.0504 10.37207  6.587646       14.00342  
1 1 1 1  1  22 o 43.28113 11.01135  1.300437       0.6364886     0.9000843      0.6906227     3.558033       1.639995      37.34004 12.12799  71.37343 17.40305  -34.03339      21.21212  
1 1 1 1  1  23 o 456.8937 6.324705  139.2511       3.850605      137.2143       4.957979      142.3473       6.112706      453.3527 8.207199  461.5358 9.939273  -8.183136      12.88981  
1 1 1 1  1  24 o 206.7132 5.629832  28.52317       1.549289      32.30252       2.070878      23.71891       2.334849      219.8772 7.077287  188.1537 9.341846  31.72345       11.71999  
1 1 1 1  1  25 o 290.1387 6.625273  56.19981       2.561433      56.72825       3.375748      55.48269       3.932481      291.1562 8.710822  287.6923 10.27455  3.463867       13.47014  
1 1 1 1  1  26 o 118.6403 5.927983  9.421208       0.9341887     8.893028       1.026823      11.95866       2.250628      115.1805 6.719443  132.7023 12.88995  -17.52177      14.53622  
1 1 1 1  1  27 o 36.09580 12.85374  0.7575349      0.7784194     0.6261687      0.8200366     1.954103       2.474914      34.98706 13.07650  60.40586 22.68812  -25.41880      26.18674  
1 1 1 1  1  28 o 27.44428 10.28473  0.3788116      0.5079620     0.3248454      0.5159277     2.086110       2.901900      26.80470 10.29014  63.58854 24.40612  -36.78384      26.48671  
1 1 1 1  1  29 o 176.1663 6.284730  20.80179       1.472945      20.32467       1.704298      22.21002       2.927990      173.9356 7.370025  180.5602 12.24192  -6.624542      14.28922  
1 1 1 1  1  30 o 159.2089 5.933389  16.99660       1.256560      16.29537       1.383928      20.28880       2.998647      155.7508 6.683771  171.9013 13.19180  -16.15048      14.78839  
1 1 1 1  1  31 o 161.2993 7.001483  17.51869       1.501276      19.59779       1.830284      13.24363       2.624532      170.3260 8.087349  137.7361 14.51794  32.58994       16.61853  
1 1 1 1  1  32 o 78.80650 7.437717  4.227736       0.7718047     4.437178       0.9132273     3.704192       1.443853      80.45726 8.653948  71.28211 15.63222  9.175148       17.86777  
1 1 1 1  1  33 o 77.85258 7.429107  4.144842       0.7613617     6.312307       0.8954797     -1.509293      1.446315      96.33206 7.024352  29.30581 13.88235  67.02625       15.55832  
1 1 1 1  1  34 o 13.82007 6.950772  -1.722819      0.5755689     -0.9511465     0.6928829     -3.440743      1.033821      19.29710 9.268372  17.62615 8.919272  1.670954       12.86298  
1 1 1 1  1  35 o 49.08489 10.24010  1.758555       0.6480711     2.201221       0.6829179     -2.249963      2.055050      55.31781 9.613392  32.86038 15.82852  22.45743       18.51916  
1 1 1 1  1  36 f ?        ?         -1.961116      0.1907440     -0.5623118     0.6269857     -2.103782      0.2002350     19.86571 9.327156  ?        ?         0.000000       9.327156  
1 1 1 1  1  37 o 37.06914 12.48256  1.024854       0.7296155     -0.1452532     1.250978      1.628078       0.8982065     31.48300 14.17669  45.19387 13.71667  -13.71087      19.72627  
1 1 1 1  1  38 o 62.84015 12.58253  3.122976       1.016830      3.206265       1.386381      3.026009       1.495883      60.00164 16.71926  57.21486 17.76430  2.786785       24.39475  
1 1 1 1  2  0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 1  2  1  o 2501.374 75.92808  4427.603       252.7850      4815.877       357.9236      4041.194       357.0621      2539.585 106.0010  2299.569 116.9099  240.0164       157.8104  
1 1 1 1  2  2  o 904.5798 13.41990  546.2219       16.17594      551.1388       24.25887      542.2855       21.70592      907.5709 20.05933  900.6112 18.08703  6.959717       27.00958  
1 1 1 1  2  3  o 842.5867 16.35422  474.3611       18.36192      497.1984       29.06953      459.2002       23.68517      860.5444 25.37850  827.8840 21.48824  32.66040       33.25376  
1 1 1 1  2  4  o 935.7003 15.55363  584.8405       19.39287      575.6083       29.73123      591.6771       25.58479      926.3062 24.10760  940.2774 20.41984  -13.97119      31.59346  
1 1 1 1  2  5  o 785.9457 15.71835  412.6440       16.46164      427.1617       21.53730      392.2464       25.52890      798.7038 20.25268  764.3106 25.10026  34.39319       32.25204  
1 1 1 1  2  6  o 501.0279 13.34336  167.6882       8.900487      171.4445       10.47172      157.9123       16.89359      506.3786 15.53758  484.3522 26.27339  22.02634       30.52388  
1 1 1 1  2  7  o 1413.770 16.56686  1335.625       31.20992      1358.355       46.20637      1316.554       42.32375      1423.311 24.36288  1401.842 22.65747  21.46887       33.27027  
1 1 1 1  2  8  o 665.5254 10.25059  295.4385       9.090487      306.9376       13.94771      286.9467       11.98593      677.8643 15.44140  655.5959 13.72025  22.26837       20.65628  
1 1 1 1  2  9  o 608.7593 10.70232  247.2166       8.681546      243.7966       11.04360      252.7488       14.04599      604.2915 13.71484  614.6924 17.16510  -10.40094      21.97129  
1 1 1 1  2  10 o 196.6925 5.542436  25.80573       1.451205      25.03704       2.026672      26.61459       2.078953      193.6234 7.871518  199.6423 7.829997  -6.018906      11.10269  
1 1 1 1  2  11 o 287.0544 5.300974  54.91928       2.027652      56.95797       3.509910      53.89811       2.484094      292.0969 9.028533  284.3466 6.556116  7.750366       11.15782  
1 1 1 1  2  12 o 217.1291 3.806923  31.41726       1.101452      34.91198       1.952338      29.78559       1.334029      228.7546 6.411214  211.4038 4.735645  17.35078       7.970571  
1 1 1 1  2  13 o 658.7350 7.908442  289.4066       6.941850      279.8035       9.922338      298.6135       9.715449      647.3452 11.50283  668.8239 10.90128  -21.47870      15.84781  
1 1 1 1  2  14 o 645.6197 7.223331  277.9971       6.214237      280.6580       8.064361      274.1074       9.750225      648.4808 9.332527  640.5970 11.42237  7.883789       14.75014  
1 1 1 1  2  15 o 226.9230 5.685915  34.35660       1.717949      33.96002       2.146579      35.06320       2.865283      225.5161 7.152291  228.9695 9.411159  -3.453400      11.82054  
1 1 1 1  2  16 o 156.5514 4.695869  16.35343       0.9784873     16.41771       1.224198      16.23971       1.628241      156.7931 5.869736  155.7938 7.868712  0.9993286      9.816844  
1 1 1 1  2  17 o 343.8249 5.119890  78.82320       2.345695      78.40504       3.000630      79.48032       3.761467      342.8261 6.568483  345.0480 8.180959  -2.221893      10.49157  
1 1 1 1  2  18 o 506.1906 6.000191  170.9014       4.047181      170.6628       5.293321      171.2372       6.279317      505.6401 7.856211  506.2995 9.307465  -0.6593323     12.17986  
1 1 1 1  2  19 o 237.2382 5.927002  37.53724       1.873670      36.81987       2.209655      39.37292       3.534688      234.8030 7.070371  242.4203 10.97073  -7.617310      13.05170  
1 1 1 1  2  20 o 179.6457 6.719302  21.55899       1.605641      20.35524       2.082102      23.32521       2.522066      174.3632 8.991725  186.5623 10.18378  -12.19914      13.58530  
1 1 1 1  2  21 o 667.8607 7.486393  297.6266       6.662421      292.0703       8.728582      305.3820       10.31241      661.2225 9.906554  675.8229 11.45127  -14.60040      15.14171  
1 1 1 1  2  22 o 412.6451 5.673723  113.5489       3.119739      115.2176       4.088003      111.2218       4.827620      415.5380 7.382899  408.1323 8.876843  7.405701       11.54580  
1 1 1 1  2  23 o 190.0033 5.694110  24.09817       1.440026      27.73012       2.069250      20.68736       2.005265      203.6876 7.637385  175.8042 8.585870  27.88333       11.49116  
1 1 1 1  2  24 o 234.4438 5.678876  36.66370       1.774086      36.72034       2.232893      36.56673       2.921587      234.4345 7.156186  233.7054 9.400774  0.7290955      11.81463  
1 1 1 1  2  25 o 51.97886 7.346352  1.840194       0.4946618     1.981331       0.5232362     0.6528574      1.517628      53.95224 7.478917  43.50787 17.36422  10.44437       18.90635  
1 1 1 1  2  26 o 120.4325 5.322173  9.699276       0.8519860     9.890530       0.9345134     8.757665       2.073563      121.5761 5.785111  113.1201 14.05886  8.455925       15.20260  
1 1 1 1  2  27 o 97.73975 5.784320  6.404056       0.7499816     7.152088       0.8392408     3.437970       1.671160      103.2730 6.126073  69.63984 17.90891  33.63313       18.92770  
1 1 1 1  2  28 o 95.59003 10.82732  6.235147       1.354879      5.984029       1.470531      7.645865       3.485428      93.34325 12.10774  101.8983 25.68221  -8.555077      28.39319  
1 1 1 1  2  29 o 104.5574 4.473214  7.314816       0.6217889     7.637683       0.6418806     2.398251       2.504798      106.8395 4.518879  62.87833 22.96862  43.96115       23.40892  
1 1 1 1  2  30 o 46.48680 6.786090  1.479348       0.4079716     1.502860       0.4137625     0.6569511      2.447053      46.85458 6.827773  51.53802 21.47740  -4.683434      22.53658  
1 1 1 1  2  31 o 24.75652 9.382602  0.2989587      0.4254271     0.3795298      0.4356740     -1.353687      1.973159      26.21643 9.578781  37.06292 17.10925  -10.84649      19.60814  
1 1 1 1  2  32 o 89.95280 6.974035  5.486050       0.8294093     5.410301       0.8694562     6.251978       2.764729      89.23409 7.377999  89.63348 23.02676  -0.3993912     24.17988  
1 1 1 1  2  33 o 76.74537 6.647207  4.009434       0.6730786     3.788389       0.6908510     8.140624       2.986628      74.48600 7.044115  100.8073 22.77300  -26.32129      23.83756  
1 1 1 1  2  34 o 78.38532 6.422936  4.195243       0.6649971     4.220778       0.6922371     3.889820       2.394108      78.54910 6.676849  68.17918 22.60486  10.36992       23.57032  
1 1 1 1  2  35 o 33.24749 14.14203  0.2574482      1.096112      -0.7100585     1.253086      3.409680       2.261846      29.36414 13.58328  62.32901 21.93738  -32.96487      25.80221  
1 1 1 1  2  36 o 42.11596 14.95652  1.318766       1.053274      3.219096       1.409781      -1.082107      1.584608      62.25086 16.66538  31.26032 14.72403  30.99055       22.23807  
1 1 1 1  2  37 o ?        ?         -3.184999      0.7175083     -3.801675      0.9723313     -2.447729      1.063161      ?        ?         19.89216 9.921950  0.000000       9.921950  
1 1 1 1  2  38 o 52.54279 12.62564  2.208428       0.8729392     1.926619       1.229868      2.494545       1.239230      47.13854 16.20091  53.26726 16.09985  -6.128719      22.84019  
1 1 1 1  3  0  o 879.9691 22.15991  518.2387       25.94695      518.2387       25.94695      518.2387       25.94695      879.9691 22.15991  879.9691 22.15991  -0.000000      0.000000  
1 1 1 1  3  1  o 589.5159 6.843753  231.6599       5.376051      232.1791       9.203322      231.3909       6.623598      589.8934 11.70840  589.0974 8.437880  0.7960815      14.43206  
1 1 1 1  3  2  o 570.5363 1.547242  216.8809       1.176292      222.2803       6.962954      216.7222       1.193445      577.3505 9.050664  570.3275 1.570379  7.023071       9.185892  
1 1 1 1  3  3  o 773.4121 13.57537  399.3165       13.99060      385.7501       16.03780      442.5126       28.61772      759.8917 15.83870  811.5161 26.50007  -51.62439      30.87261  
1 1 1 1  3  4  o 607.7685 10.35162  246.3862       8.383399      246.0103       11.07085      246.8914       12.83582      607.0454 13.68631  607.7181 15.86425  -0.6727295     20.95207  
1 1 1 1  3  5  o 843.8544 14.75140  475.5418       16.58725      491.0479       21.83527      454.3841       25.50599      856.8246 19.12464  823.1222 23.27773  33.70245       30.12647  
1 1 1 1  3  6  o 774.8335 13.25159  400.7545       13.68201      396.5966       19.95677      404.4421       18.79409      769.7212 19.47297  777.7517 18.13455  -8.030518      26.60937  
1 1 1 1  3  7  o 564.7646 9.424682  212.7132       7.092637      229.2534       15.44168      208.2906       7.984758      585.0200 19.83713  558.7839 10.72369  26.23608       22.55015  
1 1 1 1  3  8  o 272.7379 5.092086  49.57431       1.850609      56.66280       3.202957      46.02211       2.267372      291.4022 8.257009  262.7621 6.475697  28.64011       10.49347  
1 1 1 1  3  9  o 574.3864 10.15722  220.0605       7.774147      208.6935       12.35079      227.5193       10.00476      558.5830 16.61178  583.8410 12.85993  -25.25800      21.00783  
1 1 1 1  3  10 o 746.3877 9.647970  371.5784       9.595640      376.6261       12.00884      362.6636       15.95904      751.2147 11.99674  736.6348 16.25852  14.57990       20.20548  
1 1 1 1  3  11 o 337.1736 5.460210  75.77375       2.453220      73.39146       3.922917      77.30372       3.143785      331.6067 8.885950  340.5204 6.928450  -8.913727      11.26781  
1 1 1 1  3  12 o 130.7809 3.388613  11.40503       0.5900294     11.77394       0.7798270     10.91106       0.9023791     132.8428 4.411533  127.8345 5.309011  5.008263       6.902697  
1 1 1 1  3  13 o 171.4979 4.152486  19.60152       0.9489437     18.92055       1.239110      20.56736       1.475700      168.3826 5.530041  175.5246 6.319694  -7.141922      8.397612  
1 1 1 1  3  14 f 295.1198 5.565458  58.06558       2.188632      59.42803       2.993366      56.50056       3.208174      298.3878 7.534472  290.8848 8.285260  7.502991       11.19883  
1 1 1 1  3  15 o 31.09908 3.729020  0.6538474      0.1514531     0.6609437      0.1539750     0.4425214      0.8402522     31.26454 3.772083  33.37907 13.04440  -2.114532      13.57884  
1 1 1 1  3  16 o 398.4088 5.716069  105.8530       3.034589      108.3868       3.883870      101.8819       4.862217      403.0371 7.231795  390.5627 9.342650  12.47446       11.81457  
1 1 1 1  3  17 o 394.8642 5.073129  103.9616       2.669299      102.4807       3.626081      105.7135       3.943822      391.9101 6.943484  398.0016 7.436335  -6.091461      10.17404  
1 1 1 1  3  18 o 389.2879 5.195587  101.0502       2.695126      101.8145       3.555336      100.0178       4.132389      390.6420 6.830119  387.0781 8.011781  3.563843       10.52802  
1 1 1 1  3  19 o 472.8603 6.217125  149.1406       3.917382      145.6502       4.968437      154.8758       6.368751      467.1246 7.982033  481.4487 9.927289  -14.32413      12.73829  
1 1 1 1  3  20 o 561.9722 7.155162  210.7105       5.358063      215.6734       6.498773      200.1763       9.468192      568.3760 8.580688  546.8588 12.99327  21.51727       15.57091  
1 1 1 1  3  21 o 337.2149 5.936327  75.83468       2.667461      69.92989       3.539975      83.59208       4.057475      323.5766 8.216770  353.8582 8.605043  -30.28162      11.89799  
1 1 1 1  3  22 o 123.2796 4.315302  10.14338       0.7077919     10.75671       0.8129721     8.222470       1.438744      126.9304 4.815316  110.5039 9.874806  16.42651       10.98631  
1 1 1 1  3  23 o 360.2929 5.652233  86.57470       2.713622      80.10246       4.192273      91.24201       3.560049      346.1692 9.096287  369.7596 7.225417  -23.59048      11.61676  
1 1 1 1  3  24 o 381.6582 5.960173  97.18150       3.031147      96.97791       4.397868      97.36573       4.183539      380.9702 8.663185  381.7854 8.223392  -0.8151550     11.94466  
1 1 1 1  3  25 o 153.9406 6.440563  15.84852       1.318227      14.65534       2.063613      16.67105       1.713370      147.5360 10.56676  157.7138 8.180781  -10.17780      13.36345  
1 1 1 1  3  26 o 114.2241 8.915787  8.789945       1.346292      9.035853       2.159514      8.633611       1.721855      114.8187 14.43275  112.7593 11.62610  2.059425       18.53296  
1 1 1 1  3  27 o 209.6170 7.099732  29.43030       1.980226      26.96633       3.141206      31.05528       2.550957      199.6842 11.85877  215.0082 8.923177  -15.32402      14.84094  
1 1 1 1  3  28 o 176.5525 7.631949  20.93052       1.791248      20.12230       2.150187      22.76354       3.238136      172.7602 9.375393  182.6995 13.39408  -9.939377      16.34929  
1 1 1 1  3  29 o 149.5745 7.497458  15.04759       1.489560      16.87247       1.685053      8.523343       3.186112      158.3027 8.014325  107.8553 22.87881  50.44744       24.24190  
1 1 1 1  3  30 o 12.14261 6.027014  -0.9034964     0.3732567     -0.8972135     0.3763839     -1.276884      2.901572      12.25830 6.078855  47.10633 21.36442  -34.84803      22.21241  
1 1 1 1  3  31 o 85.99280 8.761806  5.047431       0.9899798     5.315293       1.102470      3.932130       2.249612      88.07617 9.546102  72.80252 21.62021  15.27365       23.63391  
1 1 1 1  3  32 o 117.4910 7.901700  9.381325       1.229889      10.25545       1.362924      5.548079       2.854099      122.7169 8.385149  83.84483 24.20344  38.87209       25.61478  
1 1 1 1  3  33 o 43.10670 12.39124  1.336826       0.7495585     1.298970       0.7549008     3.983143       6.311668      42.56244 12.49435  76.63335 33.27782  -34.07091      35.54605  
1 1 1 1  3  34 f 35.97927 13.08952  0.8131975      0.8123001     0.7951717      0.8225037     1.526232       5.173039      35.85121 13.15126  62.88115 28.52187  -27.02994      31.40784  
1 1 1 1  3  35 o 53.65976 13.95556  2.224480       1.007113      2.698816       1.110457      0.2602808E-01  2.390658      59.00847 14.27862  43.33293 19.54764  15.67554       24.20722  
1 1 1 1  3  36 o 47.96947 13.28656  1.794500       0.8784132     1.969945       0.9439107     0.6603010      2.399963      50.04551 13.73858  44.87176 19.96074  5.173744       24.23179  
1 1 1 1  3  37 o 26.78222 11.27559  0.2009178      0.6850333     0.7930880E-01  0.7053635     2.219793       2.873987      25.94644 11.19588  51.51509 22.41208  -25.56865      25.05292  
1 1 1 1  3  38 o 69.12632 8.081738  3.435395       0.7303934     3.858166       0.8255482     1.912067       1.567065      72.91425 8.666158  46.69021 17.93124  26.22403       19.91562  
1 1 1 1  4  0  o 254.0029 4.792650  43.03651       1.620836      43.03651       1.620836      43.03651       1.620836      254.0029 4.792650  254.0029 4.792650  0.000000       0.000000  
1 1 1 1  4  1  o 134.0964 1.576942  11.98090       0.2817775     11.99168       0.3951572     11.96974       0.4019160     134.1550 2.210494  134.0321 2.250364  0.1228943      3.154429  
1 1 1 1  4  2  o 549.9833 6.760003  201.6293       4.954159      196.9129       6.508130      208.1281       7.639572      543.4115 8.987809  558.5994 10.26349  -15.18787      13.64258  
1 1 1 1  4  3  o 560.6353 6.695329  209.5134       5.001795      199.7917       6.644885      222.2229       7.597692      547.3625 9.110430  577.2277 9.877817  -29.86511      13.43768  
1 1 1 1  4  4  o 609.5542 2.549366  247.5702       2.070704      260.9798       9.634273      246.9207       2.120256      625.4207 11.56041  608.7531 2.613808  16.66760       11.85222  
1 1 1 1  4  5  o 759.3962 12.92983  384.9077       13.08383      366.2603       27.96019      390.1357       14.80477      737.7008 28.49731  764.3560 14.53558  -26.65521      31.99031  
1 1 1 1  4  6  o 214.1749 5.380750  30.59070       1.534408      28.00109       2.140114      33.33009       2.201134      204.7874 7.857179  223.4761 7.401871  -18.68878      10.79458  
1 1 1 1  4  7  o 111.1718 5.248004  8.255206       0.7752376     8.470842       1.513890      8.178561       0.9025558     112.2289 10.23569  110.6010 6.148285  1.627876       11.94030  
1 1 1 1  4  8  o 754.4172 9.085355  379.5387       9.133284      376.0473       12.40090      383.6777       13.50208      750.6492 12.39774  758.1241 13.36555  -7.474915      18.23024  
1 1 1 1  4  9  o 804.2584 9.219852  431.3759       9.880823      415.9811       14.30267      445.4312       13.66623      789.3276 13.59835  816.9176 12.55443  -27.59003      18.50754  
1 1 1 1  4  10 o 331.9397 6.069956  73.44460       2.684839      81.38152       4.319493      68.44775       3.427321      349.1855 9.291570  320.2935 8.036673  28.89203       12.28501  
1 1 1 1  4  11 o 144.4503 4.859367  13.92232       0.9340131     14.06115       1.159148      13.66531       1.577136      145.1142 6.007524  142.9059 8.318155  2.208344       10.26070  
1 1 1 1  4  12 o 142.1474 5.039672  13.48463       0.9530750     14.49255       1.456798      12.73042       1.260182      147.2341 7.449568  138.0073 6.874275  9.226776       10.13665  
1 1 1 1  4  13 o 208.2269 6.326579  28.93587       1.753376      26.71076       3.353252      29.77318       2.056985      199.5327 12.67740  211.1624 7.321472  -11.62971      14.63969  
1 1 1 1  4  14 o 29.51558 10.65334  0.4821223      0.5366814     -0.6144951E-01 0.9897675     0.7084965      0.6387312     31.14348 13.34779  34.09205 11.67669  -2.948570      17.73440  
1 1 1 1  4  15 o 430.4474 6.458578  123.5812       3.704508      124.4051       6.228157      123.1301       4.608321      431.3219 10.84499  429.5328 8.051427  1.789124       13.50701  
1 1 1 1  4  16 o 85.37055 6.432970  4.889060       0.7264172     5.820794       1.090718      4.146354       0.9738116     92.93941 8.916471  78.21119 9.541256  14.72822       13.05906  
1 1 1 1  4  17 o 299.3816 5.636580  59.77392       2.248611      57.96346       3.363865      61.23639       3.023353      294.5022 8.581037  302.9104 7.490333  -8.408173      11.39032  
1 1 1 1  4  18 o 300.5431 5.212982  60.22940       2.087692      60.21331       2.695658      60.25349       3.300090      300.4217 6.733795  300.3075 8.254642  0.1142578      10.65285  
1 1 1 1  4  19 f 328.9911 5.613362  72.17721       2.460825      70.69498       3.131536      74.57022       3.978992      325.5004 7.219920  334.0517 8.946993  -8.551331      11.49678  
1 1 1 1  4  20 o 88.07632 6.091371  5.198352       0.7105002     5.580488       0.8036249     3.830247       1.520563      91.22289 6.656957  74.17284 15.86465  17.05005       17.20472  
1 1 1 1  4  21 o 311.5221 5.998403  64.72069       2.489993      65.06255       3.138029      64.13953       4.091454      312.2558 7.541763  309.7013 9.927100  2.554443       12.46698  
1 1 1 1  4  22 f 370.7290 6.943942  91.69572       3.430332      86.12482       5.252399      95.83930       4.529846      358.7552 11.00017  378.8399 8.973343  -20.08466      14.19594  
1 1 1 1  4  23 o 81.48196 8.954963  4.488141       0.9562902     3.783072       1.065769      7.400787       2.166163      74.40057 11.08827  103.7466 16.19819  -29.34604      19.62985  
1 1 1 1  4  24 o 490.6413 8.577392  160.8644       5.607804      163.3817       8.524639      158.9440       7.445679      493.3572 12.97831  487.1355 11.47047  6.221771       17.32075  
1 1 1 1  4  25 o 303.8558 6.823296  61.66387       2.762710      56.02941       3.988795      66.85905       3.830155      288.9999 10.37470  315.9691 9.106501  -26.96915      13.80445  
1 1 1 1  4  26 o 279.0701 7.661771  52.13488       2.846459      50.13840       4.739229      53.26150       3.560132      272.4323 13.09330  281.7161 9.497346  -9.283875      16.17510  
1 1 1 1  4  27 o 171.4604 9.080447  19.78042       2.067252      17.14863       3.017858      22.10711       2.837538      158.3892 14.45805  180.6912 11.85045  -22.30200      18.69408  
1 1 1 1  4  28 o 34.36347 12.30710  0.6826883      0.7146468     1.529311       0.8146663     -2.144093      1.488609      46.74466 12.73549  28.21576 13.56058  18.52889       18.60328  
1 1 1 1  4  29 o 38.38734 12.05907  0.9911275      0.6872145     1.291930       0.8158021     0.2560995      1.275251      43.33993 13.05491  37.24977 15.51231  6.090157       20.27468  
1 1 1 1  4  30 o 38.41330 13.93891  0.8508916      0.9203294     0.4996873      0.9548395     5.447736       3.454461      35.10373 13.84899  85.32099 27.06761  -50.21727      30.40477  
1 1 1 1  4  31 o 22.88590 9.994680  -0.1055683     0.5762125     -0.8740551E-01 0.5821823     -0.9775889     4.033954      23.18418 10.08681  56.30045 25.39526  -33.11626      27.32513  
1 1 1 1  4  32 o 76.92665 12.22512  4.185798       1.211270      4.112358       1.226606      7.067729       7.683886      76.12914 12.52684  91.88701 38.15582  -15.75787      40.15953  
1 1 1 1  4  33 o 17.81021 8.445840  -0.6267163     0.5380964     -0.6267163     0.5380964     0.000000       0.000000      17.81021 8.445840  ?        ?         0.000000       8.445840  
1 1 1 1  4  34 f 28.86295 11.87182  0.2605747      0.7343233     0.2605747      0.7343233     0.000000       0.000000      28.86295 11.87182  ?        ?         0.000000       11.87182  
1 1 1 1  4  35 o 35.78134 13.48090  0.7979888      0.8752555     0.2835739      0.9293121     4.837802       2.604267      31.34429 13.16079  71.29169 23.57390  -39.94741      26.99880  
1 1 1 1  4  36 o ?        ?         -1.309564      0.1705232     -1.321314      0.1708384     1.866055       2.808453      ?        ?         51.58489 22.29975  0.000000       22.29975  
1 1 1 1  4  37 o 18.80818 9.292892  -1.678830      0.8506621     -1.827579      0.8784611     0.5604836      3.408409      18.78599 9.310821  46.84812 21.91558  -28.06213      23.81143  
1 1 1 1  4  38 o 22.11541 10.78706  -1.504690      1.035107      -1.642519      1.069976      0.5071840      4.087941      22.13899 10.83466  46.89355 22.52023  -24.75456      24.99101  
1 1 1 1  5  0  o 63.07685 4.524015  2.691808       0.3756654     2.691808       0.3756654     2.691808       0.3756654     63.07685 4.524015  63.07685 4.524015  0.000000       0.000000  
1 1 1 1  5  1  o 83.87585 3.213424  4.694634       0.3584878     4.628103       0.4441795     4.818941       0.6071495     83.24112 4.016341  84.86160 5.397184  -1.620483      6.727599  
1 1 1 1  5  2  o 302.1135 6.077029  60.83510       2.446442      61.60338       3.311310      59.91171       3.630224      303.8567 8.185653  299.6009 9.103764  4.255768       12.24269  
1 1 1 1  5  3  o 524.4743 2.516370  183.2826       1.758621      182.8115       1.818614      190.0716       6.903804      523.7986 2.605570  533.8499 9.705006  -10.05127      10.04869  
1 1 1 1  5  4  o 482.6505 6.321789  155.2724       4.065803      143.4539       5.844471      166.3558       5.659801      463.7963 9.456804  499.4934 8.503505  -35.69711      12.71773  
1 1 1 1  5  5  o 196.3696 0.4620419 25.69172       0.1209008     27.32343       0.3183902     25.41680       0.1306895     202.5082 1.179895  195.3161 0.5021452 7.192108       1.282304  
1 1 1 1  5  6  o 848.9556 8.749155  480.5857       9.897480      490.2950       11.35003      449.7680       20.22100      857.3865 9.934514  820.1146 18.50353  37.27197       21.00179  
1 1 1 1  5  7  o 444.4699 6.192350  131.6765       3.667511      132.8127       5.072392      130.4318       5.308981      446.3004 8.529272  442.2618 9.008618  4.038605       12.40579  
1 1 1 1  5  8  o 805.3499 3.475905  432.1870       3.730147      483.6057       11.70226      426.3717       3.935430      851.4603 10.31411  799.9064 3.692151  51.55389       10.95504  
1 1 1 1  5  9  o 622.4633 9.457955  258.4281       7.844847      264.9235       9.782887      246.7273       13.13022      630.0613 11.65228  607.3558 16.23847  22.70551       19.98658  
1 1 1 1  5  10 o 217.3479 6.177824  31.51541       1.787408      29.54500       2.449037      33.76130       2.614634      210.2934 8.758866  224.8237 8.744284  -14.53026      12.37660  
1 1 1 1  5  11 o 320.7782 6.928056  68.60599       2.961350      68.39375       4.732916      68.74254       3.796264      319.9105 11.11956  320.9012 8.886482  -0.9906921     14.23426  
1 1 1 1  5  12 o 257.5355 6.022100  44.21683       2.066611      44.41658       2.677261      43.92233       3.250772      257.9450 7.798106  256.3804 9.532020  1.564545       12.31543  
1 1 1 1  5  13 o 604.4846 7.466132  243.7281       6.013876      242.8548       9.812340      244.2535       7.610873      602.8293 12.21531  604.9308 9.441811  -2.101440      15.43897  
1 1 1 1  5  14 o 303.2266 5.758113  61.30943       2.326596      67.38943       3.654717      57.16647       3.016877      317.6298 8.642967  292.6051 7.744335  25.02469       11.60498  
1 1 1 1  5  15 o 279.4710 6.984817  52.10721       2.601149      51.10006       4.301503      52.68780       3.265937      276.1772 11.71511  280.7825 8.739635  -4.605347      14.61592  
1 1 1 1  5  16 o 398.0363 7.677119  105.7395       4.071875      108.4057       6.740464      104.2074       5.109561      402.2446 12.59103  394.9384 9.709139  7.306213       15.89973  
1 1 1 1  5  17 o 298.1532 6.613423  59.30500       2.627479      64.27767       3.577568      53.48184       3.871440      310.1360 8.665390  282.6886 10.29477  27.44739       13.45627  
1 1 1 1  5  18 o 240.9475 6.916808  38.76630       2.218462      42.29591       3.729742      36.83389       2.759723      251.2524 11.16816  234.6922 8.840366  16.56015       14.24359  
1 1 1 1  5  19 o 207.8401 5.972600  28.83306       1.652401      30.26120       2.048660      26.17417       2.795329      212.8411 7.233900  197.6085 10.65524  15.23267       12.87879  
1 1 1 1  5  20 o 149.8393 5.487602  14.99083       1.093825      13.99497       1.279817      17.68972       2.106886      144.6938 6.655632  162.4445 9.778625  -17.75079      11.82873  
1 1 1 1  5  21 o 258.7832 6.193926  44.66484       2.135874      42.33363       3.054956      46.89400       2.987343      251.6225 9.126452  264.9081 8.473742  -13.28564      12.45377  
1 1 1 1  5  22 o 230.6547 6.262895  35.51294       1.923131      33.91465       2.767985      37.00440       2.673891      225.1466 9.245915  235.2645 8.543496  -10.11794      12.58882  
1 1 1 1  5  23 o 355.2968 6.910718  84.24446       3.271810      81.02274       6.457289      85.35725       3.795024      347.2786 13.98259  357.5390 7.965583  -10.26047      16.09234  
1 1 1 1  5  24 o 158.3266 6.954439  16.76838       1.463622      16.61312       2.092653      16.91706       2.047822      157.2492 10.03944  158.7267 9.728818  -1.477524      13.98000  
1 1 1 1  5  25 o 31.23345 12.73507  0.2455653      0.8357810     0.6690759      1.087692      -0.3649763     1.305965      38.72813 14.92194  33.80041 14.89482  4.927723       21.08364  
1 1 1 1  5  26 o 322.6837 7.280829  69.64191       3.130628      62.50135       6.017034      72.29241       3.665896      303.4830 14.92481  328.4563 8.382704  -24.97330      17.11782  
1 1 1 1  5  27 o 157.9455 10.01169  16.83772       2.096270      16.04755       3.688419      17.21472       2.547743      151.7989 18.62449  159.2457 12.09695  -7.446808      22.20828  
1 1 1 1  5  28 o 26.96260 12.26668  -0.5776616     0.9657852     -1.510145      1.175716      1.357009       1.693501      25.84915 12.32220  50.15030 18.78198  -24.30115      22.46328  
1 1 1 1  5  29 o 46.05561 16.33636  1.292895       1.256256      1.020044       1.496692      1.943451       2.311065      45.60480 17.52153  58.50883 21.93500  -12.90403      28.07398  
1 1 1 1  5  30 o 37.36356 14.45100  0.6497351      1.022939      1.472954       1.411691      -0.2604062     1.484350      48.70428 17.31334  36.38549 15.96192  12.31879       23.54856  
1 1 1 1  5  31 o 135.9860 9.701099  12.62344       1.746332      11.96890       2.043748      14.39427       3.361612      131.6511 11.77426  141.1908 18.29757  -9.539612      21.75854  
1 1 1 1  5  32 o 75.24645 15.31623  4.142636       1.483436      4.688600       1.519920      -6.822232      6.811460      80.41677 14.72659  58.07663 28.17742  22.34015       31.79370  
1 1 1 1  5  33 o 49.14767 18.80980  1.498956       1.720361      1.498956       1.720361      0.000000       0.000000      49.14767 18.80980  ?        ?         0.000000       18.80980  
1 1 1 1  5  34 o 54.85830 14.67586  2.305465       1.093752      2.305465       1.093752      0.000000       0.000000      54.85830 14.67586  ?        ?         0.000000       14.67586  
1 1 1 1  5  35 o 85.27297 10.28792  5.242712       1.145398      7.072801       1.267534      -2.904307      2.674378      99.59958 9.672196  36.18901 17.58075  63.41056       20.06575  
1 1 1 1  5  36 o 16.35774 7.763845  -0.5105240     0.4566464     -0.4679054     0.4625179     -2.157216      2.874981      16.79688 7.924791  38.53490 18.60169  -21.73802      20.21943  
1 1 1 1  5  37 o 48.13404 15.35923  1.945382       1.110961      1.657435       1.160478      5.105132       3.844208      44.87378 15.71974  61.89452 26.41074  -17.02075      30.73495  
1 1 1 1  6  0  o 157.0323 4.419475  16.47010       0.9231123     16.47010       0.9231123     16.47010       0.9231123     157.0323 4.419475  157.0323 4.419475  0.000000       0.000000  
1 1 1 1  6  1  o 906.7715 2.385118  547.8549       2.881916      532.8194       14.63321      548.4615       2.939487      893.5524 12.28983  907.2725 2.431421  -13.72003      12.52804  
1 1 1 1  6  2  o 152.6368 3.528193  15.52456       0.7176043     14.42953       0.8997161     17.43910       1.189662      147.0766 4.596442  161.6650 5.530622  -14.58835      7.191318  
1 1 1 1  6  3  o 918.2463 2.641263  561.8162       3.231799      537.0245       14.65412      563.0837       3.313380      897.0730 12.25910  919.2800 2.704892  -22.20697      12.55396  
1 1 1 1  6  4  o 807.1108 7.239721  434.2632       7.786253      441.9313       9.337834      416.7661       14.10535      814.1113 8.607735  790.1479 13.39682  23.96338       15.92382  
1 1 1 1  6  5  o 363.8278 5.344420  88.22027       2.591015      86.96288       2.930576      92.72254       5.545391      361.2092 6.088645  372.6365 11.18059  -11.42731      12.73095  
1 1 1 1  6  6  o 717.1067 8.123385  342.8625       7.762370      351.6360       12.51281      337.3738       9.896916      725.8275 12.93743  711.1787 10.44354  14.64874       16.62662  
1 1 1 1  6  7  f 663.6622 8.377094  293.6853       7.408222      288.0526       11.75221      297.3995       9.543037      656.8586 13.42685  667.6763 10.72623  -10.81775      17.18523  
1 1 1 1  6  8  o 787.4005 11.98147  413.7950       12.57128      391.8552       17.13171      439.3918       18.50448      765.6050 16.79277  810.6588 17.13031  -45.05377      23.98843  
1 1 1 1  6  9  o 543.7059 9.014932  197.1656       6.531306      204.4467       8.627020      187.3884       9.996988      553.4542 11.69784  529.4525 14.18273  24.00165       18.38449  
1 1 1 1  6  10 o 449.5383 9.207292  134.8058       5.515337      140.2414       6.577914      121.9385       10.12065      458.4087 10.76866  426.4592 17.84920  31.94949       20.84606  
1 1 1 1  6  11 o 294.4797 5.353092  57.80418       2.100553      58.88743       2.632976      55.90767       3.483850      297.1881 6.648780  289.3411 9.047108  7.847015       11.22749  
1 1 1 1  6  12 o 205.0027 5.230822  28.03321       1.427737      29.92528       1.722530      23.88015       2.552011      211.7686 6.110631  188.8601 10.17832  22.90849       11.87173  
1 1 1 1  6  13 o 169.3245 4.295825  19.12266       0.9684765     19.46906       1.148502      18.27014       1.801755      170.8177 5.051296  165.2640 8.207388  5.553696       9.637261  
1 1 1 1  6  14 o 413.0058 6.505587  113.7711       3.580273      121.1326       4.701479      103.6089       5.523912      426.0130 8.282056  393.6389 10.54062  32.37402       13.40512  
1 1 1 1  6  15 o 212.2066 6.034050  30.05817       1.704512      28.43811       2.328732      31.92774       2.501632      206.2130 8.492989  218.5086 8.608589  -12.29564      12.09292  
1 1 1 1  6  16 o 151.3178 6.875251  15.30840       1.382662      18.52950       2.100230      12.84445       1.836882      166.2712 9.519078  138.2776 10.03743  27.99358       13.83340  
1 1 1 1  6  17 o 116.9302 7.585220  9.163204       1.175488      16.96384       2.878011      7.601339       1.287803      158.5373 13.75958  106.2876 9.182680  52.24979       16.54230  
1 1 1 1  6  18 o 345.9226 7.040127  79.83810       3.245136      82.79411       4.895077      77.52035       4.334514      351.8178 10.45322  340.5299 9.561847  11.28790       14.16682  
1 1 1 1  6  19 o 610.3937 8.358443  248.7062       6.798435      239.0191       10.21983      256.3956       9.105283      597.6208 12.83348  619.3227 11.03324  -21.70190      16.92426  
1 1 1 1  6  20 o 401.6975 7.345184  107.6628       3.931655      103.7934       5.397644      112.0363       5.738386      394.0076 10.28959  409.3311 10.52937  -15.32349      14.72220  
1 1 1 1  6  21 o 376.7127 7.951250  94.71583       3.991344      97.46682       5.353460      91.27278       5.989100      381.7490 10.53413  369.1688 12.19156  12.58017       16.11217  
1 1 1 1  6  22 o 259.6754 7.013695  45.02759       2.424674      48.57219       3.257877      40.62630       3.630286      269.5104 9.084623  246.2207 11.09327  23.28970       14.33844  
1 1 1 1  6  23 o 392.4515 7.665757  102.8399       4.008802      102.8957       5.792844      102.7886       5.553341      391.9352 11.10304  391.8152 10.64639  0.1199951      15.38256  
1 1 1 1  6  24 o 228.0718 7.573301  34.78835       2.298411      32.38681       3.105025      37.69912       3.418415      219.6375 10.64092  236.9706 10.85455  -17.33315      15.20034  
1 1 1 1  6  25 o 270.9016 7.750063  49.11563       2.794756      50.39937       4.478344      48.29678       3.576709      273.4930 12.32010  268.2267 10.02473  5.266266       15.88333  
1 1 1 1  6  26 o 97.07667 15.08105  6.533075       1.887542      9.598836       3.176786      4.860157       2.346693      116.3350 21.27674  82.42474 21.23522  33.91029       30.06051  
1 1 1 1  6  27 o 87.41187 14.91713  5.336542       1.675213      6.587312       3.240228      4.880257       1.957065      94.84052 25.20931  82.73297 18.24353  12.10754       31.11810  
1 1 1 1  6  28 o 22.40306 10.61865  -1.010213      0.8485750     -0.6525329     0.9588429     -2.302525      1.822568      26.37957 12.08537  32.12201 15.32063  -5.742443      19.51354  
1 1 1 1  6  29 o 44.97911 13.84743  1.387578       0.9112025     0.9391967      0.9973031     3.653149       2.241777      40.18605 14.52011  71.23656 21.67993  -31.05051      26.09316  
1 1 1 1  6  30 o 112.5787 9.960954  8.652314       1.478873      6.902258       1.688106      14.42846       3.066851      99.56052 13.03739  143.0759 16.38116  -43.51540      20.93600  
1 1 1 1  6  31 o 51.96656 19.33277  1.631954       1.788337      2.542326       4.059339      1.412716       1.992068      68.93052 28.08097  51.68574 20.11749  17.24478       34.54351  
1 1 1 1  6  32 o 86.30315 22.12199  5.893775       2.555630      6.800117       3.960101      5.246912       3.345540      88.72390 29.05667  79.82977 26.72797  8.894127       39.48005  
1 1 1 1  6  33 o 80.47474 24.33538  5.572245       2.830792      5.426822       2.882006      9.555298       15.08296      79.23083 24.66657  86.84812 42.08792  -7.617287      48.78353  
1 1 1 1  6  34 o 48.82249 22.45837  -0.2668617     3.357511      -0.4454551     3.600293      0.9249622      9.300604      49.56433 22.96125  66.66784 32.47732  -17.10350      39.77430  
1 1 1 1  6  35 o 41.96342 18.31039  0.5476490      1.930335      -1.438579      2.924752      2.080602       2.569442      41.39809 19.64867  52.90255 22.02395  -11.50445      29.51483  
1 1 1 1  6  36 o 42.17601 18.58926  0.6373038      2.035074      1.246565       2.618549      -0.2919849     3.233958      47.66914 21.04518  45.02413 21.15308  2.645004       29.83878  
1 1 1 1  6  37 o 68.03545 16.23819  3.981221       1.451621      4.926506       1.625496      0.2582706      3.225879      75.60170 16.59180  44.75608 21.05823  30.84562       26.80927  
1 1 1 1  7  0  o 235.3354 5.664898  36.96968       1.774124      36.96968       1.774124      36.96968       1.774124      235.3354 5.664898  235.3354 5.664898  0.000000       0.000000  
1 1 1 1  7  1  f 549.1824 5.382030  201.0067       3.938549      205.7158       5.530017      196.1592       5.610759      555.4988 7.470847  542.4296 7.762555  13.06921       10.77362  
1 1 1 1  7  2  o 200.5615 3.429330  26.80360       0.9164956     27.21997       1.135714      26.02621       1.551851      202.1068 4.217107  197.5193 5.902750  4.587494       7.254409  
1 1 1 1  7  3  o 633.6415 7.759175  267.6763       6.551378      270.4677       7.490706      258.5932       13.51235      636.8766 8.826610  621.9019 16.31965  14.97473       18.55371  
1 1 1 1  7  4  o 630.2554 6.418814  264.7698       5.390697      272.3018       7.812799      257.9258       7.447506      639.0099 9.175410  621.9246 8.986687  17.08533       12.84324  
1 1 1 1  7  5  f 718.0294 6.934764  343.6842       6.635099      354.4246       8.250257      324.0171       11.16421      729.0654 8.492341  696.8098 12.02375  32.25562       14.72041  
1 1 1 1  7  6  o 566.4766 7.141130  213.9265       5.390418      213.1962       7.296162      214.8042       7.998570      565.3684 9.684772  567.4369 10.57843  -2.068481      14.34218  
1 1 1 1  7  7  o 407.6940 5.613271  110.7848       3.049466      111.8479       4.538919      109.9102       4.117069      409.5507 8.317089  406.0156 7.609776  3.535034       11.27310  
1 1 1 1  7  8  o 705.5057 11.59268  332.2113       10.89828      328.0203       15.95334      335.8786       14.92317      700.3133 17.09565  708.8511 15.79911  -8.537842      23.27817  
1 1 1 1  7  9  o 416.4593 9.533799  115.7075       5.290687      120.7022       7.307439      110.2047       7.670045      424.9239 12.92068  405.8635 14.20412  19.06042       19.20159  
1 1 1 1  7  10 o 332.2115 7.799170  73.60457       3.452524      74.35856       4.280902      72.20163       5.839444      333.6829 9.637915  328.4444 13.37041  5.238495       16.48203  
1 1 1 1  7  11 o 201.6859 7.817371  27.17323       2.096943      27.28738       2.419552      26.82877       4.203223      202.0224 9.010652  199.5672 15.93828  2.455185       18.30903  
1 1 1 1  7  12 o 259.6380 7.587911  45.00965       2.622393      42.54355       2.938707      54.65073       5.810508      252.3279 8.753381  285.2494 15.34324  -32.92151      17.66456  
1 1 1 1  7  13 o 45.84446 12.60939  1.449187       0.7942615     1.930355       0.9870964     0.5655250      1.337688      52.75037 13.86393  40.92115 16.31213  11.82922       21.40780  
1 1 1 1  7  14 o 111.5132 7.215954  8.331748       1.066487      7.666268       1.450882      9.113955       1.572989      106.6122 10.34275  116.3403 10.25138  -9.728073      14.56240  
1 1 1 1  7  15 f 234.3926 6.606053  36.68006       2.061228      37.74014       2.255974      31.32311       5.071368      237.7181 7.129998  215.1042 17.85376  22.61392       19.22482  
1 1 1 1  7  16 o 206.2759 6.825099  28.41901       1.873408      31.81846       2.702023      25.27207       2.599735      218.0569 9.320705  194.2099 10.08029  23.84697       13.72909  
1 1 1 1  7  17 o 495.4334 7.802234  163.8232       5.150837      161.7290       6.777630      166.6864       7.924963      491.9310 10.33951  499.1623 11.91467  -7.231323      15.77545  
1 1 1 1  7  18 o 400.1125 8.332273  106.8656       4.442415      104.7992       5.673704      110.1395       7.141656      395.8275 10.76690  405.3929 13.23829  -9.565460      17.06396  
1 1 1 1  7  19 o 225.4634 6.446212  33.93332       1.934675      39.66225       3.040461      30.03558       2.507895      243.5237 9.387259  211.9148 8.901079  31.60887       12.93638  
1 1 1 1  7  20 o 160.7231 8.626868  17.29424       1.840817      20.97584       3.561624      15.95229       2.150293      176.2325 15.31865  154.1516 10.53156  22.08083       18.58964  
1 1 1 1  7  21 o 261.6495 6.620708  45.69885       2.306476      46.02630       3.140007      45.31514       3.399073      262.3769 8.994441  260.2526 9.819097  2.124329       13.31595  
1 1 1 1  7  22 o 300.1082 7.402897  60.11633       2.960419      59.13422       3.637742      62.04227       5.094196      297.3591 9.191765  304.0955 12.59893  -6.736359      15.59557  
1 1 1 1  7  23 o 91.59106 14.12318  5.762975       1.668349      9.338297       2.670861      3.475330       2.136426      116.3580 17.79008  71.04668 21.06192  45.31131       27.56976  
1 1 1 1  7  24 o 40.84624 11.22832  1.153615       0.6300045     1.151832       0.6656681     1.168933       1.950929      40.93091 11.64898  51.43308 19.93940  -10.50217      23.09282  
1 1 1 1  7  25 o 91.58128 8.657839  5.665607       1.044007      4.353643       1.341029      7.684185       1.663412      79.35925 13.14087  106.2307 11.95855  -26.87141      17.76765  
1 1 1 1  7  26 o 127.4130 9.240597  10.95035       1.558210      9.698030       2.211132      12.18585       2.196227      118.8245 14.24864  133.8060 12.46090  -14.98148      18.92875  
1 1 1 1  7  27 o 54.19048 15.17975  2.061338       1.139601      3.753942       1.713947      0.7201079      1.525707      72.46688 17.86478  43.72333 17.42357  28.74355       24.95458  
1 1 1 1  7  28 o 89.06970 13.02860  5.503826       1.500594      7.399527       2.079074      3.442410       2.168043      102.7524 15.68057  69.57948 21.34857  33.17291       26.48852  
1 1 1 1  7  29 o 177.1671 10.97645  21.36496       2.578578      19.97365       3.396899      23.25681       3.961092      169.6442 15.18743  182.5320 16.46227  -12.88785      22.39787  
1 1 1 1  7  30 o 41.06526 17.89604  -0.1429362     1.839022      -0.1193836     2.951730      -0.1578789     2.351099      51.51706 22.55693  46.14957 20.17090  5.367489       30.26021  
1 1 1 1  7  31 o 115.6246 15.20270  9.546404       2.285619      12.09052       3.349630      7.329813       3.126592      127.1685 20.46117  96.31557 24.35145  30.85296       31.80649  
1 1 1 1  7  32 o 36.33251 16.86403  -1.274561      1.956345      0.6360650      2.777471      -3.155808      2.756034      51.56069 22.23227  38.46354 18.47681  13.09715       28.90789  
1 1 1 1  7  33 o 70.62417 21.29256  4.136470       2.169464      2.653756       2.936341      5.918734       3.219318      60.61594 24.16616  80.62582 26.18469  -20.00988      35.63203  
1 1 1 1  7  34 o 63.25594 21.44221  3.493631       2.152983      3.798302       3.949850      3.364846       2.568016      64.60201 27.12928  61.88929 23.13867  2.712723       35.65664  
1 1 1 1  7  35 o 34.00922 14.49607  0.3293759      1.155862      -1.851388      2.740745      0.8011529      1.274772      38.86436 18.60465  38.64608 15.73902  0.2182884      24.36903  
1 1 1 1  7  36 o 52.98418 18.10194  2.466079       1.534858      -4.080495      3.095640      4.600010       1.767395      35.63220 17.62768  72.08820 18.35367  -36.45599      25.44783  
1 1 1 1  7  37 o 31.32325 14.40215  -0.3437292     1.378569      4.762696       3.126956      -1.575672      1.535885      61.49779 24.79346  28.13541 13.58519  33.36238       28.27141  
1 1 1 1  8  0  o 209.9151 5.382709  29.42083       1.503392      29.42083       1.503392      29.42083       1.503392      209.9151 5.382709  209.9151 5.382709  0.000000       0.000000  
1 1 1 1  8  1  o 411.8454 2.425326  113.0161       1.330999      112.0354       3.299676      113.2066       1.454587      409.9857 6.039890  412.1900 2.648310  -2.204285      6.594985  
1 1 1 1  8  2  o 674.6409 5.852974  303.3575       5.261660      297.8142       6.199295      317.6386       9.950338      668.3957 6.960415  690.0195 10.82189  -21.62384      12.86703  
1 1 1 1  8  3  o 314.9031 5.021533  66.08792       2.107108      64.34624       2.407307      71.79395       4.357258      310.7107 5.814356  327.9258 9.983212  -17.21506      11.55298  
1 1 1 1  8  4  o 1114.750 2.157218  827.9843       3.204387      838.1526       5.262918      821.9941       4.039431      1121.523 3.521640  1110.692 2.729311  10.83105       4.455455  
1 1 1 1  8  5  o 281.0876 3.555788  52.64945       1.331837      54.74535       1.979795      50.91690       1.800017      286.6029 5.184013  276.4050 4.887167  10.19791       7.124493  
1 1 1 1  8  6  o 1291.969 13.06294  1114.547       22.48880      1134.922       26.89367      1067.176       41.00753      1303.146 15.48757  1260.784 24.40897  42.36230       28.90783  
1 1 1 1  8  7  o 561.0746 8.684393  209.9595       6.492823      205.9161       8.045359      217.5115       10.99520      555.4825 10.86930  570.3676 14.47858  -14.88507      18.10445  
1 1 1 1  8  8  o 466.8664 13.25032  145.7203       8.234800      141.9439       10.49893      151.7578       13.27501      460.2375 17.14944  475.2283 21.01525  -14.99084      27.12460  
1 1 1 1  8  9  o 274.4915 7.299064  50.27998       2.667374      49.59656       3.874508      50.89572       3.677658      272.3675 10.69628  275.9749 10.01727  -3.607330      14.65456  
1 1 1 1  8  10 o 48.14642 4.679149  1.559658       0.2964140     1.259210       0.6359875     1.643031       0.3350263     42.63908 11.09036  49.37749 5.168331  -6.738415      12.23551  
1 1 1 1  8  11 o 420.5839 7.447683  118.0010       4.173951      119.8277       5.187060      114.6452       7.030385      423.6904 9.187539  413.8711 12.76321  9.819244       15.72610  
1 1 1 1  8  12 o 157.3578 6.129564  16.53793       1.282802      16.29036       1.892526      16.74836       1.744780      155.9381 9.148039  158.1971 8.306020  -2.259018      12.35624  
1 1 1 1  8  13 o 340.2343 6.762273  77.22360       3.065803      79.35149       4.045052      74.35136       4.699601      344.6255 8.815764  333.3737 10.59272  11.25174       13.78127  
1 1 1 1  8  14 o 357.0054 9.211519  85.18070       4.378412      90.38580       7.952909      82.91690       5.244817      366.5621 16.32283  351.9647 11.19723  14.59741       19.79426  
1 1 1 1  8  15 o 358.5157 7.974300  85.79671       3.809555      87.04900       4.207337      80.09763       8.975451      361.0545 8.745025  344.2391 19.64853  16.81534       21.50675  
1 1 1 1  8  16 o 587.7989 9.169664  230.7591       7.182170      233.6192       8.605813      224.1952       13.03718      591.1287 10.92537  577.4376 16.96197  13.69110       20.17603  
1 1 1 1  8  17 o 296.8293 6.687740  58.77470       2.645208      61.42380       3.557419      55.49868       3.956027      303.1807 8.814980  288.0107 10.32477  15.16995       13.57589  
1 1 1 1  8  18 o 305.8217 7.314781  62.40200       2.980871      66.54884       4.429732      58.97018       4.029772      315.4023 10.55483  296.9204 10.20028  18.48184       14.67823  
1 1 1 1  8  19 o 356.9593 7.304017  85.01380       3.474193      97.36076       5.674866      77.61202       4.393833      381.4822 11.17574  340.7484 9.686728  40.73376       14.78952  
1 1 1 1  8  20 o 322.3016 7.388721  69.31354       3.173257      66.05399       5.465670      70.97089       3.897376      313.8609 13.09749  325.8928 8.983354  -12.03189      15.88222  
1 1 1 1  8  21 o 275.0912 6.646369  50.48759       2.436322      48.19185       4.245079      51.61517       2.975066      268.1024 11.91234  277.9435 8.041247  -9.841064      14.37239  
1 1 1 1  8  22 o 141.5912 7.689127  13.42530       1.445287      12.02259       2.091730      14.70677       1.999291      133.4670 11.88558  147.9429 10.20415  -14.47592      15.66499  
1 1 1 1  8  23 o 94.00219 11.18979  6.003295       1.374150      2.761176       1.971687      9.065455       1.916185      64.28848 20.45570  115.5482 12.65176  -51.25971      24.05209  
1 1 1 1  8  24 o 107.2329 4.500068  7.683878       0.6415852     7.553043       0.6923870     8.478587       1.706437      106.2850 4.902017  111.7743 11.62681  -5.489357      12.61795  
1 1 1 1  8  25 o 21.17786 9.754189  -0.4919793     0.6361738     -1.231662      0.7295776     1.854740       1.299509      19.04625 9.236342  52.52886 16.59374  -33.48260      18.99111  
1 1 1 1  8  26 o 116.4273 8.471725  9.138650       1.305324      10.49805       1.653742      6.892041       2.125976      124.5488 10.04975  99.18625 16.67659  25.36258       19.47065  
1 1 1 1  8  27 o 80.34560 9.405834  4.401374       0.9879703     4.569407       1.270554      4.144389       1.571271      81.30494 12.09521  76.44276 15.94246  4.862175       20.01140  
1 1 1 1  8  28 o 193.2167 8.413911  25.15393       2.161094      26.16012       3.001387      24.07066       3.114234      196.0997 11.53705  187.7326 12.52067  8.367096       17.02559  
1 1 1 1  8  29 f 78.65782 21.69235  4.580776       2.347124      4.840647       2.882093      4.069017       4.044468      80.62642 24.59076  78.15501 29.07404  2.471405       38.07893  
1 1 1 1  8  30 o 79.43797 17.00508  4.603717       1.745710      1.705476       2.389411      7.921940       2.556681      56.41974 22.01195  103.8305 19.18554  -47.41071      29.19950  
1 1 1 1  8  31 o 84.52829 12.22995  5.044424       1.337541      8.380652       2.817781      4.074064       1.519658      104.6614 20.93621  74.46056 15.80545  30.20081       26.23236  
1 1 1 1  8  32 o 66.00243 15.96892  3.286519       1.389069      2.945814       3.915064      3.335585       1.485728      66.46236 27.38238  66.16957 16.81748  0.2927856      32.13444  
1 1 1 1  8  33 o 76.01167 12.96298  4.255871       1.265923      6.952523       3.997087      3.955224       1.334627      82.81035 29.16114  72.48309 14.32621  10.32726       32.49019  
1 1 1 1  8  34 o 22.83720 11.04452  -1.430920      1.025174      3.136592       3.985362      -1.754566      1.060874      60.98503 26.46324  22.21354 10.85348  38.77149       28.60247  
1 1 1 1  8  35 o 27.45630 12.35239  -0.2317656     0.9473224     -2.483052      3.551855      -0.5935516E-01 0.9829277     42.03975 20.38512  29.10410 12.86939  12.93565       24.10756  
1 1 1 1  8  36 o 52.83688 16.31301  2.395176       1.263493      1.333375       3.200951      2.591146       1.375157      48.72544 22.23106  54.40652 17.05397  -5.681080      28.01888  
1 1 1 1  8  37 o 24.29249 11.35665  -0.5933644     0.9128028     -0.5280409     2.357996      -0.6048788     0.9899886     38.05018 17.93418  25.34643 11.84206  12.70375       21.49114  
1 1 1 1  9  0  o 704.0347 9.399774  330.5963       8.814761      330.5963       8.814761      330.5963       8.814761      704.0347 9.399774  704.0347 9.399774  0.000000       0.000000  
1 1 1 1  9  1  o 917.3035 2.970181  560.6821       3.630526      566.1345       12.53624      560.1829       3.793070      921.2130 10.21254  916.8904 3.104558  4.322571       10.67400  
1 1 1 1  9  2  o 1326.368 3.341725  1172.281       5.906200      1172.545       6.012744      1165.040       31.51361      1326.514 3.401634  1319.720 17.92019  6.793213       18.24019  
1 1 1 1  9  3  o 377.4578 4.584275  94.95036       2.305752      96.74783       2.800575      91.16829       4.062380      380.9909 5.516442  369.7531 8.245086  11.23773       9.920311  
1 1 1 1  9  4  o 218.3601 3.947064  31.77458       1.148474      32.44018       1.422847      30.53020       1.945497      220.6239 4.839853  213.8886 6.834823  6.735291       8.374902  
1 1 1 1  9  5  o 505.4492 1.600148  170.2213       1.077733      170.4779       1.087342      155.8991       8.124595      505.8298 1.613200  483.0264 12.63369  22.80338       12.73627  
1 1 1 1  9  6  o 241.6219 5.260927  38.91297       1.693839      36.96029       2.552978      40.44847       2.263891      235.2728 8.155660  246.2097 6.907268  -10.93687      10.68762  
1 1 1 1  9  7  o 730.0542 4.122988  355.2000       4.010890      340.2621       10.65854      357.6643       4.329102      713.9131 11.20415  732.5665 4.434832  -18.65344      12.04992  
1 1 1 1  9  8  o 569.9906 9.438599  216.8033       7.168837      210.1463       10.01360      223.8025       10.26771      560.7214 13.40200  578.6654 13.31596  -17.94397      18.89255  
1 1 1 1  9  9  o 570.3271 10.36508  217.1842       7.877170      212.0024       9.837123      226.4451       13.15084      563.1187 13.10976  581.0583 17.00308  -17.93970      21.47022  
1 1 1 1  9  10 o 153.3024 5.960860  15.69465       1.215355      14.33026       1.548358      17.88443       1.961569      146.3347 7.970640  163.4360 9.042290  -17.10121      12.05380  
1 1 1 1  9  11 o 319.5348 6.313993  68.09489       2.688412      67.77305       3.672839      68.46635       3.945796      318.5214 8.661500  320.0880 9.260802  -1.566559      12.68007  
1 1 1 1  9  12 o 518.6401 8.866232  179.6047       6.127435      174.2535       7.184052      193.8892       11.73751      510.6241 10.55831  537.2137 16.41592  -26.58960      19.51821  
1 1 1 1  9  13 o 400.8085 9.249334  107.2949       4.939931      104.5318       7.404803      109.5108       6.631264      394.7293 14.10064  404.3590 12.32148  -9.629700      18.72557  
1 1 1 1  9  14 o 228.0506 6.172335  34.71401       1.873936      31.76299       2.680362      37.53561       2.620928      217.8761 9.253380  236.9724 8.312986  -19.09625      12.43908  
1 1 1 1  9  15 o 184.5356 7.093106  22.75467       1.740927      25.43376       2.320296      19.30372       2.633409      194.9523 8.955772  169.4790 11.73325  25.47339       14.76059  
1 1 1 1  9  16 o 285.3816 7.363779  54.37889       2.797933      57.01389       3.600584      50.36236       4.445364      292.0385 9.264225  274.1072 12.20122  17.93127       15.31978  
1 1 1 1  9  17 o 233.0882 6.543630  36.26752       2.030404      38.99709       2.865754      33.51625       2.877130      241.5141 8.920099  223.8031 9.670432  17.71097       13.15619  
1 1 1 1  9  18 o 272.1871 6.796149  49.41954       2.464926      55.82170       4.042844      45.63147       3.109802      288.8497 10.52126  261.2809 8.945251  27.56885       13.80994  
1 1 1 1  9  19 o 611.3858 9.725649  249.6705       7.923325      253.4510       10.84025      245.3342       11.60985      615.3418 13.22054  605.1475 14.39765  10.19427       19.54674  
1 1 1 1  9  20 o 248.9537 6.646581  41.37568       2.202935      39.23850       4.446311      42.07097       2.536088      241.6159 13.86849  250.9626 7.592441  -9.346695      15.81076  
1 1 1 1  9  21 o 100.3266 6.852262  6.747995       0.9105597     7.035613       2.149503      6.685095       1.005207      101.0190 16.54030  99.78215 7.617715  1.236885       18.21019  
1 1 1 1  9  22 o 248.6579 6.484015  41.29537       2.146590      39.60420       3.891156      42.03519       2.573633      242.7794 12.06580  250.7518 7.711620  -7.972351      14.31966  
1 1 1 1  9  23 o 85.29919 8.346591  4.911545       0.9365689     5.584134       2.709598      4.820285       0.9980869     88.67631 22.80390  84.40288 9.013726  4.273430       24.52071  
1 1 1 1  9  24 o 55.99439 11.31363  2.181441       0.8150671     -2.762122      2.389721      2.832234       0.8670584     37.68163 17.84841  64.14604 10.50737  -26.46442      20.71160  
1 1 1 1  9  25 o 58.40633 11.01101  2.369219       0.8255388     3.311833       2.397224      2.242391       0.8793245     69.75529 22.59082  56.62647 12.02537  13.12882       25.59208  
1 1 1 1  9  26 o 81.82641 4.714310  4.485863       0.5118501     4.244442       0.5642595     5.607350       1.216155      79.52036 5.356338  90.69693 10.24183  -11.17657      11.55792  
1 1 1 1  9  27 o 168.1319 6.391511  18.95494       1.429340      20.44224       2.233593      17.92349       1.860068      173.9112 9.676505  163.0636 8.590790  10.84760       12.93972  
1 1 1 1  9  28 o 126.4538 7.122656  10.76490       1.195331      10.62976       1.817844      10.86784       1.586568      124.7566 11.04915  126.5611 9.476538  -1.804489      14.55639  
1 1 1 1  9  29 o 122.9108 7.871292  10.21690       1.282393      7.172648       1.912308      12.70468       1.728712      100.9165 14.64832  136.6613 9.553167  -35.74472      17.48818  
1 1 1 1  9  30 o 95.55156 9.717009  6.276180       1.220019      8.181864       1.727964      4.381907       1.722783      108.3504 12.17889  77.14053 17.19887  31.20989       21.07430  
1 1 1 1  9  31 o 60.19406 15.74190  2.692059       1.276757      6.680931       3.259324      1.969027       1.387654      89.51433 25.87206  52.38535 17.20267  37.12898       31.06921  
1 1 1 1  9  32 o 120.6459 9.660064  10.12877       1.540015      13.43063       3.333558      9.232891       1.736414      131.0734 19.69462  114.1042 11.58054  16.96915       22.84704  
1 1 1 1  9  33 o 65.66422 12.60083  3.203538       1.062472      -1.181617      3.910393      3.553069       1.104003      49.19452 23.15851  69.34087 12.40373  -20.14634      26.27107  
1 1 1 1  9  34 o 41.60603 13.83092  1.294114       0.8961314     8.861616       4.930658      1.035606       0.9113089     81.14651 31.63136  38.55330 13.88659  42.59320       34.54534  
1 1 1 1  9  35 o 12.93776 6.564179  -2.066618      0.5845503     0.8699096E-01  4.162034      -2.109954      0.5904024     49.62061 23.51855  12.94464 6.570730  36.67597       24.41918  
1 1 1 1  9  36 o 29.73753 13.54722  -0.2732693     1.182916      1.326430       2.588108      -0.6956956     1.329961      46.41425 20.68256  29.33424 13.71188  17.08001       24.81499  
1 1 1 1  10 0  o 576.1528 9.403251  221.4821       7.214869      221.4821       7.214869      221.4821       7.214869      576.1528 9.403251  576.1528 9.403251  0.000000       0.000000  
1 1 1 1  10 1  o 952.1744 2.116565  604.0938       2.685477      612.2750       14.07241      603.7847       2.735754      957.7972 11.02609  951.9295 2.156744  5.867737       11.23504  
1 1 1 1  10 2  o 608.7001 6.276124  247.0015       5.090593      249.8811       7.310788      244.2913       7.092543      612.0553 8.963963  605.1840 8.795105  6.871338       12.55812  
1 1 1 1  10 3  o 226.9149 4.480189  34.31631       1.354668      34.67470       1.850356      33.90232       1.988695      227.9861 6.096257  225.4044 6.628335  2.581741       9.005507  
1 1 1 1  10 4  o 484.4873 6.310723  156.4877       4.074131      154.4447       4.840153      161.4537       7.546232      481.2495 7.547712  491.7562 11.51614  -10.50665      13.76915  
1 1 1 1  10 5  o 312.2521 5.124970  64.98969       2.132408      63.75178       2.780258      66.75830       3.323222      309.2143 6.747642  316.3778 7.882788  -7.163483      10.37637  
1 1 1 1  10 6  o 283.4288 3.919123  53.53663       1.480152      53.82656       2.116139      53.25891       2.071091      284.1549 5.588762  282.6551 5.498811  1.499786       7.840356  
1 1 1 1  10 7  o 369.8228 5.089842  91.17002       2.508254      88.57634       2.799796      101.7144       5.645197      364.4980 5.764448  390.1200 10.87003  -25.62201      12.30392  
1 1 1 1  10 8  o 144.3848 1.516809  13.89019       0.2918273     13.82249       0.2971153     15.74159       1.553701      144.0323 1.548074  153.4232 7.623695  -9.390915      7.779284  
1 1 1 1  10 9  o 301.2987 7.810686  60.61239       3.133240      61.29432       3.270001      52.96759       10.94863      302.9652 8.107222  277.4527 30.09545  25.51254       31.16830  
1 1 1 1  10 10 o 211.2393 6.158387  29.78430       1.731614      28.64741       2.052521      32.59153       3.225273      207.0757 7.450637  220.5539 11.00914  -13.47824      13.29335  
1 1 1 1  10 11 o 80.85872 9.423459  4.425526       0.9963305     3.504817       1.318304      5.651909       1.521485      71.06033 14.41593  91.00201 12.90892  -19.94167      19.35095  
1 1 1 1  10 12 o 43.92102 8.943498  1.334997       0.5056164     0.5894460      1.080188      1.544180       0.5721681     37.99977 14.80731  47.25326 9.417684  -9.253487      17.54848  
1 1 1 1  10 13 o 352.8005 7.657457  83.06869       3.599874      85.88532       4.829947      79.54858       5.399517      358.3635 10.12466  344.6484 11.77453  13.71512       15.52895  
1 1 1 1  10 14 o 472.6098 9.073837  149.1650       5.714355      148.6640       6.877380      150.2821       10.26958      471.5644 10.94482  472.8652 16.32276  -1.300781      19.65252  
1 1 1 1  10 15 o 280.0021 8.525539  52.38726       3.177243      52.00883       3.927992      53.10344       5.403617      278.7682 10.59363  281.1512 14.47222  -2.382935      17.93516  
1 1 1 1  10 16 o 138.0876 10.73395  12.81908       1.959592      12.57021       2.341395      13.40104       3.580443      136.4388 13.03678  139.7669 19.77646  -3.328079      23.68683  
1 1 1 1  10 17 o 333.8464 8.519540  74.44384       3.786879      75.96182       4.436337      70.36782       7.269581      337.0893 9.887253  323.3625 16.93018  13.72684       19.60584  
1 1 1 1  10 18 o 184.2706 6.649305  22.67882       1.630022      25.30216       2.633073      21.04880       2.075545      194.3456 10.20325  177.3455 8.810499  17.00011       13.48077  
1 1 1 1  10 19 o 328.0081 7.242044  71.78797       3.165332      73.47133       4.947286      70.62128       4.118676      331.3026 11.22267  325.0197 9.520125  6.282867       14.71669  
1 1 1 1  10 20 o 396.0183 8.769510  104.7477       4.627689      103.5865       6.964981      105.6655       6.192070      392.9637 13.32055  397.1965 11.71201  -4.232758      17.73720  
1 1 1 1  10 21 o 186.4635 6.097914  23.22299       1.513088      21.46016       3.443498      23.64479       1.684410      178.1488 14.63478  188.1001 6.731100  -9.951309      16.10852  
1 1 1 1  10 22 o 205.5328 6.482995  28.23039       1.773319      25.83499       3.848181      28.87621       1.998121      195.3222 14.89771  207.7974 7.227194  -12.47519      16.55820  
1 1 1 1  10 23 o 42.87041 9.928012  1.281101       0.5559703     1.814081       2.739988      1.258215       0.5677816     61.57212 23.69402  42.47761 10.16670  19.09451       25.78310  
1 1 1 1  10 24 o 102.8870 7.015751  7.112029       0.9560974     5.183620       2.972777      7.334513       1.009745      85.19984 24.73348  104.4559 7.300426  -19.25601      25.78839  
1 1 1 1  10 25 o 107.6459 5.844099  7.767712       0.8351356     6.546244       2.956316      7.873640       0.8705952     94.89583 23.50299  108.3556 6.053706  -13.45982      24.27010  
1 1 1 1  10 26 f 97.35368 7.853736  6.398983       1.010191      12.12596       4.162232      6.040519       1.041326      128.5376 25.20205  94.48543 8.356889  34.05222       26.55148  
1 1 1 1  10 27 o 164.8777 6.090930  18.22511       1.335894      18.11116       1.838411      18.35259       1.944529      163.8928 8.446501  164.8812 8.883342  -0.9884338     12.25794  
1 1 1 1  10 28 o 157.0405 6.545299  16.57123       1.366664      15.10931       1.836005      18.38778       2.046611      149.2970 9.274689  164.7281 9.362374  -15.43112      13.17854  
1 1 1 1  10 29 o 94.42404 8.774403  6.082209       1.091380      5.426681       1.522707      6.774702       1.565051      87.75974 13.44908  98.69623 12.15680  -10.93649      18.12914  
1 1 1 1  10 30 o 54.41410 14.55539  2.156633       1.075944      0.2746740      1.243144      7.775325       2.147998      36.38204 15.24529  103.5457 16.09002  -67.16365      22.16545  
1 1 1 1  10 31 o 46.92238 15.58718  1.557325       1.138209      -0.8351845     3.237250      1.894810       1.215839      48.83064 22.30869  50.89164 16.04727  -2.061005      27.48077  
1 1 1 1  10 32 o 45.31922 17.39517  1.286139       1.474212      4.691889       2.833495      0.2205293E-01  1.726253      72.78772 24.59905  38.98894 17.15507  33.79878       29.99016  
1 1 1 1  10 33 o 42.25154 16.76052  1.068189       1.405599      0.6391460      4.014155      1.128147       1.500603      53.53593 24.60091  43.31281 17.27313  10.22312       30.05937  
1 1 1 1  10 34 o 44.73681 16.52282  1.493549       1.301952      1.896155       2.547412      1.351201       1.514728      51.50820 21.71782  44.36378 17.46116  7.144421       27.86675  
1 1 1 1  10 35 o 25.27915 11.83778  -0.7034238     0.9987417     -1.177250      2.333558      -0.5971662     1.105068      36.93620 17.53670  27.29983 12.67251  9.636368       21.63627  
1 1 1 1  10 36 o 30.36843 13.84748  -0.2531331     1.239594      0.4251405      2.793712      -0.4194050     1.383211      43.49356 20.17571  31.05159 14.33094  12.44197       24.74743  
1 1 1 1  11 0  o 346.1229 6.019756  79.91623       2.774511      79.91623       2.774511      79.91623       2.774511      346.1229 6.019756  346.1229 6.019756  0.000000       0.000000  
1 1 1 1  11 1  o 324.9901 2.648006  70.37808       1.146734      65.42750       2.349491      71.92620       1.313856      313.2835 5.628112  328.5394 3.001143  -15.25592      6.378284  
1 1 1 1  11 2  o 584.5901 5.060942  227.7959       3.942360      224.6022       6.067438      230.1293       5.186348      580.2906 7.846685  587.4803 6.625136  -7.189697      10.26951  
1 1 1 1  11 3  o 613.0825 5.869697  250.5877       4.795216      252.3661       6.732508      248.7567       6.831494      615.0652 8.214520  610.6339 8.395784  4.431335       11.74596  
1 1 1 1  11 4  o 1126.527 3.456335  845.7234       5.188369      847.7052       20.38221      845.5861       5.365102      1125.944 13.58504  1126.426 3.574388  -0.4826660     14.04741  
1 1 1 1  11 5  o 345.8905 5.736552  79.76646       2.644010      78.51433       3.125375      82.91837       4.958648      343.1153 6.835787  352.2091 10.57746  -9.093842      12.59408  
1 1 1 1  11 6  o 963.6630 9.085537  619.8758       11.66673      626.8692       15.21160      609.8854       18.18123      968.4670 11.78736  954.5538 14.29385  13.91327       18.52717  
1 1 1 1  11 7  o 507.1201 7.022143  171.5440       4.745195      177.5098       5.505255      154.3020       9.359145      515.7717 8.010256  479.7954 14.65602  35.97626       16.70219  
1 1 1 1  11 8  o 380.2007 5.815318  96.39238       2.946185      98.82230       4.335520      94.30754       4.015883      384.7789 8.455833  375.9212 8.016978  8.857697       11.65217  
1 1 1 1  11 9  o 290.1060 5.031180  56.11188       1.944912      57.07812       2.317603      53.81113       3.576283      292.5533 5.945118  283.6916 9.473742  8.861755       11.18464  
1 1 1 1  11 10 o 187.0098 6.086717  23.34950       1.514754      22.05742       2.450190      24.14882       1.927153      181.4077 10.17690  190.0765 7.624238  -8.668793      12.71606  
1 1 1 1  11 11 f 264.5935 2.172658  46.65100       0.7660272     47.72589       3.449585      46.59525       0.7856429     267.1057 9.708078  264.4344 2.229635  2.671234       9.960826  
1 1 1 1  11 12 o 363.8601 7.496528  88.34981       3.634696      79.72886       5.183552      96.68850       5.097990      345.1216 11.28668  380.2683 10.06973  -35.14673      15.12576  
1 1 1 1  11 13 o 90.24319 3.639277  5.436739       0.4367284     8.816763       1.608632      5.167783       0.4537715     114.3604 10.67969  87.96646 3.880760  26.39397       11.36292  
1 1 1 1  11 14 o 549.8245 9.400599  201.8905       6.887366      206.9705       8.338940      190.9878       12.21651      556.4163 11.24702  533.0239 17.22255  23.39240       20.56968  
1 1 1 1  11 15 o 117.4091 7.765608  9.238748       1.208103      10.67253       1.697287      7.766389       1.719969      125.9857 10.19730  107.0639 12.27791  18.92184       15.96033  
1 1 1 1  11 16 o 536.2776 10.25426  192.1254       7.327698      193.4309       8.426394      188.0753       14.84136      537.8708 11.75683  527.8997 21.14113  9.971069       24.19029  
1 1 1 1  11 17 o 298.2006 10.51849  59.48877       4.173060      62.83557       4.740671      47.96937       8.795076      306.3470 11.63436  265.0223 25.20802  41.32471       27.76334  
1 1 1 1  11 18 o 149.2131 11.84157  14.98380       2.335156      15.38520       3.368243      14.61231       3.240291      150.4098 17.10934  146.5720 16.89953  3.837814       24.04836  
1 1 1 1  11 19 o 224.1998 8.243203  33.60575       2.458469      33.09985       2.909109      34.86988       4.598548      222.3396 9.843454  227.4496 15.26099  -5.109924      18.16016  
1 1 1 1  11 20 o 352.0069 10.55845  82.97038       4.946908      80.62018       5.990463      88.00938       8.771623      346.5337 12.99606  360.7662 18.30638  -14.23254      22.45041  
1 1 1 1  11 21 o 397.8785 9.681758  105.9251       5.133082      120.1896       8.202030      96.74129       6.581221      422.4356 14.59284  379.3639 13.03836  43.07172       19.56911  
1 1 1 1  11 22 o 189.8226 7.188822  24.11244       1.815071      21.33193       4.130648      24.77779       2.020598      176.4906 17.80724  192.3409 7.900604  -15.85027      19.48120  
1 1 1 1  11 23 o 406.6279 7.667539  110.6283       4.154576      128.7276       9.359058      106.1864       4.636434      435.2103 16.16646  398.1309 8.739461  37.07941       18.37750  
1 1 1 1  11 24 o 135.4781 5.306606  12.27742       0.9561335     10.78885       3.770239      12.37973       0.9884467     122.3650 23.98053  136.0260 5.464400  -13.66105      24.59524  
1 1 1 1  11 25 o 115.2384 7.255806  8.931671       1.108527      -0.2394792E-01 6.738489      9.180774       1.123839      77.43564 33.98856  116.8408 7.254095  -39.40515      34.75405  
1 1 1 1  11 26 o 153.6730 6.663814  15.84943       1.361321      9.206325       3.454924      17.07036       1.481145      111.8331 23.90886  159.4358 6.988667  -47.60275      24.90933  
1 1 1 1  11 27 o 88.42836 9.318009  5.331719       1.081479      5.423321       2.857846      5.316409       1.168368      85.32668 24.08709  88.11739 10.13483  -2.790710      26.13240  
1 1 1 1  11 28 o 58.47593 5.551294  2.311193       0.4273774     2.030555       0.4690597     3.683015       1.037060      54.60743 6.578553  72.78493 11.03864  -18.17750      12.85025  
1 1 1 1  11 29 o 139.3576 5.286071  13.04210       0.9798263     14.26054       1.347874      11.67667       1.426865      145.3118 6.981479  131.1099 8.208399  14.20190       10.77585  
1 1 1 1  11 30 o 52.36621 8.929980  1.920145       0.6007925     0.7600884      0.7073661     4.923578       1.138187      34.80880 12.26664  84.00543 10.38912  -49.19664      16.07496  
1 1 1 1  11 31 o 90.71981 20.47705  6.598718       2.416484      13.77917       5.416828      4.814683       2.700043      116.6220 33.24304  75.28079 23.93579  41.34125       40.96367  
1 1 1 1  11 32 o ?        ?         -2.801886      0.5588447     -3.519006      0.6633732     -1.048850      1.037188      ?        ?         24.80223 11.75105  0.000000       11.75105  
1 1 1 1  11 33 o 26.95165 11.77453  -0.2333922E-01 0.8003370     0.4007317      1.498308      -0.1926461     0.9467150     37.97784 16.35184  27.90693 12.46733  10.07090       20.56251  
1 1 1 1  11 34 o 62.79665 17.62387  3.383004       1.534587      6.061279       2.850658      2.290142       1.820959      75.89299 24.63927  51.98157 19.47427  23.91142       31.40606  
1 1 1 1  11 35 o 36.76830 16.42981  0.2103429      1.645113      1.724577       3.042240      -0.4154357     1.955723      49.49000 22.21113  36.37240 16.87525  13.11760       27.89459  
1 1 1 1  12 0  o 388.0924 6.857245  100.4961       3.543663      100.4961       3.543663      100.4961       3.543663      388.0924 6.857245  388.0924 6.857245  -0.000000      0.000000  
1 1 1 1  12 1  o 490.0256 2.274875  160.0043       1.485422      154.3030       2.149933      165.2118       2.054708      481.1830 3.353059  497.9110 3.096883  -16.72806      4.564394  
1 1 1 1  12 2  o 299.3589 3.847651  59.72755       1.534834      61.10024       2.292452      58.61235       2.066289      302.7190 5.683124  296.5086 5.229741  6.210388       7.723217  
1 1 1 1  12 3  o 229.1885 4.076601  35.01039       1.244986      32.79161       1.802646      37.03393       1.721507      221.6700 6.108637  235.6820 5.481620  -14.01202      8.207534  
1 1 1 1  12 4  o 20.95523 8.199303  0.1712447      0.3323198     0.4438098      0.3963854     -0.4735264     0.6096566     26.94607 9.199358  20.77181 9.560487  6.174252       13.26767  
1 1 1 1  12 5  o 292.4015 5.413156  57.00583       2.109131      55.86107       2.422235      60.59509       4.289053      289.4142 6.280914  300.9578 10.71212  -11.54364      12.41771  
1 1 1 1  12 6  o 143.8934 4.681933  13.81760       0.8965220     12.78055       1.628726      14.26840       1.073843      138.0733 8.899879  146.1786 5.522876  -8.105270      10.47426  
1 1 1 1  12 7  o 194.0624 4.487144  25.10511       1.160339      24.87139       1.524622      25.42682       1.788789      193.0269 5.934538  195.1089 6.891138  -2.082001      9.094313  
1 1 1 1  12 8  o 592.2336 8.600130  234.1605       6.786903      233.7364       10.53795      234.4610       8.871901      590.8434 13.38475  592.1869 11.24306  -1.343445      17.48021  
1 1 1 1  12 9  o 249.4799 4.214698  41.48902       1.401121      40.70449       1.480069      48.25988       4.348099      247.1013 4.495039  268.2975 12.19400  -21.19620      12.99611  
1 1 1 1  12 10 o 150.7278 4.991139  15.16390       1.001076      15.45693       1.046403      11.99957       3.438594      152.1690 5.168087  131.9827 20.19302  20.18629       20.84388  
1 1 1 1  12 11 o 426.0725 7.377362  121.1350       4.188496      114.6213       4.785377      142.4692       8.660455      414.3393 8.667353  460.9295 14.11708  -46.59024      16.56547  
1 1 1 1  12 12 o 496.7271 7.643845  164.6521       5.059450      167.1289       7.415793      162.4953       6.920175      500.0060 11.13035  493.1125 10.53168  6.893463       15.32322  
1 1 1 1  12 13 o 149.0060 3.655206  14.79802       0.7257537     12.58509       2.019737      15.12611       0.7776958     136.7619 11.18046  150.5956 3.878694  -13.83368      11.83414  
1 1 1 1  12 14 o 295.9118 7.731497  58.46918       3.045981      59.83498       3.769622      55.89988       5.170249      299.1869 9.467355  288.6763 13.47806  10.51062       16.47085  
1 1 1 1  12 15 o 207.6999 5.711503  28.78727       1.579239      28.42397       2.579544      29.00507       1.997291      206.1040 9.417426  208.3882 7.203575  -2.284286      11.85662  
1 1 1 1  12 16 o 331.8301 9.418876  73.58827       4.160531      78.50039       5.054107      63.26170       7.328049      342.5358 11.08760  306.3497 18.03110  36.18613       21.16731  
1 1 1 1  12 17 o 127.4977 15.05355  11.04605       2.508238      11.04605       2.508238      0.000000       0.000000      127.4977 15.05355  ?        ?         0.000000       15.05355  
1 1 1 1  12 18 o 283.5707 8.881114  53.75771       3.351711      53.51559       4.515781      54.05471       5.001401      282.5325 12.02222  283.7646 13.26366  -1.232086      17.90135  
1 1 1 1  12 19 o 157.7339 9.228835  16.68398       1.931274      16.36753       3.263577      16.85452       2.395795      155.2181 16.00831  158.2696 11.43715  -3.051529      19.67421  
1 1 1 1  12 20 o 240.4959 6.658213  38.64003       2.131674      34.38265       3.817694      40.56867       2.569539      226.0124 12.72781  246.3022 7.839109  -20.28986      14.94821  
1 1 1 1  12 21 o 294.0334 7.696088  57.82888       3.012775      62.88665       5.182486      55.24705       3.702734      305.6014 12.75455  287.0577 9.694005  18.54364       16.02037  
1 1 1 1  12 22 o 41.38840 14.60911  1.015507       1.003635      3.620122       2.437362      0.4837116      1.101338      72.55576 22.69873  37.13802 14.80207  35.41775       27.09859  
1 1 1 1  12 23 f 114.6371 12.23503  8.960821       1.840120      8.623129       5.126019      9.010776       1.971529      108.0318 32.76383  114.7635 13.12813  -6.731697      35.29613  
1 1 1 1  12 24 o 25.02021 10.11837  0.1806741      0.5225852     2.712615       3.402935      0.1195201      0.5288585     69.94159 26.52954  24.40121 10.05973  45.54037       28.37278  
1 1 1 1  12 25 o 84.99477 6.229866  4.860619       0.7006757     0.6733570      4.028840      4.991219       0.7115188     63.77072 27.11858  86.13345 6.241620  -22.36274      27.82760  
1 1 1 1  12 26 o 70.99419 10.28541  3.473778       0.9447019     0.8975942      3.463776      3.680810       0.9819283     60.50225 25.40627  73.09898 10.37163  -12.59673      27.44174  
1 1 1 1  12 27 o 61.33841 10.36091  2.617466       0.8167130     12.51546       7.214169      2.488962       0.8219975     120.3672 39.20519  59.69471 10.72815  60.67246       40.64653  
1 1 1 1  12 28 o 190.6044 7.417770  24.52238       1.880398      34.85102       4.646008      22.49900       2.056351      222.4626 15.77523  182.1909 8.493646  40.27179       17.91647  
1 1 1 1  12 29 o 128.4645 11.31257  11.46075       1.916741      10.17583       3.007586      12.33957       2.487290      116.0925 20.17375  131.7287 14.40463  -15.63626      24.78858  
1 1 1 1  12 30 o 48.04868 9.561067  1.640254       0.5906151     1.637937       0.6141512     1.668750       2.154077      47.91353 9.945235  52.92332 20.82494  -5.009796      23.07783  
1 1 1 1  12 31 o 33.59174 13.70734  0.4315099      0.9691861     1.233286       2.662420      0.3090336      1.040581      51.78669 22.03463  33.40221 13.96895  18.38448       26.08939  
1 1 1 1  12 32 o 49.31575 11.60368  1.814367       0.7497190     2.520815       0.8858002     0.3024779E-01  1.407691      58.23126 11.82006  35.14862 15.47745  23.08264       19.47473  
1 1 1 1  12 33 o 27.32140 11.98500  -0.3452799E-01 0.8367462     0.3447657      0.9208027     -1.832091      2.004568      31.55995 13.16514  33.03425 15.83958  -1.474295      20.59644  
1 1 1 1  12 34 o 56.79181 15.81925  2.699900       1.241377      3.286539       1.472317      1.257389       2.308741      61.60024 17.25346  46.21579 20.09728  15.38445       26.48740  
1 1 1 1  12 35 o 49.89993 20.96829  2.212559       2.361848      4.656100       3.415121      -0.2762132E-01 3.269924      60.65886 25.33256  44.22334 20.92662  16.43552       32.85821  
1 1 1 1  13 0  o 121.3164 6.781562  9.903257       1.088391      9.903257       1.088391      9.903257       1.088391      121.3164 6.781562  121.3164 6.781562  -0.000000      0.000000  
1 1 1 1  13 1  o 478.6684 3.111311  152.6947       1.984503      150.8955       4.117052      153.2392       2.265000      475.6362 6.495879  479.5030 3.544895  -3.866730      7.400184  
1 1 1 1  13 2  o 126.2483 2.859946  10.62157       0.4811238     10.53275       0.5529858     10.89823       0.9759734     125.6714 3.305074  127.7109 5.749789  -2.039467      6.632012  
1 1 1 1  13 3  o 298.0372 3.025464  59.19574       1.201534      53.52462       2.744766      60.54011       1.336382      283.1430 7.280924  301.3948 3.327525  -18.25183      8.005265  
1 1 1 1  13 4  f 350.3189 5.189242  81.82471       2.422373      85.08330       3.246550      77.73218       3.638336      357.1325 6.822117  341.2762 8.000614  15.85632       10.51433  
1 1 1 1  13 5  o 693.5339 7.483038  320.9533       6.915430      311.5875       10.08803      329.2562       9.498372      682.7175 11.08899  701.9971 10.15407  -19.27954      15.03565  
1 1 1 1  13 6  o 776.6954 7.884325  402.6212       8.159974      403.3035       10.86674      401.7390       12.35608      776.8344 10.49778  774.9714 11.96524  1.862976       15.91761  
1 1 1 1  13 7  o 274.8376 4.038872  50.34935       1.479142      53.32039       2.465303      48.67828       1.848899      282.7255 6.543827  270.2003 5.135158  12.52524       8.318144  
1 1 1 1  13 8  o 94.45139 3.855843  5.956094       0.4842696     8.216871       1.173184      5.491765       0.5316797     110.6669 8.009841  90.65745 4.414491  20.00945       9.145780  
1 1 1 1  13 9  o 397.6436 7.728514  105.5228       4.095090      103.3581       4.966304      110.1212       7.238306      393.3813 9.474278  405.3258 13.42018  -11.94455      16.42751  
1 1 1 1  13 10 o 235.6845 5.830296  37.04287       1.831029      39.02878       2.320128      33.76354       2.981425      241.7540 7.210252  224.5911 9.987239  17.16290       12.31798  
1 1 1 1  13 11 o 222.6514 5.863339  33.08139       1.738064      32.64581       2.089344      34.06006       3.131821      221.0975 7.100945  225.5395 10.44919  -4.442032      12.63365  
1 1 1 1  13 12 o 398.0250 8.652716  105.7526       4.589193      103.1874       5.394519      112.4722       8.730862      392.8766 10.31333  409.2202 16.04238  -16.34360      19.07151  
1 1 1 1  13 13 o 217.6179 1.034215  31.55328       0.2999018     24.35335       2.855497      31.63358       0.3015697     190.5526 11.29657  217.8947 1.038646  -27.34207      11.34422  
1 1 1 1  13 14 o 387.3500 8.323779  100.1392       4.296330      102.2973       5.453529      96.60849       6.975449      391.1653 10.47212  379.6364 13.81196  11.52887       17.33308  
1 1 1 1  13 15 o 308.2135 8.284501  63.44886       3.399363      64.78717       4.573015      61.79604       5.082022      311.1518 11.04705  303.6750 12.58625  7.476776       16.74667  
1 1 1 1  13 16 o 84.43790 6.492496  4.783783       0.7248992     3.403245       1.888939      5.022211       0.7850047     70.08625 19.51068  86.49396 6.867367  -16.40771      20.68399  
1 1 1 1  13 17 o 179.0244 10.18938  21.49077       2.420676      19.96639       3.070596      23.99360       3.934530      172.1079 13.49690  188.3930 15.81905  -16.28506      20.79444  
1 1 1 1  13 18 o 89.65054 15.64390  5.555656       1.800896      5.766696       2.239274      5.169204       3.030204      90.77321 19.11789  86.16277 24.95893  4.610435       31.43950  
1 1 1 1  13 19 o 294.2777 9.295882  57.97325       3.640628      62.82825       4.260267      44.82926       7.009801      306.1740 10.45762  256.2088 20.70866  49.96512       23.19936  
1 1 1 1  13 20 o 257.1589 7.410016  44.22748       2.536537      42.00232       3.830147      45.96579       3.385309      249.9237 11.53205  261.8148 9.720426  -11.89116      15.08227  
1 1 1 1  13 21 o 185.1156 9.632651  23.03308       2.367913      19.77026       3.576023      25.58076       3.159917      170.1158 15.96192  194.6029 12.24788  -24.48709      20.11948  
1 1 1 1  13 22 o 17.77376 8.524212  -0.8359532     0.5812653     9.155889       4.931092      -0.9767476     0.5853463     111.1443 31.72929  17.12575 8.297467  94.01852       32.79628  
1 1 1 1  13 23 o 171.2567 7.184351  19.67126       1.635848      19.85786       2.628673      19.55331       2.089816      171.1655 11.59357  170.3725 9.239814  0.7930145      14.82514  
1 1 1 1  13 24 o 214.4823 7.381880  30.87417       2.106610      24.79658       3.888252      33.39939       2.506332      189.7758 15.51108  222.8417 8.455849  -33.06590      17.66621  
1 1 1 1  13 25 f 125.6690 8.753968  10.67678       1.456742      12.37984       3.100415      10.19430       1.650243      132.4846 18.02968  122.4618 10.20553  10.02279       20.71768  
1 1 1 1  13 26 o 61.33358 5.886736  2.542632       0.4752123     0.2854739      2.640437      2.618191       0.4831008     51.17026 21.86303  62.24515 5.894740  -11.07489      22.64376  
1 1 1 1  13 27 o 186.7207 6.471307  23.44597       1.607685      20.20890       4.427391      23.93764       1.725463      166.6256 20.36294  188.5577 6.878859  -21.93208      21.49344  
1 1 1 1  13 28 o 93.31920 8.467356  5.952415       1.041463      8.591851       9.378343      5.919459       1.047945      98.26433 41.56327  93.03605 8.548538  5.228279       42.43328  
1 1 1 1  13 29 o 98.67681 11.06541  6.821366       1.429942      6.871643       2.656244      6.800850       1.696793      93.04126 21.80723  97.44081 13.42453  -4.399551      25.60807  
1 1 1 1  13 30 o 57.72441 19.87191  2.559694       1.850612      5.283496       2.668715      0.3665028E-01  2.568484      78.48405 23.60550  46.38575 20.64100  32.09831       31.35715  
1 1 1 1  13 31 o 43.38535 18.51227  0.6760525      1.888620      -2.284951      3.226059      2.220012       2.329544      42.44493 20.28234  54.81789 21.63002  -12.37296      29.65183  
1 1 1 1  13 32 o 78.47660 8.600869  4.348663       0.8846895     4.552000       0.9892374     3.536335       1.977232      79.83821 9.483647  63.12593 20.52225  16.71228       22.60757  
1 1 1 1  13 33 o 51.78025 12.00444  2.050899       0.8121226     1.748130       0.9880616     2.681385       1.425825      46.91308 14.41542  56.11285 17.33013  -9.199768      22.54191  
1 1 1 1  13 34 o 15.01920 7.504272  -1.561912      0.6196855     -1.543878      0.6887854     -1.638504      1.419496      16.40785 8.151419  26.87188 12.99587  -10.46403      15.34074  
1 1 1 1  14 0  o 441.4553 3.745108  129.8958       2.202694      129.8958       2.202694      129.8958       2.202694      441.4553 3.745108  441.4553 3.745108  -0.000000      0.000000  
1 1 1 1  14 1  o 408.0668 2.990514  110.9721       1.626113      111.7161       2.035490      109.6596       2.703475      409.4043 3.731152  405.5561 5.002625  3.848145       6.240814  
1 1 1 1  14 2  o 401.0262 5.393539  107.2352       2.882174      112.2693       4.680839      104.1611       3.657811      410.0811 8.566047  395.1319 6.947133  14.94916       11.02904  
1 1 1 1  14 3  o 314.9524 4.850039  66.13257       2.035465      61.26267       3.066161      69.96972       2.721693      302.8963 7.602754  323.8881 6.306242  -20.99182      9.877781  
1 1 1 1  14 4  o 282.7119 4.371836  53.27958       1.646954      52.25386       2.016254      55.33619       2.855001      279.9384 5.405169  287.8765 7.448891  -7.938080      9.203360  
1 1 1 1  14 5  o 106.0254 4.956737  7.511062       0.6983541     7.375741       0.7843018     8.028957       1.534340      105.0203 5.625020  109.0880 10.69251  -4.067772      12.08183  
1 1 1 1  14 6  o 271.5867 5.089811  49.17754       1.841975      47.79424       2.101242      53.76829       3.827900      267.7078 5.890356  283.5032 10.14917  -15.79541      11.73464  
1 1 1 1  14 7  o 730.6691 4.899029  355.9315       4.769845      381.0317       10.46700      349.3529       5.358583      755.1362 10.40216  723.8182 5.555804  31.31793       11.79288  
1 1 1 1  14 8  o 139.6834 4.645779  13.02143       0.8635195     13.59317       0.9303809     9.467041       2.319777      142.7073 4.899883  117.9046 15.11232  24.80269       15.88682  
1 1 1 1  14 9  o 188.9347 5.159632  23.81699       1.297768      22.23111       1.744875      25.78035       1.941469      182.4041 7.192975  196.4291 7.430788  -14.02501      10.34193  
1 1 1 1  14 10 o 141.2600 2.368409  13.29668       0.4458095     13.21986       0.4590939     14.56676       1.866721      140.8507 2.446071  147.3866 9.556423  -6.535965      9.864507  
1 1 1 1  14 11 o 278.4346 5.753070  51.69463       2.134501      54.17524       2.732711      47.81297       3.418400      284.8798 7.204556  267.4099 9.609007  17.46991       12.00994  
1 1 1 1  14 12 o 153.2125 7.310697  15.69592       1.488236      17.22637       1.845495      12.84982       2.516680      160.4150 8.665817  137.8612 13.88885  22.55383       16.37060  
1 1 1 1  14 13 o 256.2006 5.618493  43.76684       1.918110      47.47365       2.750615      40.25801       2.676152      266.6228 7.750328  245.4715 8.193039  21.15129       11.27801  
1 1 1 1  14 14 o 312.1633 4.901728  64.96478       2.038940      57.77646       2.978622      71.30293       2.796941      294.1599 7.605412  326.9638 6.419630  -32.80392      9.952585  
1 1 1 1  14 15 o 314.7441 6.964302  66.09297       2.920847      70.38677       4.565197      63.11712       3.800537      324.3458 10.57691  307.2729 9.292798  17.07285       14.07932  
1 1 1 1  14 16 o 169.5739 4.731760  19.18709       1.068145      17.11447       2.676234      19.57982       1.164956      159.3643 12.70777  171.2809 5.109907  -11.91656      13.69666  
1 1 1 1  14 17 o 164.7188 6.124839  18.12745       1.342005      20.10995       3.046311      17.65006       1.494878      172.6541 13.34459  162.4691 6.920819  10.18503       15.03249  
1 1 1 1  14 18 o 448.3684 8.507930  134.3745       5.083145      134.1091       7.018814      134.6672       7.371448      447.1097 11.79113  447.8875 12.36306  -0.7777100     17.08438  
1 1 1 1  14 19 f 264.7155 8.455300  46.91726       2.978684      43.26488       4.210032      50.57819       4.214964      253.4463 12.50457  274.2867 11.55820  -20.84039      17.02810  
1 1 1 1  14 20 o 176.8043 9.365129  21.00627       2.198509      18.04728       3.993536      22.29302       2.633501      161.6563 18.89522  181.8814 10.91629  -20.22504      21.82189  
1 1 1 1  14 21 o 98.03780 10.41098  6.529377       1.339292      7.390256       2.200306      6.022703       1.688015      102.9848 16.59788  93.37139 13.99806  9.613419       21.71257  
1 1 1 1  14 22 o 25.59789 12.17690  -1.424738      1.135960      -0.2548212     2.040011      -1.950527      1.367605      43.36179 18.87341  27.17047 13.04246  16.19131       22.94148  
1 1 1 1  14 23 o 268.0984 8.123440  48.28059       2.898721      47.74894       4.208456      48.76049       3.998425      265.3748 11.93168  268.4512 11.20226  -3.076416      16.36630  
1 1 1 1  14 24 o 249.3498 7.523126  41.75820       2.496801      37.42784       4.226401      44.07970       3.094523      233.9220 13.61784  255.7260 9.095731  -21.80399      16.37613  
1 1 1 1  14 25 o 146.5372 8.990035  14.53143       1.746977      17.73341       3.656419      13.58428       1.988642      158.6931 17.58600  141.2202 10.64624  17.47287       20.55748  
1 1 1 1  14 26 o 147.9566 9.253159  14.87016       1.815174      10.79685       3.554863      16.30676       2.111138      120.0186 23.06586  154.6161 10.30563  -34.59744      25.26341  
1 1 1 1  14 27 o 68.54513 5.596971  3.173923       0.5067679     10.69254       3.839190      3.040598       0.5112413     116.4639 25.45122  67.04966 5.778426  49.41428       26.09895  
1 1 1 1  14 28 o 30.31908 12.65941  0.1863787      0.8526006     -3.011573      2.642939      0.5578402      0.9007580     37.99870 18.21142  34.53778 13.50337  3.460915       22.67149  
1 1 1 1  14 29 o 30.43306 12.30524  0.3413714      0.7727387     6.138444       5.897041      0.2400905      0.7794598     80.65783 33.45375  29.51957 12.19551  51.13826       35.60736  
1 1 1 1  14 30 o 31.16245 12.19508  0.4799655      0.7352392     -3.754172      2.539656      0.8673016      0.7681330     34.05142 16.67035  36.16304 12.77924  -2.111622      21.00499  
1 1 1 1  14 31 o 50.72942 14.94694  2.014509       1.078671      2.767394       2.838821      1.887467       1.166133      57.98227 23.53406  49.13398 15.74209  8.848293       28.31370  
1 1 1 1  14 32 o 17.25174 8.336674  -0.8514197     0.5812320     -0.9882440     0.5884800     4.600708       3.714780      16.73290 8.155442  64.97934 26.71175  -48.24644      27.92899  
1 1 1 1  14 33 o 20.73668 10.21510  -1.842403      1.001730      -1.432043      1.090383      -4.062589      2.536246      23.45907 11.35612  31.74997 15.75080  -8.290903      19.41776  
1 1 1 1  14 34 o 28.84674 13.29697  -0.4441517     1.185572      -0.6818810     1.338740      0.4200758      2.552518      29.47631 13.77133  42.74767 19.63384  -13.27136      23.98202  
1 1 1 1  15 0  o 18.49308 12.77887  -0.8522055     1.065249      -0.8522055     1.065249      -0.8522055     1.065249      18.49308 12.77887  18.49308 12.77887  0.000000       0.000000  
1 1 1 1  15 1  o 527.9499 3.052149  185.7534       2.147197      178.3820       4.914762      187.4923       2.387058      517.0820 7.132956  530.4005 3.377423  -13.31854      7.892151  
1 1 1 1  15 2  o 438.5979 4.780068  128.2447       2.793664      133.7224       3.951840      122.7726       3.949836      447.7421 6.623658  428.9972 6.909572  18.74496       9.571574  
1 1 1 1  15 3  o 339.0435 5.824489  76.65535       2.631399      74.06183       3.677685      79.37584       3.766631      333.1064 8.285485  344.8564 8.196740  -11.75000      11.65486  
1 1 1 1  15 4  o 404.4854 5.771584  109.1000       3.110795      106.9108       4.273273      111.5680       4.537240      400.2463 8.012347  408.8438 8.328384  -8.597534      11.55680  
1 1 1 1  15 5  o 330.7756 5.979669  72.96385       2.635628      72.43526       3.102121      74.33569       4.997458      329.5156 7.064953  333.2935 11.26870  -3.777954      13.30027  
1 1 1 1  15 6  o 461.5828 5.698553  142.0689       3.504998      147.0827       4.608405      135.1886       5.398449      469.5281 7.365726  449.9912 9.003087  19.53687       11.63226  
1 1 1 1  15 7  o 509.2418 5.740563  172.9212       3.895400      173.6992       4.615218      170.9942       7.263604      510.3027 6.787204  505.8725 10.77550  4.430145       12.73490  
1 1 1 1  15 8  o 678.7307 7.628398  307.3685       6.899290      295.7697       8.800262      325.8680       11.11395      665.4722 9.924124  698.1335 11.94693  -32.66132      15.53118  
1 1 1 1  15 9  o 219.5514 6.858850  32.18350       2.004139      32.48011       2.497874      31.64753       3.357749      220.4361 8.519867  217.2803 11.63971  3.155792       14.42467  
1 1 1 1  15 10 o 149.4778 5.314034  14.91563       1.056776      16.43277       1.397475      12.88934       1.615035      156.8202 6.703036  138.6830 8.784616  18.13716       11.04989  
1 1 1 1  15 11 o 87.14533 9.713295  5.133950       1.108784      5.956856       1.386832      3.675982       1.845961      93.73266 11.33333  72.62560 18.89665  21.10706       22.03469  
1 1 1 1  15 12 o 360.6408 7.704937  86.78548       3.702691      89.58037       5.067194      83.58341       5.423764      366.0293 10.39965  353.4094 11.53270  12.61990       15.52920  
1 1 1 1  15 13 o 224.3174 7.060544  33.60341       2.107820      32.81765       2.626038      35.02647       3.534036      221.5219 8.914535  228.5736 11.64137  -7.051697      14.66255  
1 1 1 1  15 14 o 306.6249 5.353228  62.69443       2.187241      60.62162       2.705213      66.60751       3.716906      301.4385 6.734869  315.6933 8.844452  -14.25479      11.11678  
1 1 1 1  15 15 o 102.2449 1.271460  6.965479       0.1732280     12.96464       1.054317      6.799035       0.1756146     139.3029 5.691844  101.0158 1.304661  38.28710       5.839455  
1 1 1 1  15 16 o 184.0537 5.873683  22.62381       1.438707      28.83115       3.119584      20.94689       1.621437      207.1894 11.34267  177.0126 6.887345  30.17679       13.26996  
1 1 1 1  15 17 o 464.9366 8.582680  144.5212       5.317288      135.2458       10.29574      147.8951       6.209506      447.0883 17.31461  470.0616 9.913540  -22.97330      19.95179  
1 1 1 1  15 18 o 374.6421 8.098345  93.86293       4.042838      98.33225       6.354329      90.82339       5.240255      382.2809 12.49100  367.8640 10.70172  14.41693       16.44846  
1 1 1 1  15 19 o 122.1677 5.592985  9.985728       0.9080715     10.85935       3.670998      9.928788       0.9371970     123.6338 23.13309  121.7998 5.791040  1.834045       23.84693  
1 1 1 1  15 20 o 130.6203 10.01397  11.52421       1.729681      6.319201       3.224350      13.62727       2.049540      93.42191 25.28802  141.9319 10.92076  -48.51000      27.54536  
1 1 1 1  15 21 o 141.2303 8.419636  13.42410       1.577316      15.00957       2.753024      12.64932       1.924501      148.0805 14.12292  136.6611 10.65226  11.41948       17.68975  
1 1 1 1  15 22 o 239.7848 7.401005  38.57307       2.361923      37.33842       3.564649      39.53935       3.153532      234.7958 11.42771  242.1511 9.793413  -7.355362      15.05003  
1 1 1 1  15 23 o 178.0271 9.283562  21.39850       2.194680      23.57729       3.482596      19.96324       2.826575      185.2989 14.21297  171.0185 12.48960  14.28041       18.92085  
1 1 1 1  15 24 o 47.00527 18.93261  0.8192869      1.821453      0.3818288      2.494718      1.318732       2.665613      50.51833 21.40544  56.84531 22.90078  -6.326981      31.34706  
1 1 1 1  15 25 o 111.6245 12.61457  8.634996       1.843479      3.142117       3.381260      10.95836       2.199060      70.35062 26.49848  125.6345 13.33938  -55.28385      29.66662  
1 1 1 1  15 26 o 66.39310 16.88198  3.239521       1.496668      7.644511       3.552684      2.289061       1.650255      97.79382 26.57513  56.97384 18.76246  40.81997       32.53102  
1 1 1 1  15 27 o 64.71640 18.69055  3.160048       1.701622      3.529949       3.262914      3.021867       1.994285      69.60761 26.07029  63.51793 20.60763  6.089680       33.23153  
1 1 1 1  15 28 o 54.84478 7.434490  2.079892       0.5293480     -0.4522676E-01 3.812199      2.121673       0.5345262     54.70174 24.67954  55.40386 7.427199  -0.7021179     25.77291  
1 1 1 1  15 29 o 46.64958 12.09452  1.607734       0.7579975     -0.4829237     3.556720      1.707208       0.7758206     50.22446 23.10756  48.05497 12.11952  2.169495       26.09295  
1 1 1 1  15 30 o 28.25679 10.72989  0.4394731      0.5570250     -7.392097      6.876797      0.4911962      0.5588614     50.85678 25.34565  28.99616 10.80349  21.86061       27.55208  
1 1 1 1  15 31 o 44.34900 13.61035  1.509443       0.8811269     -1.135192      3.066470      1.747450       0.9199219     43.11887 20.36226  47.43892 13.75503  -4.320057      24.57280  
1 1 1 1  15 32 o 28.33344 11.97901  0.2095822      0.7784522     15.65259       7.926736      0.5919325E-01  0.7822334     80.87331 36.10637  27.07723 11.73696  53.79607       37.96611  
1 1 1 1  15 33 o 43.05988 9.808969  1.389995       0.5502063     1.368411       0.5773055     1.603839       1.817158      42.51500 10.30008  45.76853 18.73367  -3.253525      21.37854  
1 1 1 1  16 0  o 93.17264 9.650776  5.974038       1.166137      5.974038       1.166137      5.974038       1.166137      93.17264 9.650776  93.17264 9.650776  0.000000       0.000000  
1 1 1 1  16 1  o 349.9633 4.702671  81.64393       2.193010      81.07117       3.147542      82.18428       3.057199      348.6319 6.775336  351.0308 6.535893  -2.398926      9.413983  
1 1 1 1  16 2  o 476.1601 3.784877  151.1128       2.401476      153.2029       2.902746      146.5794       4.275047      479.4048 4.543945  468.7775 6.843852  10.62738       8.214971  
1 1 1 1  16 3  o 775.2296 8.086948  401.0455       8.353886      412.2473       12.31290      391.4911       11.37153      785.2863 11.76682  765.3928 11.14964  19.89343       16.21026  
1 1 1 1  16 4  o 314.5269 5.156841  65.95363       2.161300      66.12484       2.815649      65.70805       3.372153      314.8646 6.710907  313.6909 8.074080  1.173737       10.49891  
1 1 1 1  16 5  o 222.6205 5.329886  33.04229       1.581090      32.77222       2.007622      33.48336       2.565628      221.5570 6.808300  223.8133 8.618797  -2.256332      10.98347  
1 1 1 1  16 6  o 81.68835 8.804304  4.505536       0.9432427     4.493511       1.344840      4.517180       1.323314      80.97513 12.89576  81.23540 12.63548  -0.2602768     18.05425  
1 1 1 1  16 7  o 69.43645 6.753519  3.246124       0.6169871     1.756911       1.032981      4.072059       0.7692847     50.65654 14.54181  77.76459 7.517515  -27.10805      16.37001  
1 1 1 1  16 8  o 254.3773 5.218706  43.14048       1.768947      43.17553       2.051137      43.03874       3.494634      254.4519 6.049443  253.6229 10.36228  0.8290710      11.99886  
1 1 1 1  16 9  o 174.2789 1.217241  20.23713       0.2826799     20.25694       0.2850067     19.03896       2.216727      174.3641 1.226661  168.5525 9.913462  5.811615       9.989065  
1 1 1 1  16 10 o 454.2923 5.334398  137.6024       3.229195      142.5355       5.451803      134.9362       4.007913      462.0731 8.854336  449.7774 6.687242  12.29565       11.09588  
1 1 1 1  16 11 o 277.6854 8.831782  51.53371       3.263790      48.64626       4.137177      56.29213       5.311031      269.4857 11.54790  289.6100 13.80204  -20.12436      17.99584  
1 1 1 1  16 12 o 180.2810 6.211080  21.70422       1.489846      23.68153       1.813683      17.60167       2.612467      188.2487 7.243810  161.7331 12.21235  26.51561       14.19909  
1 1 1 1  16 13 o 321.5197 6.295617  68.96251       2.697239      66.73596       3.413065      72.66591       4.401784      316.0504 8.110988  329.5650 10.03507  -13.51453      12.90313  
1 1 1 1  16 14 o 259.7770 4.456522  44.99488       1.542660      44.52944       1.673032      47.63697       3.986082      258.4121 4.858675  266.5378 11.24841  -8.125763      12.25290  
1 1 1 1  16 15 o 110.3479 4.311850  8.131649       0.6327973     7.512564       0.7113149     10.48062       1.385560      106.0095 5.050033  124.9565 8.369595  -18.94704      9.775119  
1 1 1 1  16 16 o 146.3040 1.176132  14.26220       0.2292904     15.97239       1.707376      14.23079       0.2313864     154.3378 8.332912  146.1427 1.188194  8.195084       8.417199  
1 1 1 1  16 17 o 163.4021 1.055102  17.79049       0.2297341     19.66246       0.6017126     17.47105       0.2485641     171.7540 2.629110  161.9274 1.151979  9.826569       2.870414  
1 1 1 1  16 18 o 113.1747 5.229434  8.568470       0.7865056     11.97104       6.095929      8.510871       0.7931348     126.5162 34.98542  112.7873 5.292075  13.72895       35.38341  
1 1 1 1  16 19 o 201.8760 8.245151  27.34932       2.213308      32.70256       3.822917      24.65025       2.714525      219.6222 13.12291  191.1591 10.69946  28.46313       16.93190  
1 1 1 1  16 20 o 189.9758 6.711551  24.17957       1.696336      24.42404       4.217873      24.13239       1.852782      188.1674 17.00527  189.6868 7.344040  -1.519424      18.52334  
1 1 1 1  16 21 o 88.22322 7.410231  5.253065       0.8630971     4.732144       2.924736      5.302757       0.9033262     81.05782 24.78171  88.59282 7.729270  -7.534996      25.95910  
1 1 1 1  16 22 o 126.7276 10.57103  10.92046       1.768854      10.72409       2.836909      11.04535       2.262506      123.3651 17.76938  126.6262 13.62292  -3.261108      22.39050  
1 1 1 1  16 23 f 118.1205 11.64016  9.564322       1.808354      7.058459       2.949415      11.07375       2.289091      97.46189 23.07081  126.4987 13.80385  -29.03680      26.88509  
1 1 1 1  16 24 o 94.77153 18.05185  6.503702       2.196452      7.086392       3.265174      6.022094       2.968485      96.12499 25.19162  88.96320 24.34021  7.161789       35.02947  
1 1 1 1  16 25 f 116.2452 16.46187  9.690676       2.478673      10.52904       4.442995      9.311844       2.986644      113.4295 29.21706  111.6419 20.84260  1.787529       35.88942  
1 1 1 1  16 26 o 36.80387 17.37409  -2.060917      2.228948      1.037353       3.856370      -3.615219      2.731410      60.52075 26.14674  37.49022 18.10575  23.03053       31.80361  
1 1 1 1  16 27 o 51.88863 20.96452  1.418608       2.241046      7.657903       4.468220      -0.6784371     2.590423      90.39889 30.88573  44.43653 20.16658  45.96236       36.88657  
1 1 1 1  16 28 f 99.86830 14.81760  7.419145       1.912168      15.08604       5.286568      6.265110       2.051037      122.0074 32.09309  89.62148 17.80239  32.38592       36.70002  
1 1 1 1  16 29 o 38.19820 10.45215  1.066951       0.5473548     -8.103104      4.617517      1.197640       0.5512413     40.93760 20.45889  40.44864 10.22399  0.4889603      22.87129  
1 1 1 1  16 30 o 70.46362 10.28161  3.596076       0.9369501     9.926343       4.651932      3.328422       0.9565530     88.90684 31.44592  67.34610 11.04146  21.56074       33.32806  
1 1 1 1  16 31 o 34.85363 16.76691  -1.970989      2.288493      -10.52234      5.204674      0.7853921E-01  2.548022      39.43624 19.96216  43.17942 19.75150  -3.743176      28.08219  
1 1 1 1  16 32 o 32.24284 12.72564  0.5926792      0.8065231     -1.931669      3.104185      0.7754225      0.8352061     39.62583 19.17704  34.46387 13.12650  5.161957       23.23927  
1 1 1 1  17 0  o 417.0701 5.512417  115.9963       3.062342      115.9963       3.062342      115.9963       3.062342      417.0701 5.512417  417.0701 5.512417  0.000000       0.000000  
1 1 1 1  17 1  o 84.35682 7.639193  4.786415       0.8494005     7.214872       1.405754      3.389954       1.066003      103.4205 10.33913  70.26980 11.80256  33.15066       15.69070  
1 1 1 1  17 2  o 56.82380 9.310974  2.211772       0.6806201     2.760679       0.8772476     1.381668       1.078797      63.41294 10.76637  46.35629 15.16476  17.05665       18.59797  
1 1 1 1  17 3  o 410.5336 4.691943  112.3485       2.566699      111.0288       3.609721      113.6980       3.650340      408.0089 6.639426  412.8845 6.634852  -4.875580      9.386333  
1 1 1 1  17 4  o 505.0740 6.057508  170.1105       4.076829      168.5203       5.198377      172.6511       6.570819      502.5677 7.762466  508.4866 9.697649  -5.918976      12.42177  
1 1 1 1  17 5  o 309.9122 5.142723  64.03181       2.123759      66.18145       2.444118      57.40625       4.290930      315.0432 5.822086  292.9033 11.01357  22.13995       12.45774  
1 1 1 1  17 6  o 584.7135 7.293015  228.0842       5.682294      226.8792       8.593655      229.0204       7.574450      582.6730 11.06826  585.6184 9.706505  -2.945435      14.72151  
1 1 1 1  17 7  o 70.75795 8.654023  3.391605       0.7989937     2.660661       0.9815771     4.826929       1.375490      61.99607 12.31615  84.01900 12.68028  -22.02293      17.67702  
1 1 1 1  17 8  o 208.2042 5.170690  28.90179       1.434536      28.72529       1.891537      29.14075       2.200910      207.4002 6.853763  208.8157 7.924177  -1.415558      10.47696  
1 1 1 1  17 9  o 374.1523 5.577417  93.34958       2.780706      91.59795       3.299789      97.64076       5.164801      370.5562 6.682801  382.1437 10.15169  -11.58746      12.15387  
1 1 1 1  17 10 o 152.0864 6.194256  15.45388       1.252689      15.64403       1.380779      14.56931       2.978149      152.9780 6.790556  146.5563 15.48377  6.421722       16.90735  
1 1 1 1  17 11 o 84.62985 3.803011  4.783758       0.4277733     4.644377       0.5257385     5.056801       0.7358421     83.32564 4.754710  86.82691 6.405084  -3.501274      7.976990  
1 1 1 1  17 12 o 186.2773 5.911861  23.17143       1.465573      25.29989       2.310014      21.73751       1.896030      194.3792 8.942449  180.2487 7.913329  14.13048       11.94103  
1 1 1 1  17 13 o 241.2194 7.017013  38.87947       2.253078      36.31776       2.900337      42.77808       3.577983      232.8634 9.366139  252.5733 10.65501  -19.70985      14.18640  
1 1 1 1  17 14 o 171.6100 6.948486  19.69905       1.585650      21.26031       1.889305      15.97890       2.916384      178.1832 7.977452  153.4388 14.43334  24.74442       16.49124  
1 1 1 1  17 15 o 104.7969 1.158233  7.317673       0.1617401     7.310927       0.1620943     8.856125       2.447927      104.7486 1.161305  113.2484 16.72408  -8.499893      16.76435  
1 1 1 1  17 16 o 412.6773 6.542086  113.7815       3.597496      113.4863       5.354370      114.0244       4.857152      411.4409 9.766240  412.6465 8.833443  -1.205658      13.16849  
1 1 1 1  17 17 o 70.10529 2.041988  3.278300       0.1905524     3.102474       0.2147177     3.930192       0.4134415     68.18362 2.366865  76.64964 4.062413  -8.466026      4.701622  
1 1 1 1  17 18 o 64.62968 2.491854  2.788593       0.2141971     3.020711       1.957905      2.785781       0.2154906     66.00648 20.29410  64.59618 2.508269  1.410309       20.44852  
1 1 1 1  17 19 o 158.0714 6.842193  16.75563       1.437779      18.28653       2.912176      16.26219       1.653333      163.6811 13.47110  155.5361 8.004216  8.145004       15.66965  
1 1 1 1  17 20 o 141.1115 4.509785  13.31050       0.8469028     9.726140       2.691714      13.70431       0.8922154     117.6062 17.72639  143.1676 4.683129  -25.56146      18.33457  
1 1 1 1  17 21 o 192.5683 8.238043  24.96270       2.109005      18.05921       3.536154      28.77405       2.627460      161.0464 16.72118  206.4084 9.579022  -45.36200      19.27059  
1 1 1 1  17 22 o 113.9429 9.757182  8.832610       1.467198      5.428313       2.822115      10.09358       1.717565      85.34813 23.88060  121.6137 10.70805  -36.26560      26.17146  
1 1 1 1  17 23 o 90.96244 13.96665  5.820151       1.638865      10.33824       3.744600      4.749679       1.822702      116.5801 24.86412  80.88721 17.42563  35.69285       30.36243  
1 1 1 1  17 24 o 118.2501 18.48642  10.19830       2.817601      7.958439       4.084209      12.23242       3.892106      98.64544 29.08966  126.2654 24.00996  -27.62000      37.71851  
1 1 1 1  17 25 o 46.12815 19.53550  0.4903208      2.076155      -6.514697      3.612712      3.944577       2.536916      39.28119 19.35969  71.46861 23.24689  -32.18742      30.25253  
1 1 1 1  17 26 o 37.45397 17.57775  -1.706300      2.222847      -2.757583      3.553943      -1.030774      2.848866      45.69184 21.67867  45.31955 20.78816  0.3722878      30.03518  
1 1 1 1  17 27 o 49.69950 21.58500  0.7110988      2.656245      -8.129706      4.713898      4.824300       3.215321      42.69184 21.22859  73.56509 26.13125  -30.87326      33.66742  
1 1 1 1  17 28 o 31.83206 15.09187  -1.503464      1.716322      -3.958366      3.268733      -0.5690162     2.016693      39.10688 19.09539  38.43470 17.57763  0.6721802      25.95394  
1 1 1 1  17 29 o 54.98592 21.59177  2.429413       2.311476      12.33396       6.096541      0.7665881      2.497983      90.70486 35.22473  46.86860 20.62875  43.83626       40.82067  
1 1 1 1  17 30 o 30.78746 12.16057  0.4908023      0.7369989     0.4285126      5.294918      0.4920330      0.7442436     54.30132 25.95783  30.88246 12.21326  23.41886       28.68750  
1 1 1 1  17 31 o 41.93600 20.09181  -1.278730      3.211064      -5.408850      5.653477      0.6881840      3.901458      45.07434 22.54303  49.41403 23.22127  -4.339687      32.36380  
1 1 1 1  18 0  o 27.80653 16.91523  0.4616347      1.172936      0.4616347      1.172936      0.4616347      1.172936      27.80653 16.91523  27.80653 16.91523  0.000000       0.000000  
1 1 1 1  18 1  o 396.7539 5.211883  104.9500       2.755430      106.0229       4.194108      104.1352       3.654846      398.6007 7.896379  395.1065 6.941949  3.494263       10.51397  
1 1 1 1  18 2  o 367.3836 4.497714  89.97165       2.201836      88.99554       3.235409      90.81372       3.005068      365.2744 6.647164  369.0188 6.111282  -3.744354      9.029538  
1 1 1 1  18 3  o 608.1658 3.932832  246.5245       3.187139      247.7534       3.560545      241.5704       7.149065      609.6503 4.382906  601.5288 8.919065  8.121521       9.937785  
1 1 1 1  18 4  o 208.7215 6.355503  29.08294       1.765568      30.08245       2.215375      27.34296       2.922977      212.1725 7.849352  201.9766 10.90092  10.19591       13.43288  
1 1 1 1  18 5  o 190.0668 5.363737  24.10680       1.357103      23.71897       1.574540      25.22732       2.676357      188.4753 6.278161  194.0279 10.38946  -5.552597      12.13903  
1 1 1 1  18 6  f 812.8585 8.783751  441.1844       9.514117      442.0457       13.83163      440.4109       13.10754      812.6661 12.77284  811.3466 12.12387  1.319519       17.61062  
1 1 1 1  18 7  o 434.8264 5.660276  126.0929       3.279646      122.1091       4.515309      130.5415       4.771531      427.7065 7.922608  442.2094 8.097599  -14.50293      11.32867  
1 1 1 1  18 8  o 472.0793 5.278389  148.6133       3.320396      147.0275       4.654488      150.2567       4.738129      469.3488 7.442222  474.4693 7.494200  -5.120453      10.56171  
1 1 1 1  18 9  o 395.3726 4.935294  104.2374       2.600118      104.1112       3.627975      104.3707       3.728323      394.9745 6.893214  395.4491 7.075374  -0.4746094     9.878123  
1 1 1 1  18 10 o 277.9217 5.664788  51.52567       2.097875      49.76147       2.436194      56.58734       4.126525      273.0556 6.695565  290.6035 10.67453  -17.54788      12.60064  
1 1 1 1  18 11 o 127.2788 7.908034  10.86349       1.334589      10.52320       1.550773      11.83518       2.620495      125.0955 9.371330  131.7868 15.20057  -6.691299      17.85719  
1 1 1 1  18 12 o 277.7731 5.364093  51.47891       1.985455      53.49374       2.835315      49.54028       2.781183      282.8665 7.528917  272.1869 7.675785  10.67963       10.75185  
1 1 1 1  18 13 o 192.8522 5.403728  24.83898       1.387277      25.01404       2.098512      24.70308       1.848918      193.2352 8.168313  192.1412 7.234355  1.093994       10.91133  
1 1 1 1  18 14 o 95.69689 9.034308  6.186553       1.138402      6.287382       1.483198      6.041994       1.775947      96.01370 11.84368  93.50437 14.74131  2.509331       18.90976  
1 1 1 1  18 15 o 221.6483 8.565210  32.95176       2.524979      32.25623       3.391022      33.81723       3.782721      218.6660 11.68031  223.6485 12.74579  -4.982544      17.28828  
1 1 1 1  18 16 o 161.9568 5.348082  17.53547       1.152590      16.79842       1.256457      21.44857       2.895091      158.4469 5.961636  177.9297 12.28613  -19.48274      13.65614  
1 1 1 1  18 17 o 326.5516 4.703995  71.19230       2.046879      69.12243       2.413112      76.50158       3.864773      321.6277 5.630547  337.5978 8.598139  -15.97012      10.27770  
1 1 1 1  18 18 o 241.9894 5.967506  39.15969       1.924256      42.62241       3.411839      37.54444       2.330231      251.3717 10.20711  236.5983 7.400281  14.77342       12.60751  
1 1 1 1  18 19 o 132.8468 1.161361  11.76016       0.2055851     8.749466       1.813033      11.79938       0.2069197     112.9989 12.23586  133.0680 1.166957  -20.06911      12.29138  
1 1 1 1  18 20 o 97.37366 9.443677  6.448421       1.209972      6.405255       1.366512      6.605113       2.603524      96.74758 10.78291  95.16609 21.08598  1.581490       23.68312  
1 1 1 1  18 21 o 118.2522 4.609816  9.360897       0.7249923     -1.429019      2.215618      10.65473       0.7672294     39.68711 18.25163  126.1763 4.570799  -86.48919      18.81527  
1 1 1 1  18 22 o 89.50891 3.961690  5.363788       0.4713494     3.933503       2.285568      5.427320       0.4817042     72.89757 21.82713  90.03149 4.025429  -17.13392      22.19522  
1 1 1 1  18 23 o 102.0542 13.25162  7.319524       1.759565      6.029734       2.536321      8.516244       2.443099      88.93808 21.61575  108.2529 17.53608  -19.31477      27.83442  
1 1 1 1  18 24 o 109.6953 10.85031  8.355113       1.565248      7.925737       3.010080      8.514247       1.832489      100.2525 23.01922  109.9220 12.74679  -9.669510      26.31283  
1 1 1 1  18 25 o 121.2452 14.99270  10.69151       2.370688      9.818050       3.593369      11.36470       3.154631      108.0990 25.38263  121.1281 20.25969  -13.02909      32.47665  
1 1 1 1  18 26 o 39.79929 17.64301  -0.9733647E-01 1.858749      0.7525131      2.416041      -1.329835      2.909554      48.39370 20.79952  43.87963 20.43447  4.514065       29.15797  
1 1 1 1  18 27 o 57.59554 21.21315  2.671157       2.143507      2.568312       2.615081      2.881732       3.741935      57.74444 22.87561  61.64083 26.17101  -3.896385      34.75939  
1 1 1 1  18 28 o 48.94352 20.56837  1.396528       2.272955      -8.375377      7.373857      2.422487       2.389297      50.79229 25.45270  55.23890 21.87126  -4.446602      33.55878  
1 1 1 1  18 29 o 44.20737 18.15392  1.191871       1.713512      -0.4758075     2.604543      2.464510       2.275245      41.99139 19.47950  54.17252 21.37612  -12.18113      28.92039  
1 1 1 1  18 30 o 35.26925 16.81569  -1.421219      2.191557      0.5124820      2.874417      -4.105947      3.386923      45.65308 20.91880  37.47309 18.52011  8.179989       27.93905  
1 1 1 1  19 0  o 500.4997 6.455367  167.0875       4.303636      167.0875       4.303636      167.0875       4.303636      500.4997 6.455367  500.4997 6.455367  0.000000       0.000000  
1 1 1 1  19 1  o 421.0078 5.813342  118.2155       3.261291      115.7974       5.073503      119.9182       4.257410      416.3616 9.144580  423.8792 7.537543  -7.517639      11.85065  
1 1 1 1  19 2  o 752.0234 8.623583  377.6676       8.641570      363.3615       12.35198      391.3826       12.09415      736.6833 12.58294  764.7681 11.86785  -28.08472      17.29671  
1 1 1 1  19 3  o 99.88110 7.223313  6.692478       0.9548810     6.794966       1.263506      6.555988       1.458117      100.3917 9.560370  98.35276 11.33278  2.038933       14.82675  
1 1 1 1  19 4  o 327.2313 6.871624  71.45532       2.996317      72.19347       4.249148      70.72527       4.225812      328.5175 9.717342  325.1505 9.764377  3.366913       13.77570  
1 1 1 1  19 5  o 428.3104 6.724512  122.4171       3.837893      122.1075       4.089149      124.7067       11.12021      427.7221 7.174599  429.3908 19.48587  -1.668671      20.76473  
1 1 1 1  19 6  o 224.1257 6.951220  33.55919       2.073485      34.95277       2.481674      30.33686       3.773664      228.6204 8.159306  212.2707 13.40988  16.34966       15.69711  
1 1 1 1  19 7  o 398.5744 6.583647  106.0233       3.496628      106.1836       4.861859      105.8516       5.032513      398.5594 9.154524  397.8868 9.491871  0.6725769      13.18715  
1 1 1 1  19 8  o 482.9165 5.676643  155.5898       3.652895      155.1584       4.839160      156.1612       5.569419      481.9960 7.534476  483.3669 8.646880  -1.370941      11.46895  
1 1 1 1  19 9  o 390.1167 5.271611  101.5305       2.740383      104.2970       3.633749      97.88204       4.172930      395.2131 6.900015  382.6933 8.183080  12.51984       10.70388  
1 1 1 1  19 10 o 59.02895 1.351970  2.321745       0.1063422     2.310203       0.1065159     5.851376       1.862660      58.88201 1.357558  91.87898 15.78250  -32.99697      15.84077  
1 1 1 1  19 11 o 229.4884 4.834105  35.13559       1.478259      34.48034       1.677235      37.41617       3.129033      227.2909 5.537813  236.0989 9.968297  -8.807983      11.40326  
1 1 1 1  19 12 o 209.4933 6.833253  29.35873       1.904977      28.10515       2.383271      31.57671       3.170121      204.6997 8.757648  216.5876 11.02043  -11.88786      14.07645  
1 1 1 1  19 13 o 165.1016 6.498962  18.24377       1.426986      16.81555       1.995223      19.73932       2.041704      158.0780 9.516171  171.4047 8.970380  -13.32669      13.07766  
1 1 1 1  19 14 o 360.2249 6.913896  86.78327       3.318716      82.92024       4.130706      93.81716       5.573881      351.5901 8.823836  373.2247 11.22037  -21.63464      14.27434  
1 1 1 1  19 15 o 163.6342 6.927980  17.94759       1.507198      15.94376       1.981470      20.69873       2.321743      153.7507 9.721345  175.2072 9.985984  -21.45657      13.93644  
1 1 1 1  19 16 o 478.5197 8.087423  153.5502       5.156839      151.6826       6.821838      156.0405       7.877230      474.4093 10.79132  480.1949 12.32087  -5.785553      16.37854  
1 1 1 1  19 17 o 196.5273 5.683826  25.84512       1.486896      25.85601       1.877483      25.82681       2.435259      196.3136 7.189296  195.7322 9.364202  0.5813599      11.80569  
1 1 1 1  19 18 o 26.95702 8.076667  0.4928407      0.3128679     0.4750595      0.3248855     0.7199374      1.161059      26.66385 8.278750  39.74669 15.38949  -13.08283      17.47495  
1 1 1 1  19 19 o 119.5701 4.507988  9.565717       0.7169690     9.174326       1.007636      9.967068       1.020378      116.8273 6.498312  121.8150 6.307664  -4.987671      9.056195  
1 1 1 1  19 20 o 33.65535 8.796454  0.7920960      0.3988169     1.362566       0.5798653     0.2800092      0.5493921     44.00393 10.10298  26.68614 10.51209  17.31779       14.57993  
1 1 1 1  19 21 o 60.31716 3.362082  2.436794       0.2691540     3.557919       1.577876      2.403195       0.2731574     69.79601 17.10192  59.89141 3.437183  9.904606       17.44390  
1 1 1 1  19 22 o 94.51685 5.989666  6.026300       0.7504912     5.890935       1.591900      6.064984       0.8509972     91.21795 13.50412  94.65525 6.792139  -3.437302      15.11603  
1 1 1 1  19 23 o 135.8222 12.56269  12.95481       2.247910      14.41170       3.316857      11.71721       3.057061      139.5409 18.27716  125.2283 18.90866  14.31255       26.29814  
1 1 1 1  19 24 o 28.98668 13.67872  -1.327920      1.379256      -1.618297      2.818456      -1.236484      1.581573      43.04540 20.06804  31.99599 14.95500  11.04941       25.02755  
1 1 1 1  19 25 o 55.80175 16.93425  2.401885       1.369079      5.475111       2.971487      1.573692       1.542561      78.27451 25.13402  48.21512 17.95172  30.05938       30.88662  
1 1 1 1  19 26 o 38.87112 16.97764  0.1921048      1.663054      -0.5649881     2.763459      0.6219853      2.082343      44.30526 20.37843  44.52010 19.22362  -0.2148361     28.01478  
1 1 1 1  19 27 o 52.35999 22.34459  1.676404       2.752137      1.319223       4.014967      1.992982       3.779882      55.27355 25.09338  56.79536 25.16934  -1.521809      35.54115  
1 1 1 1  19 28 o 52.44961 19.76457  2.266661       1.881561      1.834420       3.391797      2.458807       2.261425      53.71391 23.82099  54.22403 21.33730  -0.5101242     31.98000  
1 1 1 1  19 29 o 64.13477 21.38234  3.994396       2.141483      0.3813753      3.315712      6.580094       2.804984      47.17387 21.91617  79.00818 24.29049  -31.83430      32.71614  
1 1 1 1  20 0  o 208.9708 6.353968  29.19959       1.765606      29.19959       1.765606      29.19959       1.765606      208.9708 6.353968  208.9708 6.353968  0.000000       0.000000  
1 1 1 1  20 1  o 349.6546 5.186829  81.54689       2.416655      87.07896       3.950234      78.23798       3.055067      361.0165 8.211495  342.3597 6.696759  18.65680       10.59600  
1 1 1 1  20 2  o 72.74190 8.881601  3.589192       0.8430621     2.832797       1.292608      4.149155       1.112173      63.63240 15.41010  77.95879 11.01249  -14.32638      18.94060  
1 1 1 1  20 3  o 218.7829 5.405498  31.93169       1.575878      29.47838       2.096057      35.12139       2.390023      209.9540 7.504201  229.1570 7.838539  -19.20300      10.85153  
1 1 1 1  20 4  o 356.8565 6.087520  84.98819       2.894727      86.09958       3.993059      83.75717       4.202490      358.9176 8.349056  353.8118 8.920874  5.105865       12.21838  
1 1 1 1  20 5  o 286.3545 7.685614  54.82520       2.929970      54.37266       3.566016      55.76547       5.140197      284.9202 9.405505  287.7680 13.44205  -2.847839      16.40586  
1 1 1 1  20 6  o 542.0355 3.782670  195.8891       2.732119      201.9708       8.266195      195.1433       2.894808      548.8282 11.30305  540.9780 4.015749  7.850220       11.99522  
1 1 1 1  20 7  o 131.0770 8.971234  11.54994       1.557493      11.09764       1.983692      12.27692       2.514894      128.0573 11.75616  134.2773 14.27387  -6.220062      18.49191  
1 1 1 1  20 8  f 130.7063 5.301591  11.41963       0.9214551     13.76556       1.390767      9.584060       1.230221      143.3338 7.305792  119.4789 7.769266  23.85488       10.66471  
1 1 1 1  20 9  o 334.8119 5.024217  74.80524       2.241521      74.91669       3.033678      74.67124       3.326497      334.8413 6.799187  334.1924 7.469940  0.6489258      10.10094  
1 1 1 1  20 10 o 211.7829 6.125864  29.98428       1.726932      31.35369       2.003220      26.02156       3.407688      216.4648 6.953950  196.0582 13.11921  20.40666       14.84827  
1 1 1 1  20 11 o 55.01500 1.815472  2.019222       0.1329073     2.027892       0.1330595     -1.766316      2.780374      55.13318 1.813638  45.02174 20.60860  10.11143       20.68825  
1 1 1 1  20 12 o 118.4714 4.578204  9.381130       0.7213796     9.673656       0.7832410     7.745651       1.851977      120.2798 4.897092  106.2524 13.37625  14.02741       14.24449  
1 1 1 1  20 13 o 222.2222 7.689792  33.11498       2.273635      33.36622       2.658156      32.43011       4.388728      222.8064 8.971564  217.8787 15.21202  4.927704       17.66054  
1 1 1 1  20 14 o 187.3496 6.662649  23.51667       1.660662      24.25714       2.480669      22.91534       2.235483      189.6606 9.849379  184.4854 9.121891  5.175217       13.42457  
1 1 1 1  20 15 o 245.3185 6.900590  40.33157       2.253504      41.01138       2.784434      39.04090       3.836630      247.0150 8.471951  239.9304 12.03874  7.084625       14.72091  
1 1 1 1  20 16 o 162.3770 8.063833  17.74301       1.739316      17.37637       2.229673      18.31293       2.779865      160.1320 10.50740  163.7427 12.84326  -3.610672      16.59382  
1 1 1 1  20 17 o 171.5588 7.857607  19.80846       1.791522      18.23796       2.505915      21.45032       2.562212      163.6361 11.56702  177.7438 10.86998  -14.10767      15.87301  
1 1 1 1  20 18 o 116.7884 7.671686  9.205969       1.187279      9.645945       1.398721      8.071702       2.245815      119.3066 8.861452  106.8992 16.27944  12.40739       18.53498  
1 1 1 1  20 19 o 31.41781 10.00857  0.6576898      0.4718976     0.7229803      0.4838612     -0.6138629     2.135321      32.66615 10.09670  42.01628 18.75043  -9.350136      21.29605  
1 1 1 1  20 20 o 50.94069 2.700681  1.736423       0.1826657     1.667857       0.1867362     3.257922       0.8796542     49.91201 2.819156  68.55644 9.916964  -18.64443      10.30989  
1 1 1 1  20 21 o 60.68339 3.490958  2.469179       0.2810938     3.119870       0.3381987     1.015367       0.5055202     68.20742 3.735320  37.87553 9.905517  30.33189       10.58640  
1 1 1 1  20 22 o 50.63874 3.647543  1.724357       0.2444765     3.247152       0.4203778     0.9461045      0.3005240     69.43847 4.568624  36.95200 6.330987  32.48647       7.807287  
1 1 1 1  20 23 o 37.80223 13.86113  0.8746545      0.9135421     1.721709       1.350791      0.1606530      1.240172      49.25520 16.97673  35.04240 14.97816  14.21280       22.63967  
1 1 1 1  20 24 o 38.79750 10.14199  1.089344       0.5301045     2.053622       1.813759      0.9992810      0.5543075     53.06786 19.51889  37.23392 10.64089  15.83394       22.23096  
1 1 1 1  20 25 o 26.50457 11.76421  -0.1673955     0.8289971     -2.892373      4.553058      -0.7396166E-01 0.8430897     48.58325 23.44159  27.43313 12.03229  21.15012       26.34927  
1 1 1 1  20 26 o 45.04869 20.07118  0.3911814      2.436456      7.363836       5.255270      -1.517903      2.749847      76.10394 31.57437  40.55396 19.19030  35.54998       36.94873  
1 1 1 1  20 27 o 36.46229 15.77171  0.3274404      1.406490      -2.992511      2.908779      1.340521       1.606819      37.39340 18.20423  44.76840 17.86722  -7.374996      25.50748  
1 1 1 1  20 28 o 41.91349 17.78271  0.9241620      1.725551      -3.936150      3.292208      2.765086       2.026158      37.35350 18.42321  55.06371 20.55983  -17.71021      27.60654  
1 1 1 1  21 0  o 654.9331 7.171486  286.3075       6.256945      286.3075       6.256945      286.3075       6.256945      654.9331 7.171486  654.9331 7.171486  0.000000       0.000000  
1 1 1 1  21 1  o 266.3663 4.959316  47.33876       1.760251      46.47077       2.680611      47.99678       2.333973      263.5474 7.641178  268.0717 6.533883  -4.524261      10.05382  
1 1 1 1  21 2  o 500.7059 6.070405  167.3943       4.050176      171.6299       6.225528      164.2860       5.333097      506.2904 9.227901  495.6269 8.075160  10.66354       12.26223  
1 1 1 1  21 3  o 131.9391 7.469668  11.67371       1.307889      12.43900       1.666923      10.44805       2.109544      135.9808 9.254656  123.9513 12.96363  12.02952       15.92810  
1 1 1 1  21 4  o 295.5730 6.525908  58.35973       2.570273      57.26669       3.139581      60.58109       4.475738      292.4804 8.063358  300.1751 11.20934  -7.694641      13.80822  
1 1 1 1  21 5  o 158.6697 6.818936  16.85474       1.438365      16.46617       1.627984      18.23738       3.070919      156.7071 7.821005  163.7957 14.21041  -7.088577      16.22048  
1 1 1 1  21 6  o 423.9928 7.421292  120.2169       4.192871      117.7487       5.794340      122.9298       6.074831      418.8792 10.38106  427.9137 10.65380  -9.034515      14.87514  
1 1 1 1  21 7  o 142.0570 8.591570  13.56417       1.618728      17.08097       2.251184      9.799183       2.329266      159.1246 10.67879  119.4464 14.96163  39.67818       18.38170  
1 1 1 1  21 8  o 289.3086 6.465228  55.94100       2.492405      57.13299       3.383871      54.52748       3.684928      291.8743 8.710250  284.9054 9.720559  6.968842       13.05212  
1 1 1 1  21 9  o 182.7659 0.8286856 22.25656       0.2018174     22.14985       1.650517      22.25818       0.2033432     181.8642 6.822917  182.7725 0.8349209 -0.9082642     6.873811  
1 1 1 1  21 10 o 230.0183 3.944233  35.29833       1.208923      32.13587       2.017280      37.07058       1.510140      219.0582 6.919559  235.6446 4.809347  -16.58643      8.426749  
1 1 1 1  21 11 o 107.8626 4.913535  7.784983       0.7043630     8.013471       0.7455494     5.886710       2.148945      109.4166 5.127780  91.06614 18.34395  18.35048       19.04717  
1 1 1 1  21 12 o 256.6135 5.884245  44.02624       2.012074      42.97313       2.305758      47.38840       4.119879      253.2811 6.838090  264.6279 11.71258  -11.34680      13.56260  
1 1 1 1  21 13 o 274.7405 6.535345  50.52233       2.392570      52.22160       2.679504      43.83849       5.314166      279.0922 7.211028  252.6501 15.86500  26.44212       17.42691  
1 1 1 1  21 14 o 239.3447 8.141064  38.50631       2.592662      38.76252       3.022472      37.79275       5.044172      239.7665 9.478880  234.0591 16.27437  5.707367       18.83360  
1 1 1 1  21 15 o 292.8416 5.968453  57.39882       2.328993      61.05737       3.279428      53.67590       3.308146      301.3184 8.175239  282.2930 8.805265  19.02536       12.01529  
1 1 1 1  21 16 f 81.80824 7.093293  4.524565       0.7656136     4.138980       1.681188      4.625454       0.8599628     75.83437 17.05217  82.57816 7.911875  -6.743790      18.79825  
1 1 1 1  21 17 o 146.2623 7.124312  14.40807       1.384333      12.97683       2.163141      15.40083       1.801568      137.4436 11.92902  150.7520 9.009485  -13.30838      14.94899  
1 1 1 1  21 18 o 134.3354 9.433397  12.29141       1.677886      13.56110       2.226569      10.62286       2.552453      140.2048 12.03420  122.3187 16.04658  17.88607       20.05779  
1 1 1 1  21 19 f 93.65546 7.962651  5.971854       0.9843080     5.425231       1.108912      8.002358       2.137249      88.82085 9.517563  105.6517 15.65409  -16.83083      18.32033  
1 1 1 1  21 20 o 58.68947 7.048903  2.358940       0.5402393     2.178456       0.5562548     5.358544       2.267702      56.23676 7.618787  83.34871 20.55004  -27.11195      21.91689  
1 1 1 1  21 21 o 78.27383 10.17948  4.288410       1.036607      6.555302       2.538029      3.834547       1.135647      90.92675 21.31972  73.25358 12.05317  17.67317       24.49101  
1 1 1 1  21 22 o 58.63079 7.160581  2.371061       0.5478383     4.913235       0.8352789     0.4519385      0.7257388     84.59111 7.487502  30.94843 12.11465  53.64268       14.24175  
1 1 1 1  21 23 o 39.77375 11.66606  1.151513       0.6583620     0.9284231      0.7549708     1.859700       1.345130      36.91843 12.69314  49.85713 16.94793  -12.93871      21.17423  
1 1 1 1  21 24 f 35.12488 13.47510  0.7103009      0.8843226     -0.3699792     2.233394      0.9111574      0.9630310     40.95849 18.64183  37.92168 14.17132  3.036812       23.41675  
1 1 1 1  21 25 o 27.94897 12.74053  -0.4315698     1.048353      2.110939       3.392367      -0.7000199     1.102309      56.03087 24.36343  27.26056 12.65511  28.77031       27.45412  
1 1 1 1  21 26 o 27.32915 10.50568  0.4039330      0.5382704     0.9034560      1.462158      0.3256235      0.5789269     40.71243 16.74961  26.88203 10.72604  13.83040       19.88963  
1 1 1 1  21 27 o 61.71687 20.95208  3.631227       2.055749      1.452056       2.584944      7.381237       3.390953      48.43299 21.15998  79.30107 26.90949  -30.86808      34.23252  
1 1 1 1  22 0  o 143.8128 8.339408  13.95372       1.585706      13.95372       1.585706      13.95372       1.585706      143.8128 8.339408  143.8128 8.339408  0.000000       0.000000  
1 1 1 1  22 1  o 331.5193 4.819028  73.35393       2.128834      73.00919       2.814011      73.81525       3.255201      330.5198 6.389322  332.1732 7.354271  -1.653442      9.742111  
1 1 1 1  22 2  o 83.64528 8.072108  4.727572       0.8885451     4.547319       1.358183      4.862445       1.174846      81.11719 13.00452  84.40782 10.68438  -3.290634      16.83073  
1 1 1 1  22 3  o 274.4637 5.995086  50.33050       2.192572      51.69514       3.006093      48.77931       3.204985      277.7162 8.131968  269.5957 8.933872  8.120544       12.08069  
1 1 1 1  22 4  o 123.3525 6.526992  10.20048       1.069021      11.03042       1.331379      8.694433       1.793489      128.1181 7.836100  112.9503 12.10478  15.16781       14.41979  
1 1 1 1  22 5  o 160.2744 6.387836  17.19957       1.361510      14.91152       1.672830      21.68943       2.343346      148.9257 8.464489  179.4471 9.837645  -30.52141      12.97794  
1 1 1 1  22 6  o 171.9453 10.55298  19.96044       2.406257      23.72284       3.322123      15.80817       3.490003      186.7811 13.43760  151.0648 17.67112  35.71629       22.19994  
1 1 1 1  22 7  o 202.7097 6.603211  27.51428       1.781244      26.91851       2.652862      28.00338       2.403655      199.8592 9.993022  204.1020 8.859043  -4.242798      13.35452  
1 1 1 1  22 8  o 376.3864 7.084754  94.83681       3.553303      94.33558       4.965230      95.36298       5.087249      374.3952 9.961428  376.3567 10.15329  -1.961426      14.22390  
1 1 1 1  22 9  o 93.23844 1.043493  5.792698       0.1296457     3.507639       2.136398      5.801144       0.1298851     70.45351 21.10457  93.30638 1.044659  -22.85287      21.13041  
1 1 1 1  22 10 o 223.3931 4.829833  33.33120       1.437723      31.77144       2.064403      34.80023       2.003462      217.6744 7.126880  227.9255 6.603477  -10.25110      9.715880  
1 1 1 1  22 11 o 210.1154 1.072910  29.41816       0.3003964     29.42699       0.3021536     28.66557       2.789434      210.1468 1.079025  205.9816 10.19449  4.165161       10.25144  
1 1 1 1  22 12 o 173.1841 4.199831  20.02570       0.9691997     20.11984       1.018260      19.11870       3.160510      173.5164 4.407541  166.7540 14.36337  6.762405       15.02440  
1 1 1 1  22 13 o 174.9574 7.194489  20.56845       1.673702      21.51015       1.941461      17.84326       3.302713      178.7064 8.174606  160.3736 15.65389  18.33272       17.65979  
1 1 1 1  22 14 o 79.33898 17.82236  4.549429       1.838059      5.877262       3.040775      3.784920       2.307300      88.50607 24.79728  72.27217 21.99436  16.23389       33.14599  
1 1 1 1  22 15 o 38.67542 15.76615  0.4592299      1.280652      1.047389       1.749898      -0.2190914     1.879243      47.77243 18.77839  41.23519 18.02801  6.537239       26.03146  
1 1 1 1  22 16 o 65.46421 9.857412  2.969942       0.8332337     2.734603       1.178839      3.204907       1.177902      61.63324 14.58284  67.03825 13.65041  -5.405014      19.97481  
1 1 1 1  22 17 o 134.0791 5.800397  12.09114       1.033865      12.04166       2.113621      12.10670       1.185349      131.7304 12.17899  133.9656 6.661066  -2.235168      13.88155  
1 1 1 1  22 18 o 53.98291 16.76921  2.105755       1.332804      1.690845       1.837843      2.566026       1.935701      52.31721 19.57165  59.78559 20.33065  -7.468388      28.22029  
1 1 1 1  22 19 o 78.66517 13.32404  4.453266       1.346862      4.570755       1.466850      3.821975       3.400165      79.24447 14.42247  70.86110 26.59770  8.383369       30.25632  
1 1 1 1  22 20 o 35.01353 13.83807  0.5668518      0.9548756     0.7414836      1.246426      0.3187538      1.485650      39.58147 15.75647  38.85920 16.49413  0.7222748      22.81059  
1 1 1 1  22 21 o 103.9251 10.09598  7.586648       1.380516      6.435481       2.062940      8.520273       1.857820      91.06411 17.63793  108.3429 13.13658  -17.27882      21.99241  
1 1 1 1  22 22 o 45.97285 8.931746  1.511502       0.5274342     1.580886       0.5538173     0.8348805      1.729454      46.96176 9.179275  43.40564 18.06945  3.556118       20.26731  
1 1 1 1  22 23 o 25.60174 10.49875  0.2093794      0.5720644     -0.6310809E-01 0.6118100     2.104522       1.613482      23.51687 10.28389  51.96061 18.50541  -28.44374      21.17093  
1 1 1 1  22 24 o 18.20577 8.917279  -1.314603      0.7294020     -1.257839      0.7770352     -1.735467      2.115813      19.32598 9.408556  34.64585 16.51961  -15.31988      19.01101  
1 1 1 1  22 25 o 64.90467 5.300345  2.883066       0.4544212     1.014258       0.8092270     3.743792       0.5491872     37.58492 13.12970  73.89964 5.619175  -36.31472      14.28160  
1 1 1 1  22 26 o 81.18324 6.866167  4.588646       0.7358113     0.1173540      1.990619      5.296257       0.7918972     39.46016 17.81559  87.25437 6.866242  -47.79421      19.09295  
1 1 1 1  23 0  o 219.8757 6.984680  32.38256       2.041750      32.38256       2.041750      32.38256       2.041750      219.8757 6.984680  219.8757 6.984680  0.000000       0.000000  
1 1 1 1  23 1  o 215.1938 5.261158  30.93520       1.508637      34.92411       2.482155      28.59841       1.899818      228.0766 8.180476  206.5947 6.910842  21.48189       10.70887  
1 1 1 1  23 2  o 203.8713 5.650792  27.79861       1.533627      28.00933       2.123027      27.56865       2.217832      204.2876 7.813421  202.5904 8.232689  1.697174       11.35019  
1 1 1 1  23 3  o 96.29266 9.634962  6.294291       1.219694      6.526169       1.762400      6.081146       1.689710      97.10033 14.02712  93.68437 13.96113  3.415955       19.79074  
1 1 1 1  23 4  o 271.8534 5.788558  49.40407       2.096905      44.37063       2.738993      56.53178       3.259370      257.1204 8.004056  290.1399 8.439455  -33.01950      11.63139  
1 1 1 1  23 5  o 173.8503 6.103620  20.23838       1.411764      18.84974       1.790216      22.52230       2.295898      167.4584 8.046328  182.7857 9.458372  -15.32735      12.41790  
1 1 1 1  23 6  o 243.2705 8.595769  39.78600       2.782048      37.64176       3.389633      44.21180       4.869810      235.9998 10.80741  254.4358 14.42256  -18.43594      18.02250  
1 1 1 1  23 7  o 187.2857 6.727013  23.51577       1.676078      21.77355       2.757779      24.53624       2.110617      179.0926 11.61873  191.0021 8.312639  -11.90944      14.28618  
1 1 1 1  23 8  o 140.8181 9.179023  13.39508       1.712990      10.53844       2.840276      15.02816       2.147518      122.3637 17.95313  148.7850 10.90769  -26.42131      21.00696  
1 1 1 1  23 9  o 141.5549 5.269917  13.41416       0.9923007     10.15663       2.648347      13.94617       1.070268      120.3036 16.99312  144.2978 5.576704  -23.99422      17.88480  
1 1 1 1  23 10 f 91.48882 1.428140  5.578229       0.1741055     7.677204       0.9287441     5.501779       0.1772478     106.8448 6.554875  90.85911 1.463992  15.98573       6.716373  
1 1 1 1  23 11 o 187.3845 1.973780  23.40743       0.4928401     22.57534       0.6408631     24.61177       0.7710046     183.9851 2.614022  192.0733 3.012426  -8.088272      3.988461  
1 1 1 1  23 12 o 121.1673 4.090160  9.818708       0.6594413     9.798230       0.6702386     10.43897       3.688712      121.0326 4.161981  118.0606 24.25926  2.971992       24.61370  
1 1 1 1  23 13 o 133.4466 3.196830  11.88632       0.5684610     11.83394       0.5765027     13.72450       3.415329      133.1483 3.249318  138.0907 19.06917  -4.942459      19.34402  
1 1 1 1  23 14 o 116.0641 8.798923  9.164792       1.350683      8.199884       1.477027      14.09202       3.337698      109.3355 10.25784  139.8175 18.35785  -30.48206      21.02936  
1 1 1 1  23 15 o 152.3329 6.556137  15.64234       1.327692      14.98672       1.478428      18.37463       3.018114      148.8396 7.478276  161.8415 14.13674  -13.00186      15.99288  
1 1 1 1  23 16 o 73.95502 16.00980  4.021099       1.531888      3.819285       1.897656      4.398638       2.595517      70.95403 19.48038  75.10531 23.41260  -4.151276      30.45710  
1 1 1 1  23 17 f 187.1258 5.495990  23.56850       1.368933      25.55352       2.264004      22.42453       1.718707      193.3357 8.811191  181.9058 7.104239  11.42987       11.31845  
1 1 1 1  23 18 o 55.20560 11.15209  2.190005       0.7921025     1.556028       2.644584      2.252485       0.8302174     54.84715 22.54135  55.88534 11.53130  -1.038197      25.31962  
1 1 1 1  23 19 o 53.10426 17.63577  2.115563       1.457080      0.9611432E-02  2.431824      3.295060       1.819937      45.27566 20.11939  64.29140 19.52737  -19.01575      28.03762  
1 1 1 1  23 20 o 79.43380 11.92960  4.576114       1.223736      4.095166       1.453436      5.747325       2.268111      73.17215 15.39497  83.16095 20.58038  -9.988800      25.70131  
1 1 1 1  23 21 o 46.92529 15.29617  1.660176       1.098047      0.7033667      1.448476      2.952940       1.683674      40.15925 16.61121  60.00288 18.87902  -19.84363      25.14657  
1 1 1 1  23 22 o 96.43415 8.113528  6.484190       1.032931      6.531199       1.190886      6.341399       2.075511      96.05372 9.425508  88.01638 18.29425  8.037338       20.57960  
1 1 1 1  23 23 o 68.40262 6.729505  3.241621       0.6054462     2.984239       0.6429579     5.256300       1.798858      65.29326 7.527562  79.95828 17.38048  -14.66502      18.94057  
1 1 1 1  23 24 o 51.67857 5.787569  1.845727       0.3917098     1.805934       0.4010528     2.670054       1.825370      51.04038 6.011960  55.10226 19.67662  -4.061882      20.57458  
1 1 1 1  23 25 o 53.98568 3.109244  1.963433       0.2227234     1.780096       0.2276159     6.091116       1.080018      51.34926 3.344760  92.33900 8.887165  -40.98974      9.495742  
1 1 1 1  24 0  o 270.1448 7.613300  48.90314       2.735662      48.90314       2.735662      48.90314       2.735662      270.1448 7.613300  270.1448 7.613300  0.000000       0.000000  
1 1 1 1  24 1  o 247.7828 5.081181  41.03034       1.677680      42.31162       2.405578      39.81700       2.340939      251.1381 7.195836  243.6107 7.219377  7.527435       10.19311  
1 1 1 1  24 2  o 116.4513 6.573234  9.109976       1.015851      7.986272       1.451396      10.18909       1.422308      108.3607 10.17061  122.8039 8.749073  -14.44316      13.41595  
1 1 1 1  24 3  o 394.6331 6.988233  104.3750       3.674805      103.3342       5.271166      105.3592       5.125802      391.2733 10.11854  395.3984 9.728668  -4.125122      14.03680  
1 1 1 1  24 4  f 258.3183 6.304936  44.67858       2.170248      44.58633       2.863551      44.80308       3.326633      257.4395 8.358573  257.6333 9.707489  -0.1937866     12.81019  
1 1 1 1  24 5  o 209.4600 6.417609  29.41364       1.789103      26.74915       2.220834      34.34008       3.019783      199.2972 8.381309  225.3373 10.08255  -26.04008      13.11122  
1 1 1 1  24 6  o 44.07180 16.93146  0.9466882      1.397518      -1.435405      2.273178      2.394093       1.771940      40.41711 18.55049  59.25807 19.43816  -18.84096      26.86936  
1 1 1 1  24 7  o 158.3279 8.477318  16.91924       1.781981      15.61764       3.292957      17.45825       2.119068      149.2882 16.84733  160.4489 9.960508  -11.16078      19.57152  
1 1 1 1  24 8  o 91.72519 14.50951  5.911026       1.714508      6.737308       2.381694      5.022276       2.470081      96.41276 19.21346  82.35932 22.06426  14.05344       29.25728  
1 1 1 1  24 9  o 104.9794 8.102276  7.464367       1.124639      4.137835       2.873519      8.066092       1.222130      75.48554 24.75313  109.0708 8.475290  -33.58529      26.16387  
1 1 1 1  24 10 o 267.8180 7.905735  48.36385       2.818253      46.81021       4.281756      49.55141       3.743480      261.2602 12.33397  269.9080 10.42807  -8.647766      16.15152  
1 1 1 1  24 11 o 46.57438 6.364266  1.483091       0.3846532     1.538023       0.3916403     -0.1535665E-01 2.045479      47.44587 6.354239  43.81488 18.98585  3.630989       20.02096  
1 1 1 1  24 12 o 194.1574 6.210465  25.35463       1.604695      24.54666       1.955848      27.01868       2.806865      190.5472 7.718960  198.6502 10.64259  -8.102997      13.14713  
1 1 1 1  24 13 o 85.51177 8.414341  5.002038       0.9463752     5.255336       0.9991693     2.793353       2.950456      87.59982 8.673521  65.19164 24.70862  22.40817       26.18675  
1 1 1 1  24 14 o 131.5378 10.25103  11.93231       1.782588      11.36590       2.065290      13.58687       3.529853      127.4107 12.31815  134.2149 20.37658  -6.804153      23.81054  
1 1 1 1  24 15 o 153.5305 7.757243  16.04570       1.581853      15.64242       1.834096      17.21685       3.125521      150.9540 9.161222  154.4068 15.39585  -3.452866      17.91536  
1 1 1 1  24 16 o 78.19741 10.17120  4.290981       1.034745      4.068737       1.070980      7.409615       4.011886      75.83141 10.91266  89.89407 29.23340  -14.06266      31.20381  
1 1 1 1  24 17 o 42.99128 17.45563  0.8605525      1.562405      3.104188       2.113834      -1.841204      2.319625      62.49367 21.24562  37.50668 17.71135  24.98700       27.65986  
1 1 1 1  24 18 o 84.79201 8.485219  5.000443       0.9458539     5.238743       3.247849      4.978360       0.9887098     75.22372 26.30197  84.41756 8.924418  -9.193848      27.77479  
1 1 1 1  24 19 o 37.64111 13.68718  0.9242685      0.8880160     1.837024       1.765293      0.6150457      1.027485      50.59061 19.12641  35.69154 14.27322  14.89907       23.86513  
1 1 1 1  24 20 o 46.05083 17.71799  1.432863       1.531953      2.136023       1.680102      -2.035009      3.731128      52.35269 18.85542  45.79638 21.86420  6.556309       28.87161  
1 1 1 1  24 21 o 65.26791 14.82912  3.337209       1.260275      4.651974       1.829443      2.149746       1.738621      74.46059 18.51613  51.99692 19.11279  22.46367       26.61102  
1 1 1 1  24 22 f 34.42215 14.91781  0.2295969      1.263177      1.346988       1.540590      -2.062670      2.206566      44.46257 17.57562  34.15662 16.43989  10.30595       24.06600  
1 1 1 1  24 23 o 24.21152 11.46456  -0.9074984     0.9845118     -0.5870087     1.238576      -1.457490      1.622533      29.26451 13.52562  30.13909 14.39705  -0.8745842     19.75393  
1 1 1 1  25 0  o 232.6989 8.661423  36.44030       2.677240      36.44030       2.677240      36.44030       2.677240      232.6989 8.661423  232.6989 8.661423  0.000000       0.000000  
1 1 1 1  25 1  o 201.2977 5.379261  27.14108       1.441603      27.10900       2.034851      27.17341       2.042640      200.6441 7.624714  200.8770 7.645069  -0.2329102     10.79738  
1 1 1 1  25 2  o 256.9624 5.728701  44.22622       1.961550      42.38253       2.679441      46.35543       2.879445      250.7883 8.028295  262.2078 8.251456  -11.41953      11.51260  
1 1 1 1  25 3  o 208.5611 7.644214  29.29911       2.120822      30.85401       3.880252      28.63672       2.532583      211.4564 13.84719  205.6635 9.265085  5.792847       16.66093  
1 1 1 1  25 4  o 35.51023 14.76118  0.2594427      1.151743      -1.210721      1.389662      3.484758       2.058318      30.22347 14.09072  69.14574 20.71590  -38.92226      25.05388  
1 1 1 1  25 5  o 50.41642 17.94131  1.598366       1.516332      -10.39320      4.005557      3.604282       1.638254      37.53497 18.80207  70.32448 17.54171  -32.78951      25.71438  
1 1 1 1  25 6  o 75.69765 15.70910  4.125362       1.532602      3.434751       2.524549      4.528434       1.928671      69.25100 23.21844  78.45880 18.71145  -9.207802      29.81970  
1 1 1 1  25 7  o 43.76755 17.55672  0.7654340      1.559536      1.512603       2.624022      0.3573748      1.939187      56.86138 22.78568  44.79070 18.92029  12.07068       29.61697  
1 1 1 1  25 8  o 80.62288 17.41226  4.763447       1.815835      4.984228       2.074704      4.040640       3.753939      81.80302 19.34005  75.58573 28.03074  6.217285       34.05525  
1 1 1 1  25 9  o 212.9498 7.593456  30.65157       2.151268      31.99508       3.205909      29.55106       2.901518      215.7867 11.18764  207.7289 10.51647  8.057831       15.35446  
1 1 1 1  25 10 o 116.3407 1.047168  9.020428       0.1623385     8.486538       2.571179      9.022565       0.1626631     107.0504 18.70529  116.3544 1.049138  -9.304031      18.73469  
1 1 1 1  25 11 o 178.9941 4.114125  21.44670       0.9812726     19.89467       1.574130      22.43314       1.254947      171.5357 6.900808  182.7484 5.158617  -11.21271      8.615827  
1 1 1 1  25 12 o 59.90297 6.048722  2.441522       0.4762135     2.715316       0.4983451     -0.4372567     1.615928      63.21616 5.987365  36.30730 16.24932  26.90886       17.31730  
1 1 1 1  25 13 o 23.62304 10.83296  -0.4905058     0.7729123     -0.7501175     0.8853027     0.3416690      1.585028      24.11207 11.24321  40.19383 17.04777  -16.08176      20.42146  
1 1 1 1  25 14 o 71.54091 12.22920  3.691335       1.123952      3.814902       1.555747      3.556429       1.625568      70.65043 16.77672  67.74672 17.78467  2.903709       24.44898  
1 1 1 1  25 15 o 85.92834 15.74742  5.571916       1.736671      5.621427       1.830548      5.126008       5.493556      85.76835 16.61723  75.17734 31.80500  10.59101       35.88440  
1 1 1 1  25 16 o 101.4133 9.359479  7.197114       1.250533      6.490219       1.328262      12.71217       3.710062      95.62299 10.60227  121.5817 23.75236  -25.95872      26.01120  
1 1 1 1  25 17 o 102.4136 6.648899  7.179813       0.9024581     8.222317       1.467375      6.545609       1.144503      107.6563 10.35652  96.70570 8.984351  10.95058       13.71043  
1 1 1 1  25 18 o 36.19158 16.99512  -1.295946      2.083132      -1.537607      4.014930      -1.206926      2.436790      48.54768 23.03601  39.54026 18.50782  9.007427       29.54991  
1 1 1 1  25 19 o 49.82011 17.55737  1.933555       1.449157      -1.740376      5.325332      2.227376       1.505991      52.59158 25.36970  52.63290 17.93201  -0.4131317E-01 31.06733  
1 1 1 1  25 20 o 25.88079 12.75533  -2.774176      1.568274      1.593028       4.357789      -3.423935      1.680895      55.63490 25.58987  25.63882 12.73678  29.99607       28.58438  
1 1 1 1  25 21 o 46.60859 18.35788  1.592121       1.675360      -0.2172672     5.658846      1.765953       1.753993      53.69453 25.96307  48.12597 18.83515  5.568569       32.07560  
1 1 1 1  26 0  o 16.94356 12.32050  -3.345480      1.575994      -3.345480      1.575994      -3.345480      1.575994      16.94356 12.32050  16.94356 12.32050  0.000000       0.000000  
1 1 1 1  26 1  o 95.26128 9.206231  6.215917       1.154071      6.438111       2.035538      6.110660       1.401007      94.14970 16.84348  93.75426 11.45179  0.3954315      20.36778  
1 1 1 1  26 2  o 158.9633 6.963660  17.05527       1.471475      15.31888       2.208138      18.44229       1.973530      149.1138 11.19482  164.6020 9.032394  -15.48825      14.38430  
1 1 1 1  26 3  o 122.6051 10.72314  10.35811       1.734264      11.25719       2.437535      9.436414       2.467988      126.0470 14.79383  114.3577 16.68739  11.68930       22.30081  
1 1 1 1  26 4  f 58.74181 17.62191  2.521378       1.488669      2.210108       2.028010      2.885072       2.192148      57.52929 20.71638  63.34758 21.63368  -5.818295      29.95304  
1 1 1 1  26 5  o 70.57015 17.61668  3.710026       1.651353      3.652906       2.348918      3.765846       2.322045      69.49720 22.34942  70.38555 22.17445  -0.8883514     31.48338  
1 1 1 1  26 6  o 79.00736 16.47122  4.597968       1.677801      0.9383957      2.952068      6.344119       2.039163      55.01639 23.29700  92.84261 17.11316  -37.82621      28.90693  
1 1 1 1  26 7  f 48.39397 18.61967  1.319197       1.691855      0.1628991      2.981242      1.868495       2.054784      51.59824 22.62881  54.65278 20.64120  -3.054543      30.62878  
1 1 1 1  26 8  o 66.39436 22.73244  3.345138       2.420814      4.175476       4.234657      2.942051       2.950465      74.60045 29.24550  64.95750 24.68800  9.642944       38.27266  
1 1 1 1  26 9  o 163.8844 9.468884  18.47767       2.059003      19.01165       2.940881      17.96426       2.883699      163.5439 13.61837  158.8472 13.75931  4.696732       19.35920  
1 1 1 1  26 10 o 45.63305 5.709684  1.424604       0.3396105     0.4538171      0.5525252     2.014058       0.4305415     28.77885 10.73822  54.30377 6.052693  -25.52492      12.32657  
1 1 1 1  26 11 o 71.41718 5.722343  3.463024       0.5400123     3.437238       0.5861788     3.607652       1.388238      71.01959 6.258051  69.26508 15.43580  1.754517       16.65614  
1 1 1 1  26 12 o 161.1177 1.200867  17.30610       0.2578171     17.35180       0.2592640     13.24625       2.443738      161.3299 1.206018  135.0786 13.76902  26.25125       13.82174  
1 1 1 1  26 13 o 106.9527 9.208072  7.974713       1.299538      8.273027       1.424146      6.490317       3.176818      108.5481 9.956787  84.19481 25.84404  24.35330       27.69570  
1 1 1 1  26 14 o 37.42994 14.52505  0.7790997      1.036046      1.263657       1.220202      -0.4726918     1.961215      43.43641 16.00390  38.64290 17.54122  4.793503       23.74488  
1 1 1 1  26 15 o 92.03729 8.635310  5.914783       1.046677      5.464300       1.177321      7.613344       2.286105      87.61028 10.28011  97.63197 18.24301  -10.02169      20.94011  
1 1 1 1  26 16 o 82.87558 12.38611  5.059114       1.325938      5.366776       1.540917      4.181474       2.602565      84.17013 14.24650  67.65997 23.55197  16.51016       27.52559  
1 1 1 1  26 17 o 90.84167 7.155741  5.706769       0.8592010     4.333541       1.571413      6.292377       1.026178      73.57097 16.44328  94.88661 8.196315  -21.31564      18.37283  
1 1 1 1  26 18 o 55.57189 14.46236  2.435798       1.081115      3.612310       1.394585      0.6638649      1.711474      66.98006 15.87007  41.11680 17.58557  25.86326       23.68779  
1 1 1 1  26 19 o 48.40413 18.28177  1.830721       1.611907      0.4449474      2.779005      2.533325       1.978783      46.04522 20.89313  54.25798 20.30609  -8.212765      29.13521  
1 1 1 1  27 0  o 36.39450 21.64720  1.148905       1.836287      1.148905       1.836287      1.148905       1.836287      36.39450 21.64720  36.39450 21.64720  0.000000       0.000000  
1 1 1 1  27 1  f 29.01162 13.05241  -0.4056229     1.057805      -0.8864956     1.950046      -0.2051284     1.259160      37.85192 17.30112  33.10538 14.60549  4.746544       22.64176  
1 1 1 1  27 2  o 112.9369 8.875406  8.769411       1.324940      11.30797       2.146911      7.207839       1.683842      126.2612 12.94363  100.6112 12.85286  25.64996       18.24098  
1 1 1 1  27 3  o 56.68662 18.09285  2.393544       1.541531      2.724391       1.781296      1.406719       3.076395      60.06382 19.47528  56.77655 23.89869  3.287266       30.82911  
1 1 1 1  27 4  o 136.7285 11.53701  13.11556       2.082371      12.70668       2.545400      13.94301       3.620964      132.5731 14.65303  133.7929 21.00124  -1.219833      25.60788  
1 1 1 1  27 5  o 105.0503 12.60266  7.867768       1.728963      10.69494       2.298781      4.185408       2.623520      121.4745 14.48682  71.60866 23.66016  49.86588       27.74294  
1 1 1 1  27 6  o 67.13710 16.96687  3.451527       1.518305      2.119701       2.196575      4.670007       2.101026      55.88501 21.28699  76.48306 20.28581  -20.59805      29.40493  
1 1 1 1  27 7  o 107.7067 16.09282  8.658311       2.238942      8.015520       3.166004      9.301375       3.166680      96.89732 24.50771  106.0393 23.06879  -9.141991      33.65704  
1 1 1 1  27 8  o 38.67251 18.28973  -1.969546      2.491211      -1.910367      3.771239      -2.015362      3.318278      48.31963 22.74544  45.07490 21.25424  3.244724       31.13033  
1 1 1 1  27 9  o 148.2835 14.15085  16.07891       2.762206      11.78635       4.679752      18.37397       3.421861      108.7072 30.86949  155.9269 16.73034  -47.21973      35.11167  
1 1 1 1  27 10 o 16.66021 7.084057  0.1095432E-01  0.2748744     0.3983529      0.5900013     -0.9644152E-01 0.3106474     28.34762 10.97191  16.25901 7.209875  12.08861       13.12879  
1 1 1 1  27 11 o 40.62534 16.40972  0.8134295      1.372657      -3.685878      3.233275      1.802654       1.516063      39.80988 19.33769  49.72642 17.91107  -9.916538      26.35816  
1 1 1 1  27 12 o 88.32477 1.916943  5.207780       0.2256136     5.289663       0.2282506     1.725238       1.488553      89.01578 1.924294  48.74978 17.72173  40.26600       17.82590  
1 1 1 1  27 13 f 36.82001 7.277584  0.9600710      0.3444003     0.9300559      0.3493934     1.987785       2.044472      36.17382 7.495068  52.38398 20.38288  -16.21016      21.71723  
1 1 1 1  27 14 o 69.53204 16.15688  3.837411       1.468374      3.462993       1.733606      4.787985       2.762264      64.21162 18.95660  71.02630 24.28373  -6.814674      30.80669  
1 1 1 1  27 15 o 58.52849 19.67364  2.928604       1.812447      2.163097       2.405949      3.933012       2.755922      53.49299 21.68255  64.41263 23.99245  -10.91964      32.33838  
1 1 1 1  27 16 o 43.14970 16.36195  1.305400       1.294144      1.288586       1.547293      1.344548       2.361010      44.23151 17.57241  48.38485 20.67342  -4.153332      27.13264  
1 1 1 1  27 17 o 86.03478 7.407000  5.162161       0.8409020     5.864374       1.764892      4.955930       0.9564446     85.31519 16.11498  83.58142 8.715600  1.733765       18.32087  
1 1 1 1  28 0  o 35.82431 21.62418  1.116856       1.885839      1.116856       1.885839      1.116856       1.885839      35.82431 21.62418  35.82431 21.62418  0.000000       0.000000  
1 1 1 1  28 1  f 26.01555 12.70414  -2.385362      1.447706      -1.374144      1.916214      -3.730119      2.209751      34.90979 16.36350  31.27916 15.36152  3.630630       22.44417  
1 1 1 1  28 2  o 56.42987 11.18510  2.309323       0.8113197     2.147645       1.630292      2.362545       0.9353722     53.50388 18.63956  56.51181 12.72828  -3.007935      22.57083  
1 1 1 1  28 3  o 43.70700 16.11766  1.257445       1.238065      2.320354       1.398519      -2.593725      2.662053      54.86348 17.19836  38.16531 18.28752  16.69817       25.10412  
1 1 1 1  28 4  o 118.5321 11.92443  10.06582       1.857855      10.41043       2.050022      8.481880       4.395008      119.7477 13.05884  90.62506 30.63632  29.12261       33.30341  
1 1 1 1  28 5  f 77.45240 26.55368  5.607717       3.303346      4.868495       5.155356      6.122633       4.302682      72.53772 30.75479  78.12331 29.78434  -5.585587      42.81313  
1 1 1 1  28 6  o 49.44648 20.67587  1.215623       2.279217      -2.328689      3.180452      4.957582       3.267928      42.61613 20.30141  73.18990 26.30489  -30.57377      33.22792  
1 1 1 1  28 7  o 38.28830 16.85364  0.3497736E-01  1.667694      -3.270539      3.828907      0.8088692      1.852658      44.58854 21.50981  44.27127 18.58502  0.3172722      28.42666  
1 1 1 1  28 8  o 54.43023 22.81940  1.790324       2.787330      -1.298533      4.808935      3.353033       3.420496      53.43855 25.31405  63.67974 25.83789  -10.24119      36.17178  
1 1 1 1  28 9  o 48.19440 20.11633  1.215960       2.151794      0.9406694      2.677332      1.718211       3.616318      49.66173 21.61840  56.77894 24.91116  -7.117210      32.98365  
1 1 1 1  28 10 o 46.14584 5.737052  1.466296       0.3451771     1.961120       0.6142571     1.237927       0.4172956     52.36020 9.136024  41.77592 7.782530  10.58428       12.00145  
1 1 1 1  28 11 o 61.46079 3.984539  2.551301       0.3245657     2.941500       0.6481925     2.420732       0.3749574     64.90817 7.640488  59.68830 4.753565  5.219872       8.998524  
1 1 1 1  28 12 o 81.11600 5.066328  4.472648       0.5448782     4.487082       0.5544284     4.064458       2.948364      81.22080 5.149278  65.05119 24.68958  16.16962       25.22083  
1 1 1 1  28 13 o 53.58902 7.316379  2.014767       0.5088218     2.055765       0.5454837     1.740161       1.411747      53.95621 7.814149  47.60566 17.26530  6.350559       18.95130  
1 1 1 1  28 14 o 42.79636 16.05977  1.300811       1.239468      1.178797       1.394669      1.759319       2.703588      42.50724 16.74740  51.51968 22.07019  -9.012444      27.70503  
1 1 1 1  29 0  o 19.84874 13.83609  -1.086814      1.321756      -1.086814      1.321756      -1.086814      1.321756      19.84874 13.83609  19.84874 13.83609  0.000000       0.000000  
1 1 1 1  29 1  o 76.99477 16.31310  4.639087       1.621574      4.499562       2.508639      4.739224       2.125255      70.85239 23.12182  74.57233 20.67099  -3.719933      31.01465  
1 1 1 1  29 2  f 50.86696 12.53670  1.939870       0.8442113     2.650560       2.703920      1.863110       0.8886335     58.35887 23.21509  49.64944 13.20398  8.709431       26.70740  
1 1 1 1  29 3  o 48.48384 19.75257  1.409836       2.008673      1.021869       2.520053      2.085752       3.326284      49.06968 21.16770  57.10501 24.47190  -8.035339      32.35653  
1 1 1 1  29 4  o 83.03926 14.02910  5.199385       1.497098      5.236019       1.563073      4.792703       5.207949      82.88900 14.68940  69.38285 30.17790  13.50615       33.56313  
1 1 1 1  29 5  o 42.94268 19.02042  0.2504284      2.155833      -2.173669      4.658715      0.9109738      2.431881      50.05157 24.03794  47.79877 20.70690  2.252796       31.72693  
1 1 1 1  29 6  o 48.88502 19.33754  1.631061       1.866173      1.725270       2.201004      1.390140       3.519763      50.83475 20.68921  54.32022 24.16785  -3.485470      31.81397  
1 1 1 1  29 7  o 47.43623 19.00035  1.472407       1.823756      0.3014719      2.621367      2.570886       2.538968      45.85706 20.59615  56.54197 22.49469  -10.68492      30.49938  
1 1 1 1  29 8  o 35.08289 16.10436  -0.5738384     1.713991      -1.098978      2.443021      -0.6478374E-01 2.405316      39.44488 18.48515  42.85157 19.44151  -3.406689      26.82673  
1 1 1 1  29 9  o 40.07813 12.69681  1.193960       0.7603297     1.075912       0.8020393     2.241194       2.388845      38.59778 13.08717  53.73655 21.66839  -15.13877      25.31390  
1 1 1 1  29 10 o 73.74097 4.308902  3.680875       0.4215535     0.5442975      3.613685      3.724147       0.4244514     50.63893 23.29593  74.17345 4.313039  -23.53452      23.69182  
1 1 1 1  29 11 o 16.17488 7.783195  -0.6901279     0.4938672     0.5665662      0.6474359     -2.438953      0.7637570     30.80242 11.59674  15.33662 7.749692  15.46580       13.94784  
1 1 1 1  30 0  o 112.9616 11.26369  9.090490       1.653873      9.090490       1.653873      9.090490       1.653873      112.9616 11.26369  112.9616 11.26369  0.000000       0.000000  
1 1 1 1  30 1  o 49.13494 17.68363  1.878931       1.477454      2.884357       2.514757      1.348951       1.825788      57.83207 22.57647  46.29197 18.84225  11.54010       29.40624  
1 1 1 1  30 2  o 68.05946 21.10985  4.175472       2.112984      2.596493       3.081426      5.576862       2.902974      56.99314 23.94975  74.58504 24.89607  -17.59190      34.54569  
1 1 1 1  30 3  o 91.55383 14.53067  6.457910       1.713553      9.817249       3.022753      4.867153       2.080068      104.3105 22.41513  74.22693 20.40163  30.08354       30.30948  
1 1 1 1  30 4  o 76.69848 25.32798  6.005889       3.006557      6.024877       3.191705      5.856324       8.957742      75.74243 26.09626  67.89094 32.78787  7.851494       41.90536  
1 1 1 1  30 5  o 113.6157 15.71874  10.12997       2.316060      11.18280       2.670124      6.931046       4.654320      117.2716 17.63221  74.24437 30.13418  43.02720       34.91366  
1 1 1 2  0  0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 2  0  1  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 2  0  2  o 208.0595 0.4672384 28.84203       0.1295373     28.84203       0.1295373     28.84203       0.1295373     208.0595 0.4672384 208.0595 0.4672384 -0.000000      0.000000  
1 1 1 2  0  3  o 886.3015 14.26286  524.3401       16.83480      524.3401       16.83480      524.3401       16.83480      886.3015 14.26286  886.3015 14.26286  -0.000000      0.000000  
1 1 1 2  0  4  o 340.2434 9.152883  77.33160       4.142953      77.33160       4.142953      77.33160       4.142953      340.2434 9.152883  340.2434 9.152883  0.000000       0.000000  
1 1 1 2  0  5  o 762.2869 17.50591  388.3963       17.76066      388.3963       17.76066      388.3963       17.76066      762.2869 17.50591  762.2869 17.50591  -0.000000      0.000000  
1 1 1 2  0  6  o 211.4666 8.332317  29.94346       2.339612      29.94346       2.339612      29.94346       2.339612      211.4666 8.332317  211.4666 8.332317  -0.000000      0.000000  
1 1 1 2  0  7  o 19.69125 12.48030  0.8514949E-01  0.7074183     0.8514949E-01  0.7074183     0.8514949E-01  0.7074183     19.69125 12.48030  19.69125 12.48030  0.000000       0.000000  
1 1 1 2  0  8  o 298.9150 14.43610  60.01247       5.719339      60.01247       5.719339      60.01247       5.719339      298.9150 14.43610  298.9150 14.43610  -0.000000      0.000000  
1 1 1 2  0  9  f 60.70992 3.635888  2.482128       0.2916936     2.482128       0.2916936     2.482128       0.2916936     60.70992 3.635888  60.70992 3.635888  -0.000000      0.000000  
1 1 1 2  0  10 o 83.94171 6.310381  4.774764       0.6964504     4.774764       0.6964504     4.774764       0.6964504     83.94171 6.310381  83.94171 6.310381  0.000000       0.000000  
1 1 1 2  0  11 o 454.1354 20.43399  138.5972       12.30835      138.5972       12.30835      138.5972       12.30835      454.1354 20.43399  454.1354 20.43399  -0.000000      0.000000  
1 1 1 2  0  12 o 353.3416 11.29088  83.51134       5.303831      83.51134       5.303831      83.51134       5.303831      353.3416 11.29088  353.3416 11.29088  -0.000000      0.000000  
1 1 1 2  0  13 o 69.09347 10.47143  3.394679       0.8986025     3.394679       0.8986025     3.394679       0.8986025     69.09347 10.47143  69.09347 10.47143  0.000000       0.000000  
1 1 1 2  0  14 f 9.357409 6.730924  -0.7162086     0.4106081     -0.7162086     0.4106081     -0.7162086     0.4106081     9.357409 6.730924  9.357409 6.730924  0.000000       0.000000  
1 1 1 2  0  15 o 189.4752 4.783627  23.97154       1.206027      23.97154       1.206027      23.97154       1.206027      189.4752 4.783627  189.4752 4.783627  -0.000000      0.000000  
1 1 1 2  0  16 o 66.40923 7.354468  3.046914       0.6304407     3.046914       0.6304407     3.046914       0.6304407     66.40923 7.354468  66.40923 7.354468  -0.000000      0.000000  
1 1 1 2  0  17 o 631.9572 13.25406  267.1225       11.15010      267.1225       11.15010      267.1225       11.15010      631.9572 13.25406  631.9572 13.25406  0.000000       0.000000  
1 1 1 2  0  18 o 76.73594 9.807549  4.116591       0.9580763     4.116591       0.9580763     4.116591       0.9580763     76.73594 9.807549  76.73594 9.807549  0.000000       0.000000  
1 1 1 2  0  19 o 540.1281 11.65810  195.0337       8.381874      195.0337       8.381874      195.0337       8.381874      540.1281 11.65810  540.1281 11.65810  -0.000000      0.000000  
1 1 1 2  0  20 f 440.4939 8.701462  129.5653       5.102971      129.5653       5.102971      129.5653       5.102971      440.4939 8.701462  440.4939 8.701462  -0.000000      0.000000  
1 1 1 2  0  21 o 146.9620 7.864495  14.52488       1.529963      14.52488       1.529963      14.52488       1.529963      146.9620 7.864495  146.9620 7.864495  -0.000000      0.000000  
1 1 1 2  0  22 o 167.2818 7.731018  18.77850       1.714881      18.77850       1.714881      18.77850       1.714881      167.2818 7.731018  167.2818 7.731018  0.000000       0.000000  
1 1 1 2  0  23 o 137.1637 8.441648  12.69018       1.529373      12.69018       1.529373      12.69018       1.529373      137.1637 8.441648  137.1637 8.441648  -0.000000      0.000000  
1 1 1 2  0  24 o 330.3609 9.544677  73.01762       4.193745      73.01762       4.193745      73.01762       4.193745      330.3609 9.544677  330.3609 9.544677  -0.000000      0.000000  
1 1 1 2  0  25 o 95.48701 9.889143  6.281140       1.224633      6.281140       1.224633      6.281140       1.224633      95.48701 9.889143  95.48701 9.889143  -0.000000      0.000000  
1 1 1 2  0  26 o 106.5204 16.33714  8.128307       2.157032      8.128307       2.157032      8.128307       2.157032      106.5204 16.33714  106.5204 16.33714  0.000000       0.000000  
1 1 1 2  0  27 o 16.92970 11.43137  -0.3510076     0.7515154     -0.3510076     0.7515154     -0.3510076     0.7515154     16.92970 11.43137  16.92970 11.43137  -0.000000      0.000000  
1 1 1 2  0  28 o 34.62151 16.57223  1.187217       0.8786615     1.187217       0.8786615     1.187217       0.8786615     34.62151 16.57223  34.62151 16.57223  0.000000       0.000000  
1 1 1 2  0  29 o 202.7078 8.961591  27.67037       2.409837      27.67037       2.409837      27.67037       2.409837      202.7078 8.961591  202.7078 8.961591  -0.000000      0.000000  
1 1 1 2  0  30 o 222.2467 9.043565  33.26664       2.668134      33.26664       2.668134      33.26664       2.668134      222.2467 9.043565  222.2467 9.043565  -0.000000      0.000000  
1 1 1 2  0  31 o 98.66796 11.96836  6.845471       1.511998      6.845471       1.511998      6.845471       1.511998      98.66796 11.96836  98.66796 11.96836  -0.000000      0.000000  
1 1 1 2  0  32 o 27.52067 16.08070  0.6367520      0.9822426     0.6367520      0.9822426     0.6367520      0.9822426     27.52067 16.08070  27.52067 16.08070  0.000000       0.000000  
1 1 1 2  0  33 o 67.34418 14.97135  3.517526       1.174103      3.517526       1.174103      3.517526       1.174103      67.34418 14.97135  67.34418 14.97135  0.000000       0.000000  
1 1 1 2  0  34 o 69.36884 19.74820  4.101942       1.581370      4.101942       1.581370      4.101942       1.581370      69.36884 19.74820  69.36884 19.74820  -0.000000      0.000000  
1 1 1 2  0  35 o 43.36177 19.67631  1.987486       1.227674      1.987486       1.227674      1.987486       1.227674      43.36177 19.67631  43.36177 19.67631  -0.000000      0.000000  
1 1 1 2  0  36 o 16.09341 11.13926  -0.5890493     0.8178850     -0.5890493     0.8178850     -0.5890493     0.8178850     16.09341 11.13926  16.09341 11.13926  -0.000000      0.000000  
1 1 1 2  0  37 o 30.49379 16.76241  1.016068       0.9827060     1.016068       0.9827060     1.016068       0.9827060     30.49379 16.76241  30.49379 16.76241  -0.000000      0.000000  
1 1 1 2  0  38 o 56.73949 16.03725  2.811497       1.049869      2.811497       1.049869      2.811497       1.049869      56.73949 16.03725  56.73949 16.03725  -0.000000      0.000000  
1 1 1 2  1  0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 2  1  1  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 2  1  2  o 1365.739 29.08605  1253.919       52.93291      1368.536       78.94005      1160.281       71.35084      1419.500 41.77931  1307.403 41.00655  112.0967       58.54100  
1 1 1 2  1  3  o 77.87524 0.4038923 4.040574       0.4191201E-01 4.261120       0.5902790E-01 3.816333       0.5952023E-01 79.97226 0.5539167 75.68339 0.5901882 4.288872       0.8094108 
1 1 1 2  1  4  o 258.9213 5.694171  44.68166       1.964589      42.90299       2.486092      47.63935       3.205882      253.5792 7.365299  267.1321 9.019265  -13.55293      11.64452  
1 1 1 2  1  5  o 962.2487 16.96812  618.8045       21.75677      681.1185       33.07312      571.2654       28.88736      1007.826 24.62726  922.9531 23.50760  84.87292       34.04570  
1 1 1 2  1  6  o 354.1081 9.018653  83.67099       4.252042      76.81047       8.266768      86.13892       4.958197      338.4295 18.40055  359.2092 10.36949  -20.77966      21.12123  
1 1 1 2  1  7  o 910.6391 13.50872  553.5912       16.39208      517.6974       25.53396      578.7545       21.37924      879.2407 21.79400  930.5313 17.24201  -51.29059      27.78966  
1 1 1 2  1  8  o 749.1866 14.05501  374.7590       14.03120      382.7426       21.88606      369.1879       18.28275      755.6907 21.75717  743.0212 18.46574  12.66956       28.53696  
1 1 1 2  1  9  o 81.99863 0.8723239 4.479816       0.9531425E-01 4.289072       0.9900746     4.481601       0.9575902E-01 79.63007 9.519114  82.01495 0.8762200 -2.384880      9.559356  
1 1 1 2  1  10 o 481.7168 8.534496  154.7359       5.478267      159.2006       7.743875      150.2630       7.751008      488.4239 11.89838  474.3332 12.27343  14.09067       17.09411  
1 1 1 2  1  11 o 348.4715 6.879756  80.95374       3.194580      80.12688       3.873309      82.71274       5.649409      346.6371 8.385588  351.8136 12.06870  -5.176422      14.69597  
1 1 1 2  1  12 o 339.2310 6.516829  76.71767       2.945814      72.00507       3.521393      87.70390       5.376616      328.5952 8.042292  362.3279 11.14938  -33.73279      13.74726  
1 1 1 2  1  13 o 511.4375 8.379138  174.4738       5.710385      168.2722       7.359396      183.8569       9.052356      502.0562 11.00060  524.5895 12.94996  -22.53333      16.99161  
1 1 1 2  1  14 o 364.7632 7.518324  88.74609       3.654311      82.52387       5.701180      93.08519       4.760932      351.2145 12.20053  373.3224 9.578407  -22.10788      15.51125  
1 1 1 2  1  15 o 165.7495 5.545954  18.33815       1.223179      17.84900       1.502057      19.30111       2.107499      163.4361 6.912684  169.7688 9.352274  -6.332657      11.62971  
1 1 1 2  1  16 o 342.8006 6.759947  78.39202       3.087865      81.36685       3.967248      73.82012       4.918207      349.1148 8.528007  332.1137 11.12911  17.00113       14.02084  
1 1 1 2  1  17 o 405.3013 7.182377  109.6128       3.878999      104.5112       5.118093      116.4984       5.945996      395.5078 9.711352  417.3142 10.70154  -21.80649      14.45107  
1 1 1 2  1  18 o 596.4283 9.024055  237.5911       7.171887      243.6900       10.73906      232.6812       9.635592      603.1504 13.36187  589.6191 12.26403  13.53125       18.13687  
1 1 1 2  1  19 o 430.9939 6.703114  123.9250       3.849650      119.7190       5.954351      126.9459       5.046135      423.2035 10.55873  436.0201 8.685180  -12.81662      13.67184  
1 1 1 2  1  20 o 329.7873 6.277775  72.54168       2.758755      77.20869       3.802113      67.35284       4.009043      340.0840 8.390066  317.4096 9.489320  22.67435       12.66651  
1 1 1 2  1  21 o 174.9569 5.343130  20.42884       1.244203      20.56546       1.754436      20.29061       1.764746      175.3959 7.524122  174.2101 7.620567  1.185745       10.70913  
1 1 1 2  1  22 o 350.2667 5.783049  81.81683       2.699164      80.39529       4.132201      82.87476       3.564742      346.8726 8.947478  352.4063 7.591210  -5.533630      11.73388  
1 1 1 2  1  23 f 206.9834 5.396243  28.58881       1.487065      28.28255       2.151786      28.86881       2.057441      205.6891 7.865301  207.8492 7.440578  -2.160080      10.82706  
1 1 1 2  1  24 o 268.9046 6.642587  48.25557       2.380176      44.73834       3.394541      51.65725       3.338317      258.4787 9.873751  277.8845 9.027477  -19.40585      13.37858  
1 1 1 2  1  25 o 63.56870 9.327188  2.760286       0.7665861     0.8397476      1.156382      4.265977       1.023900      41.16956 15.49875  79.22516 9.915403  -38.05560      18.39909  
1 1 1 2  1  26 o 141.5321 5.788062  13.39631       1.089292      14.75874       1.650522      12.34498       1.449889      148.2736 8.388008  135.6081 8.060073  12.66548       11.63286  
1 1 1 2  1  27 o 118.8057 6.791899  9.469506       1.070752      9.857500       1.512887      9.080089       1.515660      120.8377 9.471360  115.8707 9.911554  4.967049       13.70932  
1 1 1 2  1  28 o 194.5435 5.988626  25.33073       1.550601      26.86750       2.136469      23.62020       2.254010      200.0066 8.032727  187.3018 9.057950  12.70485       12.10666  
1 1 1 2  1  29 o 69.04192 10.20980  3.282970       0.9110115     4.302261       1.092737      0.9597635      1.649720      79.13321 10.63169  46.60816 18.25916  32.52505       21.12888  
1 1 1 2  1  30 o 125.1390 7.351959  10.55129       1.220540      9.292486       1.708033      11.86481       1.744761      116.5455 11.13350  132.1270 9.983812  -15.58142      14.95431  
1 1 1 2  1  31 o 123.6266 6.637867  10.29379       1.089478      11.41120       1.452477      8.856400       1.647372      129.7618 8.446076  113.5384 11.02742  16.22346       13.89029  
1 1 1 2  1  32 o 19.71819 9.603940  -1.419250      0.8122396     -1.677340      1.317342      -1.260955      1.031682      27.06129 12.93928  24.29310 11.56986  2.768190       17.35761  
1 1 1 2  1  33 o 58.95732 10.25744  2.457875       0.7765931     2.618112       1.032437      2.249075       1.178547      59.91158 13.28125  55.08683 15.43916  4.824745       20.36563  
1 1 1 2  1  34 o 65.28003 11.48407  3.079249       0.9625060     2.545932       1.039334      6.291751       2.550844      58.39934 13.60898  86.65704 22.04224  -28.25770      25.90491  
1 1 1 2  1  35 o 75.33098 10.09606  4.069242       0.9879502     2.300631       1.272503      6.753006       1.567526      53.79042 16.32651  95.62056 12.60943  -41.83014      20.62892  
1 1 1 2  1  36 o 29.68472 11.80748  0.4306199      0.6994066     1.873892       1.075227      -0.6279485     0.9208426     48.48360 15.06205  24.72234 11.50727  23.76126       18.95475  
1 1 1 2  1  37 f 38.01708 11.80332  1.099913       0.6604099     0.5575860E-01  0.9884264     1.941926       0.8876081     29.66459 13.01908  49.40158 13.22278  -19.73699      18.55635  
1 1 1 2  1  38 o 43.84562 11.74269  1.514372       0.6997630     2.723633       0.8487808     -1.051650      1.236419      59.61834 11.09233  26.53178 12.64444  33.08655       16.82027  
1 1 1 2  2  0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 2  2  1  o 663.4738 10.21838  293.6113       9.033981      289.8852       11.72077      299.0645       14.17945      658.9926 13.34757  669.0796 15.90407  -10.08698      20.76288  
1 1 1 2  2  2  o 633.6492 11.84679  267.9100       10.00284      273.6269       12.83584      259.0694       15.96204      640.0815 15.04927  622.0481 19.28038  18.03339       24.45840  
1 1 1 2  2  3  o 872.8791 12.40302  508.4666       14.42630      517.7089       20.13873      498.7249       20.67560      880.1168 17.17190  863.7019 17.96473  16.41492       24.85167  
1 1 1 2  2  4  o 728.8624 4.689015  354.0271       4.554081      340.4442       13.44014      355.7889       4.840424      714.0679 14.12507  730.6631 4.971560  -16.59521      14.97445  
1 1 1 2  2  5  o 682.9407 2.505205  310.7697       2.279816      310.8339       2.294266      305.7213       20.34479      683.0110 2.520824  675.1714 22.64543  7.839661       22.78530  
1 1 1 2  2  6  o 583.6009 2.243153  226.9336       1.744409      234.2433       19.69739      226.8758       1.751290      590.4283 25.09339  583.5264 2.252289  6.901917       25.19427  
1 1 1 2  2  7  o 183.6985 4.256804  22.48741       1.041988      22.44197       1.205080      22.62203       2.074221      183.4404 4.934487  183.9992 8.482730  -0.5588531     9.813555  
1 1 1 2  2  8  o 559.2202 11.38096  208.6500       8.480770      221.8877       11.08206      189.9406       13.17484      576.2608 14.44343  532.6159 18.59192  43.64490       23.54299  
1 1 1 2  2  9  o 651.1299 12.89439  282.9872       11.18773      271.3825       16.46328      292.9445       15.24998      636.6141 19.43011  661.7816 17.30828  -25.16754      26.02126  
1 1 1 2  2  10 o 626.9622 14.99261  262.5849       12.52541      260.0506       17.58422      265.1952       17.84590      622.7531 21.22113  628.8698 21.32716  -6.116699      30.08628  
1 1 1 2  2  11 o 251.3599 6.490115  42.14631       2.171993      43.00661       3.024973      41.23076       3.120580      253.7770 8.959373  248.4436 9.443335  5.333450       13.01718  
1 1 1 2  2  12 o 219.8367 4.090564  32.20693       1.198276      32.95462       1.330876      29.00574       2.753814      222.3682 4.491500  208.2645 9.951859  14.10370       10.91847  
1 1 1 2  2  13 o 311.1707 5.731043  64.54800       2.376326      64.01389       3.078231      65.33579       3.738421      309.8209 7.456190  312.8090 8.978112  -2.988098      11.67053  
1 1 1 2  2  14 o 369.6095 9.486409  91.24499       4.668307      101.1096       6.859514      82.73422       6.371438      388.6406 13.26504  351.4624 13.63041  37.17819       19.01972  
1 1 1 2  2  15 o 500.8021 10.05770  167.5149       6.711789      170.5737       8.211064      161.3562       11.65121      505.0586 12.20068  489.8824 17.87865  15.17618       21.64492  
1 1 1 2  2  16 o 300.6727 6.521280  60.30456       2.612765      58.37674       3.602906      62.44292       3.794554      295.5153 9.160608  305.6252 9.328391  -10.10989      13.07424  
1 1 1 2  2  17 o 575.4550 10.24817  221.3204       7.858349      217.5121       10.28301      226.6670       12.18404      569.8204 13.54281  580.9235 15.75433  -11.10303      20.77514  
1 1 1 2  2  18 o 179.3708 5.105698  21.47028       1.219097      22.71089       1.563560      19.54671       1.946937      184.4049 6.372673  170.8809 8.577798  13.52405       10.68595  
1 1 1 2  2  19 o 126.3974 6.720017  10.68836       1.127765      10.37168       1.542585      11.05196       1.652927      124.2573 9.385917  128.2508 9.745029  -3.993507      13.53001  
1 1 1 2  2  20 o 666.5767 8.705778  296.6571       7.732702      308.9536       9.704249      275.2694       12.79836      679.8853 10.71156  640.7811 14.98895  39.10419       18.42298  
1 1 1 2  2  21 o 398.0311 6.615932  105.6790       3.508986      101.6046       4.734560      110.6446       5.226781      390.0774 9.108678  407.0065 9.637389  -16.92914      13.26074  
1 1 1 2  2  22 o 594.1005 7.636852  235.5410       6.045716      232.9561       9.036743      237.6354       8.134173      590.2284 11.48995  596.3517 10.23617  -6.123352      15.38825  
1 1 1 2  2  23 o 96.13735 4.131491  6.172472       0.5280288     6.526487       0.5557290     2.884545       1.693608      98.85545 4.228569  64.72759 18.63206  34.12785       19.10587  
1 1 1 2  2  24 o 259.9865 5.605922  45.08820       1.942099      44.11492       2.373133      47.06183       3.379371      256.9909 6.936302  265.1415 9.580743  -8.150604      11.82806  
1 1 1 2  2  25 o 174.7952 5.474225  20.40603       1.273474      20.59198       1.551050      20.02139       2.230756      175.4902 6.644840  172.6831 9.733987  2.807190       11.78577  
1 1 1 2  2  26 o 22.62286 8.993223  0.1765821      0.4055069     0.2243137      0.4253343     -0.2998712     1.343808      23.73761 9.279551  34.70546 15.20724  -10.96786      17.81489  
1 1 1 2  2  27 o 258.4436 6.295136  44.64629       2.167926      43.82014       2.948546      45.61845       3.198505      255.5255 8.672215  260.5983 9.225451  -5.072784      12.66161  
1 1 1 2  2  28 o 84.67458 7.998848  4.850068       0.8918177     5.416327       1.313528      4.365809       1.214703      88.89075 11.34784  79.55816 11.81647  9.332588       16.38299  
1 1 1 2  2  29 o 38.00206 11.88834  0.9721787      0.6685955     1.118115       0.8146669     0.6710818      1.170178      40.97240 13.16067  39.39011 15.39370  1.582298       20.25263  
1 1 1 2  2  30 o 199.3251 5.935815  26.63233       1.574823      26.00830       2.061042      27.50776       2.441175      196.5178 7.886681  201.7578 9.103646  -5.239929      12.04475  
1 1 1 2  2  31 f 28.42258 11.39280  0.2785653      0.6561923     0.4538208      0.6877843     -1.498756      2.190279      30.95657 11.88176  38.91063 17.98482  -7.954054      21.55527  
1 1 1 2  2  32 o 51.45331 10.15647  1.868056       0.6716232     2.604267       0.7915524     -0.2442700E-01 1.269096      61.00714 10.08937  34.69157 14.99364  26.31557       18.07221  
1 1 1 2  2  33 o 65.54130 10.28464  3.027015       0.8686727     3.818486       0.9615653     -0.4858293     2.025773      73.85812 10.02916  40.30127 18.10291  33.55685       20.69539  
1 1 1 2  2  34 o 65.55963 9.810101  3.045945       0.8307020     2.378474       0.9574832     5.077628       1.670486      56.60324 12.97274  81.66294 15.92349  -25.05970      20.53898  
1 1 1 2  2  35 o 50.45142 9.456953  1.837574       0.6124145     2.283422       0.7533692     0.9689811      1.051532      55.93650 10.49273  38.98603 14.75661  16.95047       18.10676  
1 1 1 2  2  36 o 26.23880 10.67562  0.2652084      0.5858141     0.5915819      0.6754840     -0.7250982     1.176637      31.31207 11.83279  27.90132 12.99393  3.410755       17.57433  
1 1 1 2  2  37 o 58.53447 9.020552  2.491116       0.6810173     4.715563       0.8352721     -1.919685      1.176185      81.65556 7.770140  22.95780 11.26108  58.69777       13.68163  
1 1 1 2  2  38 o 17.07958 8.185089  -0.6576170     0.5336881     -1.301447      0.5873957     2.387986       1.277561      15.22656 7.558252  51.82578 16.46310  -36.59922      18.11521  
1 1 1 2  3  0  o 1399.233 34.89000  1315.277       64.96119      1315.277       64.96119      1315.277       64.96119      1399.233 34.89000  1399.233 34.89000  0.000000       0.000000  
1 1 1 2  3  1  o 618.0842 2.158889  254.5425       1.778080      254.2485       1.793938      270.9532       13.40248      617.7268 2.179402  636.8702 15.79286  -19.14343      15.94252  
1 1 1 2  3  2  o 214.8405 2.978832  30.75507       0.8527771     31.64777       1.170908      29.74668       1.244469      217.9276 4.032153  211.2771 4.420364  6.650528       5.983132  
1 1 1 2  3  3  o 679.6613 7.061831  307.9351       6.395631      298.5534       9.803437      314.8866       8.438773      668.9750 10.99752  687.1619 9.216090  -18.18689      14.34858  
1 1 1 2  3  4  o 1166.084 14.58474  908.0029       22.66219      919.8202       31.36420      895.0938       32.78109      1172.461 20.07531  1156.290 21.27567  16.17090       29.25187  
1 1 1 2  3  5  o 1210.036 18.74113  979.1929       30.21814      965.3298       37.99623      1003.052       49.84641      1200.077 23.76062  1220.489 30.67402  -20.41174      38.80030  
1 1 1 2  3  6  o 578.3414 23.10777  224.4773       17.77217      224.4773       17.77217      0.000000       0.000000      578.3414 23.10777  ?        ?         0.000000       23.10777  
1 1 1 2  3  7  o 420.3224 6.664382  117.7651       3.732639      115.5298       4.541502      122.4185       6.552642      416.2635 8.187619  428.1904 11.49474  -11.92688      14.11262  
1 1 1 2  3  8  o 540.1182 11.00731  194.6219       7.922162      195.3391       13.18759      194.2170       9.909478      540.1743 18.34800  539.1780 13.80392  0.9962769      22.96078  
1 1 1 2  3  9  o 697.3013 13.18229  324.5843       12.24856      331.4182       17.71309      318.3222       16.95586      703.6318 18.90903  689.6546 18.46739  13.97717       26.43097  
1 1 1 2  3  10 o 988.3221 19.62815  653.8237       25.84946      626.1674       39.31456      674.8847       34.30806      963.5094 30.66035  1002.129 25.71331  -38.61938      40.01539  
1 1 1 2  3  11 o 503.1332 10.53309  168.9086       7.061749      162.0176       8.168001      189.3055       14.05253      492.4615 12.45715  531.2745 19.88516  -38.81302      23.46488  
1 1 1 2  3  12 o 300.7785 7.345106  60.32438       2.943868      62.58671       4.080839      57.86959       4.250881      306.0956 10.01854  294.2531 10.86001  11.84259       14.77535  
1 1 1 2  3  13 o 239.5793 4.458569  38.25567       1.423372      37.85844       1.730308      39.08708       2.503277      238.3114 5.448852  241.9569 7.774302  -3.645538      9.493670  
1 1 1 2  3  14 o 66.60845 8.673298  3.010585       0.7515507     2.399230       0.8676874     4.846826       1.503770      58.92439 11.46357  84.01555 13.91917  -25.09116      18.03210  
1 1 1 2  3  15 o 205.2700 8.291762  28.16783       2.263347      29.25060       2.441824      21.56274       6.030955      209.1425 8.781446  176.5015 26.45696  32.64101       27.87624  
1 1 1 2  3  16 o 258.7662 7.365213  44.71793       2.537023      44.97241       3.087639      44.18906       4.451211      259.3573 8.947577  256.5820 13.06200  2.775299       15.83272  
1 1 1 2  3  17 o 245.9263 6.040350  40.33941       1.979432      44.39132       2.839850      36.51074       2.760515      257.7257 8.279957  233.6485 8.882704  24.07719       12.14332  
1 1 1 2  3  18 o 384.2645 6.430624  98.50079       3.292736      100.8584       4.211356      94.79268       5.281555      388.6927 8.130964  376.4252 10.53992  12.26743       13.31174  
1 1 1 2  3  19 o 504.1869 7.719627  169.6552       5.186345      161.3824       7.080149      179.2343       7.618614      491.3379 10.81406  517.7638 11.04258  -26.42593      15.45582  
1 1 1 2  3  20 o 437.4560 7.462999  127.6950       4.350321      119.1661       5.267755      145.9876       7.714636      422.4103 9.358743  466.9513 12.40953  -44.54099      15.54293  
1 1 1 2  3  21 o 398.8552 6.460038  106.1115       3.433395      104.3813       4.378038      108.8755       5.533553      395.4448 8.308454  403.5369 10.29917  -8.092163      13.23266  
1 1 1 2  3  22 o 69.23642 6.945539  3.230198       0.6321430     3.276076       0.6996638     3.026325       1.474910      69.64626 7.665687  65.88045 16.76269  3.765808       18.43233  
1 1 1 2  3  23 o 217.4774 6.090244  31.57376       1.763171      31.19349       2.157274      32.33890       3.060044      216.0522 7.504692  219.6798 10.48381  -3.627563      12.89305  
1 1 1 2  3  24 o 147.2910 5.931837  14.49771       1.161849      15.14976       1.423370      13.19580       2.011247      150.4752 7.118894  139.9918 10.86679  10.48332       12.99099  
1 1 1 2  3  25 o 274.9056 6.208333  50.44962       2.274218      50.95231       2.895193      49.63968       3.674956      275.9962 7.880353  272.0599 10.15493  3.936340       12.85390  
1 1 1 2  3  26 o 224.8006 5.760032  33.76585       1.724003      36.69436       2.086505      27.46457       3.060629      234.2380 6.691660  201.8436 11.42614  32.39436       13.24141  
1 1 1 2  3  27 o 16.47137 7.676475  -0.3879182     0.4118520     -0.3887688     0.4260329     -0.3757763     1.609682      16.85169 7.838152  37.72494 16.58347  -20.87325      18.34253  
1 1 1 2  3  28 o 242.0504 6.915310  39.26274       2.228156      39.15657       2.751892      39.46485       3.796677      241.3483 8.570451  241.3294 11.84263  0.1885986E-01  14.61850  
1 1 1 2  3  29 o 101.5518 4.081692  6.896576       0.5512082     6.886904       0.5724999     7.019400       2.040133      101.4652 4.243698  99.95531 15.84509  1.509926       16.40353  
1 1 1 2  3  30 o 17.26161 8.206825  -0.6456192     0.5145658     -0.6672357     0.5252401     -0.1299464     2.565385      17.38646 8.273381  48.62437 21.16429  -31.23791      22.72391  
1 1 1 2  3  31 o 65.54404 5.253013  2.895707       0.4549533     3.135741       0.4672516     -1.484903      1.996096      68.23372 5.177645  36.75463 17.05119  31.47909       17.81997  
1 1 1 2  3  32 o 17.35164 7.890988  -0.2377003     0.3991569     -0.5797065     0.4230652     2.534245       1.204433      15.28663 7.315593  58.84882 15.23976  -43.56219      16.90468  
1 1 1 2  3  33 o 87.35278 6.467558  5.185159       0.7474791     5.094191       0.7922952     5.921703       2.254452      86.45284 6.935699  87.07072 19.87069  -0.6178894     21.04633  
1 1 1 2  3  34 o 22.15653 8.727642  0.2058820      0.3786964     0.1551650      0.3896725     1.068299       1.606874      21.62065 8.739606  44.48273 17.82887  -22.86209      19.85571  
1 1 1 2  3  35 o 29.99551 13.28038  -0.1088795     1.049936      -3.719371      3.182069      0.3322149      1.112224      38.40736 18.77248  33.89838 14.32456  4.508972       23.61354  
1 1 1 2  3  36 o 44.69542 16.14570  1.528316       1.233018      2.335864       2.543506      1.280242       1.409742      53.40158 22.04301  43.12110 16.88312  10.28048       27.76570  
1 1 1 2  3  37 o 31.89785 13.56920  0.3338800      1.009276      -1.070263      2.143380      0.7339186      1.144048      35.59785 16.87375  36.31393 14.86419  -0.7160835     22.48706  
1 1 1 2  3  38 f 42.52277 15.52740  1.479620       1.144571      2.241356       2.386503      1.252066       1.304375      49.24749 20.90438  40.81807 16.16044  8.429428       26.42258  
1 1 1 2  4  0  o 71.38834 1.552956  3.400317       0.1475692     3.400317       0.1475692     3.400317       0.1475692     71.38834 1.552956  71.38834 1.552956  0.000000       0.000000  
1 1 1 2  4  1  o 253.3256 1.544382  42.75755       0.5213237     38.88662       2.955481      42.88186       0.5296283     241.3059 9.208405  253.6935 1.566709  -12.38763      9.340733  
1 1 1 2  4  2  f 702.9171 1.883238  329.2063       1.763936      301.4258       11.82127      329.8389       1.783907      671.9960 13.20152  703.5919 1.902733  -31.59583      13.33794  
1 1 1 2  4  3  o 892.8632 9.287377  531.6329       11.04973      524.2590       15.70745      538.8569       15.54713      886.2225 13.30116  898.5158 12.98527  -12.29327      18.58865  
1 1 1 2  4  4  o 475.6353 6.251044  150.7900       3.961870      150.1970       5.007124      151.7830       6.478967      474.6394 7.916825  477.0341 10.19255  -2.394714      12.90597  
1 1 1 2  4  5  o 534.3992 8.845857  190.4314       6.299111      200.8904       9.323583      181.6483       8.543962      548.6310 12.75349  521.7271 12.28973  26.90393       17.71127  
1 1 1 2  4  6  o 1011.702 2.189575  681.9797       2.951795      671.4875       4.203068      692.1910       4.146446      1003.862 3.142091  1019.224 3.053044  -15.36127      4.381074  
1 1 1 2  4  7  o 590.1013 9.286901  232.2207       7.302488      235.5248       11.13217      229.7249       9.675017      593.9271 14.06608  586.7101 12.37527  7.217041       18.73505  
1 1 1 2  4  8  o 731.7924 3.333707  356.8386       3.250789      349.9469       19.35285      357.0387       3.297644      722.8682 20.11103  731.9962 3.380815  -9.127991      20.39322  
1 1 1 2  4  9  o 384.5477 7.887496  98.59599       4.041689      100.3074       6.474915      97.50350       5.173304      387.4528 12.55787  382.1848 10.16733  5.267914       16.15780  
1 1 1 2  4  10 o 273.6339 7.005919  49.95023       2.552414      50.83356       3.523066      48.97438       3.702968      275.8915 9.597779  270.7448 10.28268  5.146698       14.06595  
1 1 1 2  4  11 o 636.3806 11.83020  270.3560       10.03189      270.8953       11.86564      269.0043       18.78476      636.7652 13.98422  632.8073 22.31212  3.957886       26.33228  
1 1 1 2  4  12 o 488.0548 9.868665  158.9523       6.418012      163.4663       7.954570      150.5331       10.86364      494.7430 12.06601  473.8791 17.23289  20.86389       21.03713  
1 1 1 2  4  13 o 57.95919 6.323614  2.266443       0.4804708     3.274188       0.7403227     1.533085       0.6315446     69.58572 8.137615  47.00632 10.36210  22.57940       13.17550  
1 1 1 2  4  14 o 402.0739 8.406858  107.8890       4.504154      100.8241       7.172852      112.4883       5.787482      387.8833 13.90016  410.2187 10.59655  -22.33536      17.47860  
1 1 1 2  4  15 o 42.65956 9.565661  1.263602       0.5303063     1.118239       0.6000944     1.781795       1.133025      40.24879 10.91568  51.30394 15.36959  -11.05514      18.85143  
1 1 1 2  4  16 o 334.5126 8.118816  74.69550       3.618918      75.41922       4.504664      73.37823       6.077328      335.8070 10.07838  330.6703 13.82301  5.136688       17.10700  
1 1 1 2  4  17 o 432.9717 8.088869  125.1459       4.666818      128.6323       5.889009      119.2603       7.651513      438.7240 10.07343  421.6894 13.63491  17.03461       16.95243  
1 1 1 2  4  18 o 269.5667 6.549062  48.47614       2.352442      48.12758       2.956353      49.07780       3.884101      268.3672 8.276996  270.7274 10.78836  -2.360107      13.59770  
1 1 1 2  4  19 o 417.3721 6.777193  116.2116       3.769179      112.1013       4.960834      121.8247       5.797205      409.7144 9.086569  426.9867 10.18898  -17.27231      13.65215  
1 1 1 2  4  20 o 280.3520 7.312628  52.47737       2.729479      53.11516       3.479808      51.45750       4.400361      281.8705 9.277354  277.1208 11.94446  4.749695       15.12414  
1 1 1 2  4  21 o 110.2119 4.163826  8.108164       0.6103979     8.153789       0.6410860     7.665547       1.996789      110.5119 4.362020  105.9941 14.51881  4.517799       15.15991  
1 1 1 2  4  22 o 261.4109 6.265765  45.58071       2.182585      46.60860       2.719362      43.71979       3.658957      264.1514 7.734075  255.5129 10.77075  8.638550       13.25990  
1 1 1 2  4  23 o 485.7853 8.157520  157.5779       5.280512      153.5729       7.405395      161.7208       7.531754      479.0299 11.60144  491.5929 11.49786  -12.56299      16.33384  
1 1 1 2  4  24 o 279.5903 5.960241  52.15877       2.220544      54.19769       2.810133      48.76920       3.623253      284.7925 7.411293  269.7958 10.09617  14.99664       12.52437  
1 1 1 2  4  25 o 329.0512 6.121158  72.28450       2.683926      69.55015       3.217652      78.53780       4.865935      322.6069 7.485003  342.1212 10.68675  -19.51428      13.04730  
1 1 1 2  4  26 o 86.91265 4.959795  5.057799       0.5720231     4.913504       0.6061028     6.233759       1.730279      85.62561 5.338696  95.08772 14.08083  -9.462112      15.05893  
1 1 1 2  4  27 f 197.8920 6.723558  26.22541       1.770393      26.73772       2.086073      24.90643       3.347195      199.6326 7.857304  191.4463 13.20164  8.186356       15.36296  
1 1 1 2  4  28 o 138.1195 7.381621  12.82174       1.353630      13.32296       1.750472      12.07620       2.134902      140.4256 9.409119  133.0272 12.17880  7.398376       15.39008  
1 1 1 2  4  29 o 77.04311 9.697527  4.063671       0.9735556     2.897517       1.136937      7.269130       1.884967      63.99770 13.74264  102.2146 14.22425  -38.21687      19.77851  
1 1 1 2  4  30 o 17.08189 8.168575  -0.7170087     0.5253295     -1.152101      0.5495013     3.904635       1.790921      15.43759 7.597126  73.24564 18.38101  -57.80805      19.88914  
1 1 1 2  4  31 o 106.7253 7.519685  7.712198       1.062555      9.857433       1.232886      1.517520       2.095052      120.6762 7.707327  53.36584 20.66987  67.31032       22.06006  
1 1 1 2  4  32 o 25.60308 11.10785  -0.6879903E-01 0.7018980     -0.1181568     0.7251018     0.6655807      2.796929      25.60735 11.19689  52.66051 22.50072  -27.05317      25.13271  
1 1 1 2  4  33 o 139.3188 7.227789  13.21303       1.337215      10.50777       1.593781      19.64577       2.457665      123.0859 9.798145  167.6770 11.06135  -44.59116      14.77691  
1 1 1 2  4  34 o 59.70953 8.780697  2.512099       0.6777813     2.429609       0.7411311     2.933680       1.675461      58.29196 9.894838  60.40063 18.80788  -2.108669      21.25193  
1 1 1 2  4  35 o 23.58266 10.37908  -0.8926200E-01 0.6322714     0.2477024      0.7591407     -0.8523575     1.142404      28.75350 11.97086  27.04857 12.66450  1.704924       17.42674  
1 1 1 2  4  36 o 41.71846 11.33863  1.318339       0.6466755     2.387450       0.7124205     -3.685263      1.541227      57.19963 9.692688  23.35829 11.69517  33.84135       15.18964  
1 1 1 2  4  37 f 43.16888 15.91540  1.476075       1.207065      0.6578698      2.262631      1.801572       1.427105      42.56972 19.12609  46.46710 17.27340  -3.897385      25.77164  
1 1 1 2  4  38 o 36.30761 15.75126  0.5464749      1.411248      -1.188547      2.693820      1.202787       1.656804      37.93811 18.23544  41.75291 17.55444  -3.814800      25.31184  
1 1 1 2  5  0  o 322.2535 13.64148  69.62830       5.833843      69.62830       5.833843      69.62830       5.833843      322.2535 13.64148  322.2535 13.64148  0.000000       0.000000  
1 1 1 2  5  1  o 661.2688 9.130883  291.5974       8.045710      296.2615       9.693015      281.2652       14.42696      666.4098 10.91551  648.5616 16.70752  17.84814       19.95719  
1 1 1 2  5  2  o 564.8188 6.692679  212.6515       5.037125      215.5137       7.870180      210.6656       6.555747      568.4166 10.39069  562.0803 8.752866  6.336304       13.58599  
1 1 1 2  5  3  o 178.0322 3.968561  21.12093       0.9414669     19.42722       1.331956      22.81200       1.330915      170.6270 5.866990  184.9299 5.406748  -14.30287      7.978377  
1 1 1 2  5  4  o 459.7457 6.902642  140.8963       4.228696      142.7652       6.897869      139.7710       5.352449      462.5934 11.19031  457.8345 8.773452  4.758881       14.21958  
1 1 1 2  5  5  o 665.9030 9.036715  295.6957       8.018536      298.8970       9.047977      283.9800       17.30905      669.4220 10.14327  651.1721 19.97182  18.24994       22.39999  
1 1 1 2  5  6  o 234.2481 4.032128  36.56550       1.258589      36.95372       1.787115      36.18347       1.772798      235.4678 5.695704  233.0007 5.709900  2.467163       8.064986  
1 1 1 2  5  7  o 70.73383 5.729046  3.356513       0.5353689     3.750293       0.6949885     2.781811       0.8395991     74.67238 7.068797  63.78519 10.22343  10.88718       12.42926  
1 1 1 2  5  8  o 528.0582 14.40213  186.3639       10.12456      186.6347       11.53631      185.4562       21.12161      528.1969 16.41061  523.9679 30.38194  4.229004       34.53072  
1 1 1 2  5  9  o 953.8862 17.39514  608.4979       22.11047      622.3958       30.72495      593.5701       31.84285      963.1137 23.94088  939.7809 25.45141  23.33282       34.94195  
1 1 1 2  5  10 o 677.0287 12.23434  306.0128       11.03726      307.0801       12.15520      300.9984       26.34758      678.0646 13.45295  667.5194 29.69558  10.54517       32.60075  
1 1 1 2  5  11 o 423.4390 9.198250  119.6156       5.190027      122.7387       6.511703      114.1763       8.593628      428.6309 11.41101  412.9006 15.64747  15.73026       19.36632  
1 1 1 2  5  12 o 518.3217 9.780418  179.2994       6.755077      182.9360       9.814575      176.0261       9.311507      522.8862 14.09897  512.9794 13.63426  9.906799       19.61311  
1 1 1 2  5  13 o 219.3801 6.153347  32.11642       1.797020      33.96452       2.866379      30.91967       2.306606      225.3624 9.566825  215.1262 8.060747  10.23615       12.50999  
1 1 1 2  5  14 f 338.9957 6.746764  76.65173       3.047637      81.44672       4.115225      70.82769       4.535359      349.1845 8.851469  325.4373 10.47217  23.74719       13.71185  
1 1 1 2  5  15 o 215.7159 5.934155  31.05738       1.704126      32.36926       2.532912      29.97248       2.303401      220.0160 8.656468  211.7434 8.179063  8.272568       11.90930  
1 1 1 2  5  16 o 214.9431 5.858088  30.83551       1.676284      29.74296       2.398174      31.87925       2.344002      210.8863 8.551862  218.3843 8.068827  -7.498032      11.75756  
1 1 1 2  5  17 o 347.1892 6.750188  80.42001       3.122883      89.73125       4.527406      71.96892       4.313221      366.4010 9.280449  328.0399 9.878630  38.36115       13.55412  
1 1 1 2  5  18 f 63.52938 15.32335  2.815349       1.282071      3.197592       1.653212      2.238616       2.030702      67.77065 18.00358  60.39993 20.81542  7.370720       27.52110  
1 1 1 2  5  19 o 100.1343 11.01335  6.782882       1.445289      9.701832       2.387250      5.093931       1.815904      119.3208 15.37111  85.70109 16.49998  33.61971       22.55040  
1 1 1 2  5  20 o 286.7720 7.245102  54.90351       2.766348      55.85769       3.569015      53.46759       4.378263      289.0681 9.277640  282.5362 11.65434  6.531891       14.89625  
1 1 1 2  5  21 o 636.1550 11.07178  270.5268       9.385421      282.9746       12.62004      255.1224       14.03905      649.8380 14.57411  616.1291 17.11645  33.70892       22.48060  
1 1 1 2  5  22 o 452.7500 8.099850  136.8383       4.886624      131.4239       5.872670      149.0250       8.810572      443.4841 9.937657  471.3553 14.04322  -27.87115      17.20375  
1 1 1 2  5  23 o 233.2502 6.992083  36.34303       2.170758      34.24300       3.106439      38.34711       3.034652      226.0484 10.34045  239.3378 9.534414  -13.28934      14.06521  
1 1 1 2  5  24 o 317.5300 6.768362  67.31313       2.863795      70.55946       3.648946      62.10646       4.621158      324.8047 8.437999  304.2197 11.41988  20.58499       14.19907  
1 1 1 2  5  25 o 123.5589 7.090610  10.23447       1.162528      9.528110       1.383222      11.93359       2.145323      119.0018 8.784914  132.7061 12.27081  -13.70428      15.09131  
1 1 1 2  5  26 o 134.6253 6.767719  12.14673       1.210173      12.76441       1.475691      10.87827       2.114723      137.8471 8.069149  126.4030 12.72830  11.44408       15.07053  
1 1 1 2  5  27 o 108.2579 8.936836  7.918635       1.277717      7.467005       1.621913      8.657393       2.074376      104.5420 11.85182  112.1025 14.20516  -7.560471      18.50006  
1 1 1 2  5  28 o 70.10640 10.68239  3.389849       0.9664383     4.130839       1.217024      2.124943       1.590092      77.18378 12.24121  56.23108 18.41193  20.95270       22.10987  
1 1 1 2  5  29 o 80.38754 9.135776  4.408082       0.9612670     4.350132       1.180158      4.522322       1.656987      79.31924 11.50083  79.66743 16.16191  -0.3481827     19.83624  
1 1 1 2  5  30 o 72.33185 9.889480  3.604297       0.9282489     3.226617       1.024517      5.335385       2.193395      67.91320 11.74609  85.23959 19.70511  -17.32639      22.94040  
1 1 1 2  5  31 o 108.0357 9.298775  7.976073       1.325635      6.978455       1.745487      9.335699       2.037719      99.61327 13.49691  115.4383 13.50186  -15.82499      19.09101  
1 1 1 2  5  32 o 76.02306 10.42071  4.037254       1.027889      4.164451       1.267282      3.792662       1.757344      76.33898 12.91847  70.74722 18.45218  5.591759       22.52487  
1 1 1 2  5  33 o 104.7390 10.84266  7.712907       1.491417      8.395785       1.771610      6.051551       2.763298      108.4250 12.49006  84.84117 23.59062  23.58383       26.69305  
1 1 1 2  5  34 o 83.25535 10.04515  4.921601       1.091905      7.721357       1.403732      0.6322134      1.737488      104.3961 10.22167  42.19064 17.86976  62.20546       20.58667  
1 1 1 2  5  35 o 48.36799 12.38231  1.781156       0.8013731     2.372046       0.9252253     0.6635214E-02  1.603373      55.76249 12.73246  36.63171 16.30400  19.13078       20.68661  
1 1 1 2  5  36 o 64.80186 11.71694  3.167902       0.9745234     3.221758       1.055942      2.858517       2.530880      64.72903 12.69624  55.75394 22.36539  8.975090       25.71780  
1 1 1 2  5  37 o 25.75417 11.30725  -0.3832076E-02 0.7462369     -0.8825928     0.8382623     3.352185       1.638161      21.74542 10.37669  60.03685 18.58155  -38.29143      21.28262  
1 1 1 2  6  0  o 444.4729 13.75706  132.1333       8.130189      132.1333       8.130189      132.1333       8.130189      444.4729 13.75706  444.4729 13.75706  0.000000       0.000000  
1 1 1 2  6  1  o 588.1251 8.905827  230.6474       6.979390      251.9811       11.94843      219.5984       8.598879      614.2870 14.59708  573.7216 11.24779  40.56537       18.42790  
1 1 1 2  6  2  o 929.1229 11.75067  576.0061       14.54820      592.2429       23.17845      565.4514       18.68779      941.1110 18.48289  920.1107 15.24208  21.00031       23.95701  
1 1 1 2  6  3  o 805.3068 9.387581  432.4877       10.07369      425.0181       12.31931      447.5616       17.50051      798.1265 11.58354  818.4832 16.04602  -20.35675      19.79023  
1 1 1 2  6  4  o 442.0095 5.100841  130.2049       3.004325      131.6366       3.789281      127.7817       4.929817      444.3975 6.398994  437.7710 8.451043  6.626495       10.60034  
1 1 1 2  6  5  o 1053.648 12.69551  740.9432       17.82458      735.0499       21.63950      753.3798       31.43567      1049.008 15.48085  1060.560 22.24405  -11.55188      27.10082  
1 1 1 2  6  6  o 466.8799 8.673813  145.3490       5.396210      144.2802       6.353468      148.1162       10.22285      465.0841 10.25194  470.5295 16.32940  -5.445465      19.28086  
1 1 1 2  6  7  o 848.5789 11.68679  480.5224       13.21481      500.9999       20.32109      465.5170       17.39528      865.6030 17.61793  834.7039 15.63960  30.89911       23.55819  
1 1 1 2  6  8  o 386.0663 8.174501  99.38605       4.205297      99.43474       5.694729      99.32766       6.236505      385.8690 11.08690  385.5703 12.15366  0.2986755      16.45086  
1 1 1 2  6  9  o 366.4920 8.434600  89.57497       4.119102      93.80708       5.282381      83.00927       6.579487      374.7983 10.58751  352.2297 14.04638  22.56860       17.58966  
1 1 1 2  6  10 o 288.4554 8.118686  55.53556       3.117495      52.20782       4.152715      59.83270       4.718979      279.4452 11.17477  299.1251 11.86271  -19.67987      16.29722  
1 1 1 2  6  11 o 385.4239 8.422873  99.09380       4.325860      105.1618       5.658451      90.55930       6.710617      396.7574 10.71264  367.8326 13.71513  28.92487       17.40303  
1 1 1 2  6  12 o 316.4563 6.232241  66.77400       2.628037      72.31960       5.389527      65.04409       3.010157      328.7359 12.32537  312.2881 7.233695  16.44772       14.29129  
1 1 1 2  6  13 o 565.6265 8.674303  213.5401       6.537894      207.2360       11.01852      216.9657       8.122206      556.0543 14.88412  569.8806 10.69588  -13.82629      18.32864  
1 1 1 2  6  14 o 290.7463 6.380186  56.38216       2.471844      58.64307       5.402616      55.78358       2.779865      295.6214 13.75266  289.1552 7.214714  6.466156       15.53022  
1 1 1 2  6  15 o 190.5622 6.268437  24.24789       1.589564      26.30628       4.233535      23.91008       1.715046      197.3069 16.24608  189.1906 6.814167  8.116364       17.61726  
1 1 1 2  6  16 o 278.2352 5.793746  51.62990       2.148054      52.56419       3.364350      50.98693       2.790976      280.3988 9.016052  276.2951 7.587885  4.103668       11.78411  
1 1 1 2  6  17 o 478.7020 8.389753  152.9928       5.351653      152.4795       7.061285      153.6855       8.203196      477.5292 11.09712  478.9472 12.86517  -1.417999      16.98995  
1 1 1 2  6  18 o 332.1797 7.711565  73.63972       3.413415      70.19412       4.540518      78.11788       5.176329      323.9128 10.53372  341.6084 11.38747  -17.69559      15.51237  
1 1 1 2  6  19 o 656.9346 10.88689  288.4502       9.530143      305.0244       12.17884      262.2708       15.30627      674.9578 13.54116  624.3049 18.41935  50.65295       22.86122  
1 1 1 2  6  20 o 393.6899 10.25351  103.6230       5.374405      93.47080       7.350718      115.2831       7.877734      373.1801 14.81158  414.6047 14.28047  -41.42462      20.57461  
1 1 1 2  6  21 o 181.6864 9.396946  22.10561       2.267276      23.72491       3.524994      20.96298       2.961057      187.6512 14.20267  176.5387 12.67161  11.11247       19.03380  
1 1 1 2  6  22 o 423.6884 8.890021  119.8987       5.019066      116.4637       6.526350      124.8711       7.852193      417.0251 11.75623  431.4423 13.67551  -14.41718      18.03410  
1 1 1 2  6  23 o 232.7588 8.187861  36.23258       2.535556      36.14550       3.787435      36.30331       3.413311      231.9297 12.29903  232.6275 11.04290  -0.6978149     16.52911  
1 1 1 2  6  24 o 186.1546 7.364671  23.18493       1.823236      21.96602       2.199573      25.86131       3.259329      180.9785 9.150597  195.8769 12.55346  -14.89841      15.53457  
1 1 1 2  6  25 f 121.5413 5.750792  9.884711       0.9287341     9.968440       1.134520      9.714618       1.617035      121.9291 7.012405  119.9299 10.21570  1.999176       12.39090  
1 1 1 2  6  26 o 176.1569 6.635929  20.77703       1.554883      19.67391       2.073014      22.19584       2.351002      171.0301 9.129194  181.5740 9.752643  -10.54391      13.35875  
1 1 1 2  6  27 o 87.71235 7.852295  5.197673       0.9080651     5.450722       1.229201      4.893661       1.347306      89.36324 10.52420  84.21123 12.37555  5.152016       16.24540  
1 1 1 2  6  28 o 38.41273 13.08997  0.9303228      0.8024999     -0.6514470     1.019234      3.510336       1.301707      27.42076 12.52370  70.51384 14.34255  -43.09307      19.04079  
1 1 1 2  6  29 o 115.6565 10.31945  9.115474       1.573690      9.421277       2.103111      8.726419       2.372169      116.5989 13.80352  111.2499 16.50133  5.349022       21.51350  
1 1 1 2  6  30 o 154.5313 8.954849  16.18722       1.836047      16.40338       2.998092      16.05750       2.322511      153.3118 14.86180  153.0768 11.46949  0.2350311      18.77291  
1 1 1 2  6  31 f 43.61144 14.41636  1.284828       0.9739675     2.352790       1.274497      -0.2144128     1.510069      56.89148 16.09425  36.63339 16.08425  20.25809       22.75364  
1 1 1 2  6  32 o 22.81152 10.87339  -1.121970      0.9151568     -3.287417      1.195389      1.944414       1.422488      20.43118 10.23973  52.23508 17.42726  -31.80391      20.21290  
1 1 1 2  6  33 o 47.21952 14.87674  1.635012       1.045145      2.366269       1.229140      -0.2738298     1.985874      55.81544 15.81054  40.31470 18.03032  15.50074       23.98052  
1 1 1 2  6  34 o 39.63856 17.44672  0.1466272      1.786826      1.758323       3.637852      -0.3658345     2.051324      56.68615 24.92406  39.52325 17.94038  17.16289       30.70938  
1 1 1 2  6  35 o 42.88464 14.85384  1.379196       1.034586      1.382224       1.055191      1.303938       5.260885      42.97436 14.99419  56.77556 26.76857  -13.80120      30.68195  
1 1 1 2  6  36 o 38.90194 13.48421  1.127625       0.8526581     1.370597       0.8700746     -4.759829      4.282949      42.01477 13.61018  41.14101 20.41967  0.8737526      24.53977  
1 1 1 2  6  37 o 39.78358 15.84616  1.111056       1.261375      1.034887       1.373729      1.520388       3.184570      39.72800 16.27788  48.31931 22.09455  -8.591309      27.44337  
1 1 1 2  7  0  o 703.8065 14.55634  330.8221       13.63828      330.8221       13.63828      330.8221       13.63828      703.8065 14.55634  703.8065 14.55634  0.000000       0.000000  
1 1 1 2  7  1  o 658.2935 9.459700  288.9988       8.297942      293.8409       11.86845      284.3683       11.60608      663.4653 13.42462  652.6910 13.34456  10.77423       18.92876  
1 1 1 2  7  2  f 952.2138 13.97265  605.3624       17.72911      583.0794       23.04755      637.6586       27.74685      933.7902 18.52260  975.9352 21.33630  -42.14508      28.25464  
1 1 1 2  7  3  o 308.5635 4.730036  63.45071       1.944834      62.31113       2.875338      64.41173       2.640469      305.7353 7.057809  310.8611 6.374427  -5.125885      9.510309  
1 1 1 2  7  4  o 181.0730 3.723938  21.84826       0.8985242     22.98886       1.439680      21.12050       1.149988      185.6276 5.827578  177.9562 4.854144  7.671478       7.584417  
1 1 1 2  7  5  o 1039.042 11.06864  720.2989       15.32502      704.0680       19.70677      745.1323       24.37594      1026.775 14.40345  1055.740 17.32731  -28.96472      22.53209  
1 1 1 2  7  6  o 651.2147 9.154289  282.8292       7.943691      285.8079       9.531668      276.0558       14.37329      654.4966 10.92919  642.3954 16.80557  12.10126       20.04681  
1 1 1 2  7  7  o 586.1794 9.542275  229.1936       7.453427      223.3618       10.13200      236.0715       11.00330      578.3763 13.14653  594.5289 13.88917  -16.15259      19.12434  
1 1 1 2  7  8  o 281.3416 5.453557  52.75782       2.044501      48.99911       2.561940      59.34939       3.392687      271.0034 7.100597  298.1899 8.547235  -27.18649      11.11187  
1 1 1 2  7  9  o 315.8021 6.766731  66.49239       2.847524      61.44044       4.309783      70.40638       3.793463      303.2257 10.68304  324.7698 8.773738  -21.54416      13.82411  
1 1 1 2  7  10 o 247.2508 5.839317  40.75397       1.923859      39.54855       3.072855      41.53107       2.467254      243.2667 9.497760  249.4420 7.431137  -6.175323      12.05940  
1 1 1 2  7  11 o 422.5512 7.200583  119.0809       4.054343      118.1881       4.872689      121.0898       7.309154      420.8670 8.688610  425.4304 12.90826  -4.563354      15.56005  
1 1 1 2  7  12 o 351.5540 6.585198  82.42617       3.084853      80.16581       5.265227      83.60765       3.806630      346.1628 11.43034  353.9752 8.070387  -7.812408      13.99228  
1 1 1 2  7  13 o 376.1352 6.517301  94.36375       3.266520      98.73175       5.532809      92.02658       4.047143      384.2241 10.81733  371.3317 8.179241  12.89243       13.56151  
1 1 1 2  7  14 o 280.8925 7.018694  52.64130       2.627060      55.21460       4.676373      51.45473       3.175495      287.0105 12.25572  277.4801 8.598655  9.530457       14.97129  
1 1 1 2  7  15 o 206.5741 5.916863  28.48384       1.627022      31.00796       3.235491      27.62951       1.882334      215.0304 11.33190  203.3773 6.956012  11.65302       13.29654  
1 1 1 2  7  16 o 244.0944 6.220583  39.76785       2.021661      55.16033       5.406488      37.26573       2.179792      286.5428 14.20392  236.2335 6.932185  50.30933       15.80527  
1 1 1 2  7  17 o 147.5696 7.752129  14.57370       1.519028      14.53846       2.287441      14.60150       2.031688      146.9637 11.77918  147.4487 10.40739  -0.4849548     15.71823  
1 1 1 2  7  18 o 271.6233 7.704147  49.27482       2.785648      50.90770       3.431634      46.11994       4.769966      275.9358 9.346451  262.0801 13.70628  13.85565       16.58970  
1 1 1 2  7  19 o 230.2596 6.991576  35.40271       2.142708      38.02482       3.152359      33.15088       2.921307      238.3814 9.945919  222.5591 9.875092  15.82234       14.01566  
1 1 1 2  7  20 o 286.0785 7.412133  54.64392       2.823163      55.48270       4.562433      54.12348       3.593819      287.7831 11.92338  284.5173 9.492540  3.265717       15.24058  
1 1 1 2  7  21 o 81.61951 13.32020  4.575153       1.398781      7.879414       2.251075      2.496852       1.785283      107.1537 16.27682  61.38242 19.45690  45.77126       25.36742  
1 1 1 2  7  22 o 223.3373 7.115345  33.32344       2.114834      37.49965       3.308289      30.43756       2.750121      236.5668 10.52117  213.1793 9.706761  23.38757       14.31489  
1 1 1 2  7  23 o 63.19976 12.68666  2.773630       1.031242      1.638921       1.511245      3.762418       1.410732      51.82770 17.95236  73.50618 14.91327  -21.67848      23.33866  
1 1 1 2  7  24 o 197.7688 9.545219  26.24789       2.508032      28.33711       3.388816      23.71766       3.729377      205.0006 12.46455  186.9361 15.10005  18.06453       19.58000  
1 1 1 2  7  25 o 111.4372 10.60336  8.411961       1.555564      9.111612       2.819811      8.105897       1.865023      114.0398 19.24018  108.8936 13.11698  5.146217       23.28604  
1 1 1 2  7  26 o 97.67799 4.899559  6.385931       0.6356797     6.170732       0.6772373     7.979705       1.843043      95.97432 5.316337  107.8873 13.08740  -11.91300      14.12599  
1 1 1 2  7  27 o 81.09064 6.662655  4.431139       0.7135881     4.168095       0.7918487     5.568030       1.646216      78.48154 7.669612  89.40572 14.29974  -10.92417      16.22670  
1 1 1 2  7  28 o 157.0474 7.936559  16.60514       1.655489      15.81879       2.067622      18.00964       2.763288      152.7498 10.21695  162.2302 12.88851  -9.480453      16.44688  
1 1 1 2  7  29 o 156.6624 8.571354  16.58219       1.782501      18.31658       2.310181      14.03050       2.802119      164.0794 10.62329  141.9877 15.03858  22.09174       18.41231  
1 1 1 2  7  30 o 106.9473 10.66039  7.858379       1.498991      7.009830       2.583530      8.289007       1.840457      97.14835 20.59737  109.1223 12.90677  -11.97395      24.30713  
1 1 1 2  7  31 o 59.86338 18.50876  2.627773       1.625839      2.319568       2.470371      2.863276       2.159437      60.13501 22.64992  62.95792 21.47231  -2.822910      31.21024  
1 1 1 2  7  32 o 32.23848 14.98124  -1.107207      1.550847      1.336732       2.362154      -2.958747      2.056031      52.32716 21.38163  32.00570 15.51724  20.32146       26.41891  
1 1 1 2  7  33 o 47.45700 18.59369  1.369722       1.710877      -1.790143      2.589503      3.817631       2.279186      39.81927 18.77596  67.56605 22.03837  -27.74678      28.95214  
1 1 1 2  7  34 o 89.15887 16.87632  6.320354       1.931603      3.400062       2.614104      9.832378       2.866742      61.91236 23.30381  107.5103 20.76257  -45.59799      31.21141  
1 1 1 2  7  35 o 30.50438 13.56610  -0.1014373     1.107849      -0.8391951E-01 1.134855      -0.4564193     5.108617      30.94681 13.74854  52.39684 25.16626  -21.45003      28.67687  
1 1 1 2  7  36 o 68.01306 15.32266  3.803575       1.355247      4.235995       1.403193      -2.201689      5.229143      72.10403 15.08964  47.65356 23.44819  24.45047       27.88396  
1 1 1 2  7  37 o 23.47543 11.21591  -0.9898180     0.9856547     -0.9805018     1.045230      -1.064624      2.961839      24.37037 11.61755  39.92545 19.17261  -15.55508      22.41777  
1 1 1 2  8  0  o 564.2762 9.090468  212.4055       6.831206      212.4055       6.831206      212.4055       6.831206      564.2762 9.090468  564.2762 9.090468  -0.000000      0.000000  
1 1 1 2  8  1  o 331.1450 2.558517  73.06542       1.128964      69.98147       2.543724      73.82191       1.259844      324.0298 5.891304  332.8520 2.840482  -8.822235      6.540321  
1 1 1 2  8  2  o 213.9279 4.468172  30.49841       1.273711      32.26640       1.926247      29.12477       1.697885      219.9137 6.580745  208.9451 6.104760  10.96855       8.976318  
1 1 1 2  8  3  o 1366.545 17.27386  1248.527       31.45480      1234.016       41.75196      1267.574       47.83319      1356.732 23.09454  1373.869 26.12826  -17.13696      34.87181  
1 1 1 2  8  4  o 249.9736 3.677762  41.63919       1.225043      42.45108       1.783315      40.91371       1.685744      252.3768 5.302798  247.7677 5.105914  4.609055       7.361387  
1 1 1 2  8  5  o 839.2709 8.200968  469.6919       9.171509      459.3819       12.26099      482.7893       13.81933      829.7196 11.08972  850.4592 12.19439  -20.73962      16.48287  
1 1 1 2  8  6  o 869.4583 10.92073  504.4586       12.65244      507.9290       16.92804      500.0659       19.04494      871.9084 14.57009  864.7863 16.52712  7.122192       22.03255  
1 1 1 2  8  7  o 366.3687 7.769554  89.50613       3.793045      84.74366       4.895207      96.66148       6.000259      356.2228 10.32367  380.3315 11.85400  -24.10864      15.71927  
1 1 1 2  8  8  o 676.7061 12.12303  305.7990       10.93163      307.3084       14.84899      304.0130       16.15244      677.7250 16.44258  673.5624 18.01262  4.162659       24.38878  
1 1 1 2  8  9  o 139.5998 0.7573774 12.98427       0.1408869     13.86914       1.491608      12.97631       0.1415196     143.9922 7.803113  139.5570 0.7610121 4.435211       7.840135  
1 1 1 2  8  10 o 623.3649 10.02470  259.4137       8.326974      250.9098       10.67792      272.6111       13.30210      612.6343 13.08012  638.1143 15.64401  -25.47998      20.39178  
1 1 1 2  8  11 o 292.6226 5.356411  57.08837       2.088600      57.43922       2.977909      56.74868       2.930123      293.3217 7.625391  291.5579 7.548363  1.763794       10.72960  
1 1 1 2  8  12 o 41.53721 10.00693  1.198750       0.5472752     2.344082       1.265310      0.9351776      0.6069889     58.20013 15.87800  37.29298 11.26687  20.90715       19.46929  
1 1 1 2  8  13 o 531.0276 7.383610  188.1641       5.224676      189.0291       6.955336      187.0439       7.914941      531.9379 9.812592  528.9182 11.23015  3.019714       14.91319  
1 1 1 2  8  14 o 329.0417 7.837331  72.26382       3.436312      82.10331       6.601198      68.60640       4.024606      349.7351 14.19428  320.3404 9.438698  29.39474       17.04601  
1 1 1 2  8  15 o 300.5879 6.563179  60.27440       2.628810      63.28683       5.159919      59.21841       3.055016      307.2302 12.63085  297.7732 7.705831  9.457031       14.79588  
1 1 1 2  8  16 o 139.6490 5.279457  13.02222       0.9806588     14.78488       2.686067      12.75114       1.053371      147.9334 13.78494  138.1578 5.734261  9.775574       14.93005  
1 1 1 2  8  17 f 295.2702 6.955163  58.16417       2.736531      65.92837       4.954464      54.75565       3.282703      313.7433 11.87225  286.2583 8.615778  27.48492       14.66908  
1 1 1 2  8  18 o 232.1751 5.940005  35.97180       1.836197      35.76539       3.016014      36.09337       2.314597      231.1913 9.812439  232.4598 7.482042  -1.268448      12.33957  
1 1 1 2  8  19 o 451.9126 7.736990  136.2811       4.659078      137.0103       5.768836      134.9134       7.900877      452.9326 9.558311  448.7693 13.22674  4.163269       16.31894  
1 1 1 2  8  20 o 471.1563 9.580439  148.2758       6.014838      156.2516       8.335535      139.6112       8.687935      482.9852 12.96340  456.2556 14.30777  26.72964       19.30705  
1 1 1 2  8  21 o 275.4478 7.493039  50.67595       2.747687      47.96563       3.641723      54.25805       4.186647      267.6839 10.22847  284.6162 11.06014  -16.93231      15.06481  
1 1 1 2  8  22 f 302.3836 6.525064  61.01778       2.629157      53.51078       3.582083      69.78501       3.871092      282.7582 9.520653  323.0206 9.002299  -40.26242      13.10283  
1 1 1 2  8  23 o 85.47184 11.06202  4.975558       1.230365      4.473338       2.030923      5.266750       1.546452      79.67918 19.32846  87.50013 13.71361  -7.820953      23.69921  
1 1 1 2  8  24 o 209.8364 8.038910  29.49495       2.243611      31.32307       3.489276      28.20632       2.929513      215.5106 12.20030  204.7521 10.77519  10.75851       16.27735  
1 1 1 2  8  25 o 41.86281 13.02842  1.176466       0.8040852     1.671448       1.754818      1.044919       0.9046445     53.48408 19.26919  40.84835 13.89848  12.63573       23.75856  
1 1 1 2  8  26 o 65.23859 12.23843  2.965928       1.024837      4.345461       1.971104      2.454841       1.199750      77.92104 19.12762  58.95702 15.18068  18.96402       24.41965  
1 1 1 2  8  27 o 99.84464 5.281003  6.681664       0.7001119     6.889710       0.7396936     4.892302       2.169304      101.3666 5.496817  82.25450 19.99033  19.11213       20.73230  
1 1 1 2  8  28 o 57.76633 8.953894  2.298473       0.6669334     2.876616       0.7484215     0.6880548E-01  1.469768      64.77575 8.906346  38.35160 16.34666  26.42414       18.61548  
1 1 1 2  8  29 f 91.02921 10.19157  5.681545       1.215022      6.671389       1.427134      3.074116       2.316262      98.49512 11.06481  66.33974 22.23998  32.15538       24.84042  
1 1 1 2  8  30 o 136.5349 9.032355  12.68788       1.634068      10.48487       2.138135      15.78154       2.533749      122.5225 13.30981  150.8486 12.72369  -28.32613      18.41313  
1 1 1 2  8  31 o 46.95227 17.79892  1.278567       1.531185      1.523850       3.133614      1.201634       1.754961      58.60415 24.35351  47.97738 18.82157  10.62677       30.77897  
1 1 1 2  8  32 o 147.1071 9.986748  15.02227       1.946027      13.96506       2.618791      16.32597       2.908082      138.8992 14.35569  149.9483 14.74481  -11.04913      20.57900  
1 1 1 2  8  33 o 67.20299 16.62062  3.546188       1.479980      4.656355       2.206831      2.638778       1.995156      74.00043 21.25845  57.66510 20.57364  16.33533       29.58372  
1 1 1 2  8  34 o 43.27226 18.42920  0.8090912      1.865485      -1.318917      2.140486      7.531338       3.804371      36.20085 17.07003  82.01595 28.47962  -45.81511      33.20354  
1 1 1 2  8  35 o 34.21896 15.68912  -0.4337054     1.620186      -0.6633734     1.966425      0.5177379E-01  2.858989      36.38343 16.89444  44.78595 20.64585  -8.402523      26.67720  
1 1 1 2  8  36 o 29.06279 14.11259  -1.977643      1.718255      -2.565350      2.084283      -0.7309814     3.035642      30.93825 15.13692  41.91327 19.92892  -10.97502      25.02575  
1 1 1 2  8  37 o 32.26963 14.74659  -0.2071365     1.415759      -0.7962931     1.574661      2.277993       3.234046      31.20776 14.69261  50.40253 22.73634  -19.19477      27.07054  
1 1 1 2  9  0  o 1348.652 19.51932  1215.488       35.06170      1215.488       35.06170      1215.488       35.06170      1348.652 19.51932  1348.652 19.51932  0.000000       0.000000  
1 1 1 2  9  1  o 344.1055 5.509516  78.92106       2.526263      77.92051       3.341115      80.25665       3.860190      341.8668 7.334339  346.9189 8.350397  -5.052063      11.11403  
1 1 1 2  9  2  o 863.1520 9.493186  496.9566       10.91875      498.4676       16.11533      495.6743       14.84558      863.8792 13.99951  861.6136 12.93038  2.265564       19.05730  
1 1 1 2  9  3  o 591.6212 9.121284  233.4562       7.190733      238.5007       10.47070      228.9535       9.892392      597.6273 13.14836  585.5902 12.67751  12.03705       18.26468  
1 1 1 2  9  4  o 484.9937 7.662440  156.8425       4.951955      161.5669       6.729797      151.2642       7.312706      492.0876 10.26328  476.0501 11.52795  16.03745       15.43465  
1 1 1 2  9  5  o 125.3617 2.108350  10.47131       0.3521934     10.56032       0.3673168     9.456755       1.240164      125.8930 2.189604  118.8246 7.876939  7.068405       8.175607  
1 1 1 2  9  6  o 231.8975 5.241716  35.84422       1.619732      35.35307       2.108214      36.55182       2.530456      230.1655 6.881593  233.9651 8.128948  -3.799652      10.65064  
1 1 1 2  9  7  o 578.5212 6.063037  223.1255       4.673939      222.7066       5.820692      223.8858       7.842221      577.8794 7.558992  579.1841 10.16129  -1.304749      12.66453  
1 1 1 2  9  8  o 494.3617 6.770656  162.9675       4.460145      166.5045       5.989625      158.5651       6.682261      499.5356 8.998282  487.3685 10.28946  12.16711       13.66902  
1 1 1 2  9  9  o 536.3997 8.411281  191.9839       6.012073      189.8693       6.674336      201.0810       13.84355      533.3400 9.391401  546.9733 19.02258  -13.63324      21.21454  
1 1 1 2  9  10 o 525.3025 3.939536  183.9166       2.757580      183.7149       6.734895      183.9573       3.022555      524.5371 9.635652  525.3411 4.317767  -0.8040161     10.55883  
1 1 1 2  9  11 o 82.72142 1.208313  4.559275       0.1331898     6.475732       1.665093      4.546934       0.1336179     97.50378 13.15071  82.60938 1.213841  14.89441       13.20661  
1 1 1 2  9  12 o 246.8310 4.204054  40.61211       1.382743      46.57773       3.399625      39.42958       1.513599      263.8846 9.684581  243.1969 4.670670  20.68768       10.75204  
1 1 1 2  9  13 o 269.5208 8.076658  48.53250       2.897392      55.51996       6.593781      46.86050       3.225470      286.9207 17.32718  264.7275 9.157457  22.19324       19.59822  
1 1 1 2  9  14 o 332.5049 8.438614  73.86114       3.735869      82.79420       5.704366      67.15201       4.943565      351.5471 12.19575  316.6250 11.73745  34.92206       16.92644  
1 1 1 2  9  15 o 240.5500 7.647700  38.65598       2.448260      37.86379       4.005723      39.12836       3.093255      237.5089 12.70312  241.8299 9.618323  -4.321030      15.93365  
1 1 1 2  9  16 o 105.5707 3.939333  7.439044       0.5531939     8.139296       1.987193      7.380219       0.5759610     109.3691 13.95281  105.1430 4.118890  4.226067       14.54806  
1 1 1 2  9  17 o 878.6282 10.62379  515.8723       12.43822      553.8049       21.17570      495.8909       15.36892      908.0568 17.50053  860.6911 13.40055  47.36572       22.04185  
1 1 1 2  9  18 o 304.1256 7.183543  61.70672       2.911154      63.92124       4.416067      60.00472       3.871467      309.0943 10.73819  299.5798 9.710994  9.514465       14.47799  
1 1 1 2  9  19 o 357.1263 6.994386  85.08573       3.328473      88.83093       4.377505      79.95300       5.124639      364.7442 9.006680  345.6616 11.14054  19.08261       14.32592  
1 1 1 2  9  20 o 303.5435 6.416424  61.46257       2.595299      61.52476       3.592265      61.39467       3.753668      303.3986 8.895090  303.0319 9.306987  0.3667297      12.87411  
1 1 1 2  9  21 o 220.0606 7.794929  32.37280       2.282135      30.18096       2.569649      40.55618       4.965182      212.3384 9.102940  245.2715 15.26770  -32.93304      17.77543  
1 1 1 2  9  22 o 341.6059 7.354782  77.93017       3.347871      76.35388       3.864963      82.66711       6.700034      337.8822 8.591302  350.3997 14.38015  -12.51755      16.75110  
1 1 1 2  9  23 o 167.0966 8.353038  18.71976       1.853985      17.61650       2.513271      20.03683       2.746024      161.5809 11.75318  172.3275 12.03412  -10.74652      16.82133  
1 1 1 2  9  24 o 39.56979 14.23213  0.8932037      0.9568211     -0.3454749     2.097540      1.218681       1.075205      43.73584 19.08530  44.25265 15.14999  -0.5168037     24.36742  
1 1 1 2  9  25 o 201.8811 8.361415  27.36246       2.244440      27.87647       3.140059      26.82552       3.209307      203.0494 11.65442  199.0440 12.15810  4.005447       16.84176  
1 1 1 2  9  26 o 45.10271 15.31648  1.295469       1.098593      0.2377301      1.755959      1.975780       1.408248      42.91340 18.05898  54.06038 17.29709  -11.14698      25.00632  
1 1 1 2  9  27 o 93.16573 12.85599  6.004812       1.553511      6.257807       2.983114      5.910668       1.819743      91.98696 24.06527  91.70294 15.43995  0.2840195      28.59247  
1 1 1 2  9  28 o 145.9738 5.702288  14.28597       1.107035      15.11725       1.191059      9.010083       3.000600      150.1233 5.965921  111.2224 21.01607  38.90088       21.84645  
1 1 1 2  9  29 o 133.5824 6.638944  12.01368       1.178036      11.49194       1.305088      14.30877       2.737214      130.4446 7.540409  143.1479 14.55200  -12.70322      16.38959  
1 1 1 2  9  30 o 112.4156 7.538690  8.570739       1.122738      8.512444       1.223114      8.882819       2.829956      111.8327 8.266189  108.9500 20.23783  2.882645       21.86091  
1 1 1 2  9  31 o 38.99383 16.73636  0.1630851      1.560248      -1.948098      1.925463      4.200209       2.662615      33.66046 15.96638  72.60126 23.82855  -38.94080      28.68319  
1 1 1 2  9  32 o 55.28836 13.40398  2.270741       0.9771474     3.038833       1.053278      -2.473723      2.617760      64.41766 12.72212  38.37040 18.31748  26.04726       22.30207  
1 1 1 2  9  33 o 34.43836 14.96838  0.1093904      1.279391      -1.226313      1.387928      7.661391       3.300221      28.93515 13.67469  88.99112 26.12414  -60.05597      29.48674  
1 1 1 2  9  34 o 38.61592 17.69716  -0.3986962     2.058354      1.124122       2.459740      -3.956406      3.759677      47.79974 20.76548  41.03179 20.12799  6.767956       28.91956  
1 1 1 2  9  35 o 32.18964 15.48634  -1.813230      1.952991      -0.5944940     2.308190      -4.884426      3.664128      38.95455 18.16084  38.00924 18.86899  0.9453049      26.18883  
1 1 1 2  9  36 o 49.95094 19.62143  2.254458       1.909429      0.7534963      2.402791      4.826691       3.145476      43.33285 19.56781  62.56389 24.98890  -19.23104      31.73869  
1 1 1 2  10 0  o 436.7372 7.047055  127.2276       4.098702      127.2276       4.098702      127.2276       4.098702      436.7372 7.047055  436.7372 7.047055  -0.000000      0.000000  
1 1 1 2  10 1  o 533.1649 2.960598  189.4188       2.103364      186.7097       5.436820      189.8956       2.280978      529.1398 7.710827  533.8296 3.206602  -4.689758      8.350997  
1 1 1 2  10 2  o 181.3141 2.597210  21.90537       0.6274976     21.43579       1.335229      22.03848       0.7108920     179.2396 5.597332  181.8616 2.933521  -2.621948      6.319468  
1 1 1 2  10 3  o 675.7639 7.406000  304.5120       6.668869      305.4513       9.373186      303.5492       9.490314      676.5248 10.39752  674.3973 10.56067  2.127563       14.82013  
1 1 1 2  10 4  o 275.1955 5.724821  50.48452       2.099310      51.40927       3.057339      49.65956       2.887668      277.5006 8.277360  272.7544 7.953642  4.746277       11.47933  
1 1 1 2  10 5  o 584.4930 8.138299  227.8763       6.338500      222.1803       8.486482      235.0628       9.532392      576.8648 11.04028  593.2328 12.05877  -16.36798      16.34937  
1 1 1 2  10 6  o 790.0593 9.039203  416.5093       9.516196      419.9854       13.11157      412.6399       13.83329      792.8153 12.41107  785.7014 13.21278  7.113953       18.12766  
1 1 1 2  10 7  o 354.7002 4.289978  83.85530       2.027636      80.89085       2.675475      87.85541       3.107884      348.3211 5.764314  362.9764 6.425588  -14.65530      8.632236  
1 1 1 2  10 8  o 351.3683 4.741246  82.29845       2.219875      81.24606       3.233103      83.23707       3.053358      349.0116 6.951942  353.2873 6.485988  -4.275757      9.507762  
1 1 1 2  10 9  o 400.1347 5.439136  106.7505       2.900078      104.5210       3.525706      111.4148       5.099583      395.8614 6.683891  408.4930 9.368641  -12.63156      11.50851  
1 1 1 2  10 10 o 128.5280 4.265422  11.02366       0.7295099     11.61120       1.870349      10.91824       0.7922582     131.3732 10.77891  127.8917 4.656681  3.481522       11.74179  
1 1 1 2  10 11 o 323.6620 4.655986  69.83732       2.008061      62.58452       10.58763      70.10794       2.045182      302.4580 26.53868  324.2852 4.732943  -21.82724      26.95741  
1 1 1 2  10 12 o 367.4594 7.066755  90.09213       3.460214      83.92529       5.782724      93.53168       4.318686      353.9367 12.27981  374.2733 8.659430  -20.33652      15.02596  
1 1 1 2  10 13 o 349.1357 9.186767  81.46645       4.270247      77.94315       5.995045      85.09509       6.084020      340.9275 13.22151  356.3127 12.83500  -15.38522      18.42676  
1 1 1 2  10 14 o 221.8788 9.654682  32.94825       2.847650      33.56612       3.219898      30.72994       6.101068      223.8249 10.82806  212.2530 21.88478  11.57190       24.41702  
1 1 1 2  10 15 o 239.8074 9.561425  38.46979       3.049209      45.97366       5.076371      34.23417       3.813899      261.5304 14.62484  225.8322 12.72537  35.69814       19.38610  
1 1 1 2  10 16 o 302.7032 8.839224  61.22533       3.561552      62.42025       4.503661      59.23053       5.818974      305.3950 11.08540  296.9579 14.75162  8.437073       18.45255  
1 1 1 2  10 17 o 260.6431 6.909761  45.34935       2.397726      49.01880       4.496346      43.89124       2.834357      270.4158 12.51218  256.3046 8.309962  14.11118       15.02032  
1 1 1 2  10 18 o 414.6938 9.717912  114.8620       5.369997      112.9886       8.456187      116.1281       6.951622      410.2276 15.49736  416.4435 12.54156  -6.215881      19.93637  
1 1 1 2  10 19 o 220.7810 8.755202  32.59785       2.570629      32.47934       3.475107      32.74108       3.820181      220.0317 11.89673  220.7666 13.04419  -0.7348633     17.65454  
1 1 1 2  10 20 o 173.3717 7.917086  20.10895       1.824187      19.76926       2.960458      20.31686       2.316127      171.2875 13.06927  174.0526 10.02885  -2.765091      16.47372  
1 1 1 2  10 21 o 72.79745 11.03365  3.627031       1.036801      5.791070       1.829662      2.603471       1.258330      91.55846 15.55261  61.05101 15.45564  30.50745       21.92625  
1 1 1 2  10 22 o 450.6195 8.097653  135.7318       4.862310      133.7202       6.128880      139.1481       7.987059      446.8194 10.29379  454.8446 13.19196  -8.025146      16.73291  
1 1 1 2  10 23 o 302.7294 8.278959  61.36971       3.336537      60.69281       4.144525      62.61635       5.624535      300.6238 10.36162  304.4010 13.90321  -3.777222      17.33962  
1 1 1 2  10 24 o 144.2649 10.71354  14.06637       2.044824      12.57899       2.374108      18.34045       4.024505      135.8445 13.28513  162.6399 18.92296  -26.79538      23.12084  
1 1 1 2  10 25 o 190.3226 8.796844  24.36337       2.224921      21.43939       3.679686      26.04844       2.793401      176.6294 15.80087  196.3679 10.71614  -19.73848      19.09196  
1 1 1 2  10 26 o 168.7359 11.27531  19.32821       2.520635      18.59618       3.980949      19.81809       3.256596      162.9023 18.67678  169.8470 14.52845  -6.944717      23.66216  
1 1 1 2  10 27 o 89.61803 10.21976  5.492822       1.198635      5.280062       1.945692      5.622954       1.521670      85.83430 17.60265  89.97307 13.07451  -4.138771      21.92706  
1 1 1 2  10 28 o 98.74531 10.81791  6.694186       1.400150      7.062677       2.149460      6.422584       1.845367      99.51505 16.80738  95.42582 15.00748  4.089226       22.53247  
1 1 1 2  10 29 o 47.73129 16.10958  1.523635       1.215211      -2.041728      1.919823      3.907134       1.569701      33.79249 16.00373  73.22121 16.48638  -39.42872      22.97651  
1 1 1 2  10 30 o 105.0611 6.043763  7.451362       0.8425321     7.201584       0.8941153     9.430639       2.516922      103.1645 6.537767  113.5158 17.17580  -10.35132      18.37799  
1 1 1 2  10 31 o 33.80533 12.82745  0.6176799      0.7957416     0.6011433      0.9382952     0.6600395      1.501735      35.21604 13.77797  41.42280 17.00108  -6.206764      21.88308  
1 1 1 2  10 32 o 21.17803 9.622957  -0.3060021     0.5920456     -0.3299526     0.6017851     0.4160171      3.304137      21.19723 9.658922  51.74026 23.18996  -30.54303      25.12109  
1 1 1 2  10 33 o 65.90651 13.27893  3.294093       1.125829      3.137303       1.359086      3.636952       2.009767      62.57117 16.18098  64.46651 20.66740  -1.895340      26.24816  
1 1 1 2  10 34 o 76.78725 11.87477  4.400766       1.175863      5.460473       1.455204      2.407191       1.995939      84.54282 13.36077  53.39693 20.30287  31.14589       24.30466  
1 1 1 2  10 35 o 50.91431 16.44607  2.201108       1.270990      1.953870       2.725401      2.269822       1.436795      50.36596 21.86939  51.20089 17.51357  -0.8349266     28.01777  
1 1 1 2  10 36 o 33.99481 14.63157  0.4131328      1.198801      -2.661983      2.906701      1.043404       1.315931      36.21317 17.75061  39.43918 16.01739  -3.226013      23.90902  
1 1 1 2  11 0  o 177.5233 4.477196  21.04071       1.057573      21.04071       1.057573      21.04071       1.057573      177.5233 4.477196  177.5233 4.477196  0.000000       0.000000  
1 1 1 2  11 1  o 242.9137 2.994349  39.32047       0.9692324     35.92730       1.901800      40.51100       1.126506      232.0532 6.155843  246.5574 3.428799  -14.50414      7.046351  
1 1 1 2  11 2  o 120.4370 4.842993  9.683984       0.7756405     8.944160       1.426179      9.994721       0.9242879     115.3928 9.355336  122.3107 5.686692  -6.917900      10.94810  
1 1 1 2  11 3  f 187.5738 3.556341  23.44739       0.8888922     23.76870       1.120692      22.90237       1.459572      188.8415 4.453643  185.2464 5.920527  3.595108       7.408615  
1 1 1 2  11 4  o 249.4730 4.761183  41.48509       1.582749      40.85979       2.615063      41.84657       1.988276      247.3565 7.944177  250.5247 5.955970  -3.168243      9.928925  
1 1 1 2  11 5  o 538.8861 2.949702  193.5176       2.118111      192.0446       6.720980      193.6800       2.231840      536.3627 9.403738  539.1066 3.106812  -2.743958      9.903665  
1 1 1 2  11 6  o 159.2305 4.389856  16.91293       0.9305408     16.01435       1.190302      18.32528       1.492282      154.8689 5.778057  165.6195 6.776168  -10.75060      8.905190  
1 1 1 2  11 7  o 368.1837 5.908081  90.39452       2.898575      91.90158       4.086925      88.86919       4.111595      371.0893 8.265035  364.9015 8.455925  6.187775       11.82428  
1 1 1 2  11 8  o 124.5862 5.011522  10.36496       0.8302829     10.10690       1.166762      10.62972       1.181777      122.8757 7.156926  126.0315 7.065209  -3.155807      10.05678  
1 1 1 2  11 9  o 197.3267 3.466632  25.95120       0.9115220     24.30304       1.273380      27.68328       1.305390      190.8581 5.011290  203.7747 4.807470  -12.91653      6.944407  
1 1 1 2  11 10 f 542.4585 1.631300  196.0690       1.179163      195.4583       1.262930      200.2201       3.292586      541.6100 1.749923  548.0350 4.508741  -6.425049      4.836422  
1 1 1 2  11 11 o 358.2987 6.323059  85.63078       3.018880      80.10138       5.610663      87.88389       3.581516      345.7890 12.19579  362.9048 7.406289  -17.11578      14.26851  
1 1 1 2  11 12 o 25.20211 6.962452  0.4364666      0.2415581     3.089886       2.076989      0.4000839      0.2432085     67.74289 20.91537  24.27317 7.082532  43.46972       22.08200  
1 1 1 2  11 13 o 428.7586 6.482486  122.6237       3.703633      114.6423       7.373271      125.3171       4.283190      413.5707 13.39708  433.3639 7.417218  -19.79318      15.31329  
1 1 1 2  11 14 o 145.8239 7.732975  14.22996       1.497247      15.04880       3.155983      13.99213       1.700835      148.9182 16.16316  144.4954 8.876376  4.422806       18.44011  
1 1 1 2  11 15 o 391.9044 7.208321  102.4675       3.764331      114.3783       6.139346      95.29191       4.765171      413.5214 11.15186  377.6311 9.477209  35.89029       14.63494  
1 1 1 2  11 16 o 390.5069 9.937892  101.9223       5.167059      104.5939       6.618176      97.75164       8.269163      395.2225 12.58279  381.4073 16.30807  13.81528       20.59805  
1 1 1 2  11 17 o 373.4919 10.26008  93.26430       5.101455      94.63366       6.439914      90.95731       8.358779      375.8526 12.87748  367.7029 17.10662  8.149719       21.41182  
1 1 1 2  11 18 o 252.1295 8.054260  42.47344       2.702498      43.52647       4.777547      41.97795       3.277208      254.5004 14.14342  250.4788 9.837958  4.021622       17.22852  
1 1 1 2  11 19 o 67.38421 3.698590  3.035662       0.3308257     -1.242103      1.872711      3.173460       0.3361118     37.16532 16.97486  68.90263 3.674070  -31.73730      17.36792  
1 1 1 2  11 20 o 299.8285 8.835587  60.12410       3.526207      67.38089       5.353171      54.56189       4.686651      316.7940 12.70699  285.0788 12.36683  31.71521       17.73150  
1 1 1 2  11 21 o 328.3116 7.981463  72.02976       3.491743      78.06763       4.614630      63.94242       5.340697      341.3315 10.15711  308.3000 13.02960  33.03149       16.52082  
1 1 1 2  11 22 o 23.86316 10.11312  0.1539323E-01  0.5570335     1.908253       1.712972      -0.2084374     0.5890481     55.40715 19.11679  22.38560 9.927324  33.02155       21.54074  
1 1 1 2  11 23 o 129.5368 8.806105  11.29443       1.510987      8.456783       2.387523      13.19031       1.951525      110.3587 16.76199  139.7433 10.55832  -29.38458      19.81016  
1 1 1 2  11 24 o 190.6737 9.758870  24.49082       2.471251      23.66245       4.644898      24.81787       2.918610      184.5632 19.16548  191.5448 11.48768  -6.981567      22.34463  
1 1 1 2  11 25 o 206.4315 8.139857  28.63744       2.234674      29.05008       4.914079      28.52985       2.509123      204.4708 18.22675  205.8053 9.172428  -1.334503      20.40460  
1 1 1 2  11 26 o 80.51402 15.54802  4.588199       1.607693      2.110190       2.411893      6.569560       2.156693      60.36137 22.45247  96.14156 17.47827  -35.78018      28.45352  
1 1 1 2  11 27 o 138.6232 10.48060  13.08195       1.921614      12.40459       3.020796      13.54236       2.490481      132.4703 17.54403  140.0891 13.50887  -7.618744      22.14232  
1 1 1 2  11 28 o 129.6264 12.51791  11.61679       2.135346      10.03638       3.317120      12.73515       2.790395      116.0130 22.26709  134.3458 15.89471  -18.33278      27.35809  
1 1 1 2  11 29 o 66.33368 11.88195  3.113396       1.011683      2.764066       2.202313      3.206830       1.138971      62.49261 21.67041  66.92858 13.24016  -4.435966      25.39505  
1 1 1 2  11 30 o 36.59925 15.31001  0.3216597      1.250466      3.664478       2.600567      -0.6836804     1.426160      68.71187 23.56024  32.69137 14.88595  36.02050       27.86892  
1 1 1 2  11 31 o 15.97874 8.012267  -2.062125      0.7363138     -2.158301      0.7931920     -1.462751      1.980126      16.73905 8.382319  35.43341 16.61700  -18.69436      18.61150  
1 1 1 2  11 32 o 34.63284 12.31252  0.7885574      0.7139732     0.2147968      0.8824872     1.875735       1.214768      30.38156 12.79480  49.48108 16.08577  -19.09952      20.55381  
1 1 1 2  11 33 o 51.60074 12.75371  2.036705       0.8718479     1.761685       1.197148      2.347307       1.272233      47.50579 15.98930  53.83110 16.32185  -6.325310      22.84865  
1 1 1 2  11 34 o 15.82004 7.749317  -1.003627      0.5511574     0.7311026      0.7180150     -3.492008      0.8599554     33.34155 12.27794  ?        ?         0.000000       12.27794  
1 1 1 2  11 35 o 71.36926 11.25400  3.851101       1.034847      3.761183       1.534496      3.926109       1.401517      65.26436 17.34850  68.36227 15.71471  -3.097908      23.40775  
1 1 1 2  12 0  o 615.3088 8.312407  252.5869       6.812632      252.5869       6.812632      252.5869       6.812632      615.3088 8.312407  615.3088 8.312407  -0.000000      0.000000  
1 1 1 2  12 1  o 311.6235 3.076187  64.71405       1.277369      64.41000       2.762587      64.79673       1.440619      310.7654 6.671289  311.8134 3.467216  -1.047974      7.518489  
1 1 1 2  12 2  o 469.1358 4.556672  146.7070       2.848524      143.2621       3.995259      150.2688       4.062423      463.4812 6.469032  474.6832 6.422553  -11.20203      9.115787  
1 1 1 2  12 3  o 335.4277 4.643045  75.00048       2.075274      77.59428       2.967143      72.51650       2.903648      341.0933 6.528174  329.7397 6.608442  11.35358       9.289164  
1 1 1 2  12 4  o 205.7587 3.874600  28.21758       1.062328      28.65401       1.330933      27.45140       1.763450      207.3231 4.817648  202.7725 6.535037  4.550583       8.118895  
1 1 1 2  12 5  o 703.3264 7.496175  330.0491       7.025385      334.9480       9.092607      322.7924       11.06648      708.1970 9.635202  694.7860 11.95322  13.41101       15.35307  
1 1 1 2  12 6  o 570.5646 3.339744  216.9613       2.539168      216.9700       2.681071      216.8862       7.909680      570.5662 3.526377  569.7264 10.41883  0.8397827      10.99943  
1 1 1 2  12 7  o 347.4381 5.860796  80.50106       2.713361      80.59509       3.276508      80.29583       4.840601      347.5672 7.074550  346.4827 10.49652  1.084564       12.65805  
1 1 1 2  12 8  o 295.2895 4.871798  58.13339       1.916950      59.51909       2.432503      55.86257       3.113939      298.7317 6.110807  289.1850 8.088867  9.546722       10.13764  
1 1 1 2  12 9  o 124.3350 3.326905  10.31042       0.5507021     11.12896       0.7051250     9.030364       0.8817838     129.1468 4.102611  116.2275 5.710991  12.91928       7.031844  
1 1 1 2  12 10 o 594.3610 6.769277  235.6685       5.361250      232.4732       6.722320      241.2529       8.886841      590.0927 8.549199  600.7110 11.10218  -10.61835      14.01240  
1 1 1 2  12 11 o 448.1278 7.044082  133.9819       4.206295      135.0429       5.653040      132.6658       6.295961      449.6526 9.434772  445.5327 10.60496  4.119965       14.19437  
1 1 1 2  12 12 o 219.6367 6.393836  32.20292       1.869293      30.39677       3.748592      32.80070       2.156559      212.6835 13.29346  221.6020 7.313232  -8.918518      15.17232  
1 1 1 2  12 13 o 343.5987 5.609419  78.72292       2.568283      91.18573       5.656691      75.48675       2.882509      369.1362 11.51420  336.4190 6.430084  32.71716       13.18798  
1 1 1 2  12 14 o 249.5210 7.605396  41.58102       2.525778      40.99051       3.833784      42.03390       3.357410      247.3408 11.66498  250.6532 10.07263  -3.312408      15.41199  
1 1 1 2  12 15 o 625.4280 10.73819  261.3715       8.949149      265.8011       11.26837      253.8056       14.72679      630.1929 13.41881  614.4418 18.00622  15.75104       22.45637  
1 1 1 2  12 16 o 302.6376 7.390833  61.10833       2.980505      58.71374       5.158148      62.30857       3.651859      295.9160 13.11390  305.3615 8.984598  -9.445557      15.89646  
1 1 1 2  12 17 o 229.4460 10.19219  35.24506       3.108396      30.12760       4.280127      40.95647       4.521686      211.4227 15.29600  246.9074 13.79825  -35.48463      20.59998  
1 1 1 2  12 18 o 111.8687 6.360131  8.375459       0.9441807     9.189388       2.158103      8.182784       1.050004      116.2219 14.23175  110.5021 7.169648  5.719810       15.93570  
1 1 1 2  12 19 o 400.1754 9.205836  107.0312       4.908933      105.7640       7.049955      108.2239       6.839392      396.8929 13.34929  401.6115 12.79654  -4.718597      18.49202  
1 1 1 2  12 20 o 290.4666 8.100883  56.42365       3.132404      59.26531       4.638128      54.04060       4.247393      297.0938 11.73900  283.7653 11.25517  13.32852       16.26293  
1 1 1 2  12 21 o 300.2069 7.747702  60.28974       3.096735      64.08369       4.368260      56.45668       4.390714      308.9711 10.62586  289.8147 11.39169  19.15646       15.57817  
1 1 1 2  12 22 o 155.2948 6.189838  16.13628       1.278318      15.10765       3.233213      16.32686       1.391712      148.2768 16.65133  156.1536 6.704040  -7.876831      17.95024  
1 1 1 2  12 23 o 83.63781 7.781706  4.724402       0.8573138     0.2554511      2.679029      5.234262       0.9048984     52.26675 22.16571  88.07037 7.791026  -35.80362      23.49508  
1 1 1 2  12 24 o 100.2165 9.127817  6.802613       1.205569      9.606374       2.547189      5.993247       1.368558      117.3295 16.76860  93.60844 11.19333  23.72107       20.16126  
1 1 1 2  12 25 o 206.9138 7.654871  28.76247       2.106937      25.45306       3.428341      30.77100       2.670841      192.9598 13.41706  213.5816 9.407570  -20.62177      16.38657  
1 1 1 2  12 26 o 56.50383 11.19558  2.236825       0.8131314     0.4912645      2.296709      2.486979       0.8694458     49.42276 20.71660  59.61966 11.35871  -10.19690      23.62621  
1 1 1 2  12 27 o 186.5215 7.918726  23.46614       1.963670      17.28531       3.527384      26.24183       2.363821      156.4003 17.20958  196.9069 9.033140  -40.50656      19.43623  
1 1 1 2  12 28 o 90.53064 9.670148  5.630162       1.148504      9.220380       3.172229      5.088564       1.232090      110.3074 22.34843  85.61572 11.05778  24.69167       24.93445  
1 1 1 2  12 29 o 93.34422 9.924178  6.027543       1.215500      2.467097       3.330624      6.574605       1.305546      64.18610 25.68788  97.42892 10.20747  -33.24283      27.64163  
1 1 1 2  12 30 o 37.24569 13.98662  0.7979143      0.9404685     4.091147       3.174660      0.4810984      0.9846674     70.86229 25.86232  34.57104 13.92169  36.29124       29.37130  
1 1 1 2  12 31 o 36.78246 16.71634  -0.5326597     1.787559      -1.973824      2.764130      0.5033351      2.343584      40.48280 19.18127  46.26770 20.18218  -5.784897      27.84316  
1 1 1 2  12 32 o 16.77762 7.925407  -0.4935268     0.4652037     -2.397531      0.6802157     1.179593       0.6376411     14.00013 7.100832  39.90348 11.41565  -25.90335      13.44391  
1 1 1 2  12 33 o 47.46251 13.02945  1.742798       0.8489855     1.495691       0.9155224     3.259845       2.268434      44.03058 13.93042  59.50874 21.83865  -15.47816      25.90334  
1 1 1 2  12 34 o 34.03425 14.34074  0.4600550      1.109567      2.587988       1.506826      -2.060450      1.639940      54.21278 17.93185  28.19121 13.71175  26.02157       22.57351  
1 1 1 2  12 35 o ?        ?         -1.748820      0.2639827     -1.750475      0.2662446     -1.652642      2.029507      ?        ?         32.61385 15.71482  0.000000       15.71482  
1 1 1 2  13 0  o 347.1395 7.258756  80.44928       3.354371      80.44928       3.354371      80.44928       3.354371      347.1395 7.258756  347.1395 7.258756  0.000000       0.000000  
1 1 1 2  13 1  o 311.6880 3.660976  64.74970       1.520514      62.85019       2.893868      65.47410       1.787076      306.9333 7.075567  313.4063 4.279191  -6.473083      8.268926  
1 1 1 2  13 2  o 127.1240 4.850750  10.78949       0.8201861     12.75988       1.310986      9.522266       1.051354      138.1110 7.147864  119.2957 6.639994  18.81535       9.756100  
1 1 1 2  13 3  o 564.4053 3.053802  212.2922       2.296707      201.9951       5.586484      214.3865       2.519474      550.1892 7.619966  567.1690 3.333679  -16.97980      8.317288  
1 1 1 2  13 4  o 373.1901 4.645638  92.84470       2.310197      91.24075       2.696325      97.27281       4.480098      369.9108 5.470181  381.6970 8.808363  -11.78619      10.36871  
1 1 1 2  13 5  o 329.9373 4.855279  72.57513       2.134613      69.29781       2.660560      78.49635       3.576177      322.3361 6.194277  342.9554 7.825426  -20.61923      9.980298  
1 1 1 2  13 6  o 628.5155 2.862195  263.2541       2.397114      259.5786       3.514203      266.4524       3.278156      624.0281 4.226192  632.2605 3.890990  -8.232422      5.744606  
1 1 1 2  13 7  o 126.2086 5.916599  10.64620       0.9922569     9.663165       1.370923      11.72780       1.438005      119.9985 8.631277  132.2982 8.197310  -12.29979      11.90356  
1 1 1 2  13 8  o 290.7108 5.769346  56.35913       2.234916      63.24326       3.114386      49.05019       3.209036      307.8509 7.592040  270.8893 8.902244  36.96158       11.69996  
1 1 1 2  13 9  o 523.9406 6.562558  183.1138       4.581722      185.2365       5.593546      178.7858       7.987123      526.8211 7.968023  517.0643 11.59237  9.756775       14.06672  
1 1 1 2  13 10 o 170.1814 4.825576  19.32348       1.093191      20.09526       1.332633      17.73558       1.911512      173.4974 5.772303  162.7469 8.847634  10.75050       10.56410  
1 1 1 2  13 11 o 57.43908 13.27692  2.296479       0.9958478     -0.8317491     1.435755      5.196700       1.382441      33.20547 15.04737  87.31242 12.21606  -54.10695      19.38184  
1 1 1 2  13 12 o 650.1758 5.055897  281.8290       4.380287      303.9498       11.58493      278.1390       4.731538      674.0122 12.89888  645.8674 5.497756  28.14484       14.02164  
1 1 1 2  13 13 o 210.8266 7.158904  29.68553       2.008237      34.82705       4.403866      28.33563       2.256520      227.5701 14.59965  205.8890 8.241588  21.68105       16.76525  
1 1 1 2  13 14 o 252.4268 4.887142  42.47901       1.643857      50.92783       4.640615      41.26673       1.757840      275.6340 12.66871  248.7857 5.302497  26.84830       13.73363  
1 1 1 2  13 15 o 262.7910 8.309722  46.13957       2.906192      48.36850       4.733504      44.79106       3.681820      268.5020 13.27118  258.6790 10.70452  9.822998       17.05025  
1 1 1 2  13 16 o 316.1765 7.554634  66.71065       3.182853      65.75500       5.020006      67.35307       4.115907      313.2904 12.04741  317.3794 9.743792  -4.089020      15.49457  
1 1 1 2  13 17 o 36.01537 14.11701  0.5076735      0.9865808     1.318825       2.372943      0.3381568      1.084783      56.22415 21.93587  35.79306 14.54048  20.43109       26.31745  
1 1 1 2  13 18 o 231.8797 6.074915  35.89745       1.875436      29.70665       3.878183      37.78712       2.142630      209.9442 13.94178  237.8507 6.767228  -27.90657      15.49738  
1 1 1 2  13 19 o 228.1912 8.341570  34.84777       2.532146      33.52635       3.659363      36.06176       3.507456      223.2212 12.35073  231.6969 11.39548  -8.475693      16.80469  
1 1 1 2  13 20 o 275.9111 9.772371  51.05273       3.587205      45.12177       4.571965      60.55136       5.785901      258.6338 13.31090  299.3681 14.54769  -40.73431      19.71840  
1 1 1 2  13 21 o 323.0697 8.123569  69.89721       3.494395      75.23405       4.988788      64.75671       4.896157      334.4200 11.21098  310.0501 11.87280  24.36990       16.32941  
1 1 1 2  13 22 o 245.3500 8.723557  40.40714       2.847485      36.43747       5.346606      41.97890       3.364306      230.3462 17.55116  249.7613 10.12976  -19.41507      20.26463  
1 1 1 2  13 23 o 227.8977 6.421028  34.77090       1.947982      30.55657       3.274930      37.07835       2.423280      212.4511 11.61245  235.0895 7.746225  -22.63838      13.95898  
1 1 1 2  13 24 o 43.29671 13.06637  1.285101       0.8166838     3.364342       2.230438      0.9631802      0.8776315     69.21492 21.72259  39.48532 13.68058  29.72960       25.67156  
1 1 1 2  13 25 f 159.9295 7.267586  17.19494       1.544741      16.07302       2.950465      17.61860       1.813099      152.5094 14.70039  161.6403 8.447104  -9.130890      16.95450  
1 1 1 2  13 26 o 116.9962 7.362069  9.233802       1.141925      6.434070       2.882486      9.754997       1.243681      92.61491 23.36264  120.1742 7.808764  -27.55930      24.63310  
1 1 1 2  13 27 o 89.42284 10.08966  5.500378       1.181292      4.408425       2.879143      5.721406       1.295342      76.62255 24.75292  90.99103 10.90013  -14.36848      27.04662  
1 1 1 2  13 28 o 155.3004 8.961767  16.45313       1.846679      11.58571       4.341380      17.52838       2.040481      118.6468 27.92696  160.0323 9.612982  -41.38553      29.53514  
1 1 1 2  13 29 o 33.36478 13.97149  0.2431314      1.043010      -4.654973      2.736475      1.075654       1.128172      34.89450 17.12847  41.83913 15.39317  -6.944626      23.02899  
1 1 1 2  13 30 o 31.73569 13.81137  -0.1679197E-01 1.092171      -1.329696      3.037662      0.1781265      1.170441      44.87303 20.89117  34.11107 14.56474  10.76196       25.46709  
1 1 1 2  13 31 o 42.89523 14.75495  1.330976       1.020195      -1.226975      2.672570      1.767290       1.103780      41.34573 19.36248  48.09861 15.30521  -6.752888      24.68106  
1 1 1 2  13 32 o 51.38921 19.84306  2.059618       1.926405      0.6870884      3.571282      2.622871       2.287783      51.03012 23.35804  55.78962 21.60215  -4.759491      31.81589  
1 1 1 2  13 33 o 30.47240 7.780516  0.6721244      0.3169852     0.6106438      0.3256975     1.775401       1.379709      29.07675 8.104265  47.13444 17.07195  -18.05770      18.89790  
1 1 1 2  13 34 o 47.46295 11.47218  1.739792       0.7174497     2.497445       0.8777762     0.2149469      1.245264      56.79016 11.97704  33.38115 14.63267  23.40901       18.90938  
1 1 1 2  14 0  o 390.6438 3.226173  101.7083       1.679096      101.7083       1.679096      101.7083       1.679096      390.6438 3.226173  390.6438 3.226173  -0.000000      0.000000  
1 1 1 2  14 1  f 336.8117 4.007690  75.61536       1.798684      72.24974       2.783335      78.02879       2.356952      329.1210 6.346529  342.0943 5.170486  -12.97330      8.186108  
1 1 1 2  14 2  o 513.4252 5.973164  175.8020       4.086534      176.1093       5.510735      175.4266       6.091233      513.6680 8.051066  512.5680 8.918261  1.100037       12.01478  
1 1 1 2  14 3  o 567.5476 3.776209  214.6933       2.855827      211.7075       3.145126      228.7201       6.816890      563.5618 4.188157  585.2944 8.740542  -21.73260      9.692148  
1 1 1 2  14 4  o 81.94634 6.095092  4.503296       0.6607882     4.051257       0.8088308     5.410510       1.145840      77.50762 7.943674  89.47116 9.769543  -11.96354      12.59150  
1 1 1 2  14 5  o 384.0391 5.606507  98.34814       2.869071      100.0961       3.785043      95.98737       4.398717      387.3192 7.333788  379.1730 8.705930  8.146179       11.38322  
1 1 1 2  14 6  o 429.2663 5.720618  122.8803       3.272226      122.5206       4.301819      123.3742       5.040789      428.4980 7.534072  429.8678 8.800150  -1.369781      11.58468  
1 1 1 2  14 7  o 270.9091 5.283415  48.93440       1.907269      49.90272       2.818099      48.11600       2.590786      273.3504 7.744635  268.4486 7.249276  4.901825       10.60808  
1 1 1 2  14 8  f 500.4359 6.787009  167.0550       4.525852      162.2279       5.691079      175.3604       7.464995      492.9674 8.663690  512.2366 10.93668  -19.26920      13.95243  
1 1 1 2  14 9  o 796.4594 10.03163  423.7275       10.64654      436.9961       12.53182      389.3098       20.18334      808.4759 11.63251  760.3016 19.93924  48.17432       23.08438  
1 1 1 2  14 10 o 225.3974 4.736241  33.86758       1.422513      32.30534       1.734022      37.08258       2.487540      220.0234 5.919798  235.6012 7.934858  -15.57780      9.899796  
1 1 1 2  14 11 o 423.3267 5.141229  119.4749       2.900121      118.7883       4.155804      120.1267       4.049060      421.9626 7.391074  424.3506 7.160707  -2.387970      10.29095  
1 1 1 2  14 12 o 210.2250 3.186372  29.45241       0.8925951     29.09147       0.9538532     31.99480       2.531543      208.9288 3.426176  218.7625 8.701745  -9.833618      9.351954  
1 1 1 2  14 13 o 176.3939 8.195354  20.80998       1.921039      20.04691       3.191612      21.24348       2.405600      172.4785 14.00724  178.0432 10.18214  -5.564651      17.31701  
1 1 1 2  14 14 o 179.0967 6.042133  21.41556       1.439889      22.99904       2.919116      20.90640       1.655272      185.0711 11.90000  176.8855 7.036732  8.185547       13.82482  
1 1 1 2  14 15 o 467.7756 7.750392  146.0395       4.830975      159.8443       7.818105      137.5127       6.144403      488.7945 12.00333  453.6318 10.16489  35.16269       15.72911  
1 1 1 2  14 16 o 263.1346 8.676035  46.29491       3.037935      54.61002       5.526497      42.69428       3.636678      284.9388 14.60414  252.4280 10.83694  32.51083       18.18571  
1 1 1 2  14 17 o 406.4092 8.424026  110.3453       4.562016      112.3675       6.325172      108.1529       6.586063      409.4550 11.60462  401.5437 12.32349  7.911285       16.92737  
1 1 1 2  14 18 o 150.3781 7.381002  15.14043       1.474500      13.85588       2.637176      15.72462       1.778463      142.8954 14.03063  153.1098 8.753507  -10.21436      16.53730  
1 1 1 2  14 19 o 388.5335 8.220525  100.9608       4.255999      107.6841       7.296643      97.49387       5.239637      399.6816 13.72082  381.2499 10.32328  18.43167       17.17064  
1 1 1 2  14 20 o 284.3914 10.95547  54.40466       4.143886      57.70376       6.690304      52.35122       5.278258      290.8465 17.34143  278.0329 14.29491  12.81360       22.47375  
1 1 1 2  14 21 o 38.20272 16.86652  -0.4598376     1.682071      -1.679001      2.258204      1.059664       2.521058      39.72415 18.32546  55.20444 22.26007  -15.48030      28.83285  
1 1 1 2  14 22 o 212.8961 10.04065  30.55607       2.840389      26.66507       3.876485      35.06684       4.173807      197.4555 14.84177  226.9305 13.86900  -29.47499      20.31322  
1 1 1 2  14 23 o 314.7008 10.30563  66.83798       4.315786      65.71424       5.214995      69.28027       7.688107      311.0568 12.60786  316.0978 18.33123  -5.040985      22.24842  
1 1 1 2  14 24 o 121.4363 11.00592  10.05535       1.761617      11.15500       2.735164      9.275844       2.302850      126.1927 16.67338  115.3406 15.36525  10.85210       22.67361  
1 1 1 2  14 25 o 86.23412 7.560947  5.034860       0.8600360     5.227522       2.608449      5.011362       0.9109762     83.86446 22.76356  85.94014 8.048593  -2.075684      24.14456  
1 1 1 2  14 26 o 81.11126 9.798849  4.523649       1.037643      6.529451       2.933692      4.236837       1.109352      92.50379 23.69686  78.15871 10.95184  14.34508       26.10525  
1 1 1 2  14 27 o 40.78618 13.14139  1.134482       0.8118532     2.578879       3.042925      1.023787       0.8423882     64.42416 24.92220  39.52686 13.41223  24.89730       28.30201  
1 1 1 2  14 28 o 39.47312 16.36351  0.4726251      1.409892      -3.686554      3.224700      1.455589       1.567668      41.37203 19.90283  48.44381 18.08533  -7.071781      26.89241  
1 1 1 2  14 29 o 33.38228 15.86582  -1.893773      1.919912      6.926507       5.313686      -3.218137      2.059010      83.45508 32.74732  31.11656 15.18545  52.33852       36.09688  
1 1 1 2  14 30 o 56.97404 20.52720  2.574655       1.991447      4.638844       3.776743      1.779710       2.343750      70.15023 27.58353  52.60957 21.37255  17.54066       34.89465  
1 1 1 2  14 31 o 36.61946 16.03874  0.1579387      1.493291      -2.826661      3.751509      0.7198659      1.627807      43.61967 21.10315  41.17728 17.36125  2.442398       27.32683  
1 1 1 2  14 32 o 45.47488 18.82980  1.289744       1.863931      1.409740       2.891095      1.204388       2.438349      50.25220 22.15243  47.61009 20.67911  2.642109       30.30438  
1 1 1 2  14 33 o 44.41285 18.46088  1.331506       1.801295      0.4686385      4.053511      1.543826       2.010736      49.17145 23.27739  46.45394 19.42192  2.717506       30.31580  
1 1 1 2  14 34 f 49.28601 21.51523  1.975754       2.667781      9.842672       8.638841      1.146436       2.804875      62.67593 30.69681  46.30466 21.00265  16.37127       37.19416  
1 1 1 2  15 0  o 145.2176 5.528542  14.11680       1.066276      14.11680       1.066276      14.11680       1.066276      145.2176 5.528542  145.2176 5.528542  -0.000000      0.000000  
1 1 1 2  15 1  o 250.2696 5.245469  41.76131       1.749306      41.84444       2.928555      41.71519       2.181187      250.2009 8.797663  249.9951 6.553338  0.2058105      10.97019  
1 1 1 2  15 2  o 288.1144 4.969326  55.34198       1.907814      53.70533       2.743806      56.87384       2.654521      283.6251 7.265960  291.9911 6.822493  -8.365967      9.966975  
1 1 1 2  15 3  o 229.7403 5.704871  35.19528       1.746452      33.69862       2.778666      36.17260       2.245397      224.4534 9.310662  232.7356 7.249144  -8.282150      11.79994  
1 1 1 2  15 4  f 356.7787 4.839810  84.85982       2.300916      81.74807       3.463927      87.31699       3.078107      350.0338 7.426516  361.8268 6.384243  -11.79300      9.793451  
1 1 1 2  15 5  o 377.4454 5.399593  94.98869       2.715743      93.42388       3.447987      97.54574       4.407623      374.2353 6.914287  382.2711 8.652857  -8.035797      11.07607  
1 1 1 2  15 6  o 590.9383 5.682959  232.8522       4.474971      234.2173       5.210990      229.0175       8.733625      592.5842 6.599282  585.3682 11.19675  7.215942       12.99683  
1 1 1 2  15 7  o 320.8851 5.593233  68.65595       2.391586      68.38885       2.943954      69.17432       4.101224      320.1959 6.899885  321.7129 9.577570  -1.517029      11.80416  
1 1 1 2  15 8  o 719.2056 7.980116  345.1623       7.647787      340.2849       8.921621      358.6781       14.85148      713.8952 9.378552  731.6539 15.23318  -17.75873      17.88873  
1 1 1 2  15 9  o 274.8773 5.595952  50.37898       2.049682      48.82225       2.337294      55.56236       4.264946      270.5622 6.482950  288.1379 11.12902  -17.57571      12.87959  
1 1 1 2  15 10 o 446.0623 7.170487  132.7325       4.262042      128.0934       5.088943      143.6306       7.799911      438.0672 8.717928  463.2325 12.64805  -25.16531      15.36150  
1 1 1 2  15 11 o 544.5300 6.615915  197.7674       4.800486      204.5946       7.289514      192.5392       6.379045      553.4824 9.883739  537.0485 8.913919  16.43390       13.30963  
1 1 1 2  15 12 o 144.1158 5.816935  13.87226       1.114772      17.75573       2.796189      13.13837       1.215551      162.3805 13.03221  140.1990 6.524504  22.18156       14.57421  
1 1 1 2  15 13 o 324.7309 6.864750  70.34801       2.970448      73.09776       3.714370      65.46914       4.947646      330.8011 8.433328  312.6403 11.89798  18.16077       14.58366  
1 1 1 2  15 14 o 199.5637 7.273687  26.61233       1.931001      26.29638       2.802700      26.89783       2.664253      198.0393 10.65995  200.3716 10.01021  -2.332260      14.62323  
1 1 1 2  15 15 o 350.7482 9.128279  82.25874       4.262738      80.03354       6.542027      83.90057       5.619447      345.0830 14.25778  353.7892 11.93707  -8.706268      18.59510  
1 1 1 2  15 16 o 371.1310 7.467497  91.97732       3.692970      89.15290       6.082370      93.62646       4.647702      364.4273 12.54401  374.2075 9.320781  -9.780212      15.62783  
1 1 1 2  15 17 o 174.9427 1.202159  20.39227       0.2802408     22.42699       3.280473      20.37731       0.2812690     182.1582 13.61340  174.8784 1.207013  7.279724       13.66680  
1 1 1 2  15 18 o 425.2183 10.80704  121.3692       6.118432      115.4082       7.872743      130.4609       9.722673      413.4779 14.31052  438.6432 16.66446  -25.16528      21.96577  
1 1 1 2  15 19 o 142.1916 4.495898  13.50312       0.8507811     11.86748       4.045304      13.57881       0.8702450     128.9091 24.44442  142.5831 4.586330  -13.67403      24.87095  
1 1 1 2  15 20 o 154.3926 7.839443  16.00190       1.607539      13.96545       2.837146      16.96482       1.950920      142.6911 15.15285  158.7505 9.262781  -16.05940      17.75973  
1 1 1 2  15 21 o 63.29849 17.34020  2.834910       1.505496      1.874888       1.793390      5.125991       2.770475      55.24495 19.52612  84.20041 23.69753  -28.95546      30.70573  
1 1 1 2  15 22 o 138.8018 14.41964  13.26272       2.628180      12.72945       3.735704      13.78533       3.698195      133.3009 21.78291  139.3439 20.53186  -6.043030      29.93414  
1 1 1 2  15 23 o 58.34111 18.64141  2.339302       1.636073      0.4459032      3.060157      3.097116       1.935993      55.72898 23.66426  66.13425 20.15117  -10.40527      31.08162  
1 1 1 2  15 24 f 33.68994 14.78310  -0.2510593     1.273919      -0.5769753E-01 2.576765      -0.3136087     1.465552      49.09425 21.29126  35.90096 15.80115  13.19329       26.51403  
1 1 1 2  15 25 o 129.5005 6.447230  11.28526       1.109048      10.93126       3.392789      11.32761       1.173516      121.5548 21.74483  129.6687 6.815661  -8.113831      22.78795  
1 1 1 2  15 26 o 142.5446 6.811831  13.71289       1.290119      8.685546       4.482533      14.16694       1.347119      101.7211 30.59283  144.8389 7.000599  -43.11775      31.38359  
1 1 1 2  15 27 o 48.89330 13.34163  1.731998       0.8932484     0.3278331      3.369133      1.838163       0.9264011     54.68309 24.01651  50.30382 13.52828  4.379269       27.56460  
1 1 1 2  15 28 o 67.02080 11.82253  3.229817       1.017251      1.657492       3.484541      3.376302       1.063582      59.11940 25.18316  68.44427 12.10438  -9.324871      27.94115  
1 1 1 2  15 29 o 36.20006 14.08761  0.7043184      0.9767255     -0.2081545     3.558666      0.7786552      1.015732      50.90931 23.30800  37.29556 14.40664  13.61375       27.40099  
1 1 1 2  15 30 o 42.25951 18.65868  0.2945063      2.058802      -1.693748      6.909770      0.4882151      2.156763      57.56037 28.03005  43.87797 19.24492  13.68240       34.00075  
1 1 1 2  15 31 o 46.35541 18.17680  1.520442       1.636135      6.293310       4.652241      0.8467953      1.747788      71.06203 29.61362  42.39228 17.93740  28.66974       34.62249  
1 1 1 2  15 32 o 50.21933 21.37090  1.894292       2.505086      -9.425245      10.76241      2.542695       2.575835      52.74171 26.89298  53.67739 22.17227  -0.9356766     34.85459  
1 1 1 2  15 33 o 34.90798 16.00308  -0.2412882     1.684988      0.2323952      3.314430      -0.4063791     1.956710      45.50705 21.39085  36.37791 16.87839  9.129143       27.24791  
1 1 1 2  16 0  o 472.5688 5.142100  148.8906       3.237154      148.8906       3.237154      148.8906       3.237154      472.5688 5.142100  472.5688 5.142100  0.000000       0.000000  
1 1 1 2  16 1  o 202.5095 4.855410  27.33904       1.310222      25.48849       1.843813      29.22667       1.862191      195.3438 7.095219  209.2238 6.688026  -13.87994      9.750478  
1 1 1 2  16 2  o 470.7122 4.079838  147.6827       2.559010      148.6360       3.089236      145.5981       4.568098      472.1864 4.909804  467.1681 7.338186  5.018280       8.829222  
1 1 1 2  16 3  o 477.3123 7.485129  151.9974       4.760751      153.3567       5.978617      149.6417       7.870222      479.2592 9.361745  472.8645 12.50138  6.394714       15.61815  
1 1 1 2  16 4  o 350.5416 5.080938  81.92028       2.373324      83.88885       3.431963      80.11605       3.285594      354.6140 7.262952  346.5569 7.114850  8.057068       10.16718  
1 1 1 2  16 5  o 508.6858 4.877214  172.4999       3.305939      173.5834       4.033367      170.2819       5.770856      510.2114 5.932586  505.1058 8.574018  5.105621       10.42638  
1 1 1 2  16 6  o 920.1569 7.702945  564.9096       9.444789      553.7484       12.58538      579.2998       14.29039      910.5005 10.37320  930.9934 11.51924  -20.49292      15.50149  
1 1 1 2  16 7  o 429.8880 5.231791  123.2079       2.996948      123.7908       3.734876      122.1539       5.022062      430.8268 6.505790  427.7885 8.810073  3.038300       10.95183  
1 1 1 2  16 8  o 224.6498 6.137151  33.67999       1.835436      33.48633       2.163047      34.17803       3.468791      223.9287 7.258667  225.8351 11.56543  -1.906403      13.65458  
1 1 1 2  16 9  o 129.9174 6.794636  11.28899       1.172182      10.85975       1.298637      13.17659       2.723290      127.3460 7.688774  139.4713 14.88300  -12.12534      16.75175  
1 1 1 2  16 10 o 176.4133 1.026228  20.73566       0.2412395     20.74417       0.2420622     19.49038       2.928540      176.4494 1.029516  170.1768 13.01320  6.272659       13.05386  
1 1 1 2  16 11 o 512.0995 7.883498  175.0202       5.379561      173.4639       7.076085      177.1515       8.280887      509.4952 10.42268  514.6220 12.07577  -5.126770      15.95169  
1 1 1 2  16 12 o 246.1503 4.577375  40.39384       1.501379      40.96746       1.785008      39.00664       2.775849      247.8614 5.404530  241.5404 8.638383  6.320969       10.18973  
1 1 1 2  16 13 o 74.70807 1.021180  3.718721       0.1016584     3.730860       0.1021827     2.544897       1.004831      74.82990 1.024775  60.50399 12.86005  14.32591       12.90082  
1 1 1 2  16 14 o 381.0963 7.501628  96.97057       3.809464      98.71947       5.322269      95.13336       5.454972      383.9996 10.41103  376.8724 10.87374  7.127167       15.05416  
1 1 1 2  16 15 o 271.0709 5.695558  49.02657       2.057276      47.67284       2.558285      51.50425       3.461040      267.0922 7.194654  277.3399 9.378772  -10.24765      11.82051  
1 1 1 2  16 16 o 116.4819 8.345484  9.118675       1.286756      6.557405       2.049648      10.78479       1.653120      97.25230 16.39903  126.5268 9.883382  -29.27449      19.14705  
1 1 1 2  16 17 o 217.2468 4.095905  31.47747       1.185705      22.59327       6.020441      31.83598       1.209392      178.8237 26.02902  218.4772 4.154202  -39.65349      26.35844  
1 1 1 2  16 18 o 42.40429 7.466885  1.238034       0.4065085     0.9582688      2.308152      1.246990       0.4129636     52.94423 21.31676  42.54614 7.561181  10.39809       22.61804  
1 1 1 2  16 19 o 107.4587 4.865295  7.724583       0.6948581     3.544568       2.764814      8.006404       0.7179002     72.69487 24.29704  109.3988 4.937403  -36.70396      24.79362  
1 1 1 2  16 20 o 60.15780 5.810057  2.441428       0.4599538     -2.806705      2.607409      2.609984       0.4672817     39.69546 18.75488  62.23233 5.698111  -22.53687      19.60137  
1 1 1 2  16 21 o 148.2296 13.42755  15.04733       2.623455      16.63000       3.456752      12.89743       4.028864      154.6561 17.05661  133.4518 23.51485  21.20428       29.04955  
1 1 1 2  16 22 o 111.1845 12.19755  8.485208       1.777500      9.596986       3.164634      7.972812       2.148408      115.1652 21.40974  106.7609 15.55919  8.404297       26.46631  
1 1 1 2  16 23 o 82.96894 13.03528  4.805649       1.393684      6.646438       3.136637      4.352837       1.555684      93.99675 24.71825  78.20208 15.47703  15.79467       29.16385  
1 1 1 2  16 24 o 159.8029 10.09400  17.39143       2.138438      15.00146       3.392867      18.96654       2.754398      145.0025 17.94216  165.9504 12.54889  -20.94792      21.89511  
1 1 1 2  16 25 o 117.4355 14.03556  9.713044       2.152917      10.10598       4.264697      9.578656       2.494046      111.2698 28.60620  115.3565 16.71130  -4.086678      33.12978  
1 1 1 2  16 26 o 55.88820 5.615889  2.120367       0.4125643     6.263681       3.993071      2.075659       0.4147842     86.06576 29.20106  55.27188 5.714059  30.79388       29.75487  
1 1 1 2  16 27 o 46.67509 10.91855  1.571440       0.6669322     -0.4080009     3.692085      1.638208       0.6780871     52.94746 24.04756  47.66922 10.91138  5.278240       26.40726  
1 1 1 2  16 28 o 71.33708 10.08052  3.610823       0.9315633     1.374447       3.282484      3.806723       0.9715078     55.49782 24.04965  73.20962 10.23832  -17.71180      26.13827  
1 1 1 2  16 29 o 72.82201 12.15739  3.911068       1.138151      4.775907       4.000160      3.834888       1.187221      69.15703 27.98472  71.67307 12.90544  -2.516037      30.81712  
1 1 1 2  16 30 o 51.04448 15.24412  2.066123       1.115929      -2.749342      5.321298      2.287640       1.141308      50.20196 24.48030  53.60036 15.25267  -3.398403      28.84318  
1 1 1 2  16 31 o 40.59543 18.54426  -0.7536813E-01 2.236073      6.350959       9.124490      -0.4859650     2.306402      64.48953 31.57728  39.54192 18.33889  24.94762       36.51629  
1 1 1 2  16 32 o 46.16031 20.00010  1.372678       2.269389      -2.981668      3.808180      3.770581       2.825997      41.05719 20.16411  59.06789 23.65437  -18.01070      31.08248  
1 1 1 2  17 0  o 81.17446 9.774350  4.582263       1.016646      4.582263       1.016646      4.582263       1.016646      81.17446 9.774350  81.17446 9.774350  -0.000000      0.000000  
1 1 1 2  17 1  o 237.8973 5.392905  37.73288       1.709566      36.38344       2.550553      38.83370       2.303640      233.3552 8.215260  241.1725 7.176232  -7.817307      10.90820  
1 1 1 2  17 2  o 377.4129 5.774336  94.97714       2.903971      93.65306       3.658677      97.23161       4.774061      374.6829 7.328021  381.6191 9.388245  -6.936218      11.90962  
1 1 1 2  17 3  o 187.4357 5.488766  23.44383       1.369407      22.81758       2.119594      23.89252       1.794114      184.6969 8.636221  189.1216 7.132047  -4.424774      11.20046  
1 1 1 2  17 4  o 295.2662 5.446886  58.12691       2.143066      57.90903       2.926883      58.37872       3.146528      294.5270 7.463742  295.6773 7.993532  -1.150299      10.93636  
1 1 1 2  17 5  o 424.9701 5.230659  120.4055       2.962022      115.5837       4.090255      125.7223       4.295113      416.2388 7.374530  434.1067 7.425138  -17.86792      10.46501  
1 1 1 2  17 6  f 180.4959 5.360859  21.74036       1.287935      22.38075       1.554312      20.33733       2.300659      183.0778 6.381071  174.2193 9.951597  8.858536       11.82169  
1 1 1 2  17 7  f 253.5274 5.015880  42.85192       1.694515      44.15821       2.138955      40.65039       2.776799      257.3177 6.238188  246.6395 8.461589  10.67821       10.51254  
1 1 1 2  17 8  o 540.9128 6.964186  195.1883       5.019624      195.8526       7.403984      194.6232       6.828524      541.4272 10.26247  539.8332 9.492786  1.593994       13.97967  
1 1 1 2  17 9  o 558.1564 7.969979  207.9352       5.927705      211.8358       7.547230      201.6547       9.576723      563.0706 10.05892  548.8342 13.09490  14.23639       16.51237  
1 1 1 2  17 10 o 364.1126 5.676696  88.41787       2.754260      89.81802       3.457831      85.98769       4.555495      366.8851 7.072943  358.6281 9.541216  8.257050       11.87692  
1 1 1 2  17 11 o 406.1393 7.942553  110.1312       4.298418      107.5229       5.525989      114.1272       6.839782      400.8735 10.35363  412.6229 12.45411  -11.74936      16.19576  
1 1 1 2  17 12 o 320.7087 7.290133  68.66439       3.115443      66.48804       3.759161      73.43773       5.567228      315.2994 8.956423  330.7686 12.65444  -15.46918      15.50330  
1 1 1 2  17 13 f 143.7177 7.964074  13.84071       1.519209      12.77654       2.221037      14.77637       2.082609      137.5053 12.24979  148.1923 10.61685  -10.68700      16.21033  
1 1 1 2  17 14 o 128.9181 7.304756  11.13782       1.249720      9.387020       2.091340      12.11026       1.558608      117.3936 13.62183  134.2826 8.758307  -16.88897      16.19451  
1 1 1 2  17 15 o 210.5763 6.202072  29.63454       1.738386      30.85508       2.127976      27.18585       3.014102      214.7286 7.448371  200.9502 11.30186  13.77844       13.53552  
1 1 1 2  17 16 o 138.5408 8.455261  12.89603       1.553478      13.46180       2.182736      12.31528       2.211444      141.0261 11.72109  134.7029 12.46166  6.323212       17.10780  
1 1 1 2  17 17 o 170.0323 8.356750  19.41122       1.887599      21.87357       3.225164      18.12830       2.327965      179.4344 13.58982  163.8909 10.71859  15.54349       17.30813  
1 1 1 2  17 18 o 211.2104 7.032240  29.88412       1.976408      29.04954       3.774132      30.19947       2.319946      206.6459 13.78502  212.1122 8.223607  -5.466339      16.05162  
1 1 1 2  17 19 o 165.7592 1.869017  18.31267       0.4128233     16.64354       4.317287      18.32807       0.4147237     153.1321 21.77049  165.8286 1.876834  -12.69649      21.85124  
1 1 1 2  17 20 o 199.4897 1.251469  26.51927       0.3326702     20.39326       4.985004      26.54668       0.3334135     168.8387 22.73469  199.5927 1.253617  -30.75401      22.76923  
1 1 1 2  17 21 o 215.3816 9.038486  31.28457       2.588281      31.75616       5.447633      31.14707       2.941493      212.4570 19.45843  214.5151 10.32078  -2.058136      22.02610  
1 1 1 2  17 22 o 109.9499 20.17148  8.767084       2.846455      7.386290       3.897962      10.34463       4.166427      97.98230 28.28559  116.2253 27.35945  -18.24296      39.35243  
1 1 1 2  17 23 o 60.79681 16.97609  2.671418       1.427703      -0.5003724     2.907841      3.678892       1.638836      49.68726 22.04459  71.02017 17.44559  -21.33291      28.11250  
1 1 1 2  17 24 o 105.7624 14.07176  7.902473       1.933977      13.21835       3.533511      5.628968       2.310825      133.5275 20.51442  86.39746 20.40072  47.13005       28.93149  
1 1 1 2  17 25 o 29.66572 13.40873  -0.5016464     1.131362      2.446339       2.955761      -1.007694      1.224622      62.48673 24.45206  28.40977 13.23927  34.07696       27.80614  
1 1 1 2  17 26 o 73.21528 17.25169  4.087309       1.655283      2.684605       3.061584      4.666709       1.967671      62.75936 24.78642  77.32663 19.18788  -14.56727      31.34552  
1 1 1 2  17 27 o 15.74191 7.500353  -0.5429979     0.4344793     -1.739200      2.764530      -0.5127035     0.4399466     41.42077 19.49061  16.09183 7.632669  25.32894       20.93183  
1 1 1 2  17 28 o 81.67262 6.387120  4.572025       0.6895877     0.1148714      3.061697      4.810215       0.7077736     48.30822 21.92397  83.78449 6.387682  -35.47627      22.83556  
1 1 1 2  17 29 o 26.22638 12.19231  -0.6869570     1.028774      -1.323320      3.789107      -0.6363130     1.068927      46.93526 22.30201  27.08176 12.53382  19.85349       25.58273  
1 1 1 2  17 30 f 33.83822 13.58393  0.5911245      0.9343343     16.22350       8.972112      0.4197384      0.9394422     80.80175 36.99952  32.32464 13.37478  48.47711       39.34272  
1 1 1 2  17 31 o 20.66603 10.07626  -1.402690      0.9007502     -3.294451      3.696956      -1.283301      0.9287386     40.26039 19.79167  21.58055 10.45484  18.67983       22.38334  
1 1 1 2  18 0  o 78.12305 13.76066  4.433389       1.299776      4.433389       1.299776      4.433389       1.299776      78.12305 13.76066  78.12305 13.76066  0.000000       0.000000  
1 1 1 2  18 1  o 307.2390 4.840180  62.92960       1.981579      63.38860       2.888240      62.52139       2.723741      308.2555 7.031517  306.1585 6.676454  2.096924       9.696250  
1 1 1 2  18 2  o 219.0842 5.386424  32.00292       1.572480      32.06804       1.835885      31.82355       3.046808      219.1872 6.292259  217.9893 10.52011  1.197922       12.25828  
1 1 1 2  18 3  o 401.9415 6.411600  107.7541       3.434020      112.6961       5.299669      104.1775       4.508558      410.7742 9.682156  395.0488 8.564725  15.72543       12.92666  
1 1 1 2  18 4  o 198.3767 5.424596  26.25976       1.432596      26.51327       2.101628      26.03973       1.957984      199.1598 7.935072  197.4083 7.456787  1.751495       10.88894  
1 1 1 2  18 5  o 303.4048 4.910132  61.37296       1.985130      58.60637       2.718181      64.53513       2.906019      296.3924 6.882367  311.0155 7.012017  -14.62308      9.825241  
1 1 1 2  18 6  o 411.2255 5.195606  112.7572       2.847015      114.7211       3.355263      107.7072       5.380258      414.7319 6.071353  401.3531 10.06806  13.37881       11.75701  
1 1 1 2  18 7  o 440.7885 6.231809  129.6036       3.660310      130.4162       4.815310      128.4915       5.633334      441.9799 8.176136  438.5328 9.640285  3.447144       12.64058  
1 1 1 2  18 8  o 609.3802 4.749911  247.5948       3.856980      248.6252       4.270675      243.0358       8.982992      610.5971 5.248900  602.7321 11.18467  7.864990       12.35507  
1 1 1 2  18 9  o 358.1544 6.244807  85.58302       2.980319      84.63947       3.916083      86.88171       4.594310      355.9898 8.255451  360.3978 9.575237  -4.407990      12.64269  
1 1 1 2  18 10 o 209.9756 5.687350  29.43411       1.589836      29.12909       1.908429      30.12585       2.873978      208.7880 6.868923  211.9650 10.20525  -3.177002      12.30159  
1 1 1 2  18 11 o 226.5706 7.039032  34.30907       2.122574      32.17981       2.447433      40.77070       4.263512      219.2734 8.391771  246.1183 13.04681  -26.84489      15.51261  
1 1 1 2  18 12 o 118.8750 8.529857  9.497224       1.342176      9.812567       1.595113      8.732611       2.483824      120.6493 10.01194  112.4482 17.11582  8.201118       19.82903  
1 1 1 2  18 13 o 287.7312 6.734577  55.30108       2.582087      56.21228       3.474900      54.17767       3.858376      289.6599 9.013828  284.1413 10.20711  5.518585       13.61742  
1 1 1 2  18 14 o 81.61314 6.629118  4.479402       0.7147216     2.042337       2.145630      4.783567       0.7580121     59.11417 21.30588  84.33612 6.802788  -25.22195      22.36557  
1 1 1 2  18 15 o 261.3047 6.349880  45.62605       2.210988      42.69870       2.814405      50.34516       3.573379      252.3722 8.380586  273.7578 9.811650  -21.38559      12.90359  
1 1 1 2  18 16 o 123.5551 1.057334  10.17197       0.1740789     10.19013       0.1744796     6.230886       2.570006      123.6653 1.058823  93.24969 21.16869  30.41566       21.19515  
1 1 1 2  18 17 o 140.8989 3.617320  13.25187       0.6785919     13.36155       0.7132202     12.20398       2.204584      141.4684 3.786880  133.8034 12.50978  7.664932       13.07039  
1 1 1 2  18 18 o 31.56125 12.05124  0.4689922      0.7051095     2.038146       1.450675      -0.1639370E-01 0.8068283     54.86701 17.55578  28.24410 12.07698  26.62291       21.30865  
1 1 1 2  18 19 o 246.5526 7.515634  40.80572       2.466274      39.53302       4.515195      41.34689       2.944298      240.3959 14.15804  247.8033 8.931244  -7.407394      16.73969  
1 1 1 2  18 20 o 194.0194 3.454161  25.12021       0.8930203     23.24347       4.409970      25.20045       0.9119132     181.9020 18.44872  194.3230 3.521727  -12.42104      18.78185  
1 1 1 2  18 21 o 71.99583 2.567211  3.461416       0.2458933     2.201091       3.644974      3.467178       0.2464548     67.20627 26.88083  72.05557 2.570945  -4.849304      27.00350  
1 1 1 2  18 22 o 91.71642 19.76815  6.211380       2.344675      3.195170       4.644260      7.243111       2.716244      75.22694 30.25535  98.53455 21.30865  -23.30760      37.00600  
1 1 1 2  18 23 o 24.11943 11.47639  -1.222964      1.010259      -6.873692      4.176868      -0.8718497     1.041173      43.35999 21.25884  26.33143 12.24942  17.02855       24.53541  
1 1 1 2  18 24 o 49.07068 20.97607  0.5236654      2.432655      7.395607       4.151723      -3.069128      3.001960      92.35275 29.71428  41.18435 19.64834  51.16840       35.62296  
1 1 1 2  18 25 f 41.06220 16.80313  0.6620551      1.461480      1.580969       4.535785      0.5556015      1.543815      63.54055 27.88767  41.08970 17.08601  22.45085       32.70557  
1 1 1 2  18 26 o 55.83524 15.77496  2.387862       1.225241      -1.500643      3.269241      3.023289       1.321564      45.80621 21.43963  62.72675 15.81688  -16.92054      26.64266  
1 1 1 2  18 27 o 97.90796 11.58623  6.935049       1.482331      9.356326       4.306584      6.609636       1.578802      92.66864 30.29831  94.73615 12.83653  -2.067505      32.90538  
1 1 1 2  18 28 o 26.45259 12.96524  -2.526433      1.549781      0.2454941      5.664515      -2.750711      1.611258      56.96762 27.12556  26.58466 13.06825  30.38296       30.10938  
1 1 1 2  18 29 o 53.86394 9.015034  2.092630       0.6242051     1.667456       3.717614      2.104964       0.6331944     53.67586 24.27938  53.97584 9.128820  -0.2999802     25.93884  
1 1 1 2  18 30 o 55.53270 13.99174  2.474628       1.034752      2.444207       5.202709      2.475881       1.055845      55.98236 26.46274  55.39509 14.22960  0.5872650      30.04593  
1 1 1 2  19 0  o 41.71132 16.23778  1.590872       0.8601085     1.590872       0.8601085     1.590872       0.8601085     41.71132 16.23778  41.71132 16.23778  0.000000       0.000000  
1 1 1 2  19 1  o 617.3846 6.093341  254.2522       5.012852      263.1603       7.786459      247.9465       6.551023      627.6162 9.310487  609.4119 8.067234  18.20435       12.31931  
1 1 1 2  19 2  o 368.8739 5.742100  90.75253       2.822423      92.86879       3.654097      87.62271       4.443803      373.0240 7.351395  362.0392 9.218902  10.98480       11.79115  
1 1 1 2  19 3  o 390.0648 5.352767  101.4677       2.782202      97.36109       4.708053      103.6713       3.448818      381.7311 9.255721  394.1837 6.565959  -12.45258      11.34814  
1 1 1 2  19 4  o 447.5719 7.326459  133.7100       4.369487      133.9358       5.739547      133.3986       6.738813      447.6532 9.621935  446.3394 11.33957  1.313843       14.87170  
1 1 1 2  19 5  o 247.0765 5.430764  40.71579       1.787993      39.23687       2.369455      42.67161       2.724835      242.3314 7.346271  252.6494 8.104210  -10.31795      10.93828  
1 1 1 2  19 6  o 290.1937 5.692486  56.17604       2.201220      55.51706       2.858261      57.13655       3.450771      288.2656 7.447309  292.2755 8.870603  -4.009857      11.58231  
1 1 1 2  19 7  o 215.3127 6.007595  30.95651       1.721944      30.62984       2.014461      31.84271       3.317994      214.0805 7.071385  217.7407 11.47621  -3.660141      13.47991  
1 1 1 2  19 8  o 292.9070 5.178665  57.22844       2.021255      59.70095       2.757031      54.35526       2.972035      299.0301 6.919158  285.1384 7.829534  13.89163       10.44875  
1 1 1 2  19 9  o 30.01519 12.31741  0.1970144      0.7881401     0.3993789      0.8851675     -0.5772182     1.731386      33.50801 13.29783  38.39909 17.02477  -4.891075      21.60266  
1 1 1 2  19 10 o 161.4126 6.809820  17.43227       1.461402      17.52381       1.720231      17.19489       2.770290      161.7065 8.008277  159.3893 13.16063  2.317169       15.40567  
1 1 1 2  19 11 o 282.1967 4.011491  53.10792       1.508451      52.63572       1.574393      58.39341       5.267301      280.9261 4.205789  294.1779 13.47284  -13.25174      14.11404  
1 1 1 2  19 12 o 117.0669 2.702504  9.135242       0.4215742     9.095877       0.4274717     10.53246       2.546739      116.8135 2.746255  123.7706 15.80151  -6.957085      16.03838  
1 1 1 2  19 13 o 135.3599 3.095600  12.21593       0.5583525     12.17030       0.5662681     13.81412       3.351080      135.1053 3.145401  141.2148 18.23383  -6.109451      18.50314  
1 1 1 2  19 14 o 323.1747 6.714746  69.83994       2.891614      69.60449       4.152217      70.06166       4.029274      321.8521 9.692711  322.9970 9.371612  -1.144867      13.48242  
1 1 1 2  19 15 o 129.3531 6.404651  11.21664       1.100508      9.566052       2.350639      11.67998       1.245431      117.6415 15.36180  131.9117 7.111666  -14.27023      16.92810  
1 1 1 2  19 16 o 222.5097 6.115876  33.13596       1.811628      32.79956       2.367271      33.61145       2.814416      221.0123 8.051643  223.4021 9.475781  -2.389862      12.43460  
1 1 1 2  19 17 f 192.1780 1.186462  24.61040       0.3038304     24.61854       0.3051339     23.66366       3.290501      192.2096 1.191357  186.1779 13.35223  6.031723       13.40527  
1 1 1 2  19 18 o 222.9371 6.386173  33.30738       1.895173      30.79456       2.399950      37.47015       3.088967      213.8883 8.437124  235.5388 9.863696  -21.65048      12.97989  
1 1 1 2  19 19 o 119.8534 10.12343  9.774819       1.601678      9.757540       2.042385      9.802422       2.581338      118.9202 13.10575  117.8934 16.91559  1.026840       21.39855  
1 1 1 2  19 20 o 122.8814 5.843720  10.13988       0.9541197     9.145236       1.412662      10.97421       1.293815      115.9944 9.215302  127.5002 7.650505  -11.50580      11.97715  
1 1 1 2  19 21 o 81.28866 5.608228  4.450849       0.6037527     5.937179       3.155319      4.394362       0.6151183     87.48426 25.50609  80.74552 5.754700  6.738739       26.14722  
1 1 1 2  19 22 o 46.14500 18.94741  0.7531984      1.866299      3.572093       3.388295      -0.4744909     2.236074      71.18694 26.58579  43.10892 19.21616  28.07801       32.80343  
1 1 1 2  19 23 o 95.48826 1.822983  6.081055       0.2319562     1.935383       4.112069      6.094288       0.2323262     64.67077 27.44522  95.59206 1.823907  -30.92129      27.50576  
1 1 1 2  19 24 o 24.28776 10.63317  -0.1022570     0.6557266     1.058425       4.569286      -0.1266631     0.6625848     61.75719 27.50280  24.20661 10.64034  37.55058       29.48933  
1 1 1 2  19 25 o 58.98289 12.28623  2.556840       0.9342506     6.134714       5.025465      2.428762       0.9508254     77.98308 31.43435  57.25999 12.78535  20.72309       33.93499  
1 1 1 2  19 26 o 28.03062 13.46949  -1.746019      1.467365      -4.609419      3.680088      -1.204718      1.600061      40.62354 19.92487  31.61338 14.86082  9.010159       24.85648  
1 1 1 2  19 27 o 52.72520 15.08980  2.188883       1.113929      6.475404       5.139989      1.977637       1.141046      72.93246 30.80540  50.16669 15.50480  22.76577       34.48727  
1 1 1 2  19 28 o 36.16299 16.21899  -0.6634052E-01 1.619169      1.897303       4.293019      -0.3919984     1.748285      55.81752 25.57200  35.80822 16.37255  20.00930       30.36425  
1 1 1 2  19 29 o 38.39026 16.94469  0.3509832      1.696595      7.575769       4.789900      -0.6854672     1.814213      71.26850 29.89861  34.65153 16.13664  36.61697       33.97525  
1 1 1 2  20 0  o 444.4486 7.753124  131.8975       4.588531      131.8975       4.588531      131.8975       4.588531      444.4486 7.753124  444.4486 7.753124  0.000000       0.000000  
1 1 1 2  20 1  o 409.5695 5.330293  111.8991       2.909057      112.2815       4.538001      111.6323       3.790280      409.9130 8.308056  408.9065 6.956228  1.006500       10.83572  
1 1 1 2  20 2  o 122.0794 6.171792  9.971316       1.000728      10.15637       1.231086      9.610838       1.718199      123.0841 7.542291  119.3019 10.92949  3.782104       13.27930  
1 1 1 2  20 3  o 294.4902 5.941521  57.87262       2.331535      56.07706       4.101368      58.72995       2.834008      289.1848 10.66164  296.5562 7.171673  -7.371399      12.84926  
1 1 1 2  20 4  o 119.2268 7.179363  9.527789       1.135315      10.13621       1.538319      8.799963       1.682510      122.7257 9.480139  114.0521 11.21577  8.673576       14.68559  
1 1 1 2  20 5  o 92.34908 6.662819  5.723806       0.8143939     5.790676       0.9165239     5.472923       1.775266      92.80295 7.474721  88.85904 15.55964  3.943909       17.26192  
1 1 1 2  20 6  f 369.1292 5.193850  90.90916       2.554708      92.49734       3.622891      89.33838       3.602998      372.0851 7.307006  365.6640 7.394492  6.421082       10.39571  
1 1 1 2  20 7  o 28.92253 13.11477  -0.6313742     1.092717      -1.024711      1.466504      -0.1404137     1.638417      32.58224 14.93415  39.59110 17.07331  -7.008858      22.68318  
1 1 1 2  20 8  o 200.6584 4.599500  26.85983       1.229820      26.47782       1.502249      27.63610       2.141463      199.0814 5.668657  203.1338 7.926641  -4.052368      9.745015  
1 1 1 2  20 9  o 80.43007 8.624372  4.379563       0.9098963     4.204045       1.118396      4.723177       1.564838      78.38372 11.01087  82.41743 14.79229  -4.033714      18.44047  
1 1 1 2  20 10 o 167.1769 5.793847  18.68640       1.288724      18.49016       1.413505      19.65296       3.137043      166.2319 6.393223  170.0498 13.96729  -3.817871      15.36094  
1 1 1 2  20 11 o 117.0686 1.095401  9.131957       0.1708784     9.120733       0.1711046     13.36773       3.323934      116.9966 1.097526  138.7607 18.43227  -21.76405      18.46491  
1 1 1 2  20 12 o 291.0901 6.741254  56.66764       2.614819      56.11847       3.190982      57.79013       4.562075      289.2819 8.286618  292.6207 11.72368  -3.338776      14.35663  
1 1 1 2  20 13 o 79.90027 10.52575  4.368047       1.093432      4.221629       1.196282      5.111401       2.695464      78.25674 11.84178  84.17849 23.25864  -5.921745      26.09966  
1 1 1 2  20 14 o 31.73902 14.09447  -0.3998215     1.191401      2.585876       1.909309      -2.303670      1.524648      61.86390 20.17051  28.21360 13.60114  33.65031       24.32777  
1 1 1 2  20 15 o 156.0585 7.514072  16.36257       1.557967      17.47736       1.820577      13.31277       3.011252      161.1128 8.510369  138.3850 16.66498  22.72780       18.71224  
1 1 1 2  20 16 o 198.1478 6.671776  26.32696       1.759076      28.52864       3.007154      25.18169       2.168861      205.1606 11.04056  193.4142 8.435592  11.74640       13.89435  
1 1 1 2  20 17 o 148.2959 7.230604  14.78867       1.424513      13.81928       1.869089      16.13210       2.200329      142.7625 9.886281  154.0536 10.78687  -11.29108      14.63199  
1 1 1 2  20 18 f 126.5755 1.172488  10.67664       0.1977568     10.69927       0.1984100     7.256207       2.439279      126.7095 1.175116  100.2135 18.96106  26.49603       18.99744  
1 1 1 2  20 19 o 68.80652 6.448521  3.205210       0.5843500     3.143397       0.6083540     3.942456       2.100974      68.07363 6.797412  73.02022 20.66623  -4.946587      21.75541  
1 1 1 2  20 20 o 59.71370 5.288101  2.408450       0.4164270     2.370668       0.4636422     2.566125       0.9471586     59.12963 5.965924  60.08124 12.24660  -0.9516106     13.62246  
1 1 1 2  20 21 o 18.28865 8.301158  -0.2496959     0.4391184     1.079335       1.295376      -0.4222483     0.4667548     43.57528 16.40392  17.55046 8.176962  26.02481       18.32897  
1 1 1 2  20 22 o 40.08276 15.85959  0.7569293      1.255549      -1.525107      1.559480      4.961592       2.116822      30.73831 14.51732  79.90934 19.94414  -49.17103      24.66822  
1 1 1 2  20 23 o 16.78134 8.173026  -1.019083      0.5879886     6.086139       4.175161      -1.162853      0.5939076     81.15954 29.65293  16.26016 7.981146  64.89938       30.70822  
1 1 1 2  20 24 o 91.00036 2.615406  5.540004       0.3168145     9.459253       5.830475      5.528398       0.3172832     89.14905 34.49492  90.90396 2.622073  -1.754913      34.59443  
1 1 1 2  20 25 o 55.31599 14.51350  2.361638       1.082958      -2.228373      7.627468      2.456070       1.094041      59.55442 29.09904  56.42727 14.47945  3.127159       32.50244  
1 1 1 2  20 26 o 40.60716 11.05959  1.223846       0.6144872     3.194342       4.084924      1.178224       0.6215599     61.45367 26.72801  39.85648 11.22705  21.59719       28.99022  
1 1 1 2  20 27 o 82.24020 7.522721  4.724675       0.8152692     3.527204       4.283822      4.769677       0.8304470     60.72480 26.85838  82.57797 7.633363  -21.85317      27.92205  
1 1 1 2  20 28 o 31.03682 14.35190  -0.5766536     1.397074      0.3986491      5.439484      -0.6455347     1.445567      52.93089 25.55978  31.25286 14.50284  21.67803       29.38766  
1 1 1 2  21 0  o 652.5624 7.098661  284.2391       6.171010      284.2391       6.171010      284.2391       6.171010      652.5624 7.098661  652.5624 7.098661  0.000000       0.000000  
1 1 1 2  21 1  o 298.4814 5.440283  59.46161       2.163776      59.12590       3.076353      59.79028       3.043987      297.2672 7.772995  298.9539 7.647538  -1.686798      10.90432  
1 1 1 2  21 2  o 311.3379 5.936519  64.71745       2.462847      62.07069       3.154868      68.84705       3.940752      304.5773 7.779752  320.5082 9.236758  -15.93097      12.07652  
1 1 1 2  21 3  o 315.6522 5.962179  66.52824       2.507768      69.18668       4.130059      64.97569       3.156213      321.1877 9.660906  311.7360 7.598114  9.451660       12.29083  
1 1 1 2  21 4  o 474.4958 7.336222  150.5171       4.638508      151.3261       6.269906      149.5389       6.894115      475.1061 9.903687  471.9645 10.96215  3.141632       14.77335  
1 1 1 2  21 5  o 128.6679 6.514336  11.08906       1.113265      10.51419       1.223279      13.86076       2.686045      125.1849 7.365859  142.5882 14.33110  -17.40324      16.11324  
1 1 1 2  21 6  o 281.2595 5.011569  52.79654       1.878254      51.82434       2.343261      54.54371       3.141315      278.5172 6.313861  285.3347 8.270692  -6.817474      10.40525  
1 1 1 2  21 7  o 321.5816 4.947685  69.02336       2.120151      71.44128       2.877850      66.15336       3.135367      326.9391 6.605835  314.4666 7.482389  12.47250       9.981143  
1 1 1 2  21 8  o 233.3091 0.7239901 36.26808       0.2250805     36.86928       2.219459      36.26183       0.2262469     234.6774 7.105636  233.2890 0.7278048 1.388351       7.142812  
1 1 1 2  21 9  o 203.0816 5.404455  27.56334       1.461201      29.32448       1.898414      25.00339       2.288808      209.2850 6.816463  192.8876 8.929181  16.39738       11.23363  
1 1 1 2  21 10 o 131.7366 6.455206  11.63275       1.129707      11.61435       1.381160      11.66994       1.963671      131.4319 7.923025  131.1285 11.34988  0.3034515      13.84175  
1 1 1 2  21 11 o 309.7377 4.738429  64.05555       1.955699      63.89918       2.085873      65.19235       5.624084      309.3131 5.060764  309.7903 13.65775  -0.4771729     14.56522  
1 1 1 2  21 12 o 108.7357 4.969500  7.913674       0.7181394     7.882969       0.7480429     8.274846       2.565549      108.5017 5.188920  108.2269 18.45097  0.2748184      19.16672  
1 1 1 2  21 13 o 251.6194 7.825027  42.50522       2.620446      41.48932       3.182094      44.64574       4.618991      248.1026 9.643529  255.9488 13.59191  -7.846252      16.66546  
1 1 1 2  21 14 o 264.7348 9.658337  47.27293       3.401405      46.86172       5.245716      47.57125       4.467971      261.2728 15.13210  264.3891 12.71947  -3.116302      19.76779  
1 1 1 2  21 15 o 142.6075 11.54516  13.87250       2.175152      14.26707       2.713421      13.16305       3.638448      143.7390 14.35866  135.4476 20.82494  8.291397       25.29524  
1 1 1 2  21 16 o 226.6198 7.599292  34.54921       2.291553      38.56334       3.000125      28.92745       3.550426      238.8198 9.446108  205.3987 13.03939  33.42116       16.10138  
1 1 1 2  21 17 o 175.6374 6.587678  20.73554       1.539049      21.21649       2.996900      20.56326       1.793635      175.5105 12.90454  174.6169 7.727719  0.8936768      15.04144  
1 1 1 2  21 18 o 100.6810 11.47588  7.015414       1.512141      9.647453       2.839194      5.973177       1.786620      114.8927 19.22370  91.52238 15.18150  23.37029       24.49548  
1 1 1 2  21 19 o 13.21793 6.566477  -1.088797      0.4468471     -1.308915      0.4576927     3.391380       2.064878      12.62263 6.327636  67.36126 20.86399  -54.73863      21.80241  
1 1 1 2  21 20 o 129.2473 1.762532  11.13979       0.3035513     11.18778       0.3093725     9.900488       1.572194      129.5234 1.792503  119.8248 9.935848  9.698624       10.09624  
1 1 1 2  21 21 o 89.94054 4.691888  5.445370       0.5603667     4.811065       0.6075830     9.057200       1.449840      84.37366 5.433000  114.4060 9.598800  -30.03232      11.02971  
1 1 1 2  21 22 f 64.56380 4.406357  2.812795       0.3768178     2.827769       0.3842917     2.439017       1.919975      64.72183 4.483628  56.92130 20.19540  7.800529       20.68713  
1 1 1 2  21 23 o 89.46608 8.844436  5.590113       1.040611      10.69767       6.737243      5.465285       1.053251      89.49633 36.28070  88.34678 9.075714  1.149551       37.39863  
1 1 1 2  21 24 o 22.51327 10.42665  -0.5228805     0.7416286     2.151470       2.149439      -0.8842809     0.7901515     53.62978 20.89053  21.36597 10.16149  32.26381       23.23080  
1 1 1 2  21 25 o 25.12123 10.32139  0.2006699      0.5542521     -5.712011      3.792676      0.3296976      0.5602670     38.81167 19.25525  26.78453 10.59543  12.02714       21.97789  
1 1 1 2  21 26 o 22.24290 10.35212  -0.5431726     0.7449448     -2.284909      4.075117      -0.4829567     0.7577125     45.18494 21.89244  22.84515 10.56588  22.33979       24.30878  
1 1 1 2  21 27 o 19.97053 9.920259  -2.200974      1.019044      0.9092069      4.539990      -2.365985      1.045727      52.11757 24.66094  19.91494 9.918405  32.20263       26.58076  
1 1 1 2  22 0  o 14.81712 10.69885  -2.027584      1.084247      -2.027584      1.084247      -2.027584      1.084247      14.81712 10.69885  14.81712 10.69885  -0.000000      0.000000  
1 1 1 2  22 1  o 232.2129 4.961737  35.99486       1.535301      35.34526       2.328730      36.49430       2.041918      229.6879 7.619194  233.5605 6.567449  -3.872681      10.05900  
1 1 1 2  22 2  o 300.7213 7.014232  60.48418       2.810722      63.45990       4.059020      57.74281       3.895917      307.2831 9.926112  293.0835 9.990337  14.19955       14.08313  
1 1 1 2  22 3  o 306.8461 6.760345  62.95992       2.764159      60.03102       4.555989      64.66606       3.477261      298.3921 11.47976  310.5555 8.410551  -12.16345      14.23103  
1 1 1 2  22 4  o 195.0195 5.876884  25.43390       1.525467      22.12255       1.944803      30.72912       2.459323      181.5633 8.058562  213.9369 8.644738  -32.37357      11.81829  
1 1 1 2  22 5  o 333.3312 5.514894  74.21883       2.449552      74.00132       3.232478      74.51221       3.754138      332.5218 7.295279  333.3046 8.459537  -0.7827759     11.17071  
1 1 1 2  22 6  o 82.55846 2.145591  4.546070       0.2358380     4.648236       0.2383272     -0.2684404     1.636050      83.48168 2.144216  38.63385 16.85728  44.84783       16.99310  
1 1 1 2  22 7  o 29.79039 12.42884  0.1272868      0.8208682     -2.133530      1.436399      1.223713       1.000304      27.54540 13.25944  43.65633 14.61498  -16.11094      19.73348  
1 1 1 2  22 8  o 138.6615 4.274506  12.84490       0.7888534     13.10058       1.576020      12.75944       0.9112147     139.4818 8.520160  138.1343 4.958504  1.347458       9.857985  
1 1 1 2  22 9  o 78.03648 9.719597  4.157403       0.9888471     5.133037       1.196578      2.056000       1.756111      86.66380 10.58080  56.53032 19.36142  30.13347       22.06395  
1 1 1 2  22 10 o 271.0475 5.533709  49.10857       1.998643      48.28596       2.663449      50.16877       3.023721      268.3083 7.456894  273.2730 8.313366  -4.964630      11.16769  
1 1 1 2  22 11 o 61.36633 6.117095  2.544389       0.4935500     2.592443       0.5137044     1.967787       1.779466      61.92088 6.314170  55.76651 19.47069  6.154362       20.46892  
1 1 1 2  22 12 o 178.0170 1.066447  21.11676       0.2529730     21.11215       0.2535666     22.09862       3.699085      177.9975 1.069067  178.8038 15.68412  -0.8063507     15.72051  
1 1 1 2  22 13 o 221.4038 6.347365  32.86501       1.870697      31.51353       2.112495      37.77559       4.026779      216.5734 7.330665  235.1407 12.90101  -18.56729      14.83828  
1 1 1 2  22 14 o 59.59916 10.65562  2.476527       0.8151735     2.674657       0.8837612     1.346657       2.110442      61.88660 11.12576  52.87991 20.67083  9.006687       23.47479  
1 1 1 2  22 15 o 62.55642 15.33585  2.816126       1.268330      4.106120       2.220506      2.191451       1.545202      74.52436 21.29737  56.17900 18.13245  18.34536       27.97077  
1 1 1 2  22 16 o 102.6049 16.55774  7.551082       2.186774      6.926517       3.065973      8.197798       3.119864      94.83472 24.18886  103.8364 23.14011  -9.001701      33.47485  
1 1 1 2  22 17 o 139.1903 8.120930  13.14869       1.499677      13.40933       1.740649      12.39798       2.954139      140.1452 9.374846  131.0062 17.34857  9.139053       19.71955  
1 1 1 2  22 18 o 43.24562 15.10553  1.219217       1.071089      0.9975160      3.336850      1.244684       1.130935      57.54034 24.58101  43.91004 15.50717  13.63029       29.06369  
1 1 1 2  22 19 o 54.59664 16.00389  2.205829       1.239318      1.044416       1.975377      2.959706       1.591500      48.15702 19.59985  62.45659 18.08699  -14.29958      26.67008  
1 1 1 2  22 20 o 78.03197 8.653989  4.220819       0.8847230     6.989295       2.218949      3.697520       0.9647217     95.44553 18.10922  72.39353 10.29015  23.05199       20.82861  
1 1 1 2  22 21 o 34.14307 8.580384  0.8334531      0.3898593     1.493603       0.5055777     -0.1348706     0.6123178     45.89885 8.581754  23.04066 10.17424  22.85819       13.31021  
1 1 1 2  22 22 o 66.16534 2.064935  2.926251       0.1818354     2.928067       0.1826977     2.735193       1.873775      66.18494 2.074134  58.08389 19.99588  8.101048       20.10316  
1 1 1 2  22 23 o 68.24910 10.43058  3.362475       0.9185239     4.248291       1.028900      -0.1144077     2.038432      76.92507 10.29594  40.31337 18.12961  36.61170       20.84921  
1 1 1 2  22 24 o 42.46585 18.09513  0.7599152      1.800102      -0.6442888     2.365863      2.690445       2.774040      40.24976 18.63467  56.95681 23.20961  -16.70705      29.76469  
1 1 1 2  22 25 o 44.47216 11.78023  1.506357       0.7091039     1.562168       1.549216      1.491565       0.7975546     45.96301 17.78210  43.98684 12.82309  1.976170       21.92338  
1 1 1 2  22 26 o 41.09558 13.06727  1.301151       0.8047096     -0.5586705     2.978785      1.447565       0.8357849     42.97502 20.22503  43.06882 13.26248  -0.9379959E-01 24.18564  
1 1 1 2  23 0  o 59.22672 20.25310  3.069031       1.435014      3.069031       1.435014      3.069031       1.435014      59.22672 20.25310  59.22672 20.25310  -0.000000      0.000000  
1 1 1 2  23 1  o 148.8355 6.226154  14.84012       1.232082      13.08708       2.158354      15.68749       1.500601      138.7406 11.78614  152.8656 7.388737  -14.12497      13.91066  
1 1 1 2  23 2  o 88.97327 9.884392  5.388184       1.152126      7.308032       1.627121      3.457771       1.631592      103.3325 12.04249  69.66663 17.57872  33.66589       21.30805  
1 1 1 2  23 3  o 117.6247 8.203338  9.323743       1.277710      11.54018       1.691561      6.379141       1.949723      130.6332 9.788820  95.48177 15.88191  35.15144       18.65627  
1 1 1 2  23 4  o 200.7487 7.090177  27.01994       1.893655      25.91605       2.621066      28.22531       2.738883      195.9716 10.07095  204.5353 10.08026  -8.563736      14.24905  
1 1 1 2  23 5  o 126.3798 6.324037  10.71201       1.061607      9.595136       1.210328      14.43734       2.210459      119.4037 7.647162  145.7793 11.47161  -26.37550      13.78684  
1 1 1 2  23 6  o 311.0868 6.317651  64.75343       2.618850      65.18521       2.992647      63.34162       5.411397      311.9236 7.200021  305.1602 13.34008  6.763336       15.15909  
1 1 1 2  23 7  o 180.3013 6.880518  21.80499       1.650046      21.59229       1.960256      22.32206       3.056389      179.1601 8.233047  180.9759 12.75573  -1.815796      15.18196  
1 1 1 2  23 8  o 171.4740 6.282315  19.70715       1.433035      19.74787       2.234664      19.67870       1.867607      170.9156 9.853757  170.9899 8.220830  -0.7431030E-01 12.83272  
1 1 1 2  23 9  o 136.1130 2.074100  12.35027       0.3761862     13.05061       1.877340      12.32097       0.3839741     138.6908 10.23032  135.9499 2.119579  2.740967       10.44759  
1 1 1 2  23 10 o 149.5918 6.054438  15.00706       1.204361      15.47858       1.450623      13.96099       2.160636      151.7258 7.195500  143.0723 11.42813  8.653473       13.50471  
1 1 1 2  23 11 f 179.6890 6.069561  21.65300       1.451204      20.48312       2.023684      22.89150       2.082191      174.1489 8.748664  184.1926 8.506468  -10.04370      12.20242  
1 1 1 2  23 12 o 224.3647 1.245628  33.54766       0.3724059     33.51832       0.3742747     36.46404       3.731277      224.2663 1.252429  230.8797 12.17124  -6.613480      12.23551  
1 1 1 2  23 13 o 135.1688 4.559983  12.23286       0.8201460     11.61020       0.8601222     18.46812       2.721829      131.6276 4.912499  163.7071 12.57353  -32.07953      13.49912  
1 1 1 2  23 14 o 61.46601 17.83612  2.751348       1.546232      2.054751       1.766766      5.030825       3.195991      55.50767 19.39966  80.96188 26.07275  -25.45421      32.49823  
1 1 1 2  23 15 o 92.14472 12.37819  5.953249       1.481444      3.440726       2.062018      8.633620       2.129781      67.85845 20.81993  110.1544 14.89074  -42.29591      25.59694  
1 1 1 2  23 16 o 129.9416 9.646772  11.59483       1.658422      10.83766       3.032997      11.91776       1.980754      120.2910 19.59585  130.9574 11.46638  -10.66640      22.70407  
1 1 1 2  23 17 o 47.85989 18.33957  1.334869       1.636768      3.232617       3.347372      0.7385581      1.876382      67.44999 26.12658  45.52811 18.87589  21.92188       32.23193  
1 1 1 2  23 18 o 116.5436 7.651564  9.284173       1.181689      8.834207       1.693683      9.710977       1.649513      111.9065 11.52254  117.8564 10.61708  -5.949913      15.66816  
1 1 1 2  23 19 o 37.91094 14.93139  0.7302244      1.108268      2.002292       2.220840      0.3083880      1.278893      54.53115 21.23665  36.30280 15.35146  18.22836       26.20425  
1 1 1 2  23 20 o 41.82714 11.43030  1.283699       0.6550862     -1.314426      2.245181      1.525466       0.6848876     38.03177 17.78989  45.54454 11.33135  -7.512768      21.09218  
1 1 1 2  23 21 o 55.04438 8.993459  2.156483       0.6368920     3.646154       0.9328571     0.8558605      0.8716568     71.39396 10.08637  36.65720 13.52288  34.73676       16.87018  
1 1 1 2  23 22 o 82.86020 5.203087  4.668137       0.5715875     4.751930       0.5818550     2.356556       3.056098      83.58807 5.250447  56.56771 23.81577  27.02037       24.38766  
1 1 1 2  23 23 o 20.47690 9.999183  -1.487453      0.8966680     -1.659155      1.006518      -0.8271295     1.973841      21.63078 10.56940  36.21825 16.85456  -14.58747      19.89443  
1 1 1 2  23 24 o 100.5040 7.946589  7.094501       1.055580      6.857131       1.099881      9.864385       3.757191      98.46208 8.465158  92.85803 28.02648  5.604050       29.27699  
1 1 1 2  24 0  o 188.3434 8.340325  23.87067       2.083814      23.87067       2.083814      23.87067       2.083814      188.3434 8.340325  188.3434 8.340325  -0.000000      0.000000  
1 1 1 2  24 1  o 187.4926 5.177546  23.51449       1.292307      28.46970       2.248333      21.06970       1.579249      205.7209 8.218329  177.2294 6.699217  28.49155       10.60285  
1 1 1 2  24 2  o 259.3174 5.435184  44.96375       1.878103      43.35880       2.263265      48.51282       3.365592      254.3282 6.684116  268.2347 9.430816  -13.90648      11.55931  
1 1 1 2  24 3  o 56.93362 16.79443  2.276415       1.361147      0.5035591      1.999089      3.808677       1.858497      46.87314 19.46277  72.67282 18.98634  -25.79968      27.18971  
1 1 1 2  24 4  o 248.9696 6.613027  41.55733       2.191974      41.47657       3.243199      41.62524       2.974091      247.7940 9.841789  248.5173 8.995829  -0.7233734     13.33363  
1 1 1 2  24 5  o 160.9554 6.666642  17.39086       1.426741      15.77468       1.628996      22.71390       2.956356      153.0202 8.017065  182.4642 12.22984  -29.44395      14.62335  
1 1 1 2  24 6  o 201.8698 5.634204  27.29052       1.514092      27.91397       1.614124      22.72307       4.368890      204.1062 5.941138  179.6765 18.51228  24.42967       19.44226  
1 1 1 2  24 7  o 23.27316 10.60400  -0.4471905     0.7251219     -0.2631950     0.8313394     -1.032377      1.482594      26.62340 11.80081  32.42337 14.91807  -5.799969      19.02125  
1 1 1 2  24 8  o 139.8340 7.503886  13.17856       1.393089      12.66026       1.848158      13.86051       2.119939      136.3734 10.24526  142.4176 11.26247  -6.044266      15.22526  
1 1 1 2  24 9  o 213.6003 6.188455  30.61959       1.759542      31.47407       2.688104      29.97903       2.327421      215.5589 9.380968  210.7429 8.304233  4.815994       12.52848  
1 1 1 2  24 10 o 78.34752 10.91058  4.253316       1.108201      4.060764       1.410208      4.564232       1.791966      75.46544 14.55109  79.18996 17.45304  -3.724518      22.72318  
1 1 1 2  24 11 o 226.7513 6.082848  34.53814       1.836275      32.70484       2.384440      37.21000       2.878562      219.9328 8.150323  234.1277 9.244935  -14.19492      12.32463  
1 1 1 2  24 12 o 97.60485 1.273891  6.349586       0.1656828     6.339351       0.1661539     8.146750       2.201686      97.52602 1.278547  106.5728 15.99710  -9.046806      16.04811  
1 1 1 2  24 13 o 216.5403 6.516481  31.60520       1.878153      33.13148       2.176986      27.16233       3.714241      221.3482 7.391209  196.4458 14.28672  24.90247       16.08541  
1 1 1 2  24 14 o 133.6331 10.27923  12.32406       1.816354      13.47375       1.962369      5.449601       4.798540      139.5950 10.62955  81.91635 31.39853  57.67870       33.14899  
1 1 1 2  24 15 o 146.9407 10.61599  14.98557       2.064610      13.38035       2.712455      17.19651       3.183351      135.9818 15.23093  153.9149 15.74291  -17.93306      21.90480  
1 1 1 2  24 16 o 148.1687 10.04980  15.24605       1.972469      12.93035       2.534833      18.80047       3.140451      133.5299 14.47751  160.9332 14.81044  -27.40326      20.71104  
1 1 1 2  24 17 o 104.3451 10.08751  7.634340       1.385117      6.425676       2.170645      8.464542       1.798986      90.49802 18.62160  108.4095 12.69343  -17.91153      22.53635  
1 1 1 2  24 18 o 70.46845 13.67826  3.705072       1.238067      2.690411       2.538157      4.021866       1.418231      59.15443 22.79395  72.67396 15.13739  -13.51953      27.36247  
1 1 1 2  24 19 o 88.00165 15.16098  5.904222       1.713677      5.216005       4.418213      6.026092       1.859225      71.92718 29.29813  87.96150 16.46736  -16.03432      33.60884  
1 1 1 2  24 20 o 106.9306 8.652442  7.999582       1.222340      13.08344       3.679709      7.369018       1.295930      120.9043 23.68771  102.0186 9.647577  18.88569       25.57701  
1 1 1 2  24 21 o 33.25318 9.629478  0.8013285      0.4511158     3.013770       1.854749      0.6622178      0.4650819     59.12544 19.90207  30.75176 9.949733  28.37367       22.25061  
1 1 1 2  24 22 o 42.27507 18.15098  0.7691693      1.836340      0.6096857      2.185229      1.152471       3.387732      43.59069 19.23574  51.06155 23.12903  -7.470852      30.08265  
1 1 1 2  24 23 f 69.45195 8.910559  3.458132       0.8056625     3.516910       0.8496138     2.933706       2.537777      69.79446 9.372042  56.31720 22.46166  13.47726       24.33848  
1 1 1 2  25 0  o 59.57324 17.55904  2.948868       1.211512      2.948868       1.211512      2.948868       1.211512      59.57324 17.55904  59.57324 17.55904  0.000000       0.000000  
1 1 1 2  25 1  o 70.38509 7.758546  3.372247       0.7156122     3.948111       1.314625      3.129758       0.8530769     74.76480 13.70039  67.34425 9.793120  7.420555       16.84060  
1 1 1 2  25 2  o 235.6203 6.676863  37.29129       2.094212      35.31199       3.171558      38.82145       2.788590      227.9283 10.47038  239.7187 8.744552  -11.79039      13.64170  
1 1 1 2  25 3  o 111.8220 8.871697  8.492760       1.311100      6.965366       1.987511      9.669500       1.744514      99.19514 15.54689  118.7358 11.15676  -19.54062      19.13581  
1 1 1 2  25 4  o 113.9238 13.18962  9.016676       1.965313      7.222054       2.558692      11.59882       3.069177      99.18544 20.04989  127.0197 18.69170  -27.83430      27.41127  
1 1 1 2  25 5  o 74.97352 10.54013  3.890438       1.023963      4.179317       1.159402      2.866177       2.183143      77.47191 11.58625  64.05550 21.59230  13.41640       24.50446  
1 1 1 2  25 6  o 101.3088 5.769110  6.903700       0.7755867     6.734463       0.8163459     8.472637       2.485589      99.98901 6.156866  108.3407 17.83750  -8.351700      18.87017  
1 1 1 2  25 7  o 162.5677 7.989627  17.87889       1.725449      18.24326       2.095403      17.11146       3.040993      163.6557 9.651515  156.2052 14.78588  7.450485       17.65712  
1 1 1 2  25 8  o 79.88947 14.35860  4.560943       1.472349      2.361553       2.183063      6.396185       1.994168      59.66462 21.49266  94.06502 16.51164  -34.40040      27.10292  
1 1 1 2  25 9  o 126.7786 0.9069565 10.71074       0.1532166     12.82060       1.974901      10.69797       0.1536798     136.3918 10.95850  126.7028 0.9102420 9.688988       10.99623  
1 1 1 2  25 10 f 104.6647 10.37818  7.569341       1.428379      5.293959       2.099668      9.529528       1.948822      83.77435 19.21822  116.5529 12.75612  -32.77854      23.06640  
1 1 1 2  25 11 o 73.68099 8.489811  3.736712       0.8183202     4.214754       0.9083179     1.676654       1.885579      78.19695 8.873874  52.31448 19.76973  25.88246       21.66998  
1 1 1 2  25 12 o 42.96497 7.542345  1.286768       0.4160676     1.311962       0.4244087     0.6646664      2.108979      43.37543 7.620859  47.00727 19.78703  -3.631836      21.20387  
1 1 1 2  25 13 o 46.45671 6.777866  1.490396       0.4072253     1.541873       0.4101420     -2.090322      3.420677      47.28638 6.696267  46.41474 21.79023  0.8716431      22.79592  
1 1 1 2  25 14 o 121.4765 11.85803  10.46515       1.895045      9.562604       2.009611      17.71070       5.693938      115.1679 13.34154  136.0852 31.94988  -20.91725      34.62357  
1 1 1 2  25 15 o 86.82655 13.89649  5.554372       1.553599      4.725429       1.706540      9.567139       3.754707      78.23676 16.86653  102.1624 27.12843  -23.92564      31.94420  
1 1 1 2  25 16 o 36.31416 16.93678  -1.190035      2.010815      1.327207       3.075812      -3.068880      2.657314      53.96855 23.33364  36.72279 17.76511  17.24577       29.32674  
1 1 1 2  25 17 o 55.58706 16.24567  2.423076       1.278700      2.038363       1.478415      3.565458       2.547611      51.54827 17.76088  64.18238 23.20495  -12.63411      29.22189  
1 1 1 2  25 18 o 29.84731 13.65855  -0.5404204     1.220096      -3.762608      1.853955      1.921284       1.620472      27.09161 13.44445  50.43563 18.46627  -23.34402      22.84199  
1 1 1 2  25 19 o 24.25599 11.89457  -2.230165      1.309425      -3.716256      1.660913      0.2104052      2.128482      24.92378 12.42687  42.13034 18.76607  -17.20656      22.50761  
1 1 1 2  25 20 o 20.74408 9.556924  -0.3870841     0.6112731     0.3798141      2.330822      -0.4437259     0.6334447     43.65947 19.52938  20.79623 9.633092  22.86324       21.77598  
1 1 1 2  25 21 o 15.04107 7.429553  -1.140525      0.5424020     5.188171       4.170643      -1.249407      0.5470481     65.99034 27.80441  14.70432 7.298169  51.28602       28.74628  
1 1 1 2  26 0  o 88.38907 11.44047  5.532935       1.285354      5.532935       1.285354      5.532935       1.285354      88.38907 11.44047  88.38907 11.44047  0.000000       0.000000  
1 1 1 2  26 1  o 73.58757 8.214112  3.707640       0.7917305     3.685991       1.235386      3.722729       1.031378      71.86481 13.39332  73.00346 10.93876  -1.138641      17.29270  
1 1 1 2  26 2  o 172.9922 7.094084  20.20855       1.631827      20.93023       2.385963      19.57432       2.236759      174.7865 10.28982  169.1556 9.967551  5.630890       14.32594  
1 1 1 2  26 3  o 30.34171 13.71858  -0.5449934     1.185350      -0.3628711     1.535210      -0.8138394     1.865254      36.06148 16.00749  37.73896 17.12132  -1.677483      23.43884  
1 1 1 2  26 4  o 63.28684 17.69555  2.968827       1.550146      0.5147279      2.952252      3.902968       1.821435      53.35456 22.96262  72.09022 18.77733  -18.73566      29.66260  
1 1 1 2  26 5  o ?        ?         -2.273449      0.1647466     -2.285322      0.1654230     -0.8304864     1.823668      ?        ?         37.08799 16.86659  0.000000       16.86659  
1 1 1 2  26 6  f 68.96169 9.306997  3.297606       0.8334340     3.224984       0.9666241     3.508009       1.645317      67.64359 11.10934  68.37279 17.86492  -0.7292023     21.03741  
1 1 1 2  26 7  o 86.76250 14.20366  5.421979       1.585354      5.551555       2.410022      5.323138       2.104888      84.27674 21.41890  83.54266 19.29687  0.7340775      28.82947  
1 1 1 2  26 8  o 135.1066 9.199208  12.53543       1.646275      14.92548       2.606526      10.94925       2.123413      144.9889 13.65198  124.3889 13.00274  20.59995       18.85332  
1 1 1 2  26 9  o 164.7311 0.7102853 18.08294       0.1559129     18.45025       2.300726      18.08124       0.1562722     163.0118 10.65018  164.7234 0.7119555 -1.711533      10.67395  
1 1 1 2  26 10 o 105.5715 3.806922  7.474741       0.5346660     11.75546       2.376421      7.246500       0.5487347     127.5686 14.22154  103.9151 3.970176  23.65343       14.76531  
1 1 1 2  26 11 o 52.80811 15.42608  2.090183       1.153177      1.864422       1.775255      2.254984       1.516759      52.09097 19.28386  54.77848 17.98495  -2.687511      26.36903  
1 1 1 2  26 12 o 58.77244 5.475443  2.350919       0.4238782     2.031865       0.4480560     5.070149       1.308047      54.41027 6.295883  83.92551 12.04091  -29.51524      13.58755  
1 1 1 2  26 13 o 88.14605 12.74453  5.661718       1.453525      7.194447       2.741099      5.062141       1.714409      91.89529 22.55537  81.05732 16.43574  10.83797       27.90839  
1 1 1 2  26 14 o 43.87139 16.40490  1.271163       1.290932      2.478527       2.683033      0.9074578      1.472590      57.94043 23.10003  42.08480 16.99752  15.85563       28.67973  
1 1 1 2  26 15 o 87.97472 16.45667  6.030091       1.858283      7.186336       2.640804      4.895987       2.615398      91.17501 21.99240  73.47884 23.57863  17.69617       32.24310  
1 1 1 2  26 16 o 80.56673 13.99366  4.910083       1.447834      5.401506       1.699906      3.611797       2.763009      83.19915 15.91286  63.55594 23.95055  19.64321       28.75496  
1 1 1 2  26 17 o 89.78876 9.307895  5.717967       1.097511      5.444438       1.145036      8.809328       3.849396      87.17205 10.04075  89.80402 28.58281  -2.631966      30.29510  
1 1 1 2  26 18 o 33.73920 14.78427  0.9667038E-01  1.270176      -0.5276937     1.515261      1.572230       2.329414      33.01300 15.14969  49.42586 20.79971  -16.41286      25.73210  
1 1 1 2  26 19 o 34.68449 15.56189  -0.1034664     1.492208      -3.623531      2.651416      1.528337       1.805246      34.04174 16.73985  46.72477 18.83811  -12.68303      25.20114  
1 1 1 2  27 0  o 43.56364 20.09760  1.946440       1.282775      1.946440       1.282775      1.946440       1.282775      43.56364 20.09760  43.56364 20.09760  0.000000       0.000000  
1 1 1 2  27 1  o 134.0109 5.547897  12.10895       0.9885573     11.22926       1.144840      14.68732       1.959994      128.6912 6.699159  145.6525 10.16240  -16.96126      12.17182  
1 1 1 2  27 2  o 96.72983 10.12045  6.513517       1.285185      6.781583       1.747250      6.197524       1.897027      96.95255 13.92349  91.44140 16.15975  5.511154       21.33076  
1 1 1 2  27 3  o 150.0978 7.824289  15.36928       1.559519      17.14893       2.314799      13.89012       2.110339      156.7251 11.15707  140.8727 11.33790  15.85245       15.90687  
1 1 1 2  27 4  o 38.03049 15.46333  0.5638772      1.228148      2.424424       1.882358      -0.8152152     1.620610      57.42324 20.02724  34.30510 15.71463  23.11814       25.45663  
1 1 1 2  27 5  o 127.9311 8.229218  11.22270       1.395400      11.84122       1.612908      9.382124       2.782335      130.9120 9.306743  109.9155 19.72125  20.99651       21.80695  
1 1 1 2  27 6  o 134.1161 8.248588  12.34517       1.466992      11.36026       1.799080      14.29941       2.534187      127.3718 10.69874  140.9299 13.66600  -13.55811      17.35576  
1 1 1 2  27 7  o 51.12046 16.21643  1.944189       1.239934      2.443581       1.783792      1.477303       1.724760      56.82949 19.51184  48.74449 18.78801  8.084995       27.08692  
1 1 1 2  27 8  o 106.1761 10.62881  7.945228       1.483587      8.035691       2.040717      7.843821       2.160632      103.9857 15.17474  101.8048 16.49084  2.180939       22.41028  
1 1 1 2  27 9  o 57.94958 4.402202  2.269969       0.3373899     -4.208137      2.452962      2.394887       0.3406274     32.56671 16.03149  59.54639 4.322324  -26.97968      16.60395  
1 1 1 2  27 10 o 137.9859 7.208483  13.03768       1.320819      13.47544       3.068711      12.93814       1.463299      131.6532 17.96028  137.0020 8.051030  -5.348709      19.68224  
1 1 1 2  27 11 o 56.63371 17.25904  2.525634       1.420085      -0.2642985     2.938334      3.375891       1.622106      46.90717 21.36215  64.77545 18.09792  -17.86828      27.99778  
1 1 1 2  27 12 o 39.09228 16.48981  0.5064334      1.469592      -0.5818345E-01 3.031118      0.6799405      1.680291      47.87939 21.76271  41.98691 17.66714  5.892483       28.03112  
1 1 1 2  27 13 f 60.85592 13.53840  2.808928       1.069520      3.169766       1.473821      2.407524       1.554457      62.75614 17.14272  54.85019 18.21554  7.905956       25.01357  
1 1 1 2  27 14 o 76.60246 15.20409  4.560595       1.497171      5.548785       1.903148      2.956011       2.425121      82.58790 17.81736  58.96210 22.38874  23.62579       28.61318  
1 1 1 2  27 15 o 112.8206 8.702562  8.946658       1.298201      9.538754       1.390117      4.908305       3.630422      116.2741 9.043172  68.24322 26.97887  48.03085       28.45415  
1 1 1 2  27 16 o 58.07918 19.37285  2.925255       1.757850      1.895418       2.182099      4.829052       2.966884      50.71285 20.61481  68.53040 25.00315  -17.81754      32.40568  
1 1 1 2  27 17 o 39.72961 16.64703  0.7483062      1.482122      2.251260       1.928996      -1.417563      2.315659      52.18618 19.93130  36.85765 17.49068  15.32853       26.51756  
1 1 1 2  28 0  o 47.52208 19.62128  2.240711       1.232215      2.240711       1.232215      2.240711       1.232215      47.52208 19.62128  47.52208 19.62128  -0.000000      0.000000  
1 1 1 2  28 1  o 125.6638 6.772187  10.77170       1.129810      9.845010       1.753560      11.42941       1.477306      117.6990 11.32029  128.5099 8.677898  -10.81091      14.26376  
1 1 1 2  28 2  o 47.44186 13.38142  1.674043       0.8823878     2.836238       1.042196      -1.268083      1.658214      61.87096 13.05241  32.40446 15.19968  29.46650       20.03486  
1 1 1 2  28 3  o 74.93539 15.89791  4.300523       1.538222      0.5348787E-01  2.417849      7.188284       1.993732      44.97467 20.01902  97.42817 15.90534  -52.45350      25.56835  
1 1 1 2  28 4  o 66.02502 15.63629  3.350341       1.354318      2.490006       1.699416      4.847734       2.241989      56.47603 19.05057  75.94775 21.29758  -19.47171      28.57466  
1 1 1 2  28 5  o 46.56739 11.91129  1.600772       0.7419979     1.460047       0.7798831     2.944552       2.409943      44.44213 12.59562  60.66365 22.46618  -16.22152      25.75614  
1 1 1 2  28 6  o 27.25692 11.37398  0.1747307      0.6876322     -0.2820274     0.7382354     3.167974       1.889830      24.20042 10.89453  62.20642 20.05060  -38.00599      22.81923  
1 1 1 2  28 7  o 56.36029 18.40262  2.516726       1.589001      2.961715       3.038586      2.349232       1.864218      61.33995 24.54025  55.11932 19.86044  6.220631       31.56993  
1 1 1 2  28 8  o 37.64557 16.38737  0.1672246      1.538367      -1.160620      2.853257      0.7114173      1.826601      43.17366 20.14897  43.32209 18.33441  -0.1484299     27.24209  
1 1 1 2  28 9  o 79.67332 4.713656  4.295594       0.4981949     7.201232       3.136549      4.220392       0.5046008     87.23357 25.42929  78.94273 4.819890  8.290840       25.88205  
1 1 1 2  28 10 o 102.7447 1.114003  7.038420       0.1525174     3.419533       2.255469      7.055044       0.1528673     62.70043 21.91873  102.8659 1.115244  -40.16544      21.94708  
1 1 1 2  28 11 o 80.47063 14.84438  4.995049       1.533116      10.42201       3.088117      3.219971       1.766137      109.1160 21.99933  61.64059 19.32764  47.47538       29.28358  
1 1 1 2  28 12 o 31.79871 14.73549  -0.7588430     1.484424      -2.698073      3.210447      -0.2315225     1.674126      40.54299 19.59214  36.22754 16.34875  4.315453       25.51732  
1 1 1 2  28 13 o 44.60332 19.20258  0.8754811      2.065869      -0.7673001     2.662229      3.361995       3.275299      41.74084 19.47448  60.41816 24.98372  -18.67732      31.67715  
1 1 1 2  28 14 o 38.10194 16.73966  0.2582240      1.638010      -1.364759      2.870312      1.042042       1.994709      41.10121 19.49531  44.87870 19.08309  -3.777496      27.28061  
1 1 1 2  29 0  f 39.96541 15.83013  1.535492       0.8121374     1.535492       0.8121374     1.535492       0.8121374     39.96541 15.83013  39.96541 15.83013  0.000000       0.000000  
1 1 1 2  29 1  o 53.68688 12.93850  2.171718       0.9146478     3.388443       1.323569      1.059583       1.265405      66.05260 15.33341  41.57283 16.07438  24.47977       22.21484  
1 1 1 2  29 2  o 33.70572 13.02481  0.6238284      0.8304530     0.4659491      1.018395      0.9371793      1.434726      34.19450 14.01355  41.74638 16.80700  -7.551884      21.88275  
1 1 1 2  29 3  o 52.92906 15.64253  2.187350       1.179917      1.437632       2.036421      2.566236       1.447684      48.72361 19.87412  56.55279 17.46185  -7.829185      26.45557  
1 1 1 2  29 4  o 90.70677 8.349423  5.743681       0.9978670     6.559575       1.124128      2.711427       2.167114      96.73293 8.817871  57.54158 21.30531  39.19135       23.05800  
1 1 1 2  29 5  o 67.74163 9.382443  3.266512       0.8242149     3.404602       0.9221603     2.718083       1.837748      68.70244 10.39784  57.31978 19.79972  11.38266       22.36390  
1 1 1 2  29 6  o 60.79774 9.489386  2.648166       0.7436740     2.144815       0.8206237     4.960817       1.758991      53.61851 11.80575  78.37158 17.30648  -24.75307      20.94970  
1 1 1 2  29 7  o 46.71265 17.39816  1.589325       1.449131      6.449232       3.250421      0.3837243      1.618927      79.33255 26.34023  39.12049 16.92121  40.21206       31.30711  
1 1 1 2  29 8  o 92.71754 11.86886  6.320881       1.432789      6.984666       2.256707      5.872610       1.854522      91.14824 19.18820  85.44395 16.88726  5.704285       25.56104  
1 1 1 2  29 9  o 33.98168 15.35450  -0.2796129     1.482110      -3.376552      3.023449      0.6999826      1.700434      37.70484 18.40080  41.38020 17.60824  -3.675358      25.46841  
1 1 1 2  29 10 o 50.84885 7.336886  1.818409       0.4827640     1.436503       2.948143      1.828932       0.4893698     51.19091 22.47490  50.96749 7.423577  0.2234192      23.66919  
1 1 1 2  30 0  o 26.60636 16.04819  0.5868568      1.037100      0.5868568      1.037100      0.5868568      1.037100      26.60636 16.04819  26.60636 16.04819  0.000000       0.000000  
1 1 1 2  30 1  o 45.29494 13.51134  1.572685       0.8770486     0.7361963      1.114188      2.935328       1.422064      37.08292 14.85185  59.71404 17.03660  -22.63112      22.60139  
1 1 1 2  30 2  o 28.47136 11.70849  0.2862509      0.7140786     0.3918846      0.7756361     -0.3011169     1.828993      30.36380 12.30978  37.24078 16.91847  -6.876972      20.92284  
1 1 1 2  30 3  o 135.4669 12.88953  13.66760       2.298713      16.37179       3.855409      12.17605       2.863322      135.9474 22.03642  121.8607 18.18934  14.08673       28.57369  
1 1 1 2  30 4  o 44.59093 13.21341  1.520781       0.8410014     2.023196       0.9192649     -1.058619      2.082901      51.17197 13.34518  36.44169 17.07477  14.73028       21.67121  
1 1 1 2  30 5  o 76.05724 10.35379  4.191722       1.022113      4.439956       1.115113      2.886964       2.556543      77.88796 11.05436  57.58298 22.67838  20.30498       25.22910  
1 1 1 3  0  1  o 476.4492 13.73199  151.7708       8.701743      151.7708       8.701743      151.7708       8.701743      476.4492 13.73199  476.4492 13.73199  0.000000       0.000000  
1 1 1 3  0  2  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 3  0  3  o 435.7704 11.37249  126.8650       6.593525      126.8650       6.593525      126.8650       6.593525      435.7704 11.37249  435.7704 11.37249  0.000000       0.000000  
1 1 1 3  0  4  o 743.9683 12.67848  369.4038       12.56061      369.4038       12.56061      369.4038       12.56061      743.9683 12.67848  743.9683 12.67848  0.000000       0.000000  
1 1 1 3  0  5  o 672.8465 8.833827  301.9122       7.917166      301.9122       7.917166      301.9122       7.917166      672.8465 8.833827  672.8465 8.833827  -0.000000      0.000000  
1 1 1 3  0  6  o 631.9347 23.23761  267.9082       19.50746      267.9082       19.50746      267.9082       19.50746      631.9347 23.23761  631.9347 23.23761  0.000000       0.000000  
1 1 1 3  0  7  o 509.4568 14.98142  173.5815       10.15039      173.5815       10.15039      173.5815       10.15039      509.4568 14.98142  509.4568 14.98142  -0.000000      0.000000  
1 1 1 3  0  8  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 3  0  9  o 1118.870 3.401043  834.1473       5.070566      834.1473       5.070566      834.1473       5.070566      1118.870 3.401043  1118.870 3.401043  0.000000       0.000000  
1 1 1 3  0  10 o 531.8516 15.35996  189.1966       10.86509      189.1966       10.86509      189.1966       10.86509      531.8516 15.35996  531.8516 15.35996  -0.000000      0.000000  
1 1 1 3  0  11 o 94.42642 6.285820  6.020714       0.7827505     6.020714       0.7827505     6.020714       0.7827505     94.42642 6.285820  94.42642 6.285820  0.000000       0.000000  
1 1 1 3  0  12 o 19.46770 11.03865  0.3293347      0.4425264     0.3293347      0.4425264     0.3293347      0.4425264     19.46770 11.03865  19.46770 11.03865  0.000000       0.000000  
1 1 1 3  0  13 o 80.82753 6.013269  4.425914       0.6392246     4.425914       0.6392246     4.425914       0.6392246     80.82753 6.013269  80.82753 6.013269  -0.000000      0.000000  
1 1 1 3  0  14 o 241.4648 10.06185  39.08924       3.224656      39.08924       3.224656      39.08924       3.224656      241.4648 10.06185  241.4648 10.06185  0.000000       0.000000  
1 1 1 3  0  15 o 256.1924 8.514701  43.91365       2.899477      43.91365       2.899477      43.91365       2.899477      256.1924 8.514701  256.1924 8.514701  0.000000       0.000000  
1 1 1 3  0  16 o 209.3575 8.963984  29.39594       2.490253      29.39594       2.490253      29.39594       2.490253      209.3575 8.963984  209.3575 8.963984  -0.000000      0.000000  
1 1 1 3  0  17 o 194.9662 9.140170  25.52368       2.362650      25.52368       2.362650      25.52368       2.362650      194.9662 9.140170  194.9662 9.140170  -0.000000      0.000000  
1 1 1 3  0  18 o 352.0785 10.57063  82.94975       4.949100      82.94975       4.949100      82.94975       4.949100      352.0785 10.57063  352.0785 10.57063  0.000000       0.000000  
1 1 1 3  0  19 o 206.5009 10.72104  28.68668       2.931813      28.68668       2.931813      28.68668       2.931813      206.5009 10.72104  206.5009 10.72104  0.000000       0.000000  
1 1 1 3  0  20 o 472.7430 16.65632  150.0181       10.46290      150.0181       10.46290      150.0181       10.46290      472.7430 16.65632  472.7430 16.65632  0.000000       0.000000  
1 1 1 3  0  21 o 24.11258 16.11325  -0.4975988     1.423378      -0.4975988     1.423378      -0.4975988     1.423378      24.11258 16.11325  24.11258 16.11325  0.000000       0.000000  
1 1 1 3  0  22 o 168.4955 11.63606  19.22002       2.583471      19.22002       2.583471      19.22002       2.583471      168.4955 11.63606  168.4955 11.63606  -0.000000      0.000000  
1 1 1 3  0  23 f 320.4870 12.68810  68.92648       5.399189      68.92648       5.399189      68.92648       5.399189      320.4870 12.68810  320.4870 12.68810  0.000000       0.000000  
1 1 1 3  0  24 o 124.1035 14.33000  10.70324       2.287699      10.70324       2.287699      10.70324       2.287699      124.1035 14.33000  124.1035 14.33000  0.000000       0.000000  
1 1 1 3  0  25 o 273.9429 13.22412  50.56197       4.801505      50.56197       4.801505      50.56197       4.801505      273.9429 13.22412  273.9429 13.22412  0.000000       0.000000  
1 1 1 3  0  26 o 166.8514 11.60976  18.89625       2.552025      18.89625       2.552025      18.89625       2.552025      166.8514 11.60976  166.8514 11.60976  -0.000000      0.000000  
1 1 1 3  0  27 o 151.7672 15.21148  15.94367       2.999932      15.94367       2.999932      15.94367       2.999932      151.7672 15.21148  151.7672 15.21148  0.000000       0.000000  
1 1 1 3  0  28 f 40.70122 23.13595  1.501564       1.950510      1.501564       1.950510      1.501564       1.950510      40.70122 23.13595  40.70122 23.13595  -0.000000      0.000000  
1 1 1 3  0  29 o 31.64635 20.43748  0.3800983E-01  2.010226      0.3800983E-01  2.010226      0.3800983E-01  2.010226      31.64635 20.43748  31.64635 20.43748  -0.000000      0.000000  
1 1 1 3  0  30 o 74.55929 26.79345  5.068812       2.435280      5.068812       2.435280      5.068812       2.435280      74.55929 26.79345  74.55929 26.79345  0.000000       0.000000  
1 1 1 3  0  31 o 53.30223 29.79687  2.902075       3.166008      2.902075       3.166008      2.902075       3.166008      53.30223 29.79687  53.30223 29.79687  0.000000       0.000000  
1 1 1 3  0  32 o 33.54382 21.60966  0.2175599      2.229373      0.2175599      2.229373      0.2175599      2.229373      33.54382 21.60966  33.54382 21.60966  -0.000000      0.000000  
1 1 1 3  0  33 o 32.97626 21.76639  -0.1690875     2.467362      -0.1690875     2.467362      -0.1690875     2.467362      32.97626 21.76639  32.97626 21.76639  -0.000000      0.000000  
1 1 1 3  0  34 o 54.99164 30.68431  3.698518       3.349847      3.698518       3.349847      3.698518       3.349847      54.99164 30.68431  54.99164 30.68431  0.000000       0.000000  
1 1 1 3  0  35 o 56.52217 29.61625  4.084774       2.936366      4.084774       2.936366      4.084774       2.936366      56.52217 29.61625  56.52217 29.61625  -0.000000      0.000000  
1 1 1 3  0  36 o 35.20856 23.22305  0.4835925      2.800681      0.4835925      2.800681      0.4835925      2.800681      35.20856 23.22305  35.20856 23.22305  0.000000       0.000000  
1 1 1 3  0  37 o 48.31257 27.12817  3.244031       2.638854      3.244031       2.638854      3.244031       2.638854      48.31257 27.12817  48.31257 27.12817  0.000000       0.000000  
1 1 1 3  0  38 o 32.44499 22.35874  -0.4358574     3.207609      -0.4358574     3.207609      -0.4358574     3.207609      32.44499 22.35874  32.44499 22.35874  -0.000000      0.000000  
1 1 1 3  1  0  o 959.3083 56.11514  629.4924       71.16504      629.4924       71.16504      629.4924       71.16504      959.3083 56.11514  959.3083 56.11514  0.000000       0.000000  
1 1 1 3  1  1  o 820.2905 14.14049  449.2618       15.45630      427.0749       22.88593      467.8682       20.95810      798.3796 21.53189  836.4245 18.80406  -38.04492      28.58697  
1 1 1 3  1  2  o 896.7313 21.55577  538.4011       25.75724      559.1882       43.30097      527.0180       32.04264      909.2847 35.80751  885.5112 27.18789  23.77356       44.95953  
1 1 1 3  1  3  o 169.7496 1.210675  19.19851       0.2738480     21.11562       0.9653589     19.03074       0.2855795     178.0090 4.069803  169.0061 1.268093  9.002914       4.262787  
1 1 1 3  1  4  o 294.8387 3.011044  57.92345       1.182974      55.81301       1.983844      59.08795       1.473636      289.3908 5.144572  297.7802 3.713820  -8.389343      6.345004  
1 1 1 3  1  5  o 1282.599 2.853534  1096.132       4.876939      1097.134       4.925949      1046.551       34.65918      1283.183 2.880897  1250.423 20.80117  32.76013       20.99972  
1 1 1 3  1  6  o 366.5464 8.995585  89.59379       4.393715      89.78106       4.674196      88.17235       12.87756      366.7838 9.571820  361.4040 26.93402  5.379761       28.58429  
1 1 1 3  1  7  o 322.1531 7.526783  69.18835       3.231061      84.85929       5.765009      62.01148       3.901396      356.3949 12.15714  304.7773 9.618512  51.61758       15.50199  
1 1 1 3  1  8  o 520.6955 10.44059  180.8522       7.244066      186.3371       8.526691      166.6230       13.73367      528.4248 12.10943  498.5045 20.72010  29.92029       23.99919  
1 1 1 3  1  9  o 949.5313 16.42235  602.4970       20.77869      573.6438       26.80361      645.9514       32.89371      925.4828 21.73459  980.8915 25.18708  -55.40869      33.26832  
1 1 1 3  1  10 o 519.0110 26.89017  181.4942       18.53362      192.3008       26.17401      170.6272       26.24713      531.6329 37.18188  499.8813 39.73072  31.75159       54.41528  
1 1 1 3  1  11 o 356.2337 5.780159  84.58711       2.743773      90.58472       4.791599      81.66109       3.346801      368.3674 9.770333  349.9764 7.176580  18.39099       12.12282  
1 1 1 3  1  12 o 84.41512 4.964376  4.765861       0.5559517     5.372982       0.7347657     3.952812       0.8502948     89.56271 6.194873  76.51685 8.481761  13.04585       10.50318  
1 1 1 3  1  13 o 66.26901 1.195556  2.926007       0.1055733     2.577169       0.8240023     2.931829       0.1064506     61.28346 10.46596  66.33490 1.204294  -5.051441      10.53502  
1 1 1 3  1  14 o 262.8016 5.025822  46.03957       1.759984      45.96872       2.139473      46.18788       3.095378      262.5657 6.114985  262.9294 8.847489  -0.3636780     10.75505  
1 1 1 3  1  15 o 284.5894 6.994273  54.02723       2.652375      53.41805       4.405924      54.37348       3.321718      282.4262 11.73290  285.2681 8.748825  -2.841858      14.63567  
1 1 1 3  1  16 o 308.8616 8.847486  63.75189       3.637554      59.15413       5.300970      67.84354       5.000708      296.9068 13.43347  318.2551 11.81236  -21.34833      17.88826  
1 1 1 3  1  17 o 265.4720 7.212730  47.06280       2.549114      43.63877       4.610167      48.57064       3.059331      254.8586 13.62464  269.5726 8.527542  -14.71397      16.07326  
1 1 1 3  1  18 o 571.3579 11.34229  218.3354       8.635401      224.5605       12.90425      213.2869       11.62092      577.8982 16.77520  563.5745 15.48916  14.32367       22.83246  
1 1 1 3  1  19 o 407.3618 9.872736  110.8717       5.359094      116.0326       6.659790      101.3905       9.026761      416.2833 12.01857  388.0095 17.50394  28.27383       21.23285  
1 1 1 3  1  20 o 495.6394 11.73669  164.2915       7.751488      174.6282       9.584154      144.7424       13.18036      510.3748 14.10613  462.7089 21.43520  47.66592       25.66029  
1 1 1 3  1  21 o 344.2668 8.624988  79.17245       3.953530      77.87910       5.198868      80.94608       6.088113      341.0991 11.45437  347.5015 13.17163  -6.402405      17.45550  
1 1 1 3  1  22 o 305.1972 7.555569  62.15845       3.072708      62.79943       4.222744      61.43713       4.479549      306.3780 10.35830  302.9376 11.11590  3.440430       15.19400  
1 1 1 3  1  23 o 192.7180 8.096495  24.83994       2.074552      23.47897       3.062253      25.99441       2.820370      186.8675 12.36756  196.8676 10.79252  -10.00008      16.41448  
1 1 1 3  1  24 o 266.3497 7.322017  47.40000       2.596236      44.44036       4.760891      48.65266       3.097305      256.9238 13.95869  269.7016 8.629515  -12.77777      16.41077  
1 1 1 3  1  25 o 85.36135 10.86584  4.960648       1.207968      7.678163       2.222629      3.821468       1.439054      105.4611 16.34468  74.00414 15.10487  31.45697       22.25547  
1 1 1 3  1  26 o 72.91638 12.06524  3.668359       1.131328      0.1517833      2.244097      4.866652       1.309976      47.86182 20.29176  84.24712 12.00856  -36.38530      23.57882  
1 1 1 3  1  27 o 87.31648 10.11325  5.189590       1.154953      8.232477       2.594723      4.437745       1.289769      108.1851 18.67376  80.18204 12.47722  28.00310       22.45864  
1 1 1 3  1  28 o 224.9368 7.695876  33.95646       2.303307      34.43644       3.892892      33.69793       2.857062      225.0123 13.03938  223.6255 9.610360  1.386795       16.19828  
1 1 1 3  1  29 o 108.1556 12.92777  8.062735       1.826287      8.192455       2.643485      7.944285       2.526036      106.9979 19.24843  105.5399 18.64337  1.458061       26.79696  
1 1 1 3  1  30 o 70.04803 13.87285  3.472829       1.249078      5.137244       2.487138      2.911435       1.444451      83.30219 22.06046  63.62161 16.79471  19.68057       27.72592  
1 1 1 3  1  31 o 57.24199 15.25152  2.359975       1.184222      1.429681       2.344144      2.678750       1.372197      54.62165 21.65192  60.80542 16.51282  -6.183769      27.23011  
1 1 1 3  1  32 o 49.55077 16.21092  1.711791       1.232764      0.6307269      2.349073      2.122676       1.448210      49.36158 20.83622  54.52796 17.55008  -5.166378      27.24249  
1 1 1 3  1  33 o 39.29877 17.75059  -0.5945202     1.978678      1.284406       2.462501      -4.018061      3.323987      52.60751 21.69962  41.14350 19.89528  11.46401       29.43969  
1 1 1 3  1  34 o 36.30275 15.54017  0.2336908      1.338627      4.010744       2.753721      -0.9350388     1.531794      68.29453 24.19036  32.25858 14.95558  36.03595       28.44017  
1 1 1 3  1  35 o 42.93021 15.77278  1.294124       1.183836      4.484610       3.243659      0.8038359      1.271548      67.48248 25.82779  39.12296 15.79703  28.35952       30.27575  
1 1 1 3  1  36 o 22.13583 11.00975  -2.756827      1.271018      -3.950707      1.403319      2.694249       2.998591      21.25414 10.71079  55.91621 23.56880  -34.66207      25.88840  
1 1 1 3  1  37 o 43.67476 15.66167  1.519546       1.157721      2.666746       1.408396      -0.8707900     2.032988      55.07659 17.25809  35.44041 16.68818  19.63618       24.00702  
1 1 1 3  1  38 o 31.74849 13.54776  0.3629552      1.011601      0.6720526      1.115379      -1.070038      2.401580      35.08034 14.54951  36.60293 17.49318  -1.522594      22.75301  
1 1 1 3  2  0  o 1071.640 34.73655  772.4221       49.48495      772.4221       49.48495      772.4221       49.48495      1071.640 34.73655  1071.640 34.73655  0.000000       0.000000  
1 1 1 3  2  1  o 1124.763 16.12998  845.2067       24.17512      821.3173       42.23592      856.8470       29.48234      1105.100 28.70613  1131.752 19.54957  -26.65173      34.73079  
1 1 1 3  2  2  o 797.4315 16.54385  424.9037       17.57938      417.1630       20.57692      445.8186       33.82350      789.6804 19.55490  813.2146 31.27159  -23.53424      36.88233  
1 1 1 3  2  3  o 356.3576 11.38670  84.81153       5.400071      83.67686       9.222094      85.40359       6.661570      353.1226 19.67666  357.3814 14.01567  -4.258820      24.15802  
1 1 1 3  2  4  o 607.0377 8.634359  245.7081       6.984242      258.9301       9.037956      226.1074       11.00420      623.0109 10.88682  581.9294 14.19105  41.08148       17.88600  
1 1 1 3  2  5  o 922.8951 9.976846  568.0803       12.26928      580.3267       14.67445      539.6331       22.36553      932.5913 11.80856  898.2956 18.68472  34.29572       22.10341  
1 1 1 3  2  6  o 381.9236 8.501074  97.25967       4.326371      92.36594       5.383393      106.1844       7.269984      371.9413 10.87363  398.5810 13.70851  -26.63974      17.49740  
1 1 1 3  2  7  o 103.3075 5.917826  7.136608       0.8112351     8.692400       1.710677      6.685228       0.9214318     113.5670 11.46090  99.90145 6.965413  13.66553       13.41153  
1 1 1 3  2  8  o 695.2114 13.57049  322.6589       12.57146      316.0729       14.33631      344.5771       26.15359      687.8546 15.64109  715.7162 27.47415  -27.86157      31.61443  
1 1 1 3  2  9  o 848.2366 3.429556  479.4408       3.876399      479.6251       3.909485      468.6906       29.85885      848.3987 3.458168  834.9206 26.87326  13.47809       27.09485  
1 1 1 3  2  10 o 580.2574 16.13704  225.2128       12.46511      261.1491       23.31907      210.8366       14.74917      622.4434 28.18813  560.8601 19.76601  61.58325       34.42769  
1 1 1 3  2  11 o 1054.909 14.02103  743.3985       19.70919      717.0690       27.41529      771.5628       28.35443      1034.680 19.88444  1073.292 19.82575  -38.61218      28.07937  
1 1 1 3  2  12 o 234.2126 5.886462  36.59053       1.835667      36.52536       2.600156      36.65530       2.591914      233.8658 8.357142  234.2847 8.315578  -0.4188843     11.78943  
1 1 1 3  2  13 o 360.1648 9.159682  86.61261       4.392407      84.82841       6.689701      87.96470       5.823578      355.9026 14.13405  362.6817 12.06690  -6.779144      18.58444  
1 1 1 3  2  14 o 252.4026 7.698532  42.53995       2.586231      36.96989       4.645073      45.04233       3.113437      234.5191 14.94188  259.6227 9.013288  -25.10353      17.44991  
1 1 1 3  2  15 o 231.8194 6.492285  35.87138       2.003516      39.15179       2.781341      32.33334       2.888496      242.0289 8.637945  219.8003 9.887427  22.22855       13.12918  
1 1 1 3  2  16 o 451.2486 10.81560  136.1211       6.503394      137.8502       7.591591      131.3531       12.60628      453.6691 12.57011  440.5986 21.53714  13.07047       24.93704  
1 1 1 3  2  17 o 120.1000 7.687607  9.666443       1.223831      10.06624       1.567523      9.042289       1.958587      122.3639 9.692746  115.4945 12.94920  6.869476       16.17501  
1 1 1 3  2  18 o 208.1720 5.813285  28.92433       1.610987      27.90133       2.100826      30.38456       2.509936      204.3126 7.730461  213.1206 8.857503  -8.807968      11.75650  
1 1 1 3  2  19 o 199.6651 7.373518  26.63844       1.958411      27.54140       2.337771      24.51351       3.586234      202.9151 8.665931  190.7469 14.21149  12.16820       16.64526  
1 1 1 3  2  20 o 401.9063 8.584995  107.8365       4.597676      108.0967       5.703848      107.3540       7.768627      402.0327 10.65654  399.9854 14.60010  2.047394       18.07553  
1 1 1 3  2  21 o 597.2884 9.638481  238.2843       7.671251      236.9183       9.646519      240.6342       12.65254      595.1346 12.16415  598.7447 15.87252  -3.610107      19.99759  
1 1 1 3  2  22 o 281.8453 6.908630  52.99665       2.594635      49.91560       3.330975      57.75045       4.137536      273.2384 9.161588  293.7601 10.58733  -20.52167      14.00093  
1 1 1 3  2  23 o 63.64264 10.88167  2.784296       0.8896850     1.895427       1.003995      6.034555       1.919870      52.29533 14.09198  93.51009 15.98144  -41.21476      21.30705  
1 1 1 3  2  24 o 301.2490 6.371385  60.56107       2.557602      56.60086       3.298595      66.53080       4.049924      290.9252 8.518087  315.2737 9.651558  -24.34851      12.87285  
1 1 1 3  2  25 o 94.68004 8.027759  6.034769       1.003268      6.515655       1.592834      5.718526       1.291695      97.72441 12.51906  91.75591 10.76933  5.968498       16.51380  
1 1 1 3  2  26 o 22.62995 10.69433  -0.9799407     0.8486673     -1.095118      1.534833      -0.9292185     1.018536      33.16931 15.23095  25.99289 12.09988  7.176416       19.45222  
1 1 1 3  2  27 o 125.1050 7.252701  10.50904       1.203877      7.628078       1.960351      12.25342       1.525405      105.1653 14.36406  134.9346 8.527373  -29.76933      16.70456  
1 1 1 3  2  28 o 202.1528 8.383065  27.47575       2.253267      28.75659       4.279645      26.98450       2.650372      204.4958 15.82857  199.9576 9.978606  4.538223       18.71139  
1 1 1 3  2  29 o 190.8441 7.121534  24.45637       1.807854      21.08453       2.318824      29.68271       2.886909      176.5274 9.897486  209.3917 10.37901  -32.86429      14.34169  
1 1 1 3  2  30 o 210.6143 7.155544  29.81910       2.005270      29.81691       2.738887      29.82163       2.943966      209.7854 9.825018  209.5262 10.57860  0.2592010      14.43738  
1 1 1 3  2  31 o 105.6940 10.06212  7.653705       1.400065      6.035836       2.154913      8.835503       1.841746      90.82513 18.43588  112.8451 12.45522  -22.01997      22.24892  
1 1 1 3  2  32 o 92.58823 15.79550  6.216370       1.878915      6.761679       2.282694      5.070719       3.308664      95.23776 18.65491  79.85365 26.57699  15.38411       32.47063  
1 1 1 3  2  33 o 24.62481 11.70314  -1.189369      1.044421      -1.441951      1.099051      1.163546       3.354433      24.43205 11.71850  56.96002 24.49509  -32.52796      27.15387  
1 1 1 3  2  34 o 22.22173 10.46592  -0.7807786     0.8003381     0.4023148      0.9597392     -3.481893      1.450158      33.22080 13.60806  23.20529 11.57660  10.01551       17.86609  
1 1 1 3  2  35 o 18.91685 9.216272  -1.237915      0.7494770     -1.096891      0.8857210     -1.593481      1.406408      21.96965 10.53281  27.59420 13.24070  -5.624552      16.91911  
1 1 1 3  2  36 o 45.42517 16.37927  1.595722       1.268241      0.4712347      2.200235      2.155231       1.552012      42.83102 19.07887  50.93713 18.14856  -8.106106      26.33199  
1 1 1 3  2  37 o 14.32447 7.127687  -1.263921      0.5350580     -1.543054      0.5711349     0.7384844      1.529710      14.10822 7.071795  39.00424 16.65228  -24.89603      18.09167  
1 1 1 3  2  38 o 34.36229 14.21022  0.6373309      1.059687      2.296907       1.552778      -0.8093576     1.449767      49.88662 18.10508  29.86269 14.07124  20.02393       22.93019  
1 1 1 3  3  0  o 400.4114 17.97393  107.6466       9.545979      107.6466       9.545979      107.6466       9.545979      400.4114 17.97393  400.4114 17.97393  -0.000000      0.000000  
1 1 1 3  3  1  o 286.4444 1.862884  54.66887       0.7110492     54.10336       1.174202      54.99631       0.8935025     284.9498 3.092437  287.2979 2.333941  -2.348114      3.874331  
1 1 1 3  3  2  o 203.8558 1.207647  27.68830       0.3280473     29.28839       1.290285      27.57772       0.3391932     209.6413 4.618865  203.4482 1.251180  6.193085       4.785327  
1 1 1 3  3  3  o 201.1269 7.912663  27.01113       2.116498      27.08969       3.349972      26.95893       2.730491      201.0828 12.56518  200.7825 10.23948  0.3002472      16.20897  
1 1 1 3  3  4  o 735.7172 11.96484  361.1827       11.72982      329.7492       18.00807      384.3474       15.45909      701.8612 19.27320  758.5775 15.29362  -56.71625      24.60388  
1 1 1 3  3  5  o 455.9297 9.060449  138.6181       5.504541      131.4016       7.134662      149.2309       8.652164      443.5883 12.08160  472.5923 13.75393  -29.00403      18.30671  
1 1 1 3  3  6  o 642.2354 10.70790  275.1477       9.163724      272.7013       9.774344      292.9125       26.33941      639.3158 11.47357  659.1984 30.06501  -19.88257      32.17993  
1 1 1 3  3  7  o 730.7363 15.51545  356.6898       15.10771      363.7860       26.77314      353.3746       18.29952      735.4664 27.36662  726.6323 18.91564  8.834106       33.26760  
1 1 1 3  3  8  f 827.5885 13.84637  457.2729       15.26947      431.2790       18.86801      506.6085       25.99389      803.2042 17.62896  869.3337 22.45820  -66.12952      28.55085  
1 1 1 3  3  9  o 520.1654 11.29857  180.5383       7.831387      175.4170       10.61625      186.6521       11.59945      512.1593 15.57391  528.2023 16.50047  -16.04297      22.68948  
1 1 1 3  3  10 o 648.4683 2.690001  280.1952       2.324420      280.1687       2.349463      281.4196       15.96266      648.4371 2.719113  648.2566 18.49818  0.1804810      18.69696  
1 1 1 3  3  11 o 704.5675 11.12763  331.3161       10.44717      349.6448       13.46078      303.5510       16.56740      723.4335 13.96362  673.1227 18.48834  50.31073       23.16898  
1 1 1 3  3  12 o 223.7092 5.732655  33.38302       1.707479      33.78501       2.164310      32.72041       2.778696      224.9750 7.228959  221.2496 9.446823  3.725464       11.89539  
1 1 1 3  3  13 o 300.0431 5.465325  60.01459       2.185109      59.99544       2.241099      60.38344       9.837026      299.9908 5.606342  298.2828 24.97842  1.707977       25.59986  
1 1 1 3  3  14 o 245.9952 3.401357  40.32865       1.114942      40.06755       1.153528      44.03666       4.347085      245.1950 3.530555  256.2898 12.76919  -11.09476      13.24829  
1 1 1 3  3  15 o 38.02455 9.127034  1.004276       0.4565691     0.3557343      0.9838480     1.182277       0.5154306     34.56144 13.91658  41.25349 9.563141  -6.692051      16.88564  
1 1 1 3  3  16 o 98.58930 5.869814  6.505267       0.7676392     5.166216       1.135815      7.631202       1.041516      87.37579 9.931366  106.6858 7.371639  -19.31003      12.36823  
1 1 1 3  3  17 o 59.10561 7.520316  2.368963       0.5789020     1.495398       1.067682      2.732717       0.6889668     47.58814 15.04199  63.43445 8.353619  -15.84631      17.20594  
1 1 1 3  3  18 o 213.1829 5.715681  30.33051       1.622190      27.20985       2.210062      33.97563       2.388570      201.7183 8.239497  225.4682 7.962723  -23.74992      11.45837  
1 1 1 3  3  19 o 267.0716 7.354711  47.63044       2.614889      41.73763       3.297121      57.62035       4.292934      249.7489 9.927135  293.3792 11.00073  -43.63026      14.81769  
1 1 1 3  3  20 o 346.2891 8.449072  80.04934       3.898714      78.97785       4.622247      82.69104       7.257733      343.6744 10.10425  350.8117 15.56453  -7.137329      18.55668  
1 1 1 3  3  21 o 421.3197 9.035793  118.5282       5.072845      123.9820       7.915317      114.7266       6.608424      430.0517 13.83054  413.9908 11.99200  16.06088       18.30552  
1 1 1 3  3  22 o 520.1879 9.810051  180.7841       6.799939      172.3240       9.951543      188.1938       9.313289      506.7817 14.75225  530.1539 13.18340  -23.37219      19.78462  
1 1 1 3  3  23 o 160.2543 5.645948  17.14976       1.203763      15.61942       1.455068      20.46853       2.142785      152.8155 7.165613  174.7873 9.232903  -21.97182      11.68728  
1 1 1 3  3  24 o 42.87954 10.46818  1.279614       0.5928298     0.3292548      0.6901738     3.953919       1.157764      29.83301 11.77279  75.93172 11.82769  -46.09871      16.68810  
1 1 1 3  3  25 o 98.46033 6.911796  6.507107       0.9010688     4.979303       1.115276      9.379111       1.529118      85.65638 9.956559  117.9430 9.818580  -32.28660      13.98348  
1 1 1 3  3  26 o 200.6096 6.222791  26.91084       1.661441      26.14757       2.241961      27.84064       2.474474      197.4227 8.542529  203.6255 9.142949  -6.202835      12.51273  
1 1 1 3  3  27 o 144.7429 7.075221  14.05268       1.360482      12.49779       2.040330      15.29746       1.825560      135.7316 11.38580  150.7061 9.133459  -14.97450      14.59645  
1 1 1 3  3  28 o 106.8507 8.588064  7.715955       1.212484      6.225403       1.717632      9.196409       1.711804      94.69783 14.03612  116.1807 11.19572  -21.48283      17.95430  
1 1 1 3  3  29 f 214.4703 6.438250  30.83864       1.837878      31.44674       2.426462      30.02027       2.814879      216.0941 8.442938  210.6580 10.05691  5.436142       13.13105  
1 1 1 3  3  30 o 108.9192 8.555613  8.042192       1.231775      9.330838       1.488073      5.237366       2.195383      117.1179 9.619866  84.53378 19.83365  32.58414       22.04349  
1 1 1 3  3  31 o ?        ?         -3.366822      0.5859879     -4.004932      0.6224707     1.603134       1.737191      ?        ?         51.65017 19.08408  0.000000       19.08408  
1 1 1 3  3  32 o 73.26491 11.12846  3.769868       1.052314      4.107438       1.206754      2.698431       2.149909      76.12748 12.31648  61.43133 21.40467  14.69615       24.69525  
1 1 1 3  3  33 o ?        ?         -3.163049      0.2523573     -3.200566      0.2563594     -1.989486      1.433791      ?        ?         27.28517 13.16257  0.000000       13.16257  
1 1 1 3  3  34 o ?        ?         -1.695083      0.1710855     -1.675312      0.1721481     -3.281815      1.542182      ?        ?         24.77982 12.29111  0.000000       12.29111  
1 1 1 3  3  35 o 21.22888 10.02716  -0.7344508     0.7443368     -0.9775367     0.8372965     0.1815548      1.625356      21.66605 10.34759  37.92348 16.66761  -16.25743      19.61840  
1 1 1 3  3  36 o 57.48772 17.47357  2.820929       1.456884      2.703335       2.515620      2.880274       1.787079      55.21652 22.24625  56.90214 19.53005  -1.685619      29.60267  
1 1 1 3  3  37 o 53.04613 18.09049  2.534272       1.532790      -2.241140      3.756758      3.488009       1.678890      41.83833 20.43823  61.35326 18.77935  -19.51493      27.75582  
1 1 1 3  3  38 o 30.40187 10.52792  0.6580552      0.5197135     0.3581530      0.5485643     3.286305       1.623944      26.39115 10.47005  58.62730 18.55361  -32.23615      21.30395  
1 1 1 3  4  0  o 472.4150 15.62657  149.3722       9.812551      149.3722       9.812551      149.3722       9.812551      472.4150 15.62657  472.4150 15.62657  0.000000       0.000000  
1 1 1 3  4  1  o 636.0811 17.12895  270.6006       14.50512      268.4200       16.62543      277.5516       29.68251      633.1160 19.73089  640.3914 34.91626  -7.275391      40.10553  
1 1 1 3  4  2  o 564.1949 7.845148  212.2196       5.897987      231.3316       11.77130      205.8132       6.815178      588.3497 15.02695  555.5455 9.206277  32.80426       17.62285  
1 1 1 3  4  3  o 296.3810 4.938088  58.54053       1.950216      58.25840       2.486460      58.99155       3.143791      295.6416 6.311644  297.3536 7.941380  -1.711975      10.14408  
1 1 1 3  4  4  o 388.0630 7.089559  100.3877       3.666021      98.09902       6.445764      101.4821       4.457108      383.1831 12.64123  390.1241 8.573870  -6.941010      15.27455  
1 1 1 3  4  5  o 594.8429 8.895786  235.9474       7.051153      235.7301       7.454520      237.7939       21.73006      594.5390 9.409484  594.3982 27.50993  0.1408081      29.07464  
1 1 1 3  4  6  o 566.1008 9.157963  213.7086       6.908220      206.9734       8.573044      226.1797       11.66578      556.9608 11.55146  581.7449 15.06168  -24.78406      18.98132  
1 1 1 3  4  7  o 303.1621 6.231057  61.25980       2.517157      64.66460       3.725445      58.39973       3.414446      311.2730 8.991218  295.8158 8.671503  15.45715       12.49148  
1 1 1 3  4  8  o 215.0291 1.624190  30.80710       0.4653798     28.80844       1.720806      30.96481       0.4833930     207.8016 6.221554  215.5785 1.682756  -7.776917      6.445107  
1 1 1 3  4  9  o 706.9376 13.46320  333.7026       12.68244      332.8256       13.83791      338.3059       31.70327      705.8576 14.71228  706.9386 33.75244  -1.080994      36.81953  
1 1 1 3  4  10 o 319.7590 5.253903  68.14719       2.238610      67.23965       2.394645      74.43807       6.304700      317.6134 5.658077  333.5060 14.21952  -15.89267      15.30388  
1 1 1 3  4  11 o 424.9590 11.33344  120.6358       6.412015      123.2033       7.114211      109.5216       14.80144      429.3454 12.44816  402.2050 27.78823  27.14041       30.44901  
1 1 1 3  4  12 o 183.3491 6.870201  22.44723       1.675533      22.69305       2.017513      21.90079       3.007990      184.2632 8.237658  180.6241 12.57617  3.639023       15.03393  
1 1 1 3  4  13 o 225.1245 5.863668  33.81347       1.757502      35.40798       2.422466      32.04153       2.553689      230.2476 7.907407  218.9504 8.770584  11.29724       11.80890  
1 1 1 3  4  14 f 261.5089 7.847915  45.67261       2.731634      44.90134       3.307323      47.32800       4.845342      259.1354 9.594600  265.5650 13.73913  -6.429596      16.75768  
1 1 1 3  4  15 o 188.3415 5.887133  23.67953       1.475672      24.86675       1.997793      22.25399       2.189137      192.8737 7.789298  182.3328 9.038377  10.54086       11.93170  
1 1 1 3  4  16 o 260.6522 6.308388  45.31816       2.191055      45.43761       2.942043      45.16939       3.283190      260.7362 8.479145  259.8604 9.497593  0.8757935      12.73186  
1 1 1 3  4  17 o 276.7552 5.679100  51.08044       2.094348      53.95782       2.964106      48.21178       2.959610      284.2122 7.834150  268.5992 8.278946  15.61301       11.39802  
1 1 1 3  4  18 o 239.9450 5.422103  38.39189       1.733617      36.59487       2.324541      40.64404       2.602315      234.0541 7.462819  246.6356 7.928576  -12.58150      10.88834  
1 1 1 3  4  19 o 87.56050 4.779038  5.126545       0.5554854     5.190116       0.6098984     4.817209       1.345378      88.07298 5.220280  83.96168 12.39756  4.111305       13.45180  
1 1 1 3  4  20 o 111.7076 5.236691  8.338304       0.7773249     8.991820       0.9123613     6.607671       1.484708      115.9670 5.923795  98.75349 11.49753  17.21355       12.93385  
1 1 1 3  4  21 o 319.0124 7.681132  67.91263       3.265174      68.42371       3.967471      66.83990       5.747923      319.9561 9.315636  315.6432 13.69860  4.312958       16.56601  
1 1 1 3  4  22 o 408.1977 8.327293  111.2416       4.529475      106.5956       6.713150      115.1241       6.136862      398.8566 12.64693  414.7842 11.11328  -15.92761      16.83597  
1 1 1 3  4  23 f 356.3500 6.937815  84.74635       3.294375      82.95122       4.075648      88.12986       5.595433      352.3899 8.679602  362.6707 11.59327  -10.28085      14.48238  
1 1 1 3  4  24 o 245.2023 5.290679  40.10722       1.728659      41.18849       2.236490      38.50261       2.724501      248.2977 6.765902  239.8622 8.537781  8.435562       10.89363  
1 1 1 3  4  25 f 73.29454 3.820251  3.591871       0.3718223     3.564348       0.3944447     3.811380       1.113941      72.99483 4.071409  74.48792 11.60047  -1.493095      12.29419  
1 1 1 3  4  26 o 213.0307 5.387121  30.31965       1.528002      33.61988       1.949779      25.06666       2.459895      224.1904 6.533687  193.0847 9.590838  31.10570       11.60488  
1 1 1 3  4  27 o 102.6275 4.585106  7.044743       0.6254447     7.003719       0.6997693     7.207668       1.394551      102.2754 5.151227  103.0145 10.29711  -0.7390823     11.51372  
1 1 1 3  4  28 o 90.39670 4.276683  5.467738       0.5136886     5.993086       0.5616774     2.781463       1.270103      94.63152 4.466889  62.57454 15.35036  32.05698       15.98707  
1 1 1 3  4  29 f 68.27432 8.288280  3.178849       0.7386162     2.335146       0.9893642     4.241157       1.110163      57.42944 13.20470  78.44778 10.91545  -21.01834      17.13217  
1 1 1 3  4  30 o 55.88313 14.12934  2.229488       1.052583      4.384828       2.082883      1.490287       1.219799      77.20697 20.06474  47.66854 16.13977  29.53843       25.75046  
1 1 1 3  4  31 o 74.61471 12.23492  3.915806       1.174339      4.089419       2.469135      3.865054       1.334996      73.76428 22.80969  73.52360 14.13975  0.2406845      26.83681  
1 1 1 3  4  32 o 93.63044 7.129245  5.957460       0.8827886     7.089460       0.9417643     -2.240953      2.534452      102.2302 6.954778  39.28036 18.53812  62.94982       19.79977  
1 1 1 3  4  33 o 72.47079 7.376553  3.606191       0.7024260     4.276761       0.8775427     2.410362       1.171874      78.61877 8.512235  56.67959 15.20332  21.93918       17.42410  
1 1 1 3  4  34 o 86.27505 6.448369  5.092144       0.7359626     5.066695       0.7989832     5.234644       1.890625      85.84233 7.046923  80.96152 17.99168  4.880814       19.32251  
1 1 1 3  4  35 o 21.15707 9.544242  -0.2280287     0.5699534     -0.4123458     0.5996618     1.495123       1.833519      20.36145 9.410948  47.23762 19.00607  -26.87617      21.20841  
1 1 1 3  4  36 o 62.44241 18.65601  3.448062       1.671083      1.252485       2.321537      5.808924       2.407335      46.82436 20.25827  77.53599 22.18077  -30.71163      30.03971  
1 1 1 3  4  37 o 34.01199 15.99491  -0.8061184     1.856929      -2.218485      2.522732      0.8640193      2.743301      35.01381 17.02476  45.22833 20.61436  -10.21452      26.73564  
1 1 1 3  5  0  o 381.1074 13.86238  97.25101       7.018610      97.25101       7.018610      97.25101       7.018610      381.1074 13.86238  381.1074 13.86238  -0.000000      0.000000  
1 1 1 3  5  1  f 167.4845 7.117104  18.73304       1.584749      18.73304       1.584749      0.000000       0.000000      167.4845 7.117104  ?        ?         0.000000       7.117104  
1 1 1 3  5  2  o 521.7058 7.920673  181.4613       5.506319      180.9970       7.141033      182.1422       8.647720      520.9189 10.28768  522.4299 12.42224  -1.511047      16.12912  
1 1 1 3  5  3  o 496.3130 2.024114  164.1247       1.338641      163.5822       1.383253      172.1301       5.313826      495.4914 2.095037  508.1179 7.848186  -12.62650      8.123005  
1 1 1 3  5  4  o 1010.983 3.312265  681.0541       4.462130      686.4554       21.49985      680.8110       4.561450      1013.674 15.91708  1010.799 3.386604  2.874878       16.27337  
1 1 1 3  5  5  o 974.7079 12.84233  634.1015       16.67984      640.2057       20.32703      621.5189       29.18403      978.9810 15.58211  963.1782 22.73867  15.80280       27.56536  
1 1 1 3  5  6  o 947.5002 12.88391  599.2073       16.26673      603.5149       20.32791      591.5378       27.12428      950.4322 16.05085  939.8887 21.65750  10.54352       26.95695  
1 1 1 3  5  7  o 1076.960 11.95014  773.9949       17.14929      773.2087       26.80096      774.5400       22.31591      1075.167 18.70686  1076.742 15.55354  -1.575317      24.32816  
1 1 1 3  5  8  o 661.1060 8.761110  291.4632       7.717982      283.6931       10.79513      299.5878       11.03870      651.9324 12.42658  669.9526 12.36517  -18.02026      17.53047  
1 1 1 3  5  9  o 628.4869 12.92350  263.7370       10.82306      249.1962       16.70049      274.2663       14.21128      609.5667 20.59009  640.2382 16.67201  -30.67151      26.49354  
1 1 1 3  5  10 o 118.0394 7.947249  9.333569       1.242736      8.175792       1.380298      14.28898       2.855621      110.2992 9.483305  145.4563 14.94551  -35.15716      17.70032  
1 1 1 3  5  11 o 490.4964 8.005578  160.4604       5.232414      168.9760       6.684729      146.9898       8.407548      503.1992 9.969431  468.8179 13.47232  34.38123       16.75986  
1 1 1 3  5  12 o 50.67391 7.209707  1.746864       0.4731089     3.057245       0.6849952     0.5515850      0.6542195     67.25358 7.787349  32.10131 11.73651  35.15227       14.08504  
1 1 1 3  5  13 o 373.9239 4.400659  93.19704       2.192676      98.68713       5.684993      92.23760       2.376559      384.1636 11.11725  371.9788 4.794650  12.18478       12.10710  
1 1 1 3  5  14 o 169.9345 6.393463  19.28748       1.445160      18.05725       1.812409      21.43513       2.394669      164.2735 8.306668  178.8502 10.08897  -14.57669      13.06859  
1 1 1 3  5  15 o 425.9363 8.435425  121.1186       4.787680      120.0286       5.836074      123.3619       8.372298      423.8010 10.33440  428.7397 14.67636  -4.938721      17.94980  
1 1 1 3  5  16 o 219.7408 5.956241  32.22868       1.742432      32.63322       2.090397      31.30777       3.153967      221.0334 7.106605  216.1073 10.98859  4.926102       13.08637  
1 1 1 3  5  17 o 126.3165 5.632543  10.66179       0.9456809     9.909410       1.432847      11.24247       1.258785      121.4892 8.912955  129.5921 7.319284  -8.102859      11.53311  
1 1 1 3  5  18 o 294.6344 7.572582  57.96983       2.970577      58.54733       3.931333      57.20131       4.535126      295.8509 9.986570  292.2145 11.67047  3.636444       15.36006  
1 1 1 3  5  19 o 350.3754 6.930443  81.89864       3.235699      79.66742       3.964401      86.35098       5.600173      345.4473 8.612361  359.1501 11.71747  -13.70276      14.54207  
1 1 1 3  5  20 o 298.1054 7.295230  59.29200       2.897893      59.77353       3.818445      58.63794       4.450190      299.0068 9.596098  295.9508 11.30537  3.056030       14.82891  
1 1 1 3  5  21 o 360.9859 7.583155  86.95797       3.647655      85.17951       4.953009      89.06569       5.392035      356.8742 10.42669  364.8386 11.10412  -7.964386      15.23212  
1 1 1 3  5  22 f 127.4912 6.183075  10.86747       1.047276      10.30284       1.348152      11.72672       1.663087      123.9554 8.208295  132.1464 9.508216  -8.190987      12.56114  
1 1 1 3  5  23 o 439.7160 7.614909  129.0952       4.461804      129.8792       5.854520      128.0090       6.891410      440.7155 9.969180  437.0470 11.84423  3.668518       15.48129  
1 1 1 3  5  24 o 195.2471 6.528128  25.47753       1.696038      28.48557       2.479210      22.83136       2.325302      206.1823 9.045794  184.4881 9.490733  21.69427       13.11108  
1 1 1 3  5  25 o 147.0238 4.477186  14.43272       0.8761127     14.71736       0.9871641     13.37682       1.901291      148.4291 4.998234  140.8895 10.19635  7.539627       11.35552  
1 1 1 3  5  26 o 136.8429 4.070580  12.50348       0.7414280     12.18333       0.8161505     14.01560       1.773733      135.0418 4.541999  144.2639 9.276083  -9.222137      10.32838  
1 1 1 3  5  27 o 96.88231 4.067940  6.274603       0.5239924     6.514101       0.5692600     4.945851       1.340856      98.69487 4.339157  84.71736 12.23157  13.97751       12.97843  
1 1 1 3  5  28 o 74.61338 4.443762  3.730868       0.4398142     4.304395       0.4764346     0.4244724      1.143942      80.15884 4.478251  36.96428 14.96255  43.19456       15.61835  
1 1 1 3  5  29 o 159.6003 4.818320  17.04130       1.023541      17.40659       1.181447      15.94220       2.049356      161.2020 5.508185  153.2872 10.08926  7.914810       11.49492  
1 1 1 3  5  30 o 187.5510 5.632529  23.58458       1.406060      22.97098       1.687289      24.97903       2.543603      184.8103 6.863489  191.7430 9.989801  -6.932678      12.12038  
1 1 1 3  5  31 o 104.0120 4.518885  7.254392       0.6248137     7.111600       0.6522142     8.847508       2.178520      102.9438 4.767572  111.5995 15.03146  -8.655647      15.76942  
1 1 1 3  5  32 o 70.87443 6.605715  3.418670       0.6166702     4.295431       0.7127213     0.8075213      1.229971      79.46687 6.795866  40.37490 15.78106  39.09198       17.18213  
1 1 1 3  5  33 o 26.50101 12.58651  -1.301571      1.204095      -1.760857      3.534769      -1.241280      1.280690      47.45242 22.23691  27.85958 13.15716  19.59284       25.83778  
1 1 1 3  5  34 o 74.03960 14.12312  4.145314       1.342545      3.682768       2.683763      4.299699       1.550492      64.70580 23.75256  74.14260 16.15181  -9.436798      28.72395  
1 1 1 3  5  35 o 32.88608 13.68163  0.3984014      0.9906082     -1.360304      2.835809      0.6428351      1.057209      41.07118 19.45071  35.66523 14.40302  5.405952       24.20284  
1 1 1 3  5  36 o 34.98298 13.91063  0.6979002      0.9704622     -0.8540484     2.997435      0.8796300      1.025709      42.36459 20.04368  37.14471 14.44180  5.219883       24.70455  
1 1 1 3  5  37 o 44.09769 17.90085  1.483238       1.642695      -0.7643486     2.104971      4.984041       2.627071      35.95027 16.94450  66.09768 23.60512  -30.14741      29.05715  
1 1 1 3  6  0  f 21.55538 13.25849  0.2384377      0.7387444     0.2384377      0.7387444     0.2384377      0.7387444     21.55538 13.25849  21.55538 13.25849  -0.000000      0.000000  
1 1 1 3  6  1  o 1217.734 20.63636  992.4489       33.48568      0.000000       0.000000      992.4489       33.48568      ?        ?         1217.734 20.63636  0.000000       20.63636  
1 1 1 3  6  2  o 712.8459 2.866269  338.5890       2.722614      339.2126       2.752411      310.2501       18.55323      713.5015 2.894976  680.5724 20.48171  32.92908       20.68529  
1 1 1 3  6  3  o 614.1688 8.474947  251.5077       6.935827      254.0683       8.678452      246.9808       11.53925      617.1573 10.55292  608.1927 14.23846  8.964600       17.72281  
1 1 1 3  6  4  o 741.8282 6.635546  366.8214       6.559240      363.4698       10.76844      368.7984       8.270586      738.1325 10.94826  743.7229 8.345486  -5.590393      13.76632  
1 1 1 3  6  5  o 885.8474 12.64657  523.7405       14.92812      567.3843       26.21871      502.8051       18.15891      920.5354 21.37457  867.5532 15.70798  52.98224       26.52570  
1 1 1 3  6  6  o 733.8316 10.93167  359.2744       10.68947      363.8707       13.45830      351.4194       17.59381      738.2271 13.68128  724.6625 18.23458  13.56464       22.79643  
1 1 1 3  6  7  o 286.7228 4.485707  54.78643       1.713826      51.59665       2.930795      56.44397       2.112697      278.0673 7.917798  291.0111 5.448214  -12.94379      9.611168  
1 1 1 3  6  8  o 227.9145 0.7364042 34.60910       0.2236463     37.79765       1.043878      34.45570       0.2289628     238.1663 3.289242  227.4087 0.7555867 10.75758       3.374911  
1 1 1 3  6  9  o 243.1988 5.602008  39.42382       1.815427      29.70046       5.855814      40.45773       1.909509      209.4099 21.28063  246.3629 5.816648  -36.95306      22.06124  
1 1 1 3  6  10 o 536.9011 13.80341  192.7626       9.867200      198.3694       14.27743      187.6361       13.65222      543.6271 19.74227  528.7620 19.40917  14.86505       27.68526  
1 1 1 3  6  11 o 174.1950 5.582250  20.24907       1.294068      19.63338       1.664575      21.18962       2.057388      171.4246 7.303872  178.0026 8.700294  -6.577942      11.35965  
1 1 1 3  6  12 o 124.1238 5.441096  10.29110       0.8977564     11.46339       1.377267      9.424994       1.183817      130.8421 7.936784  118.6276 7.527856  12.21448       10.93897  
1 1 1 3  6  13 o 256.5021 6.335817  43.87881       2.165545      36.05258       3.366992      49.40032       2.828099      232.0244 10.92082  271.9811 7.811465  -39.95671      13.42696  
1 1 1 3  6  14 o 406.8842 8.343190  110.5151       4.523520      110.0864       5.657384      111.2749       7.532144      405.7361 10.47278  407.3529 13.89667  -1.616882      17.40104  
1 1 1 3  6  15 o 182.6469 7.796701  22.30593       1.893200      21.63850       2.443768      23.30777       2.994043      179.6519 10.25088  186.2504 12.12988  -6.598557      15.88126  
1 1 1 3  6  16 o 487.5576 10.21167  158.8678       6.634319      158.4513       9.238072      159.3113       9.533591      485.9973 14.28056  487.2158 14.70140  -1.218536      20.49550  
1 1 1 3  6  17 o 294.7614 7.177132  57.97417       2.819000      59.71764       6.195118      57.51890       3.165733      297.9225 15.66032  293.4303 8.104232  4.492126       17.63304  
1 1 1 3  6  18 o 421.4722 7.814021  118.5526       4.388509      125.1026       6.730885      113.7094       5.787891      432.3528 11.69390  412.3560 10.54219  19.99673       15.74437  
1 1 1 3  6  19 o 182.2396 5.489186  22.16511       1.331462      22.55483       1.747416      21.62564       2.055922      183.7281 7.151174  179.7799 8.607066  3.948151       11.19021  
1 1 1 3  6  20 o 150.7299 5.698785  15.17178       1.142543      15.06721       1.406517      15.37466       1.959053      150.1173 7.051086  151.4040 9.762392  -1.286697      12.04251  
1 1 1 3  6  21 o 466.5588 9.102235  145.3697       5.658847      156.8828       7.618042      131.1962       8.452485      484.2960 11.80481  442.2320 14.36273  42.06396       18.59144  
1 1 1 3  6  22 o 108.2598 4.212592  7.825001       0.6065416     8.001005       0.6636224     6.931914       1.494881      109.4531 4.560073  101.1735 11.27997  8.279579       12.16684  
1 1 1 3  6  23 o 239.6443 6.853402  38.36606       2.186254      38.83484       3.166798      37.93919       3.021946      240.7564 9.892246  238.0048 9.547941  2.751602       13.74844  
1 1 1 3  6  24 o 351.3598 6.932931  82.45384       3.245955      78.31631       4.646631      86.39723       4.536305      341.7921 10.21387  359.1574 9.486900  -17.36526      13.94003  
1 1 1 3  6  25 o 77.82767 7.355242  4.085779       0.7537404     4.136388       1.023360      4.025771       1.114342      77.89484 10.09662  76.61996 11.24925  1.274887       15.11580  
1 1 1 3  6  26 o 24.85330 11.47979  -0.7134650     0.8902354     1.311637       1.836130      -1.335808      1.017876      51.20300 19.47207  24.00639 11.44974  27.19661       22.58889  
1 1 1 3  6  27 o 48.05098 5.649112  1.564421       0.3548045     1.527423       0.3756979     1.869581       1.078978      47.40659 6.087737  51.76786 14.86242  -4.361271      16.06089  
1 1 1 3  6  28 o 49.42257 8.358903  1.685540       0.5308813     2.018914       0.6037850     0.5497223      1.114476      54.14164 8.660848  37.66199 14.92925  16.47964       17.25957  
1 1 1 3  6  29 o 185.7648 6.795903  23.17764       1.679390      23.94936       2.042114      21.56524       2.951781      188.5076 8.149004  177.4545 12.56438  11.05316       14.97564  
1 1 1 3  6  30 o 116.0133 6.786898  9.073256       1.044605      7.958769       1.239754      11.80127       1.939642      108.2176 8.669806  131.1388 11.20716  -22.92114      14.16919  
1 1 1 3  6  31 o 107.5719 7.083639  7.835745       1.009730      8.132952       1.092080      6.085056       2.650513      109.4882 7.531251  88.70999 22.41680  20.77824       23.64810  
1 1 1 3  6  32 o 88.64279 7.449231  5.364861       0.8717572     5.525542       1.064365      5.037409       1.519437      89.46487 9.052651  83.32645 14.19263  6.138412       16.83393  
1 1 1 3  6  33 o 35.59208 12.57005  0.8217727      0.7431032     -1.452101      0.8922080     5.971363       1.342670      20.83093 10.12771  91.60844 11.23406  -70.77751      15.12530  
1 1 1 3  6  34 o 64.00127 14.48984  3.157619       1.206882      3.838464       2.689936      2.986021       1.350433      65.07466 23.79738  61.23688 16.27337  3.837780       28.82946  
1 1 1 3  6  35 o 13.76010 6.961468  -2.080237      0.6276945     -3.205819      0.8483970     -0.7189389     0.9330121     ?        ?         24.46635 11.45214  0.000000       11.45214  
1 1 1 3  6  36 o 12.98803 6.580753  -1.962643      0.5744387     -1.522713      0.6757804     -3.108409      1.090592      16.27735 8.084469  18.76941 9.456554  -2.492065      12.44126  
1 1 1 3  6  37 o 38.19250 15.14678  0.9964889      1.147705      -4.695745      4.263147      1.441282       1.191703      39.59436 19.76771  42.45506 15.78410  -2.860703      25.29625  
1 1 1 3  7  0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 3  7  1  o 317.9229 7.203186  67.37946       3.051546      0.000000       0.000000      67.37946       3.051546      ?        ?         317.9229 7.203186  0.000000       7.203186  
1 1 1 3  7  2  o 232.5041 4.457918  36.02451       1.381135      36.18446       1.660686      35.66570       2.487291      233.0087 5.348622  231.1453 8.087934  1.863373       9.696517  
1 1 1 3  7  3  o 732.8924 7.997255  358.1212       7.810065      358.0067       11.78386      358.2108       10.42987      732.4453 12.07366  732.7819 10.68146  -0.3365479     16.12038  
1 1 1 3  7  4  o 537.9177 6.729954  192.8849       4.823936      187.8514       7.760060      196.0551       6.158431      530.6265 10.97495  542.2361 8.523306  -11.60968      13.89591  
1 1 1 3  7  5  o 324.8038 4.720998  70.30721       2.043283      74.62734       2.999740      66.56784       2.790833      334.5888 6.728196  316.0080 6.627691  18.58081       9.444306  
1 1 1 3  7  6  o 230.7457 4.251709  35.48199       1.307286      34.92941       1.708560      36.26233       2.030374      228.9231 5.601020  233.1420 6.542015  -4.218918      8.612164  
1 1 1 3  7  7  o 589.5488 8.434170  231.7877       6.625759      239.4423       8.474809      219.7524       10.62660      599.0403 10.61696  573.5775 13.90365  25.46289       17.49376  
1 1 1 3  7  8  o 459.3903 9.205913  140.7780       5.635366      148.7203       8.673129      134.9751       7.413514      471.6123 13.81610  449.4316 12.39086  22.18069       18.55851  
1 1 1 3  7  9  o 323.2600 5.066115  69.65060       2.182230      70.54025       7.812918      69.57532       2.272681      324.0336 18.16738  323.0796 5.279045  0.9539795      18.91883  
1 1 1 3  7  10 o 278.3011 4.976282  51.62584       1.845413      52.92849       2.951115      50.78938       2.364814      281.5865 7.872766  275.9962 6.430140  5.590302       10.16500  
1 1 1 3  7  11 o 145.1191 5.704352  14.06236       1.100925      14.99486       1.516407      13.02304       1.600914      149.7354 7.625174  139.4317 8.659276  10.30370       11.53804  
1 1 1 3  7  12 o 114.7603 4.490659  8.792271       0.6853877     9.147964       0.7875218     7.681555       1.391636      117.0312 5.061923  106.7956 9.891478  10.23558       11.11145  
1 1 1 3  7  13 o 32.40122 10.99114  0.6481780      0.5657092     1.696081       0.9081357     -0.1631182E-01 0.7231601     49.52581 13.42669  26.88787 11.46354  22.63794       17.65471  
1 1 1 3  7  14 o 313.0453 7.621249  65.39959       3.179120      65.11427       4.959666      65.59859       4.141932      311.7593 11.96095  313.1842 9.937556  -1.424896      15.55054  
1 1 1 3  7  15 o 100.7548 9.689278  6.844339       1.284840      7.540227       2.221228      6.494425       1.575086      104.7336 16.45822  97.74275 12.36992  6.990822       20.58854  
1 1 1 3  7  16 o 370.0955 8.723688  91.45997       4.302169      96.07848       7.096537      88.77625       5.409590      378.3943 14.09901  364.2004 11.15997  14.19391       17.98129  
1 1 1 3  7  17 o 204.6451 7.809165  27.99055       2.125601      32.39734       3.738473      25.88539       2.583904      219.6403 12.82932  196.5939 9.895360  23.04640       16.20215  
1 1 1 3  7  18 o 123.7433 7.238440  10.25114       1.188337      6.511894       2.722007      11.13162       1.320856      96.38874 21.71553  128.9249 7.723975  -32.53617      23.04830  
1 1 1 3  7  19 o 120.4262 7.855554  9.718964       1.253702      9.479268       2.804285      9.778838       1.401566      117.3614 18.54731  120.7115 8.773357  -3.350121      20.51767  
1 1 1 3  7  20 o 298.9297 8.312273  59.69288       3.307810      57.85695       5.588541      60.68292       4.103892      293.5289 14.33140  301.1970 10.24009  -7.668091      17.61387  
1 1 1 3  7  21 o 487.6212 8.355036  158.7480       5.428806      173.4772       8.523468      148.6942       7.041928      509.0770 12.56491  471.5378 11.20731  37.53915       16.83689  
1 1 1 3  7  22 f 338.5477 7.487036  76.51383       3.377562      73.51955       4.717870      79.66196       4.837565      331.3467 10.69940  344.9502 10.53674  -13.60352      15.01666  
1 1 1 3  7  23 o 221.3354 8.571586  32.79407       2.523271      31.05155       2.906725      38.12242       5.082901      215.1565 10.16732  237.3070 16.17074  -22.15054      19.10150  
1 1 1 3  7  24 o 101.2363 10.08282  6.934470       1.342100      8.621337       2.017091      5.594430       1.797810      112.3413 13.76155  89.77646 15.59373  22.56480       20.79771  
1 1 1 3  7  25 o 169.3942 8.225476  19.25618       1.851113      20.32303       2.978776      18.58498       2.362722      173.1238 13.00754  165.9859 10.74003  7.137863       16.86844  
1 1 1 3  7  26 o 161.9793 7.745498  17.61459       1.666949      14.63492       2.481593      20.06450       2.250199      146.5919 12.83350  172.5169 9.829166  -25.92496      16.16512  
1 1 1 3  7  27 f 55.53417 15.87525  2.165060       1.233607      4.383356       1.925007      0.6192815      1.606927      78.11936 18.73459  43.79212 17.73111  34.32724       25.79490  
1 1 1 3  7  28 o 57.61081 6.064806  2.246104       0.4586044     2.561574       0.4977070     0.4717919      1.180347      61.55250 6.150392  37.75859 15.22927  23.79391       16.42431  
1 1 1 3  7  29 o 213.1779 8.280830  30.64820       2.347810      32.79949       3.415454      28.72099       3.232687      219.2283 11.73448  205.0448 11.88244  14.18343       16.70001  
1 1 1 3  7  30 o 52.18760 14.70248  1.947563       1.065868      2.237466       1.222672      1.029771       2.175484      55.76810 15.75924  50.83696 20.61357  4.931137       25.94751  
1 1 1 3  7  31 o 20.41839 8.400743  0.9413618E-01  0.3678278     0.6094043      0.3875324     -4.589677      1.168399      29.79038 9.003092  ?        ?         0.000000       9.003092  
1 1 1 3  7  32 o ?        ?         -2.241496      0.3531025     -2.576560      0.3649346     2.675709       1.398011      ?        ?         59.46407 16.86766  0.000000       16.86766  
1 1 1 3  7  33 o 28.90065 11.57075  0.3425862      0.6760246     -0.3641633     0.7720793     2.664639       1.399475      24.25802 11.00930  58.37616 16.97706  -34.11813      20.23426  
1 1 1 3  7  34 o 74.38305 15.47112  4.340190       1.483423      -0.5800397E-01 2.739920      6.164027       1.764387      45.17116 20.59345  89.03657 15.43025  -43.86541      25.73291  
1 1 1 3  7  35 o 81.97601 9.651548  4.837215       1.034102      5.838991       1.451318      3.804126       1.473825      87.87179 12.76817  67.93893 16.45606  19.93286       20.82854  
1 1 1 3  7  36 o 29.72083 11.79635  0.4646827      0.6966447     -0.2289625     0.7853867     3.024289       1.508695      24.77536 11.18761  58.27447 17.79533  -33.49911      21.01991  
1 1 1 3  7  37 o 26.71729 12.06728  -0.1887027     0.9143655     -0.8981746E-01 1.243775      -0.3049961     1.348819      31.21682 14.08920  31.16009 14.29719  0.5673218E-01  20.07274  
1 1 1 3  8  0  o 166.6927 2.049948  18.52184       0.4551820     18.52184       0.4551820     18.52184       0.4551820     166.6927 2.049948  166.6927 2.049948  -0.000000      0.000000  
1 1 1 3  8  1  f 504.1585 10.44786  169.5633       7.018883      174.7544       11.70761      166.6507       8.769616      510.9717 17.21942  499.4478 13.18855  11.52393       21.68978  
1 1 1 3  8  2  o 689.3471 8.060120  316.8501       7.403771      315.9804       10.38603      317.7487       10.55709      688.1423 11.32656  690.0507 11.48126  -1.908447      16.12794  
1 1 1 3  8  3  o 474.0040 9.047919  149.8437       5.714842      151.4479       8.969483      148.7474       7.414691      475.9841 14.15743  472.1037 11.78643  3.880341       18.42153  
1 1 1 3  8  4  o 728.7358 8.713749  354.1573       8.461526      356.6550       11.47311      351.1787       12.52935      731.0139 11.77828  725.2469 12.96489  5.766968       17.51617  
1 1 1 3  8  5  o 693.1271 7.847369  320.3462       7.247872      312.0297       10.21510      328.7775       10.28534      683.7839 11.21115  701.9166 10.99663  -18.13269      15.70401  
1 1 1 3  8  6  o 713.5275 8.669073  339.5620       8.242461      339.2336       10.09822      340.2177       14.26701      712.9949 10.62882  713.4721 15.00660  -0.4771729     18.38940  
1 1 1 3  8  7  o 93.18153 2.514993  5.789762       0.3119917     5.624138       0.3421535     6.606865       0.7599722     91.82883 2.799471  99.38937 5.763030  -7.560547      6.406992  
1 1 1 3  8  8  o 451.9610 3.892481  136.1302       2.344234      137.1701       2.415905      119.3799       9.696155      453.6809 3.996280  421.9048 17.28351  31.77612       17.73951  
1 1 1 3  8  9  o 176.2828 1.838991  20.70573       0.4319793     20.77073       0.4611685     20.24045       1.233816      176.5585 1.960187  174.1695 5.322486  2.389023       5.671966  
1 1 1 3  8  10 o 146.9443 0.8817808 14.38654       0.1726581     17.63780       2.734354      14.37353       0.1730034     161.9252 12.77607  146.8778 0.8839440 15.04739       12.80662  
1 1 1 3  8  11 o 326.8879 6.628322  71.26865       2.887194      77.50938       5.117248      68.35430       3.496948      340.3730 11.29822  319.9399 8.209299  20.43311       13.96576  
1 1 1 3  8  12 f 447.6398 7.129505  133.6855       4.252670      116.1779       6.687217      145.5738       5.510507      416.6076 12.05874  466.9495 8.856213  -50.34195      14.96148  
1 1 1 3  8  13 o 191.0090 2.179080  24.31136       0.5546264     28.71128       5.018860      24.25697       0.5580443     205.7970 18.49893  190.7950 2.194968  15.00200       18.62870  
1 1 1 3  8  14 o 485.1353 5.162841  156.9313       3.337530      138.2901       9.103209      159.8261       3.587330      453.8311 15.07404  489.5636 5.499063  -35.73251      16.04576  
1 1 1 3  8  15 o 211.5367 8.573346  29.92568       2.411620      28.50143       3.136826      31.98428       3.771230      206.1229 11.46583  218.1845 13.03073  -12.06155      17.35699  
1 1 1 3  8  16 f 558.2659 8.852572  208.1039       6.585429      211.5658       12.80624      206.8594       7.678469      560.9410 17.15306  556.3687 10.35710  4.572266       20.03739  
1 1 1 3  8  17 o 200.1267 8.259540  26.77834       2.197860      26.38372       3.875928      26.96536       2.668340      197.8714 14.80745  200.6608 10.01103  -2.789398      17.87404  
1 1 1 3  8  18 o 376.4518 7.762846  94.56815       3.894071      97.56383       7.881995      93.60086       4.478850      381.1562 15.55151  374.4225 8.976997  6.733734       17.95650  
1 1 1 3  8  19 o 498.2022 10.04672  165.8081       6.669659      163.5562       10.86676      167.1691       8.448092      493.4186 16.55107  499.6888 12.69806  -6.270233      20.86094  
1 1 1 3  8  20 o 504.0494 8.271314  169.6003       5.555474      164.3843       9.174547      172.6201       6.980803      495.1736 13.91825  508.2466 10.30760  -13.07294      17.31948  
1 1 1 3  8  21 o 50.24840 18.09486  1.427046       1.547231      -0.3210744     2.371425      2.722779       2.041651      47.12085 20.43042  64.42047 20.84699  -17.29962      29.18902  
1 1 1 3  8  22 o 225.0459 8.189106  33.87700       2.451639      32.94055       3.352303      34.95373       3.594651      221.4971 11.39631  228.1100 11.86683  -6.612869      16.45289  
1 1 1 3  8  23 o 149.1340 9.622491  14.94739       1.902014      13.37963       2.966328      16.04200       2.478606      139.9027 16.21152  154.1356 12.16647  -14.23286      20.26910  
1 1 1 3  8  24 o 76.06119 14.92294  4.040097       1.458437      3.881125       1.878477      4.281344       2.314066      74.08098 18.95401  77.81430 21.56969  -3.733322      28.71422  
1 1 1 3  8  25 o 62.17084 16.82484  2.721584       1.427497      3.452832       2.303649      2.265764       1.818782      70.66641 22.06129  58.90423 19.70689  11.76218       29.58144  
1 1 1 3  8  26 o 189.2214 10.25145  24.17013       2.575161      27.16280       4.242042      22.42368       3.240588      198.7734 16.15475  181.3606 13.50631  17.41278       21.05698  
1 1 1 3  8  27 o 80.40462 11.20876  4.451210       1.168316      5.985557       1.696662      3.067630       1.611150      92.70051 14.18583  65.54354 17.93153  27.15697       22.86433  
1 1 1 3  8  28 o 215.8939 7.831673  31.35913       2.249304      30.10093       3.256498      32.50706       3.110514      210.2687 11.66834  218.9036 10.69602  -8.634933      15.82893  
1 1 1 3  8  29 f 133.1071 11.63101  12.16196       2.042263      13.90822       2.789032      10.14321       2.998750      141.0656 15.07062  118.2404 19.72734  22.82529       24.82522  
1 1 1 3  8  30 o 131.2456 11.98114  11.92962       2.072268      11.43506       3.281555      12.25766       2.672569      124.1232 20.55962  131.3899 15.56697  -7.266685      25.78815  
1 1 1 3  8  31 o 20.81385 9.897879  -0.9032258     0.7492993     0.6119162      0.9205572     -3.877866      1.289856      35.35249 13.69909  20.53160 10.33664  14.82089       17.16133  
1 1 1 3  8  32 o 60.30376 9.909960  2.574384       0.7686869     4.128585       0.9215241     -0.9805866     1.393706      76.96430 9.165383  30.57708 14.20673  46.38723       16.90667  
1 1 1 3  8  33 o 31.56144 11.61862  0.6015757      0.6428841     -0.7807505E-01 0.7303984     2.938863       1.354481      25.60881 11.21662  61.11669 16.32340  -35.50787      19.80571  
1 1 1 3  8  34 o 51.68404 13.79320  2.075474       0.9675967     4.450788       1.469084      0.2555596      1.285913      75.27437 15.17092  35.04950 15.12024  40.22486       21.41912  
1 1 1 3  8  35 o 36.56201 13.23513  0.9319559      0.8290824     0.3738978E-02  1.136941      1.986112       1.211618      31.37258 13.85815  49.30494 16.06747  -17.93236      21.21820  
1 1 1 3  8  36 o 26.81419 11.17291  0.2433898      0.6621192     0.2656193      0.7580438     0.1718524      1.359867      28.32467 11.88922  34.14212 15.11521  -5.817451      19.23079  
1 1 1 3  9  0  o 496.8504 2.221900  164.4883       1.470971      164.4883       1.470971      164.4883       1.470971      496.8504 2.221900  496.8504 2.221900  0.000000       0.000000  
1 1 1 3  9  1  o 656.0059 8.233602  286.9779       7.197325      293.4165       9.967368      279.9632       10.40376      663.0636 11.28111  647.6070 12.05606  15.45660       16.51096  
1 1 1 3  9  2  o 390.6215 7.436655  101.7369       3.870859      106.6785       6.285488      98.71773       4.913063      399.5957 11.81740  384.6872 9.584536  14.90845       15.21560  
1 1 1 3  9  3  o 509.1595 3.362228  172.7504       2.281153      171.6952       2.360783      187.6057       8.857749      507.5990 3.490293  530.0653 12.54066  -22.46634      13.01731  
1 1 1 3  9  4  o 299.6685 6.375144  59.86596       2.545685      60.68716       3.514296      58.95931       3.692602      301.5119 8.756299  297.1450 9.337486  4.366943       12.80084  
1 1 1 3  9  5  o 582.1274 7.263053  225.9582       5.633921      219.2037       7.283273      236.0215       8.889894      573.1942 9.535671  594.6183 11.21979  -21.42407      14.72456  
1 1 1 3  9  6  o 279.1327 4.728956  51.93065       1.758934      52.49973       2.218244      50.96685       2.886811      280.6286 5.932038  276.3307 7.847943  4.297852       9.837646  
1 1 1 3  9  7  o 455.0295 5.485234  138.0241       3.325892      138.5262       4.049531      136.9834       5.829867      455.7983 6.667430  453.0565 9.656789  2.741791       11.73491  
1 1 1 3  9  8  o 317.0035 3.880119  66.97321       1.639014      67.47515       1.823019      64.85655       3.743631      318.1784 4.299788  311.6190 9.025127  6.559387       9.997055  
1 1 1 3  9  9  o 717.3569 10.30376  343.6812       9.849279      342.8659       12.49910      345.0166       15.99748      715.9769 13.10106  717.3429 16.73599  -1.366028      21.25397  
1 1 1 3  9  10 o 606.4582 10.23009  245.6704       8.267113      236.5600       12.41480      252.9289       11.08142      593.8789 15.70180  614.7663 13.52732  -20.88739      20.72522  
1 1 1 3  9  11 o 90.67630 1.279205  5.478355       0.1545637     10.61490       1.416240      5.416437       0.1554925     125.8159 8.497336  90.16237 1.294227  35.65350       8.595333  
1 1 1 3  9  12 o 156.1226 4.605214  16.26333       0.9570047     17.54087       2.365239      16.01324       1.046492      161.6080 11.04993  154.8919 5.077161  6.716110       12.16053  
1 1 1 3  9  13 o 186.5967 5.931170  23.24523       1.472875      23.40195       2.168434      23.11099       2.006856      187.0054 8.726052  185.8913 8.121440  1.114090       11.92064  
1 1 1 3  9  14 o 241.9015 4.849819  39.01336       1.563283      44.87444       2.869957      36.54070       1.864098      259.1342 8.322249  233.9928 5.983414  25.14140       10.24993  
1 1 1 3  9  15 f 349.7142 7.443583  81.61034       3.468717      83.27104       5.560915      80.55265       4.437912      352.6379 11.85117  347.1299 9.603526  5.508026       15.25379  
1 1 1 3  9  16 o 607.6716 9.723155  246.6531       7.873171      254.7877       14.07611      242.9496       9.497809      615.7212 17.17313  602.7252 11.82580  12.99597       20.85104  
1 1 1 3  9  17 o 349.9431 7.848579  81.72110       3.659839      76.56012       7.197110      83.52113       4.250422      337.4809 16.05025  353.5701 9.028974  -16.08920      18.41556  
1 1 1 3  9  18 o 691.3013 8.668127  319.0250       7.984839      314.7792       13.55313      321.2821       9.881943      685.3985 14.83963  693.3900 10.69526  -7.991516      18.29216  
1 1 1 3  9  19 o 294.0857 8.820636  57.79567       3.452679      52.72987       6.098540      60.18533       4.188602      279.8296 16.42757  299.9245 10.49672  -20.09491      19.49477  
1 1 1 3  9  20 o 284.9663 8.278599  54.26239       3.140243      49.31958       5.960619      56.16134       3.694535      270.4430 16.62054  289.7719 9.581370  -19.32886      19.18450  
1 1 1 3  9  21 o 257.9133 7.658195  44.45193       2.629012      46.73573       4.259154      43.04616       3.341576      263.8744 12.14560  253.5413 9.909830  10.33304       15.67547  
1 1 1 3  9  22 o 56.48468 16.36943  2.195894       1.303159      1.056460       1.995675      3.042914       1.720647      51.12576 20.06665  66.17694 18.69311  -15.05119      27.42449  
1 1 1 3  9  23 o 358.8990 8.573226  86.18107       4.100059      85.35625       5.463398      87.24451       6.203596      356.3951 11.51936  359.9138 12.95629  -3.518707      17.33670  
1 1 1 3  9  24 o 259.0160 8.997055  45.01326       3.100563      48.31570       4.851486      42.73308       4.031274      267.1588 13.67347  251.6597 12.05647  15.49902       18.22971  
1 1 1 3  9  25 o 119.0982 9.922080  9.597137       1.560350      9.562325       2.564394      9.617603       1.966219      117.2170 16.90608  118.6700 12.62789  -1.453003      21.10164  
1 1 1 3  9  26 o 224.4225 8.873135  33.89318       2.648258      34.86576       3.922069      33.07820       3.590289      226.3278 13.06027  220.7109 12.25578  5.616959       17.91018  
1 1 1 3  9  27 o 106.2604 15.89573  7.916111       2.181694      7.221414       3.254598      8.483029       2.940081      98.50121 24.81233  108.2042 21.14956  -9.703026      32.60300  
1 1 1 3  9  28 o 102.5226 12.57047  7.268603       1.681400      6.307248       2.286114      8.401414       2.481617      93.28707 19.03613  108.5218 17.77596  -15.23468      26.04533  
1 1 1 3  9  29 o 78.94778 16.16660  4.498753       1.643434      6.292137       2.150642      1.981734       2.547854      93.00951 18.00348  59.32625 22.84339  33.68327       29.08515  
1 1 1 3  9  30 o 54.51612 18.92245  2.032201       1.679374      0.9115937      2.494919      2.960563       2.270851      51.99874 21.67925  64.05432 22.01429  -12.05558      30.89691  
1 1 1 3  9  31 o 104.1199 6.220961  7.340796       0.8591715     7.567571       0.9128720     5.581660       2.542512      105.6396 6.516716  83.26591 22.41992  22.37369       23.34781  
1 1 1 3  9  32 f 29.51749 12.39615  0.1799632      0.8247095     -0.2047630     0.8862825     2.663759       2.251926      27.38532 12.15903  59.06831 21.74518  -31.68299      24.91375  
1 1 1 3  9  33 o 21.09582 9.405988  -0.1624747     0.5360975     -0.1088024     0.5477206     -1.386976      2.616157      21.83205 9.632342  40.31351 18.96672  -18.48145      21.27248  
1 1 1 3  9  34 o 25.60264 11.27080  -0.7521754E-01 0.7459952     1.296503       0.8516192     -4.599016      1.546551      41.48194 13.46721  21.85508 11.04165  19.62686       17.41504  
1 1 1 3  9  35 o 19.01740 9.068996  -0.7292534     0.6381257     -1.564124      0.7059255     3.001420       1.492254      16.71361 8.294587  58.65706 17.65369  -41.94345      19.50520  
1 1 1 3  9  36 o 17.01540 8.560413  -2.441374      0.8764412     -4.745792      1.069841      2.261292       1.528308      ?        ?         50.17758 17.99445  0.000000       17.99445  
1 1 1 3  10 0  o 12.19920 7.758364  0.2601782E-01  0.2761208     0.2601782E-01  0.2761208     0.2601782E-01  0.2761208     12.19920 7.758364  12.19920 7.758364  0.000000       0.000000  
1 1 1 3  10 1  o 446.4439 6.000065  132.8689       3.569409      135.2287       4.312871      127.7384       6.359276      450.3355 7.187150  437.4541 10.90942  12.88141       13.06409  
1 1 1 3  10 2  o 349.3339 5.765200  81.34979       2.683667      80.20349       4.250912      82.10942       3.460448      346.5986 9.212277  350.9005 7.400733  -4.301941      11.81681  
1 1 1 3  10 3  o 439.8307 3.107144  128.9092       1.821044      129.9086       1.881240      114.0387       7.256826      441.5302 3.197497  412.9123 13.20609  28.61789       13.58767  
1 1 1 3  10 4  o 353.2598 7.014203  83.21514       3.301765      100.6243       7.412405      78.90590       3.687833      387.6667 14.37407  343.9453 8.046526  43.72147       16.47302  
1 1 1 3  10 5  o 459.8525 6.295032  140.9932       3.857359      138.6454       5.329102      143.5770       5.590542      455.8508 8.773194  463.8666 9.044557  -8.015778      12.60051  
1 1 1 3  10 6  o 164.1664 4.800374  17.97973       1.048978      19.18298       1.792483      17.35302       1.293626      169.3884 7.963709  161.2147 6.032497  8.173691       9.990580  
1 1 1 3  10 7  o 209.4834 4.203793  29.24911       1.173450      30.70118       1.722677      27.99207       1.602815      214.4913 6.033265  204.8101 5.879063  9.681198       8.423994  
1 1 1 3  10 8  o 328.1115 5.553608  71.77997       2.428121      72.45702       3.344726      71.02560       3.530568      329.5496 7.616689  326.2475 8.121268  3.302032       11.13413  
1 1 1 3  10 9  o 445.3526 7.342322  132.3266       4.357235      132.2774       6.769186      132.3614       5.693580      444.6906 11.43313  445.1951 9.597576  -0.5044861     14.92749  
1 1 1 3  10 10 o 583.1882 11.91835  227.4771       9.261863      219.7949       13.05326      235.2661       13.14372      571.8274 17.15029  591.7659 16.68509  -19.93848      23.92748  
1 1 1 3  10 11 o 93.94715 3.536502  5.890845       0.4419315     11.21018       3.441362      5.801652       0.4456211     127.3099 21.01876  93.22948 3.593793  34.08044       21.32378  
1 1 1 3  10 12 o 296.5683 3.405477  58.61889       1.345786      58.74283       3.549928      58.59808       1.454346      296.4509 8.996968  296.5073 3.680941  -0.5642700E-01 9.720841  
1 1 1 3  10 13 o 399.3537 8.383354  106.4697       4.461173      106.6826       5.918460      106.1897       6.788819      399.2951 11.13436  398.0946 12.81447  1.200500       16.97600  
1 1 1 3  10 14 o 210.1086 6.235381  29.46996       1.743811      30.14128       3.043725      29.14194       2.127608      212.0807 10.80599  208.8309 7.658783  3.249832       13.24486  
1 1 1 3  10 15 o 217.4389 5.147289  31.52283       1.491384      30.22036       2.714402      32.08603       1.784940      212.4974 9.611092  219.2559 6.115375  -6.758530      11.39170  
1 1 1 3  10 16 o 356.3892 7.174906  84.73622       3.407331      84.11534       5.117277      85.23074       4.566934      354.6152 10.84223  357.1118 9.605981  -2.496552      14.48547  
1 1 1 3  10 17 o 265.9179 7.442475  47.21667       2.634579      49.83721       4.208239      45.52752       3.378615      272.7826 11.60388  260.9079 9.735097  11.87476       15.14669  
1 1 1 3  10 18 o 184.4319 8.140390  22.74698       1.995646      16.59244       4.001370      24.78475       2.302443      155.8038 19.71395  192.4552 9.003079  -36.65143      21.67246  
1 1 1 3  10 19 o 434.3716 9.497356  126.0406       5.497151      119.7954       7.753497      132.3529       7.794961      422.6377 13.78597  444.3828 13.17842  -21.74512      19.07154  
1 1 1 3  10 20 o 195.2267 7.543734  25.48040       1.958760      22.26923       3.221450      27.36396       2.467234      181.7854 13.39303  202.1633 9.182692  -20.37793      16.23870  
1 1 1 3  10 21 o 296.8063 8.010447  58.89363       3.165236      60.65408       4.535038      57.22149       4.419824      300.7043 11.33826  292.0522 11.37897  8.652161       16.06353  
1 1 1 3  10 22 o 78.00121 14.77964  4.231715       1.479952      1.215078       2.524336      5.811627       1.826847      56.52987 22.44928  91.60023 15.52049  -35.07036      27.29205  
1 1 1 3  10 23 o 73.84461 14.97484  3.815595       1.423039      2.182983       2.208580      4.974498       1.860781      60.52687 21.64033  84.12874 17.18037  -23.60186      27.63094  
1 1 1 3  10 24 o 50.79732 18.00525  1.549870       1.525801      2.358306       2.423942      1.019318       1.963648      62.81269 22.64470  50.22392 19.84588  12.58878       30.11049  
1 1 1 3  10 25 o 70.67165 19.34168  3.562551       1.874117      6.573173       2.901543      1.407460       2.454900      95.04743 23.13156  56.50194 22.23203  38.54549       32.08321  
1 1 1 3  10 26 o 33.58498 14.67997  -0.2221945     1.245430      -1.114561      2.202471      0.1972716      1.510035      41.03233 18.61120  39.76860 16.74179  1.263725       25.03326  
1 1 1 3  10 27 o 47.01373 16.85591  1.329373       1.340943      1.368734       2.029701      1.298887       1.786292      52.58167 20.35071  50.20057 19.17819  2.381096       27.96345  
1 1 1 3  10 28 o 32.84525 14.76909  -0.5710912     1.352267      -0.5869460     2.685495      -0.5657055     1.565180      47.56331 21.13896  35.71730 15.98819  11.84600       26.50429  
1 1 1 3  10 29 o 40.38902 16.80062  0.4007879      1.493433      -1.442694      2.684794      1.226779       1.797128      43.83558 20.13448  49.04529 19.10270  -5.209713      27.75447  
1 1 1 3  10 30 o 97.85082 21.92700  7.466333       2.788038      8.256927       3.713954      6.445552       4.220134      99.33562 27.24456  86.95072 30.00540  12.38490       40.52888  
1 1 1 3  10 31 o 35.36643 16.68707  -1.759883      2.051394      0.9178548E-01  2.843288      -3.770227      2.962609      49.12930 21.79770  38.48145 18.64974  10.64785       28.68715  
1 1 1 3  10 32 o 37.43550 11.93940  0.9971866      0.6713796     1.141967       0.6813168     -3.857739      3.945351      39.64026 11.92819  44.18588 21.43958  -4.545616      24.53440  
1 1 1 3  10 33 o 50.41117 13.54952  1.957457       0.9296312     1.825813       0.9471599     5.415719       4.854574      48.62232 13.91412  69.37635 29.64335  -20.75403      32.74646  
1 1 1 3  10 34 o 24.91311 11.92204  -1.230958      1.123381      -1.111828      1.192697      -2.167417      3.343988      26.36805 12.52435  41.65925 20.09793  -15.29120      23.68093  
1 1 1 3  10 35 o 69.68555 12.15482  3.725271       1.087642      4.036669       1.335761      3.112638       1.873577      70.54749 14.68744  57.30766 19.98089  13.23983       24.79832  
1 1 1 3  10 36 o 37.16339 15.28956  0.8252371      1.218364      3.368735       1.506550      -3.982724      2.071325      60.83964 17.59136  27.58041 13.77110  33.25923       22.34053  
1 1 1 3  11 0  f 80.03736 6.704812  4.359027       0.7031083     4.359027       0.7031083     4.359027       0.7031083     80.03736 6.704812  80.03736 6.704812  0.000000       0.000000  
1 1 1 3  11 1  o 207.7616 4.699904  28.77148       1.301151      28.36130       1.407870      31.17350       3.406929      206.2669 5.122235  215.6824 11.90040  -9.415527      12.95595  
1 1 1 3  11 2  o 340.0300 2.454064  77.04251       1.111928      77.43119       3.502403      76.99894       1.172590      340.7040 7.714635  339.9315 2.588697  0.7724609      8.137380  
1 1 1 3  11 3  o 618.0101 10.00710  255.0000       8.240953      257.0608       11.79002      253.0314       11.52348      619.8347 14.27464  614.9962 14.06170  4.838501       20.03739  
1 1 1 3  11 4  o 510.6504 7.612373  173.9583       5.179851      173.3925       8.920941      174.2461       6.362196      509.0053 13.16375  510.9073 9.345261  -1.902039      16.14367  
1 1 1 3  11 5  o 348.1484 4.808434  80.79839       2.230702      78.61734       3.119215      83.08156       3.191402      343.3255 6.818137  352.9404 6.785889  -9.614899      9.619526  
1 1 1 3  11 6  o 748.4650 6.792266  373.6509       6.774226      366.9172       8.616943      384.5464       10.96094      741.4246 8.721933  758.6510 10.84257  -17.22644      13.91522  
1 1 1 3  11 7  o 116.1159 4.960850  9.005084       0.7658067     9.175406       1.112767      8.851833       1.055527      117.0574 7.168350  114.9872 6.920881  2.070282       9.964128  
1 1 1 3  11 8  o 353.4955 6.810515  83.35909       3.208022      78.47518       4.417681      88.80786       4.666166      342.6296 9.685721  364.5143 9.615048  -21.88470      13.64780  
1 1 1 3  11 9  o 569.3626 8.192985  216.3826       6.215908      209.8113       8.108218      225.7496       9.680544      560.2598 10.86082  580.8441 12.50739  -20.58435      16.56479  
1 1 1 3  11 10 o 505.6528 8.297428  170.6855       5.590742      170.9063       7.726397      170.4428       8.099822      505.5309 11.46980  504.7487 12.04278  0.7821350      16.63084  
1 1 1 3  11 11 o 137.4660 2.466839  12.59242       0.4518659     12.58572       0.4711689     12.66920       1.595014      137.4284 2.572922  137.4702 8.752737  -0.4187012E-01 9.123066  
1 1 1 3  11 12 o 541.3337 8.922987  195.6783       6.436486      192.2560       8.209023      201.1398       10.37028      536.1861 11.48953  547.7158 14.22097  -11.52972      18.28238  
1 1 1 3  11 13 o 258.2040 9.224822  44.57788       3.168809      47.14889       5.206544      43.06520       3.993652      264.8271 14.81317  253.4823 11.85643  11.34480       18.97379  
1 1 1 3  11 14 o 154.4006 5.762577  15.91919       1.183522      17.23721       2.681149      15.60021       1.318983      160.0156 12.67788  152.7967 6.492961  7.218918       14.24385  
1 1 1 3  11 15 o 211.8489 5.401891  29.94339       1.523671      30.11390       2.834507      29.87409       1.806933      212.0891 10.05831  211.5429 6.417600  0.5462036      11.93127  
1 1 1 3  11 16 o 296.8060 6.663753  58.75974       2.635513      54.37052       4.199759      61.61112       3.385003      285.0085 11.07952  303.7083 8.372274  -18.69971      13.88707  
1 1 1 3  11 17 o 306.9285 6.484219  62.83474       2.651969      66.14079       5.308635      61.73532       3.061328      314.1516 12.70771  304.1714 7.552974  9.980286       14.78287  
1 1 1 3  11 18 o 51.69015 10.72578  1.852124       0.7145432     0.8871713      2.494896      1.938348       0.7457844     54.70737 22.11406  52.87903 10.94505  1.828342       24.67440  
1 1 1 3  11 19 f 204.7671 7.772620  28.03175       2.116956      28.98435       3.669992      27.55673       2.591562      207.5443 13.34096  202.8374 9.615641  4.706940       16.44511  
1 1 1 3  11 20 o 233.2631 7.501959  36.37083       2.328784      39.45150       3.896051      34.65833       2.904814      242.3355 12.10350  227.4593 9.605494  14.87617       15.45186  
1 1 1 3  11 21 o 238.5811 6.916217  38.04547       2.196441      37.71999       3.109703      38.36950       3.102783      237.1669 9.861429  239.2202 9.754206  -2.053314      13.87056  
1 1 1 3  11 22 o 190.5430 10.16833  24.41277       2.572412      24.44881       3.154219      24.34118       4.445221      190.2394 12.51225  188.4727 17.91510  1.766769       21.85194  
1 1 1 3  11 23 o 174.5942 12.33616  20.64462       2.851531      29.49948       5.022611      16.43291       3.463922      207.0029 18.40026  154.4480 17.11817  52.55486       25.13168  
1 1 1 3  11 24 o 261.5865 9.318797  46.01408       3.243055      43.24062       3.728159      54.63963       6.574715      253.0855 11.08173  281.8578 17.59319  -28.77222      20.79243  
1 1 1 3  11 25 o 127.2217 11.53605  11.02769       1.934416      8.340961       2.413879      15.84993       3.233911      108.9279 17.20066  151.2344 16.30473  -42.30649      23.70035  
1 1 1 3  11 26 o 245.3613 9.438890  40.62741       3.080276      39.60549       3.507110      44.07586       6.442483      241.7326 10.91598  250.5397 19.44983  -8.807129      22.30369  
1 1 1 3  11 27 o 44.91235 17.81229  0.8415436      1.587231      1.519803       2.078451      -0.1074102     2.458467      53.81385 20.65495  47.73412 20.74832  6.079731       29.27661  
1 1 1 3  11 28 o 62.77377 23.34678  2.478857       2.607698      2.772043       2.983932      1.531177       5.364735      66.26884 24.90757  71.93766 30.95719  -5.668823      39.73329  
1 1 1 3  11 29 o 71.06034 20.39042  3.827881       2.031403      4.937595       3.281470      3.138371       2.586624      79.21080 26.46995  66.14393 23.44337  13.06687       35.35887  
1 1 1 3  11 30 o 40.72261 18.75106  -1.163658      2.348689      -2.644935      3.232538      0.4927968      3.418341      43.78991 20.74666  55.01741 24.17638  -11.22750      31.85783  
1 1 1 3  11 31 o 35.82954 16.61515  -1.083707      1.892341      -4.115411      2.494743      3.024230       2.903984      33.25473 16.32980  62.81742 24.33408  -29.56269      29.30546  
1 1 1 3  11 32 o 74.21661 22.49297  4.931883       2.416502      3.859701       2.955160      7.095705       4.198145      65.27484 24.73102  80.33890 29.67022  -15.06406      38.62571  
1 1 1 3  11 33 o 23.99116 9.213999  0.2957609      0.4137814     0.3418550      0.4162762     -3.515241      3.785113      24.75881 9.303664  42.00831 20.51997  -17.24950      22.53058  
1 1 1 3  11 34 o 69.39340 9.775540  3.504396       0.8789074     3.354612       0.9162236     5.231662       3.111339      67.42410 10.54303  68.23708 25.47769  -0.8129807     27.57296  
1 1 1 3  11 35 o 23.22796 11.45975  -2.250073      1.277102      -2.675280      1.383837      0.1917353      3.316200      23.43995 11.62938  45.24166 21.30662  -21.80171      24.27374  
1 1 1 3  12 0  o 486.4661 13.11068  158.3343       8.484721      158.3343       8.484721      158.3343       8.484721      486.4661 13.11068  486.4661 13.11068  0.000000       0.000000  
1 1 1 3  12 1  o 234.5651 5.551433  36.68513       1.735170      39.47237       2.218775      32.29642       2.784163      243.1697 6.854311  219.7250 9.531824  23.44470       11.74041  
1 1 1 3  12 2  o 322.7224 4.951749  69.43197       2.129420      68.67719       2.601060      70.96599       3.708117      320.9150 6.082566  325.9655 8.544428  -5.050446      10.48832  
1 1 1 3  12 3  o 239.6758 6.184390  38.33456       1.973475      38.41778       3.177238      38.28229       2.518125      239.6286 9.972127  239.3903 7.904840  0.2382355      12.72516  
1 1 1 3  12 4  f 663.5627 9.110103  293.9852       8.055245      306.5105       16.56413      290.1055       9.218762      675.1054 18.43019  658.9414 10.49911  16.16400       21.21092  
1 1 1 3  12 5  o 540.2595 6.686650  194.6986       4.813761      184.6303       6.788308      204.8827       6.827232      525.7630 9.689425  553.9097 9.249797  -28.14667      13.39566  
1 1 1 3  12 6  o 337.0868 4.591554  75.74840       2.062409      76.39513       2.989000      75.16068       2.849381      338.4187 6.628237  335.6885 6.370016  2.730225       9.192966  
1 1 1 3  12 7  o 628.7686 4.342704  263.5421       3.638519      264.1104       3.820387      257.9960       11.93484      629.4300 4.554979  620.5080 14.43430  8.921997       15.13595  
1 1 1 3  12 8  o 299.8118 6.001968  59.94882       2.397816      58.98855       2.703812      63.48556       5.188956      297.3568 6.823781  307.7325 12.68132  -10.37564      14.40069  
1 1 1 3  12 9  o 333.6394 5.286516  74.22300       2.350285      74.24983       2.743360      74.14897       4.556705      333.6524 6.170424  332.9531 10.28289  0.6993408      11.99217  
1 1 1 3  12 10 o 510.9496 6.206666  174.1265       4.225810      175.4138       5.440933      172.1695       6.708617      512.6573 7.964761  507.6481 9.917374  5.009155       12.71974  
1 1 1 3  12 11 o 368.4959 6.151939  90.56432       3.020774      87.24915       4.224617      94.03255       4.321054      361.4962 8.770213  375.2974 8.640534  -13.80121      12.31160  
1 1 1 3  12 12 o 410.5464 7.080183  112.4446       3.873292      119.8392       4.810826      98.81881       6.530457      423.7060 8.520822  384.0906 12.77736  39.61542       15.35791  
1 1 1 3  12 13 o 382.5561 6.124049  97.60018       3.121816      94.72968       4.185394      101.1998       4.686874      376.7344 8.337340  389.3272 9.034311  -12.59280      12.29350  
1 1 1 3  12 14 o 227.2890 4.248234  34.43476       1.286650      31.38693       3.395054      34.94592       1.390363      216.3481 11.82152  228.9620 4.557129  -12.61386      12.66948  
1 1 1 3  12 15 o 106.3233 4.884879  7.552238       0.6902300     0.9658224      2.192968      8.276472       0.7271889     52.52585 20.90291  111.3132 4.914723  -58.78733      21.47292  
1 1 1 3  12 16 o 458.0257 9.529133  140.1055       5.815897      168.0126       11.13393      129.6334       6.820357      500.0639 16.73252  440.1671 11.63851  59.89676       20.38215  
1 1 1 3  12 17 o 325.0087 8.183349  70.55576       3.541229      69.37333       7.290363      70.92090       4.051272      320.9054 17.11085  325.7244 9.343652  -4.819000      19.49577  
1 1 1 3  12 18 o 410.7770 9.257178  112.7376       5.067086      109.8860       8.506503      114.3059       6.308405      404.1647 15.82557  413.1592 11.46962  -8.994476      19.54484  
1 1 1 3  12 19 o 224.6794 8.863703  33.78828       2.648494      36.66887       4.218478      31.91407       3.402706      233.3680 13.62492  217.9631 11.75923  15.40494       17.99772  
1 1 1 3  12 20 o 152.7676 6.985194  15.61759       1.418184      15.23247       2.750089      15.75711       1.655254      149.8858 13.92871  153.3313 8.130466  -3.445557      16.12803  
1 1 1 3  12 21 o 332.4676 8.589130  74.01765       3.801965      74.31985       5.586782      73.75697       5.188828      332.1730 12.64496  331.1485 11.77782  1.024475       17.28040  
1 1 1 3  12 22 o 134.0251 9.433604  12.10416       1.673996      15.19304       2.963440      10.65662       2.028665      149.0377 15.13150  125.1924 12.32015  23.84528       19.51278  
1 1 1 3  12 23 o 252.3060 11.02884  42.94521       3.698969      43.73915       4.396061      41.02016       6.845263      254.0128 13.03132  242.4674 21.40633  11.54541       25.06085  
1 1 1 3  12 24 o 92.29941 19.55801  6.106693       2.330597      6.030241       2.415413      7.138295       8.872663      91.50809 20.33640  106.6378 42.17066  -15.12974      46.81809  
1 1 1 3  12 25 o 137.9898 14.58162  13.14708       2.640677      13.34547       2.713997      9.623305       11.43789      138.9348 14.89177  116.8069 47.30135  22.12786       49.59015  
1 1 1 3  12 26 o 100.1186 20.57637  7.303662       2.653267      7.130433       2.720178      10.69552       12.03663      98.62691 21.32041  117.4742 48.16405  -18.84728      52.67197  
1 1 1 3  12 27 o 44.27322 18.45378  0.4564527      1.807098      1.008602       3.005880      0.1439414      2.261395      57.15357 23.80959  46.89729 20.13910  10.25628       31.18460  
1 1 1 3  12 28 o 58.22009 20.90482  2.250611       2.063368      2.558187       3.049326      1.990836       2.802376      64.63976 24.96376  60.21630 23.73504  4.423458       34.44621  
1 1 1 3  12 29 o 109.6605 15.46638  8.703252       2.197334      3.018514       3.490005      12.43666       2.828287      67.32593 26.50274  130.6362 16.62348  -63.31032      31.28475  
1 1 1 3  12 30 o 49.29395 20.77853  0.9186854      2.330808      -3.598427      3.636054      4.069591       3.036810      43.94630 21.13942  70.28077 25.34508  -26.33447      33.00376  
1 1 1 3  12 31 o 43.19056 20.45768  -1.934350      3.139420      -3.974211      3.656481      3.787164       6.123764      42.08800 20.47172  69.20898 31.24701  -27.12098      37.35595  
1 1 1 3  12 32 o 48.47564 20.50840  1.307115       2.284157      2.538752       3.118029      -0.1193659     3.355612      57.25326 24.07728  48.19137 22.26965  9.061893       32.79714  
1 1 1 3  12 33 o 57.75748 22.56288  3.055866       2.513139      2.903696       3.132344      3.330798       4.210352      57.23303 24.10431  59.75889 26.51892  -2.525860      35.83673  
1 1 1 3  12 34 o 31.10100 14.98077  -1.739411      1.840621      1.946049       3.269939      -3.448730      2.226924      51.40896 23.05338  30.37156 15.01165  21.03740       27.51014  
1 1 1 3  12 35 o 41.47885 11.51120  1.339221       0.6586413     1.512241       0.6745408     -2.201769      3.051559      44.10731 11.39607  38.08194 18.56309  6.025368       21.78207  
1 1 1 3  13 0  o 184.6633 5.463615  22.78843       1.341753      22.78843       1.341753      22.78843       1.341753      184.6633 5.463615  184.6633 5.463615  0.000000       0.000000  
1 1 1 3  13 1  o 368.4732 6.120414  90.55036       3.005109      88.26669       3.532779      96.52833       5.715797      363.7210 7.289112  379.8171 11.30609  -16.09613      13.45209  
1 1 1 3  13 2  o 267.5930 6.597496  47.76396       2.352488      45.68682       2.962987      51.30632       3.869397      261.4704 8.515564  276.8927 10.50623  -15.42236      13.52389  
1 1 1 3  13 3  o 336.7970 5.209513  75.63091       2.337969      75.66535       3.336612      75.59768       3.276971      336.7453 7.435849  336.6034 7.306014  0.1419067      10.42448  
1 1 1 3  13 4  o 380.5428 3.853107  96.52228       1.953836      94.38027       2.290266      102.2491       3.744844      376.2656 4.567914  391.4723 7.178923  -15.20670      8.508982  
1 1 1 3  13 5  o 887.4907 8.817760  525.9079       10.42787      519.5064       14.45326      532.8580       15.05990      881.1708 12.30927  892.3123 12.66578  -11.14142      17.66182  
1 1 1 3  13 6  o 359.0850 4.670585  85.96097       2.234818      83.96901       3.268260      87.71030       3.062758      354.7722 6.913429  362.6279 6.338375  -7.855774      9.379259  
1 1 1 3  13 7  o 454.4312 5.819566  137.7162       3.523971      131.5155       5.061622      143.5490       4.909169      443.8424 8.558297  463.7682 7.943895  -19.92581      11.67690  
1 1 1 3  13 8  o 473.7164 7.572107  149.7483       4.779788      149.1225       7.138763      150.2568       6.435144      472.2650 11.34393  474.2195 10.18369  -1.954529      15.24442  
1 1 1 3  13 9  o 110.1189 5.114976  8.102281       0.7484988     7.834948       0.7771346     11.53055       2.782962      108.2646 5.403947  130.0752 16.42134  -21.81056      17.28765  
1 1 1 3  13 10 o 415.6246 5.425834  115.1807       3.004977      117.2639       3.642010      110.7382       5.318501      419.2949 6.518505  407.1766 9.802410  12.11829       11.77192  
1 1 1 3  13 11 o 162.1238 6.067070  17.55297       1.308376      17.54723       1.684958      17.56168       2.076415      161.9716 7.830058  161.8739 9.670483  0.9777832E-01  12.44299  
1 1 1 3  13 12 o 208.2697 6.377814  28.95624       1.767907      27.61949       2.315796      30.82358       2.737073      203.2381 8.570333  214.6305 9.594460  -11.39246      12.86485  
1 1 1 3  13 13 o 546.0016 8.219333  198.9560       5.980039      214.1320       7.939696      179.0606       9.090806      566.1407 10.52461  517.1349 13.20324  49.00586       16.88469  
1 1 1 3  13 14 o 321.7157 7.685834  69.06068       3.294859      64.85185       6.410038      70.57202       3.841143      310.6698 15.53345  325.0162 8.877462  -14.34644      17.89127  
1 1 1 3  13 15 o 334.6217 7.346615  74.70802       3.275782      76.64015       7.059890      74.17792       3.697956      337.7058 15.73189  333.3653 8.324685  4.340515       17.79867  
1 1 1 3  13 16 o 403.6548 6.163682  108.6777       3.315308      109.6532       8.531468      108.5041       3.598090      403.9103 15.88227  403.2927 6.695426  0.6176758      17.23587  
1 1 1 3  13 17 o 173.7046 5.252353  20.13982       1.214338      15.99815       3.090098      20.89623       1.320581      153.6262 15.29813  176.9173 5.608802  -23.29114      16.29391  
1 1 1 3  13 18 f 290.7845 8.918824  56.56399       3.451745      46.27870       6.401795      60.77971       4.098544      261.1786 18.51463  301.2481 10.22496  -40.06949      21.15044  
1 1 1 3  13 19 o 49.91245 4.336389  1.673800       0.2855507     1.938362       2.806110      1.671031       0.2870408     63.02349 24.04689  49.86821 4.363546  13.15528       24.43959  
1 1 1 3  13 20 o 290.9332 7.319734  56.60622       2.835418      62.62256       4.869453      53.51989       3.487670      305.0641 12.00228  282.5617 9.275502  22.50238       15.16871  
1 1 1 3  13 21 o 250.6362 9.397113  42.17475       3.132867      35.57998       6.197063      44.43882       3.631035      226.7842 20.73609  257.0152 10.62516  -30.23100      23.29978  
1 1 1 3  13 22 o 327.5072 8.873598  71.99420       3.868956      62.46198       5.349113      82.45184       5.602757      303.6495 13.25204  349.4329 12.05077  -45.78342      17.91194  
1 1 1 3  13 23 o 218.6303 8.501071  32.12740       2.471889      30.68974       3.129016      34.51414       4.031654      213.0283 11.06081  225.1489 13.50017  -12.12059      17.45268  
1 1 1 3  13 24 o 74.31145 22.15994  3.963451       2.359483      3.439023       2.638940      6.053577       5.268327      70.86968 23.73834  93.04929 33.40456  -22.17961      40.98016  
1 1 1 3  13 25 o 175.5009 11.06196  20.94144       2.573771      18.80613       2.984346      27.13986       5.084630      165.3971 13.66267  195.8578 19.75206  -30.46068      24.01692  
1 1 1 3  13 26 o 76.93105 21.32496  4.375224       2.261847      5.301801       2.410182      -2.464818      6.548450      84.50488 21.38853  68.09245 31.33783  16.41243       37.94113  
1 1 1 3  13 27 o 77.25875 21.26429  4.497200       2.257927      3.824221       3.520513      4.967474       2.942931      73.91142 27.19228  80.46878 24.90543  -6.557358      36.87412  
1 1 1 3  13 28 o 30.04585 14.70332  -3.456427      1.969589      -4.432951      2.528788      -1.950471      3.140344      33.74803 16.54522  45.63156 21.24331  -11.88353      26.92624  
1 1 1 3  13 29 o 41.22723 18.35707  -0.2818332     2.034796      -8.690834      4.655499      1.703911       2.262329      42.64555 21.18729  53.85132 21.29472  -11.20577      30.03941  
1 1 1 3  13 30 o 40.50970 18.20730  -0.3057974     2.052589      3.727089       3.740237      -2.043789      2.455358      67.37938 27.13315  37.90826 17.99542  29.47112       32.55830  
1 1 1 3  13 31 o 54.10970 21.41728  2.181176       2.290453      5.055377       4.116216      0.8920875      2.756647      70.20203 28.39492  49.40738 21.71095  20.79465       35.74405  
1 1 1 3  13 32 o 47.08593 21.50863  0.2656365      3.007859      -2.962492      3.500483      9.374828       5.880205      41.43712 20.12645  78.76604 33.09080  -37.32892      38.73080  
1 1 1 3  13 33 o 25.55902 12.21298  -1.200890      1.169504      2.414653       2.855864      -1.929375      1.281920      53.58268 22.81071  24.48229 11.95523  29.10040       25.75376  
1 1 1 3  13 34 o 48.25965 16.35307  1.982764       1.252269      0.5758822      3.602723      2.176099       1.335544      47.28708 22.25070  50.06612 16.88836  -2.779045      27.93403  
1 1 1 3  14 0  o 723.0695 11.70574  349.2672       11.27187      349.2672       11.27187      349.2672       11.27187      723.0695 11.70574  723.0695 11.70574  -0.000000      0.000000  
1 1 1 3  14 1  o 178.5110 4.647117  21.25807       1.104467      19.97930       1.424341      23.18649       1.749118      172.9672 6.189810  186.2901 7.058985  -13.32283      9.388452  
1 1 1 3  14 2  o 126.9401 5.948451  10.76982       1.003383      9.194493       1.541370      11.92829       1.321797      116.8928 9.991391  133.4950 7.460314  -16.60224      12.46933  
1 1 1 3  14 3  o 717.3923 3.066789  342.9793       2.931664      329.1383       10.13287      344.2437       3.062648      701.7393 10.83636  718.7054 3.197957  -16.96619      11.29839  
1 1 1 3  14 4  o 153.0780 4.544371  15.63486       0.9259316     15.67624       1.433808      15.60526       1.212715      153.1263 7.045848  152.8533 5.965476  0.2730560      9.232057  
1 1 1 3  14 5  o 59.80883 11.74130  2.474765       0.9023210     2.106260       1.474200      2.695525       1.141024      56.29473 17.65909  62.21656 14.09128  -5.921837      22.59221  
1 1 1 3  14 6  o 224.6447 4.872250  33.64423       1.458476      32.48129       1.982728      35.01545       2.152966      220.5608 6.754191  228.9886 7.064306  -8.427826      9.773613  
1 1 1 3  14 7  o 328.1310 4.637355  71.77642       2.027642      71.60051       2.712286      71.99928       3.052870      327.6557 6.212183  328.5239 6.973774  -0.8681641     9.339418  
1 1 1 3  14 8  o 747.3615 9.000805  372.9084       8.963664      369.8367       10.87917      379.4016       15.81750      743.9034 10.97502  752.2321 15.78020  -8.328613      19.22150  
1 1 1 3  14 9  o 437.7418 8.079520  127.8764       4.712780      136.5397       6.032986      114.3134       7.548658      452.1285 10.01375  413.0142 13.73523  39.11435       16.99799  
1 1 1 3  14 10 o 224.9786 3.308108  33.73206       0.9917321     33.84858       1.044616      32.66787       3.156904      225.3636 3.478561  220.8569 10.75934  4.506744       11.30769  
1 1 1 3  14 11 o 175.3865 4.590341  20.51897       1.071867      19.75194       1.207766      23.36354       2.325860      172.0411 5.274611  186.8277 9.372555  -14.78654      10.75483  
1 1 1 3  14 12 o 161.9507 3.955924  17.48141       0.8536979     17.17240       1.036578      18.13288       1.505082      160.4240 4.854665  164.7339 6.871606  -4.309967      8.413486  
1 1 1 3  14 13 o 373.1960 6.757953  92.90146       3.360669      91.77838       5.461403      93.58588       4.263430      370.4066 11.07746  374.4380 8.544874  -4.031372      13.99018  
1 1 1 3  14 14 o 396.2766 7.165209  104.7708       3.783561      106.3200       6.204802      103.8537       4.773782      398.5686 11.69557  394.3732 9.084095  4.195404       14.80902  
1 1 1 3  14 15 o 344.9622 7.404338  79.41396       3.403544      81.74506       6.371832      78.48332       4.026020      349.0294 13.72703  342.7048 8.823557  6.324585       16.31829  
1 1 1 3  14 16 o 116.7806 1.399873  9.086870       0.2178378     9.416957       3.384166      9.085497       0.2182905     115.9557 22.71501  116.7718 1.402889  -0.8160706     22.75829  
1 1 1 3  14 17 o 549.9037 3.186501  201.5560       2.334932      200.7529       2.428895      211.3372       8.476716      548.7974 3.321415  561.7465 11.32436  -12.94904      11.80140  
1 1 1 3  14 18 o 257.0266 8.611689  44.22246       2.945277      50.76873       5.639959      41.76783       3.453602      274.0231 15.50929  249.5100 10.41036  24.51305       18.67923  
1 1 1 3  14 19 o 341.5968 7.064992  77.97530       3.215874      84.04224       6.064563      75.60199       3.793079      353.1902 12.90769  336.0343 8.477770  17.15588       15.44283  
1 1 1 3  14 20 o 342.9810 11.06334  79.13927       5.049651      71.87805       6.690187      88.75282       7.697961      325.3423 15.47644  361.3531 16.02700  -36.01089      22.27970  
1 1 1 3  14 21 o 134.7951 4.639230  12.14194       0.8320427     8.105808       3.020291      12.47340       0.8655340     106.3586 22.03602  136.6139 4.761899  -30.25537      22.54466  
1 1 1 3  14 22 o 144.2752 7.773279  13.99142       1.488891      15.24605       2.856696      13.52350       1.744578      149.0421 14.56993  141.5650 9.299787  7.477188       17.28493  
1 1 1 3  14 23 o 238.3223 6.970726  38.08526       2.211308      33.34304       3.651113      40.83251       2.778972      221.4214 12.42447  246.4025 8.476425  -24.98112      15.04052  
1 1 1 3  14 24 o 163.0328 9.822021  17.99685       2.123883      14.42750       3.172536      20.89577       2.859105      143.5968 16.90359  174.9350 12.34462  -31.33821      20.93134  
1 1 1 3  14 25 o 69.19657 12.80367  3.369115       1.137101      5.345004       2.244614      2.686973       1.318858      85.32239 20.07922  61.16419 16.00116  24.15820       25.67513  
1 1 1 3  14 26 o 45.86814 14.22852  1.460406       0.9599112     -1.304400      2.697145      1.861399       1.027165      44.62629 20.37835  51.08882 14.44701  -6.462532      24.97985  
1 1 1 3  14 27 o 48.62201 13.72592  1.697315       0.9280012     -0.4503898     3.003861      1.923923       0.9757312     49.77805 22.22503  51.60091 13.88671  -1.822861      26.20673  
1 1 1 3  14 28 o 30.25692 12.56409  0.2169913      0.8331454     2.264710       4.080312      0.1279031      0.8510758     65.25102 27.49777  29.72581 12.54435  35.52522       30.22396  
1 1 1 3  14 29 o 110.2847 11.53850  8.634635       1.670591      11.37755       3.891275      8.014842       1.849731      113.8071 26.20190  105.0372 13.52965  8.769913       29.48883  
1 1 1 3  14 30 o 79.29258 12.90375  4.649979       1.316559      1.117119       4.215047      5.031909       1.385898      56.90486 25.78511  82.45503 13.04735  -25.55017      28.89819  
1 1 1 3  14 31 o 59.70100 15.25765  2.827648       1.218195      8.362260       4.948959      2.470673       1.256867      80.23618 31.56746  55.41811 16.08070  24.81806       35.42729  
1 1 1 3  14 32 o 18.10130 8.881890  -1.341594      0.7336069     -5.632498      3.833028      -1.178440      0.7474239     38.32259 19.07027  19.02442 9.254005  19.29817       21.19698  
1 1 1 3  14 33 o 37.79845 18.13420  -1.548025      2.635723      -0.3791601     6.291615      -1.796824      2.902714      52.06593 25.63896  38.82492 18.72916  13.24100       31.75119  
1 1 1 3  15 0  o 292.2170 7.170779  57.03278       2.788394      57.03278       2.788394      57.03278       2.788394      292.2170 7.170779  292.2170 7.170779  -0.000000      0.000000  
1 1 1 3  15 1  o 278.0659 5.247160  51.55216       1.944220      51.09412       2.802062      51.97740       2.699871      276.6155 7.609223  279.0253 7.267679  -2.409790      10.52233  
1 1 1 3  15 2  o 349.4207 6.578156  81.43703       3.062854      84.35870       4.089480      77.70432       4.622368      355.4914 8.633075  340.9042 10.18700  14.58713       13.35308  
1 1 1 3  15 3  o 161.0348 6.411749  17.32296       1.373095      19.32106       2.347913      16.28439       1.692742      169.7396 10.43105  155.9926 8.172042  13.74706       13.25100  
1 1 1 3  15 4  o 257.0510 5.266672  44.05400       1.803969      44.96474       2.682241      43.30178       2.437656      259.4724 7.766444  254.6691 7.190475  4.803314       10.58398  
1 1 1 3  15 5  o 407.4494 4.524215  110.6659       2.456351      113.2821       2.954543      104.8103       4.420261      412.1935 5.379175  396.2769 8.370968  15.91669       9.950308  
1 1 1 3  15 6  o 297.2846 5.104240  58.92065       2.021981      60.14249       2.805775      57.60050       2.916461      300.2656 7.012515  293.7341 7.457266  6.531525       10.23651  
1 1 1 3  15 7  o 606.8571 6.248334  245.6011       5.052708      244.0563       6.331797      248.3094       8.383856      604.7781 7.857011  609.6924 10.31952  -4.914246      12.97016  
1 1 1 3  15 8  o 195.4282 5.982020  25.49165       1.555955      27.08182       2.221073      23.95918       2.180396      201.2753 8.299110  189.2646 8.668566  12.01067       12.00080  
1 1 1 3  15 9  o 369.0092 7.498389  90.84618       3.687048      90.00877       5.233317      91.67152       5.195436      366.8905 10.71600  370.2883 10.54024  -3.397766      15.03094  
1 1 1 3  15 10 o 46.11338 7.633745  1.456424       0.4526733     1.857947       0.4749265     -2.529487      1.496355      52.31491 6.987394  27.29858 13.23575  25.01633       14.96692  
1 1 1 3  15 11 o 372.5058 6.292677  92.54215       3.123504      96.77986       4.437451      88.38055       4.397425      380.7639 8.745896  363.8398 9.070153  16.92404       12.59994  
1 1 1 3  15 12 o 690.2119 7.757585  317.9018       7.134811      318.8754       8.671266      315.8610       12.55431      691.0102 9.417259  686.8434 13.71708  4.166809       16.63860  
1 1 1 3  15 13 o 394.8546 6.768811  104.0119       3.561419      102.4215       4.382451      107.1046       6.111450      391.6872 8.396614  400.0321 11.47691  -8.344910      14.22050  
1 1 1 3  15 14 o 114.0459 7.598085  8.719768       1.148083      7.964454       2.228371      8.992712       1.339555      107.7590 16.00425  115.7099 8.752850  -7.950920      18.24139  
1 1 1 3  15 15 o 383.8962 7.794498  98.40836       3.987269      108.7963       7.442616      94.22670       4.722092      402.4472 13.89938  375.3390 9.448932  27.10825       16.80700  
1 1 1 3  15 16 f 661.2031 11.70804  292.9843       10.31555      295.6595       14.82029      290.4703       14.36706      661.9689 16.81502  656.3112 16.44093  5.657776       23.51699  
1 1 1 3  15 17 o 186.0562 3.544680  23.07867       0.8788096     23.80614       2.692141      22.99191       0.9297412     188.1651 10.78219  185.6988 3.757331  2.466324       11.41811  
1 1 1 3  15 18 o 499.8659 3.448901  166.5966       2.297247      167.1578       2.382988      159.2170       8.641739      500.6938 3.571710  486.0270 13.35608  14.66681       13.82542  
1 1 1 3  15 19 o 296.6563 9.711212  59.09657       3.833672      65.21014       5.610338      53.74152       5.250769      310.4929 13.59307  281.6729 14.03377  28.82007       19.53761  
1 1 1 3  15 20 o 149.6122 7.942376  15.03477       1.577728      15.21378       3.287748      14.98121       1.798322      148.4296 16.92488  149.1585 9.091038  -0.7289124     19.21194  
1 1 1 3  15 21 o 111.3458 7.631677  8.346272       1.125468      9.895519       2.913245      8.074484       1.220203      118.4043 19.11533  109.3827 8.436781  9.021576       20.89438  
1 1 1 3  15 22 o 127.1754 4.452271  10.81326       0.7533343     12.14318       2.733913      10.70398       0.7836732     132.2737 15.82456  126.5097 4.656712  5.764000       16.49550  
1 1 1 3  15 23 o 65.80921 6.372936  2.927395       0.5518696     6.746172       2.709711      2.762142       0.5636839     96.01453 21.69253  63.85324 6.725794  32.16129       22.71128  
1 1 1 3  15 24 o 195.3319 9.738098  25.85337       2.526674      23.65158       3.491222      28.27498       3.661359      185.0325 14.26994  202.7028 13.63461  -17.67029      19.73661  
1 1 1 3  15 25 o 100.8650 8.824574  6.928693       1.174129      8.897512       2.975913      6.565714       1.277786      109.5228 21.15705  97.88197 9.934198  11.64085       23.37326  
1 1 1 3  15 26 o 79.40559 12.72385  4.459972       1.300857      6.013296       2.731232      4.004207       1.479443      87.91286 23.04025  74.20026 15.46515  13.71260       27.74931  
1 1 1 3  15 27 o 42.32101 15.97425  1.028167       1.230240      -1.951950      3.099784      1.585336       1.340319      44.87584 20.96247  48.36992 16.89752  -3.494076      26.92493  
1 1 1 3  15 28 o 110.9559 10.81539  8.651217       1.578792      9.337976       3.301129      8.447550       1.797720      105.5237 24.01818  108.6153 12.65798  -3.091545      27.14954  
1 1 1 3  15 29 o 77.61768 12.18922  4.395145       1.219196      3.516088       2.598232      4.643354       1.380633      64.29589 23.40734  79.02271 13.60212  -14.72681      27.07252  
1 1 1 3  15 30 o 25.86995 12.21130  -0.9911009     1.100588      2.993660       2.519073      -1.931168      1.223543      59.11244 22.72621  24.03755 11.72533  35.07489       25.57272  
1 1 1 3  15 31 o 44.65802 16.30866  1.490792       1.262691      -3.510291      2.420488      3.360623       1.480036      32.56460 16.00967  63.48851 17.11034  -30.92391      23.43231  
1 1 1 3  15 32 o 21.55627 10.79336  -3.187399      1.313323      0.000000       0.000000      -3.187399      1.313323      ?        ?         21.55627 10.79336  0.000000       10.79336  
1 1 1 3  15 33 o 38.18686 18.12379  -0.9384572     2.487901      -1.617146      3.078769      0.3387184      4.223449      39.81413 19.22672  48.35629 23.13412  -8.542160      30.08079  
1 1 1 3  16 0  o 969.2955 13.69271  627.7584       17.67762      627.7584       17.67762      627.7584       17.67762      969.2955 13.69271  969.2955 13.69271  -0.000000      0.000000  
1 1 1 3  16 1  o 392.8503 5.991391  102.9133       3.136377      108.3263       4.661187      98.43492       4.239722      402.8588 8.683006  384.0569 8.284536  18.80185       12.00117  
1 1 1 3  16 2  o 436.7960 6.982271  127.2644       4.063955      122.2084       6.256217      130.9552       5.345287      427.5239 10.99102  442.9086 9.056978  -15.38474      14.24189  
1 1 1 3  16 3  o 536.7087 8.324088  192.2376       5.953178      195.4157       8.521322      189.2075       8.320404      540.6727 11.82767  532.0286 11.73643  8.644104       16.66246  
1 1 1 3  16 4  o 504.7535 4.505439  169.8289       3.030330      175.6870       6.235444      168.0174       3.467327      513.0026 9.121669  502.0153 5.183276  10.98730       10.49148  
1 1 1 3  16 5  o 490.0674 4.565184  160.0919       2.981176      164.1593       3.457936      148.3166       5.883581      496.2157 5.229653  471.3271 9.367977  24.88858       10.72885  
1 1 1 3  16 6  o 371.9857 5.348683  92.25524       2.651226      92.14561       3.390555      92.42775       4.253201      371.6842 6.845785  372.1349 8.577130  -0.4507446     10.97415  
1 1 1 3  16 7  o 669.5234 6.605683  298.9703       5.893280      305.9385       7.440779      287.2419       9.653371      677.0836 8.247125  655.6453 11.04935  21.43835       13.78779  
1 1 1 3  16 8  o 223.4030 5.419372  33.27600       1.613287      32.19600       2.026887      35.14300       2.664952      219.5888 6.935710  229.2885 8.738342  -9.699768      11.15629  
1 1 1 3  16 9  o 236.8533 5.865420  37.40889       1.851195      36.53232       2.297247      39.03227       3.126256      233.8875 7.380250  241.5620 9.732229  -7.674500      12.21411  
1 1 1 3  16 10 o 380.3954 6.595330  96.51798       3.343068      98.96409       4.012294      90.96420       6.045742      385.0966 7.818968  368.5631 12.32753  16.53357       14.59809  
1 1 1 3  16 11 o 229.9011 0.9680259 35.21576       0.2965524     35.14665       0.2977275     43.91879       3.341150      229.6754 0.9728168 256.2137 9.804428  -26.53831      9.852572  
1 1 1 3  16 12 o 249.7745 0.7011034 41.56678       0.2333478     41.57342       0.2340050     40.39002       3.115602      249.7944 0.7030220 245.6873 9.534785  4.107132       9.560668  
1 1 1 3  16 13 o 317.6653 5.825620  67.31261       2.465957      67.95198       3.234894      66.42566       3.810048      319.0375 7.609301  315.1699 9.081661  3.867584       11.84812  
1 1 1 3  16 14 o 318.8191 6.372819  67.83192       2.707382      70.94109       3.977952      65.14893       3.695287      325.6340 9.176764  312.0860 8.894951  13.54797       12.78019  
1 1 1 3  16 15 o 363.7333 6.510292  88.32145       3.155419      86.12438       4.452590      90.53807       4.472349      358.6900 9.323700  367.9204 9.122381  -9.230377      13.04413  
1 1 1 3  16 16 o 273.4707 8.480942  50.07178       3.086762      51.57217       4.743241      48.96957       4.065412      276.6615 12.90181  269.9232 11.32811  6.738342       17.16924  
1 1 1 3  16 17 o 375.4584 10.51367  94.66555       5.254870      96.06854       8.676625      93.85284       6.603733      375.6961 17.37876  372.9614 13.30910  2.734650       21.88958  
1 1 1 3  16 18 o 151.5807 5.479871  15.36283       1.105026      12.17713       2.141950      16.51820       1.289937      133.9246 12.13415  157.1115 6.173527  -23.18690      13.61433  
1 1 1 3  16 19 o 256.2516 4.881266  43.84108       1.666758      40.15003       3.312366      45.09253       1.928729      244.1660 10.20323  259.8015 5.571295  -15.63541      11.62520  
1 1 1 3  16 20 o 110.9644 15.48915  8.550673       2.227940      6.469653       2.987575      11.15791       3.344037      94.12046 23.80803  125.2694 20.75974  -31.14891      31.58781  
1 1 1 3  16 21 o 134.8257 6.449214  12.19611       1.155292      12.29496       3.113923      12.18034       1.244083      132.2976 18.14095  134.6617 6.956751  -2.364120      19.42912  
1 1 1 3  16 22 o 120.5415 4.492474  9.719673       0.7203357     9.764752       2.865853      9.716634       0.7442285     117.0511 19.02689  120.5062 4.643409  -3.455109      19.58529  
1 1 1 3  16 23 o 160.9814 6.124486  17.39020       1.311373      16.67229       3.837131      17.48514       1.395392      152.9053 19.25890  161.3476 6.503558  -8.442291      20.32736  
1 1 1 3  16 24 o 54.45120 20.17085  1.782194       1.942893      -0.6015273     2.748168      4.164172       2.747162      47.84279 21.31624  74.98669 24.17495  -27.14390      32.23058  
1 1 1 3  16 25 o 56.35247 12.95898  2.281545       0.9527692     12.57878       3.211146      1.287519       0.9976969     130.9590 18.95175  43.75599 14.59492  87.20296       23.92030  
1 1 1 3  16 26 o 73.26460 13.31346  3.864406       1.251886      3.306594       2.940835      3.987859       1.383500      67.22714 24.83200  73.96011 14.55663  -6.732971      28.78409  
1 1 1 3  16 27 o 82.00076 14.42525  4.943316       1.518689      0.4492013      3.270736      6.178559       1.714745      53.18464 23.49852  91.83897 14.49199  -38.65433      27.60793  
1 1 1 3  16 28 o 46.61534 18.62634  1.252203       1.748329      3.414732       2.842937      -0.6307577E-01 2.217149      64.13086 24.26615  42.76753 19.09460  21.36333       30.87798  
1 1 1 3  16 29 f 48.46293 19.61939  1.494493       1.967082      3.991291       2.716312      -1.258801      2.852425      65.82864 23.93809  42.28049 19.86473  23.54816       31.10690  
1 1 1 3  16 30 o 55.18898 20.07385  2.579086       1.910286      2.825964       3.466066      2.471379       2.289377      58.25231 24.97252  54.72214 21.48827  3.530170       32.94500  
1 1 1 3  16 31 o 48.86391 22.12842  1.061401       3.098784      -5.059544      5.925405      3.365628       3.635561      47.11462 23.48806  58.35574 25.29900  -11.24111      34.52142  
1 1 1 3  16 32 o 68.93302 25.51307  5.717218       3.107097      5.042327       4.098042      6.629757       4.765247      61.97046 26.86307  65.77833 28.73407  -3.807865      39.33537  
1 1 1 3  17 0  o 242.9937 7.559946  39.48038       2.442494      39.48038       2.442494      39.48038       2.442494      242.9937 7.559946  242.9937 7.559946  -0.000000      0.000000  
1 1 1 3  17 1  o 228.2903 5.005289  34.74362       1.522615      37.40986       2.495332      33.16205       1.921867      236.6507 7.924282  222.8956 6.477525  13.75516       10.23487  
1 1 1 3  17 2  o 391.6843 6.033539  102.3033       3.149067      102.4066       4.345205      102.1891       4.570216      391.7296 8.324350  391.2787 8.765506  0.4508972      12.08838  
1 1 1 3  17 3  o 326.0109 5.611689  70.86522       2.437807      69.78264       3.391459      72.02255       3.506581      323.3941 7.870112  328.5347 8.009937  -5.140564      11.22933  
1 1 1 3  17 4  o 175.2118 4.997132  20.48251       1.165504      23.04619       1.712248      18.26914       1.590970      185.7489 6.929932  165.3292 7.239236  20.41968       10.02150  
1 1 1 3  17 5  o 329.6656 5.549878  72.46318       2.437982      69.87478       3.238070      75.85091       3.704459      323.6232 7.508845  337.1306 8.246184  -13.50748      11.15268  
1 1 1 3  17 6  o 181.9797 3.235491  22.07006       0.7845790     21.84152       1.131319      22.28184       1.089015      180.9479 4.695966  182.8289 4.470080  -1.881012      6.483341  
1 1 1 3  17 7  o 289.9536 4.735123  56.04710       1.829503      57.59285       2.406039      53.92840       2.816880      293.8663 6.144398  284.2016 7.444616  9.664673       9.652768  
1 1 1 3  17 8  o 196.1839 6.039057  25.69284       1.576843      25.43894       1.994122      26.11653       2.575931      195.0936 7.685742  197.4848 9.819543  -2.391281      12.46973  
1 1 1 3  17 9  o 383.5084 5.911176  98.09264       3.020802      99.55267       4.038286      96.23768       4.551780      386.2019 7.847100  379.6100 8.998500  6.591858       11.93943  
1 1 1 3  17 10 o 268.0901 5.497945  47.93124       1.964060      48.51411       2.510978      47.01256       3.152377      269.5455 6.996883  265.1523 8.934909  4.393250       11.34852  
1 1 1 3  17 11 o 504.8224 7.468693  170.1252       5.024083      172.3722       5.678384      162.0257       10.78079      508.0158 8.388301  490.5317 16.51694  17.48410       18.52493  
1 1 1 3  17 12 o 448.7283 6.960478  134.4120       4.161942      135.1678       5.050566      132.8127       7.346629      449.7888 8.426706  444.9609 12.40271  4.827911       14.99455  
1 1 1 3  17 13 o 205.2743 3.079946  28.08652       0.8424637     27.87165       0.8740916     30.89547       3.160415      204.4839 3.207925  214.4660 11.09664  -9.982101      11.55103  
1 1 1 3  17 14 o 228.6961 5.206469  34.89576       1.586630      34.35639       1.958128      35.92685       2.707355      226.7415 6.487586  231.5845 8.789237  -4.842941      10.92426  
1 1 1 3  17 15 o 65.08492 6.904953  2.861927       0.5897195     6.721523       2.818030      2.685164       0.6030724     97.15678 22.24734  62.96225 7.324718  34.19454       23.42212  
1 1 1 3  17 16 o 117.6106 9.491315  9.332682       1.474840      11.32885       3.244674      8.812856       1.655774      127.3037 19.76838  114.0093 11.03688  13.29438       22.64071  
1 1 1 3  17 17 o 315.7881 9.647754  66.99272       4.054954      64.42386       6.806686      68.40594       5.048598      307.1555 16.69319  318.4177 11.91976  -11.26221      20.51202  
1 1 1 3  17 18 o 113.7650 8.605092  8.729768       1.294808      11.06172       2.615722      7.972898       1.490191      126.4903 15.86710  108.3670 10.44923  18.12336       18.99872  
1 1 1 3  17 19 o 173.7383 6.090869  20.21292       1.407913      14.82726       2.533596      22.61902       1.693456      147.3411 13.03892  183.6672 6.931848  -36.32610      14.76699  
1 1 1 3  17 20 o 200.4301 10.48614  27.17826       2.790867      25.90635       3.704616      28.84742       4.243881      194.3629 14.40638  204.6267 15.68376  -10.26378      21.29611  
1 1 1 3  17 21 o 97.60275 2.142486  6.350847       0.2786465     6.216976       2.909097      6.352087       0.2799336     91.56659 23.67042  97.61201 2.152178  -6.045418      23.76806  
1 1 1 3  17 22 f 47.25991 9.950350  1.566046       0.6067770     -1.298825      2.804825      1.706705       0.6214942     46.06757 20.93738  49.41123 9.785521  -3.343666      23.11126  
1 1 1 3  17 23 o 98.44841 6.516590  6.537323       0.8500639     2.556327       3.394116      6.803748       0.8780482     66.94420 26.20075  100.4277 6.597865  -33.48351      27.01872  
1 1 1 3  17 24 o 82.63966 4.992175  4.593302       0.5471693     5.343729       3.667262      4.576216       0.5533634     82.29980 27.98361  82.47473 5.059542  -0.1749344     28.43732  
1 1 1 3  17 25 o 78.22827 6.498872  4.155817       0.6713348     2.364274       2.997886      4.250401       0.6888284     61.96395 24.50997  79.09721 6.595434  -17.13327      25.38186  
1 1 1 3  17 26 o 79.44077 10.55489  4.446217       1.089682      0.9493209      3.355717      4.858414       1.152116      55.69843 24.22503  83.05193 10.65573  -27.35350      26.46501  
1 1 1 3  17 27 o 46.07341 13.51879  1.576304       0.8839417     3.079068       3.048397      1.438349       0.9236243     62.68846 24.74089  44.30638 13.98862  18.38208       28.42171  
1 1 1 3  17 28 o 16.25242 8.177363  -2.352596      0.8008013     -3.569123      3.329179      -2.277885      0.8250247     40.09269 19.50863  16.86113 8.458458  23.23156       21.26340  
1 1 1 3  17 29 o 46.14839 20.15927  0.8312968      2.345571      0.4023964      5.844242      0.9136492      2.560874      57.10993 27.29245  47.63951 20.93023  9.470417       34.39408  
1 1 1 3  17 30 o 60.37383 22.45054  3.513730       2.411145      2.581578       5.080876      3.784667       2.739232      57.84638 26.96037  61.46612 23.68095  -3.619740      35.88382  
1 1 1 3  17 31 o 50.09978 21.04420  2.051785       2.377560      -0.7105841     3.595980      4.197223       3.169088      44.80190 21.40999  60.88148 24.80787  -16.07959      32.76916  
1 1 1 3  18 0  o 893.3543 12.88377  533.2097       15.32981      533.2097       15.32981      533.2097       15.32981      893.3543 12.88377  893.3543 12.88377  0.000000       0.000000  
1 1 1 3  18 1  o 349.3052 5.015409  81.34666       2.334452      79.72617       3.276084      83.01827       3.327341      345.6935 7.111978  352.7608 7.078537  -7.067322      10.03424  
1 1 1 3  18 2  o 234.6881 4.849048  36.71946       1.516425      35.71314       2.133115      37.74766       2.156170      231.2715 6.929609  237.7820 6.812058  -6.510529      9.717182  
1 1 1 3  18 3  o 484.7601 3.643640  156.6219       2.353617      153.0862       5.580690      157.3869       2.595762      478.8498 8.746112  485.9241 4.008878  -7.074310      9.621100  
1 1 1 3  18 4  o 600.0968 7.833912  240.3376       6.264314      238.8495       8.396104      242.2062       9.408187      597.8264 10.53972  601.7925 11.73237  -3.966125      15.77131  
1 1 1 3  18 5  o 458.5542 6.178882  140.2496       3.775497      138.2546       6.180599      141.4372       4.768627      454.8513 10.19736  460.3445 7.773863  -5.493195      12.82260  
1 1 1 3  18 6  o 228.8746 4.721355  34.92443       1.439918      35.20094       1.767378      34.37856       2.483241      229.6682 5.779633  226.7761 8.231315  2.892120       10.05777  
1 1 1 3  18 7  o 483.6837 6.290256  156.0672       4.054182      159.3342       5.072190      150.2876       6.746432      488.5562 7.791256  474.0832 10.67938  14.47299       13.21941  
1 1 1 3  18 8  o 519.5016 5.996853  180.0332       4.151297      178.9574       5.648372      181.2969       6.121807      517.6716 8.188333  520.9489 8.818830  -3.277283      12.03414  
1 1 1 3  18 9  o 395.2607 6.006639  104.2313       3.163652      102.4979       4.546628      105.8584       4.404896      391.6682 8.711595  398.0888 8.303903  -6.420563      12.03523  
1 1 1 3  18 10 o 315.7914 6.583940  66.56097       2.770510      69.36724       3.542986      62.14431       4.444795      322.1098 8.261341  304.4573 10.97395  17.65247       13.73598  
1 1 1 3  18 11 o 248.4712 4.706346  41.17578       1.558237      41.61606       1.706659      38.96965       3.820288      249.7721 5.127778  240.7616 11.94521  9.010559       12.99931  
1 1 1 3  18 12 o 171.8634 6.382631  19.74824       1.459155      19.16671       1.619640      22.25410       3.362117      169.2293 7.198841  181.3064 14.02535  -12.07704      15.76495  
1 1 1 3  18 13 o 223.7183 7.140222  33.48063       2.125838      36.52870       3.458593      31.62985       2.695039      233.0292 11.17075  217.1272 9.336698  15.90199       14.55883  
1 1 1 3  18 14 o 292.4348 6.805487  57.15531       2.651929      57.27884       3.333180      56.94223       4.377549      292.3615 8.565120  290.8770 11.31559  1.484558       14.19169  
1 1 1 3  18 15 f 270.6086 7.308896  49.02238       2.633110      52.47195       4.113874      46.62848       3.427064      279.1245 11.08265  263.4165 9.780489  15.70798       14.78118  
1 1 1 3  18 16 o 90.58339 5.879726  5.505979       0.7058724     3.941166       1.516838      5.938522       0.7974855     74.78205 15.72167  94.02911 6.403034  -19.24706      16.97557  
1 1 1 3  18 17 o 137.8651 7.682585  12.77466       1.405770      11.89348       2.043581      13.56619       1.936830      132.2339 11.71902  141.5983 10.33621  -9.364487      15.62602  
1 1 1 3  18 18 o 64.86486 16.13162  2.992559       1.388486      4.001423       3.154344      2.750103       1.546356      76.51875 25.95381  62.36008 17.75701  14.15867       31.44697  
1 1 1 3  18 19 o 240.8215 9.825622  39.15095       3.146414      40.58230       5.091590      38.26665       4.002017      242.7006 15.83017  237.0405 12.71673  5.660156       20.30541  
1 1 1 3  18 20 o 117.2552 6.735706  9.247140       1.047991      6.538915       2.691002      9.731318       1.137821      94.31189 21.84284  120.2280 7.134310  -25.91611      22.97843  
1 1 1 3  18 21 o 106.3021 16.09108  7.996538       2.208079      9.299380       3.444823      7.087944       2.876775      111.3220 23.93472  97.45631 22.59338  13.86565       32.91401  
1 1 1 3  18 22 o 54.49389 7.860052  2.042093       0.5542722     4.715829       3.323809      1.965615       0.5621434     79.24419 26.64224  53.37986 8.161957  25.86433       27.86443  
1 1 1 3  18 23 o 172.4762 1.423125  19.82966       0.3270737     21.74759       3.703082      19.81458       0.3283570     174.6564 16.09209  172.4102 1.429255  2.246201       16.15543  
1 1 1 3  18 24 o 44.71756 9.043302  1.411386       0.5203235     2.133811       3.273902      1.392665       0.5270221     61.87258 25.21363  44.37659 9.214284  17.49599       26.84455  
1 1 1 3  18 25 o 41.00704 13.56160  1.167723       0.8618661     0.3678290      2.842584      1.248700       0.9044403     50.26131 22.06775  42.23149 13.88921  8.029823       26.07481  
1 1 1 3  18 26 o 78.27306 7.074554  4.209998       0.7299207     1.305244       4.089194      4.305596       0.7418346     58.43070 26.01985  79.15166 7.109186  -20.72095      26.97356  
1 1 1 3  18 27 o 63.21779 11.46110  2.930863       0.9299284     3.773476       4.607311      2.895078       0.9494693     65.60665 28.46110  62.65586 11.80517  2.950790       30.81227  
1 1 1 3  18 28 o 36.21365 4.940574  0.9030976      0.2321987     7.270777       8.491581      0.8983327      0.2322856     71.06595 33.65651  36.11230 4.957919  34.95365       34.01973  
1 1 1 3  18 29 o 24.30354 11.42545  -0.7786164     0.9460978     -2.820736      3.751908      -0.6399468     0.9776925     42.48595 20.68151  25.51096 11.86854  16.97499       23.84506  
1 1 1 3  18 30 o 38.97020 18.76174  -1.764289      2.878386      -3.208771      4.863361      -0.9855062     3.570989      45.26856 22.33923  44.30825 21.21757  0.9603157      30.80952  
1 1 1 3  19 0  o 131.2222 5.406626  11.53633       0.9417254     11.53633       0.9417254     11.53633       0.9417254     131.2222 5.406626  131.2222 5.406626  0.000000       0.000000  
1 1 1 3  19 1  o 163.6852 5.197258  17.88495       1.132157      17.53481       1.497937      18.35145       1.729037      161.9505 6.957477  165.6092 7.857544  -3.658676      10.49512  
1 1 1 3  19 2  o 248.3682 5.605832  41.14278       1.855281      41.86449       2.568501      40.35544       2.682754      250.3016 7.710112  245.6964 8.205751  4.605240       11.25967  
1 1 1 3  19 3  o 95.53148 7.771704  6.133157       0.9807800     6.158673       1.415503      6.109594       1.360213      95.26487 11.37528  94.94276 10.95205  0.3221054      15.79065  
1 1 1 3  19 4  o 201.4338 7.014864  27.11402       1.880017      28.49439       2.517367      25.37321       2.826977      206.2910 9.180832  194.4282 10.95595  11.86281       14.29408  
1 1 1 3  19 5  f 431.5238 6.173339  124.2436       3.549755      124.7594       4.636014      123.5126       5.518826      432.2025 8.049779  429.8117 9.635960  2.390808       12.55590  
1 1 1 3  19 6  o 277.0763 5.604035  51.21312       2.069063      52.65621       2.614559      48.79505       3.384430      280.8564 6.986194  269.9878 9.421802  10.86859       11.72933  
1 1 1 3  19 7  o 510.2278 5.807361  173.6969       3.948358      173.6139       4.643348      173.9135       7.502717      509.9661 6.833080  509.5941 11.04894  0.3719177      12.99115  
1 1 1 3  19 8  o 232.1278 5.038998  35.94241       1.558637      34.99614       1.911199      37.82157       2.693260      228.8927 6.272057  237.7092 8.516500  -8.816528      10.57684  
1 1 1 3  19 9  o 349.2072 5.926293  81.39113       2.757654      83.35736       3.742827      79.05628       4.078595      353.1505 7.953650  343.6652 8.913912  9.485291       11.94648  
1 1 1 3  19 10 o 211.8073 6.544816  29.98951       1.844975      30.90251       2.201728      27.83681       3.380798      214.8743 7.702093  203.1387 12.55102  11.73566       14.72584  
1 1 1 3  19 11 o 58.13032 6.030254  2.280504       0.4603243     2.189009       0.4735721     3.847564       1.959878      56.89787 6.354580  73.81984 19.59863  -16.92197      20.60308  
1 1 1 3  19 12 o 238.5235 9.162226  38.17801       2.906680      41.36655       4.328870      35.56009       3.922449      247.3743 13.18005  229.3808 12.88475  17.99344       18.43178  
1 1 1 3  19 13 o 130.5122 11.74966  11.55654       2.021531      10.97868       3.463884      11.85501       2.489448      124.5680 21.65372  131.6108 14.43149  -7.042831      26.02213  
1 1 1 3  19 14 o 492.9657 8.028007  162.7890       5.273488      159.2346       6.948557      167.6172       8.098495      486.5290 10.71797  498.4699 12.19248  -11.94089      16.23364  
1 1 1 3  19 15 o 244.0207 9.075089  40.03358       2.945735      40.83691       3.171853      34.99434       7.944186      246.3073 9.682984  220.0487 27.70579  26.25861       29.34912  
1 1 1 3  19 16 o 145.0640 10.53880  14.25380       2.023262      17.32553       3.032122      11.78832       2.716478      158.9261 14.47659  130.4129 15.96443  28.51317       21.55074  
1 1 1 3  19 17 o 206.5369 6.097593  28.56579       1.676308      28.03240       1.857834      30.90207       3.888205      204.4660 6.828448  212.6537 13.79599  -8.187759      15.39341  
1 1 1 3  19 18 o 45.22766 14.62965  1.365868       1.005522      -0.4655443     1.337436      3.746971       1.524997      33.38346 14.87243  72.44593 16.20373  -39.06247      21.99432  
1 1 1 3  19 19 o 151.2848 8.919307  15.47757       1.790064      18.37381       3.018134      13.90588       2.223333      163.1900 14.01502  142.5659 11.80935  20.62419       18.32707  
1 1 1 3  19 20 o 62.05187 19.61493  2.734283       1.815513      -1.284826      2.724853      5.942854       2.434636      45.19698 20.57873  89.54935 20.80182  -44.35236      29.26089  
1 1 1 3  19 21 o 103.6049 17.56744  7.778925       2.338727      9.329700       3.086321      5.687519       3.584149      111.6178 21.53097  85.29205 27.62304  26.32572       35.02306  
1 1 1 3  19 22 o 142.3401 6.371900  13.66472       1.205500      11.16086       3.188908      14.08220       1.302127      122.0344 20.32491  144.3853 6.786938  -22.35088      21.42813  
1 1 1 3  19 23 o 62.77171 5.341581  2.667361       0.4425540     -2.127774      2.704185      2.799324       0.4486022     40.95259 19.27230  64.32771 5.279897  -23.37512      19.98246  
1 1 1 3  19 24 o 72.48202 6.018840  3.572962       0.5760818     3.300948       3.390604      3.581048       0.5845814     66.32217 26.11802  72.54366 6.104016  -6.221481      26.82181  
1 1 1 3  19 25 o 68.46616 10.31289  3.343380       0.9116940     -5.486220      5.236322      3.619410       0.9258350     48.68201 23.85463  71.41772 10.00258  -22.73572      25.86687  
1 1 1 3  19 26 o 28.00883 11.53264  0.2519397      0.6939184     -4.854734      5.330917      0.3399579      0.6998730     48.65115 23.88634  29.02669 11.71998  19.62446       26.60667  
1 1 1 3  19 27 o 24.64712 9.571299  0.2974612      0.4501119     13.13797       10.50398      0.2738394      0.4505257     77.90039 37.04892  24.31184 9.536704  53.58855       38.25665  
1 1 1 3  19 28 o 19.57974 9.712385  -2.070398      0.9634987     -3.082933      5.002179      -2.031385      0.9818853     47.48783 23.27892  19.98354 9.893573  27.50429       25.29409  
1 1 1 3  19 29 o 56.37088 13.53266  2.520890       1.003609      6.134160       4.555309      2.336557       1.028891      66.44921 28.55994  53.84988 14.15511  12.59933       31.87534  
1 1 1 3  20 0  f 34.21595 13.91511  1.090505       0.6222308     1.090505       0.6222308     1.090505       0.6222308     34.21595 13.91511  34.21595 13.91511  -0.000000      0.000000  
1 1 1 3  20 1  o 235.9303 5.543197  37.13764       1.742679      39.13029       2.152374      33.34544       2.969263      242.0095 6.680784  222.9880 10.01853  19.02147       12.04175  
1 1 1 3  20 2  o 549.6960 7.020837  201.7771       5.142627      203.4287       6.330039      198.5707       8.819796      551.6266 8.611676  544.0806 12.16527  7.546021       14.90486  
1 1 1 3  20 3  o 152.4039 8.117063  15.56695       1.642477      14.47365       2.164465      17.05118       2.521922      146.5409 11.16869  158.9943 11.99195  -12.45345      16.38738  
1 1 1 3  20 4  o 122.5309 6.308520  10.04893       1.026554      10.27709       1.196359      9.411931       1.998975      123.8250 7.282851  117.6801 12.96211  6.144989       14.86796  
1 1 1 3  20 5  o 410.2563 5.522955  112.3141       3.019258      112.0909       4.727151      112.4679       3.923912      409.3803 8.665607  410.3160 7.176740  -0.9357300     11.25159  
1 1 1 3  20 6  o 294.0136 4.983036  57.67170       1.952248      58.16676       2.805715      57.20705       2.718157      295.0645 7.135973  292.6386 6.970587  2.425873       9.975530  
1 1 1 3  20 7  o 272.8289 4.668456  49.65603       1.697216      52.96410       2.496199      46.81194       2.314536      281.5876 6.652612  264.7379 6.561064  16.84967       9.343704  
1 1 1 3  20 8  o 217.1690 5.438881  31.49959       1.572675      31.64988       2.048211      31.28371       2.454792      217.5026 7.076446  216.0347 8.544271  1.467880       11.09417  
1 1 1 3  20 9  o 139.8576 5.903969  13.08559       1.097806      13.80810       1.369346      11.78581       1.836642      143.5362 7.182244  132.1055 10.52034  11.43065       12.73822  
1 1 1 3  20 10 o 161.7892 7.645341  17.55190       1.643575      17.46085       2.103668      17.69457       2.633226      161.0293 9.851039  161.6311 12.31895  -0.6017456     15.77338  
1 1 1 3  20 11 o 59.07798 17.41187  2.422317       1.463600      0.6073112      1.890755      5.135810       2.311855      46.84692 19.13440  84.75380 20.66072  -37.90688      28.16009  
1 1 1 3  20 12 o 106.1744 12.49104  7.711311       1.733454      4.823406       2.246552      11.96067       2.725126      82.04552 20.58541  131.6907 15.84764  -49.64519      25.97897  
1 1 1 3  20 13 o 251.2874 8.575044  42.41056       2.867107      45.60546       3.439262      35.13187       5.191140      260.2387 9.936154  225.8300 17.38444  34.40869       20.02364  
1 1 1 3  20 14 o 88.69467 11.30130  5.391749       1.305377      5.316917       1.544492      5.578871       2.442337      87.51094 13.69355  87.85137 21.12399  -0.3404312     25.17412  
1 1 1 3  20 15 o 80.64117 14.67381  4.564429       1.518718      3.638953       1.672614      8.910739       3.624712      71.30640 17.68900  109.8397 25.28857  -38.53327      30.86118  
1 1 1 3  20 16 o 209.2661 9.562019  29.56324       2.659333      26.30458       3.254425      36.11165       4.613422      196.4526 12.49684  229.1295 15.19601  -32.67688      19.67460  
1 1 1 3  20 17 o 212.6386 3.341463  30.17159       0.9467871     30.26710       0.9714251     28.36015       4.230690      212.9668 3.423135  202.2893 15.82088  10.67743       16.18698  
1 1 1 3  20 18 o 174.9950 5.836171  20.53663       1.358999      20.32781       1.894398      20.75805       1.950667      173.5495 8.215028  175.3370 8.373230  -1.787476      11.73020  
1 1 1 3  20 19 o 37.33340 14.30062  0.6885594      0.9949720     1.038582       1.329749      0.2433218      1.499744      43.92442 16.60144  39.55568 16.67022  4.368748       23.52667  
1 1 1 3  20 20 o 115.4728 8.309403  9.067045       1.270016      9.701244       1.405923      6.254333       2.960817      119.2858 8.909388  89.47077 24.23855  29.81499       25.82411  
1 1 1 3  20 21 o 106.2857 14.84313  8.103348       2.044944      6.632247       3.324785      8.998501       2.593528      89.97387 26.16779  110.1821 18.30688  -20.20818      31.93579  
1 1 1 3  20 22 o 80.09423 10.20123  4.485793       1.064075      -0.2875645     2.971636      5.187847       1.139643      49.09975 22.00044  86.25054 10.10744  -37.15079      24.21115  
1 1 1 3  20 23 o 47.41511 12.07324  1.645775       0.7647191     4.345085       2.467460      1.358953       0.8043222     72.19162 22.87306  43.27390 12.94629  28.91772       26.28276  
1 1 1 3  20 24 o 24.24310 10.38361  0.2763106E-01  0.5982634     3.346375       4.629985      -0.2872126E-01 0.6033213     66.22041 28.62944  23.79074 10.31006  42.42966       30.42930  
1 1 1 3  20 25 o 89.04019 8.364428  5.537117       0.9807987     4.620835       5.793161      5.564157       0.9951648     68.77137 30.77355  89.20580 8.473609  -20.43443      31.91885  
1 1 1 3  20 26 o 28.32634 11.71065  0.2609054      0.7193888     -5.652668      5.618304      0.3594757      0.7253596     47.59444 23.58156  29.42525 11.91327  18.16919       26.41999  
1 1 1 3  20 27 o 32.33940 13.70154  0.3086811      1.021995      1.537923       5.349679      0.2621197      1.041171      56.52027 26.75183  32.19469 13.74143  24.32558       30.07469  
1 1 1 3  20 28 o 62.41644 6.239169  2.703490       0.5119717     -1.855420      5.682193      2.740803       0.5140626     49.84690 24.51076  62.85748 6.218834  -13.01058      25.28737  
1 1 1 3  21 0  o 213.2318 6.247871  30.40744       1.771791      30.40744       1.771791      30.40744       1.771791      213.2318 6.247871  213.2318 6.247871  -0.000000      0.000000  
1 1 1 3  21 1  o 383.7716 5.494952  98.30965       2.810025      96.38309       4.319641      99.72306       3.699901      379.4939 8.542192  386.2655 7.188374  -6.771637      11.16431  
1 1 1 3  21 2  f 480.5698 7.438150  154.4021       4.763157      147.4415       5.525939      174.5235       9.395334      469.2805 8.836902  508.5769 13.87676  -39.29636      16.45161  
1 1 1 3  21 3  o 208.2154 6.100722  28.97819       1.690827      28.57211       2.411315      29.37099       2.371561      206.3922 8.787844  209.3042 8.521024  -2.912003      12.24067  
1 1 1 3  21 4  o 162.7538 5.980130  17.71360       1.294721      16.74976       2.442705      18.09018       1.526839      157.4214 11.72914  164.3676 6.987072  -6.946198      13.65254  
1 1 1 3  21 5  f 181.2666 4.615049  21.93756       1.113818      23.20475       1.392488      19.68671       1.855853      186.3398 5.614460  171.3171 8.153001  15.02266       9.899171  
1 1 1 3  21 6  o 381.9731 5.688826  97.43385       2.895536      94.18314       5.608295      98.61528       3.381013      374.1276 11.26244  384.1281 6.605371  -10.00046      13.05655  
1 1 1 3  21 7  o 281.4044 5.558688  52.88255       2.084379      56.03886       2.702109      48.24468       3.275455      289.4836 7.004957  268.0914 9.182414  21.39218       11.54929  
1 1 1 3  21 8  o 229.5518 6.223710  35.24234       1.901966      34.18575       2.606301      36.44605       2.781845      225.6733 8.683241  232.9660 8.978021  -7.292679      12.49014  
1 1 1 3  21 9  f 99.47390 7.107624  6.654312       0.9359140     8.433429       1.348576      5.001235       1.299929      111.7462 9.136364  85.37108 11.73744  26.37514       14.87416  
1 1 1 3  21 10 o 190.6936 5.812511  24.32485       1.475252      23.12298       1.903081      26.13460       2.335271      185.6348 7.710289  197.1458 8.912524  -11.51097      11.78481  
1 1 1 3  21 11 f 150.9415 9.194746  15.36010       1.840589      15.18182       2.375675      15.62780       2.911175      149.4371 12.03203  150.9136 14.66113  -1.476501      18.96625  
1 1 1 3  21 12 o 57.54109 19.01960  2.205399       1.695268      1.698844       2.134342      3.071187       2.790337      56.03555 21.06450  69.11282 24.36239  -13.07727      32.20620  
1 1 1 3  21 13 o 66.72221 16.30824  3.171995       1.437511      2.385641       2.059391      3.919219       2.007497      60.68461 20.95983  73.80294 19.94344  -13.11833      28.93191  
1 1 1 3  21 14 o 69.14009 14.34293  3.379011       1.278061      3.916500       1.519771      2.080772       2.361950      74.21034 15.85056  59.91048 22.23130  14.29986       27.30331  
1 1 1 3  21 15 o 173.0021 9.491895  20.24454       2.179769      22.17534       3.083109      18.31486       3.082209      179.9569 12.94368  162.9494 14.34118  17.00748       19.31860  
1 1 1 3  21 16 o 35.41904 15.84042  -0.5541329     1.532680      -1.695001      2.186754      0.5474941      2.148817      38.36111 17.81380  48.23126 20.11482  -9.870152      26.86889  
1 1 1 3  21 17 o 48.54400 18.28209  1.307774       1.609361      3.469684       3.404017      0.6854266      1.826373      72.24803 26.71076  45.88031 18.78046  26.36773       32.65226  
1 1 1 3  21 18 o 70.72636 4.256173  3.357509       0.3992639     3.361630       0.4043100     3.195516       2.535037      70.76352 4.308184  67.09921 23.25078  3.664314       23.64655  
1 1 1 3  21 19 o 190.9012 1.084549  24.28783       0.2758871     24.31430       0.2768381     20.45484       3.331361      191.0050 1.087696  170.0363 14.85194  20.96866       14.89171  
1 1 1 3  21 20 o 43.61322 18.94422  0.1065120      2.046627      -2.479353      3.741776      1.210379       2.444743      48.36036 22.73081  52.62933 21.65595  -4.268970      31.39538  
1 1 1 3  21 21 o 86.24996 11.65028  5.279006       1.304756      4.678315       1.867317      5.852062       1.823859      77.85703 18.30849  88.64676 16.03018  -10.78973      24.33449  
1 1 1 3  21 22 o 75.13448 15.11474  4.249357       1.460782      2.486032       2.289781      5.459543       1.896941      57.95935 21.81154  83.88585 17.53578  -25.92650      27.98655  
1 1 1 3  21 23 o 60.80371 10.80425  2.676095       0.8433104     -9.710360      3.848662      3.300794       0.8643146     34.92537 17.61740  68.11762 9.804256  -33.19225      20.16176  
1 1 1 3  21 24 o ?        ?         -1.825957      0.3215889     -8.976358      7.590788      -1.813100      0.3218779     51.72720 25.90719  ?        ?         0.000000       25.90719  
1 1 1 3  21 25 o 82.21088 7.060508  4.680684       0.7659778     -2.546000      3.936870      4.965018       0.7809011     44.95656 21.71781  84.72311 6.978873  -39.76655      22.81157  
1 1 1 3  21 26 f 17.74807 8.790374  -1.663133      0.7780131     -3.471855      5.896785      -1.631090      0.7848745     49.63740 24.51443  17.97881 8.891012  31.65859       26.07696  
1 1 1 3  21 27 o 23.08904 11.33179  -1.997483      1.196211      3.758007       4.294438      -2.481613      1.245506      59.14502 26.47859  22.37976 11.09104  36.76527       28.70761  
1 1 1 3  22 0  o 143.7620 6.447574  13.87545       1.229461      13.87545       1.229461      13.87545       1.229461      143.7620 6.447574  143.7620 6.447574  -0.000000      0.000000  
1 1 1 3  22 1  o 94.05304 7.449043  5.956422       0.9259512     6.094876       1.119649      5.656828       1.647013      94.92725 8.957423  90.39684 14.13592  4.530418       16.73498  
1 1 1 3  22 2  o 216.1264 6.084785  31.23889       1.750629      32.39915       2.189297      29.18150       2.915323      219.8966 7.482483  208.0897 10.54827  11.80688       12.93266  
1 1 1 3  22 3  o 201.8169 7.312446  27.29139       1.963248      28.06516       2.568794      26.20466       3.044277      204.2749 9.462859  196.8904 11.65557  7.384491       15.01326  
1 1 1 3  22 4  o 307.5005 5.888760  63.18444       2.412921      61.11749       3.811340      64.56702       3.117154      301.5766 9.496163  310.5571 7.532571  -8.980560      12.12092  
1 1 1 3  22 5  o 178.9656 6.943179  21.46133       1.652634      19.97501       3.131084      22.03531       1.945742      171.1883 13.84411  181.1658 8.080342  -9.977539      16.02971  
1 1 1 3  22 6  o 35.82284 13.43130  0.6535632      0.8665520     0.1657993      1.126841      1.359474       1.355604      34.74530 14.53393  47.71727 16.96557  -12.97197      22.33978  
1 1 1 3  22 7  o 315.4628 5.618567  66.50242       2.361823      65.64476       3.053689      67.77928       3.725987      313.0967 7.319353  317.6670 8.810800  -4.570313      11.45439  
1 1 1 3  22 8  o 80.29963 10.73308  4.419230       1.119714      4.864285       1.592508      3.984088       1.574672      83.35800 14.88321  74.98450 16.23115  8.373505       22.02181  
1 1 1 3  22 9  o 357.0916 6.147998  85.29138       2.925411      85.06470       4.175916      85.50983       4.099456      355.8856 8.805779  356.8749 8.620584  -0.9892883     12.32300  
1 1 1 3  22 10 o 240.7939 6.749196  38.85414       2.163428      38.65234       2.904592      39.10559       3.242286      239.6016 9.114113  240.7099 10.13109  -1.108231      13.62740  
1 1 1 3  22 11 o 210.1464 6.562801  29.60041       1.835490      30.39500       2.184680      27.69344       3.384438      212.7078 7.720616  201.6098 12.66194  11.09804       14.83012  
1 1 1 3  22 12 o 154.8255 10.51750  16.26731       2.156962      14.09601       2.566487      21.48966       3.980262      143.1719 13.61638  175.5523 17.23699  -32.38042      21.96633  
1 1 1 3  22 13 o 116.7435 6.327529  9.157894       0.9806499     9.095100       1.041881      9.645508       2.903351      116.2730 6.753655  115.9371 19.48367  0.3358459      20.62099  
1 1 1 3  22 14 o 175.0585 9.813229  20.79050       2.279957      23.63263       3.097024      17.42769       3.368784      185.6276 12.59529  157.7412 16.25977  27.88643       20.56748  
1 1 1 3  22 15 o 89.34888 10.68727  5.500235       1.247208      6.825058       1.523765      2.811065       2.170942      99.34937 11.73642  63.60776 21.53168  35.74161       24.52258  
1 1 1 3  22 16 o 133.6576 12.54329  12.38870       2.207871      10.57284       2.949378      14.70341       3.329948      120.3814 19.01727  142.9931 17.86496  -22.61178      26.09240  
1 1 1 3  22 17 o 116.1422 13.38975  9.483118       2.034336      9.300152       2.652910      9.744279       3.169499      112.5608 18.31650  113.2149 21.80030  -0.6540222     28.47363  
1 1 1 3  22 18 o 67.21038 21.97903  3.435972       2.266226      1.899159       3.189894      5.002102       3.220176      60.64326 24.82126  78.71725 26.21972  -18.07399      36.10497  
1 1 1 3  22 19 o 57.10279 19.93813  2.363479       1.865944      1.468882       3.054572      2.896038       2.356789      56.97248 23.88696  62.44899 22.35151  -5.476509      32.71356  
1 1 1 3  22 20 f 53.91148 3.206885  1.951288       0.2293355     1.987117       0.2359615     1.340065       0.9745881     54.39771 3.270372  43.53935 14.42204  10.85836       14.78819  
1 1 1 3  22 21 o 46.76320 9.674457  1.572002       0.5829453     1.427091       0.5961297     4.739799       2.787199      44.35211 10.28674  73.13510 24.39419  -28.78299      26.47439  
1 1 1 3  22 22 o 27.91386 10.97428  0.3640497      0.5977423     0.3122041      0.6410660     0.7092028      1.654065      27.92749 11.23772  41.90168 17.57357  -13.97419      20.85945  
1 1 1 3  22 23 f 31.66970 12.98391  0.3847257      0.8746721     3.693155       1.760263      -0.6999733     1.007909      66.26153 18.97060  25.93773 12.06148  40.32380       22.48028  
1 1 1 3  22 24 o 31.04853 12.67641  0.3971300      0.8294292     -0.1097271     1.815464      0.5308338      0.9324311     37.93613 17.08076  33.47456 13.52351  4.461567       21.78618  
1 1 1 3  22 25 o 36.03344 16.91829  -0.9806322     2.062982      3.630439       4.106624      -2.537065      2.385884      60.08423 26.44743  34.20657 16.61485  25.87766       31.23332  
1 1 1 3  22 26 o 80.94891 10.06175  4.783038       1.061963      -0.5503601     5.645546      4.978677       1.081265      51.75152 25.23133  82.63056 10.02496  -30.87904      27.14995  
1 1 1 3  23 0  o 196.5069 7.016295  25.88829       1.831892      25.88829       1.831892      25.88829       1.831892      196.5069 7.016295  196.5069 7.016295  0.000000       0.000000  
1 1 1 3  23 1  o 215.3123 5.776382  31.01190       1.655792      29.81384       2.073592      33.11998       2.750594      210.8381 7.392192  221.8101 9.327000  -10.97206      11.90115  
1 1 1 3  23 2  o 60.27090 8.470687  2.484260       0.6615511     2.740289       0.7173652     1.028354       1.710656      63.30789 8.736366  47.85506 18.63792  15.45283       20.58388  
1 1 1 3  23 3  o 109.4389 7.607388  8.064671       1.102475      7.362568       1.360001      9.410358       1.882832      104.1451 9.919683  117.3529 12.21924  -13.20779      15.73880  
1 1 1 3  23 4  o 181.8538 5.950609  22.13813       1.440032      21.55833       2.265027      22.53148       1.865615      178.7908 9.541804  183.1819 7.659941  -4.391159      12.23604  
1 1 1 3  23 5  o 76.08130 10.04859  3.963167       0.9938408     2.505558       1.255923      6.404915       1.625522      59.47956 15.64100  96.36620 12.98932  -36.88665      20.33134  
1 1 1 3  23 6  o 63.22659 15.99812  2.842291       1.348707      4.899763       1.817117      0.3184777      2.012540      83.03884 16.99507  46.04142 19.35185  36.99743       25.75513  
1 1 1 3  23 7  f 195.5769 5.661898  25.59989       1.473994      25.89573       1.880985      25.12916       2.372705      196.4333 7.198330  193.0443 9.250796  3.389038       11.72148  
1 1 1 3  23 8  o 114.2703 9.429765  8.851243       1.423077      9.394093       1.971489      8.260709       2.056255      116.9131 12.86737  109.0868 14.50507  7.826248       19.38985  
1 1 1 3  23 9  o 92.45049 9.484420  5.818938       1.151857      4.890629       1.628241      6.748915       1.629704      83.23746 15.24151  98.87357 12.65965  -15.63612      19.81339  
1 1 1 3  23 10 o 123.2795 7.671156  10.24716       1.253915      9.879502       1.812391      10.58472       1.736640      120.1631 11.45752  124.6540 10.55425  -4.490952      15.57777  
1 1 1 3  23 11 o 61.44817 15.76089  2.708152       1.296649      5.003882       1.865136      0.5607544      1.803875      83.36781 17.35461  45.07875 18.58106  38.28906       25.42515  
1 1 1 3  23 12 o 201.4975 6.941645  27.30342       1.861043      28.11378       2.139040      24.77950       3.775033      204.1996 7.875999  188.6844 15.14152  15.51515       17.06742  
1 1 1 3  23 13 o 49.55140 2.793792  1.643503       0.1837219     1.634812       0.1842388     3.186018       2.454405      49.41851 2.809381  67.17744 22.89228  -17.75893      23.06402  
1 1 1 3  23 14 o 44.22490 10.22594  1.383970       0.5905869     1.584234       0.6039029     -3.007555      2.827957      47.42428 9.877591  40.39941 19.21652  7.024864       21.60652  
1 1 1 3  23 15 f 90.13110 12.81618  5.728437       1.495910      6.908312       1.719975      2.064297       3.031030      98.88756 13.39717  61.43950 24.53334  37.44806       27.95298  
1 1 1 3  23 16 o 57.31071 19.04120  2.375150       1.698525      5.936538       2.530058      -0.5469066     2.291739      87.07340 21.84505  42.98358 19.28545  44.08982       29.13992  
1 1 1 3  23 17 o 40.02586 17.35697  0.8186105E-01  1.712158      -1.003830      2.318157      1.384976       2.539693      41.02903 18.79475  53.78658 22.09595  -12.75755      29.00817  
1 1 1 3  23 18 o 82.08447 19.63148  5.325376       2.118287      4.962042       2.560706      6.112945       3.770086      77.18262 23.10205  82.09696 28.35902  -4.914345      36.57785  
1 1 1 3  23 19 o 43.60835 18.39815  0.6572592      1.829961      4.967622       3.508165      -0.9539952     2.144891      73.95765 27.15545  38.73839 17.86679  35.21926       32.50601  
1 1 1 3  23 20 o 54.86636 10.33529  2.174593       0.7279050     2.569467       0.7738836     -0.8554140     2.143722      59.86639 10.05731  38.68121 17.84812  21.18517       20.48670  
1 1 1 3  23 21 o 49.56555 19.17162  1.723585       1.800499      -0.6486023     4.972342      2.081560       1.931580      54.59569 25.82608  52.62683 19.98157  1.968853       32.65348  
1 1 1 3  23 22 o 32.63076 10.61688  0.7487058      0.5291202     0.8093555      0.5393450     -0.8055432     2.730314      33.68611 10.69633  42.54453 19.80678  -8.858425      22.51044  
1 1 1 3  23 23 f 31.09029 9.028669  0.6980051      0.3960686     0.2976034      0.4253016     3.313928       1.087080      24.18016 9.327086  65.96515 12.82929  -41.78499      15.86144  
1 1 1 3  23 24 o 17.96712 8.293708  -0.3174364     0.4635771     0.9099230      0.6342982     -1.724700      0.6791963     35.33103 11.63204  15.71373 7.852062  19.61729       14.03421  
1 1 1 3  24 0  o 259.5477 7.492974  45.15010       2.586573      45.15010       2.586573      45.15010       2.586573      259.5477 7.492974  259.5477 7.492974  -0.000000      0.000000  
1 1 1 3  24 1  o 134.9507 5.517057  12.19969       0.9900100     13.79868       1.313392      10.09571       1.506577      143.3262 6.897182  122.0940 9.330956  21.23218       11.60336  
1 1 1 3  24 2  o 81.94557 6.506035  4.525584       0.7045931     3.989172       0.7618357     7.698031       1.852719      76.74239 7.547483  105.4972 13.48744  -28.75484      15.45560  
1 1 1 3  24 3  o 26.23350 12.63497  -1.942509      1.308574      -3.304498      1.653874      0.3374336      2.139821      26.99798 13.26514  47.23414 19.90959  -20.23616      23.92396  
1 1 1 3  24 4  o 139.6005 8.420221  13.15166       1.559051      13.23378       2.065678      13.04296       2.376515      139.3569 11.21872  137.7887 13.10100  1.568222       17.24807  
1 1 1 3  24 5  o 209.0110 5.980112  29.27156       1.663816      30.37033       1.909554      25.80763       3.390484      212.7382 6.744693  194.1070 13.18660  18.63115       14.81139  
1 1 1 3  24 6  o 47.95906 15.39854  1.556875       1.115360      1.540703       1.365686      1.589267       1.932836      49.18829 17.06444  53.40715 20.05205  -4.218853      26.33021  
1 1 1 3  24 7  o 86.11315 11.37397  5.118918       1.273253      4.900159       2.015107      5.264297       1.642721      82.07634 18.82622  86.36674 14.80657  -4.290398      23.95122  
1 1 1 3  24 8  o 38.33245 13.30934  0.9156690      0.8308491     1.505075       0.9745383     -0.6527578     1.589732      46.63884 14.31373  35.61362 16.01371  11.02521       21.47840  
1 1 1 3  24 9  o 42.93681 15.70697  1.070335       1.171989      0.8603292      1.480151      1.423275       1.918852      43.88940 17.26490  51.75825 19.85113  -7.868843      26.30863  
1 1 1 3  24 10 o 196.1226 6.085377  25.83328       1.588411      25.15210       2.165329      26.62690       2.337208      192.8041 8.448699  198.2324 8.870554  -5.428253      12.25019  
1 1 1 3  24 11 o 81.66634 11.04145  4.633426       1.170799      4.989997       1.883438      4.408862       1.494678      82.48792 17.66741  78.40066 14.85072  4.087265       23.07989  
1 1 1 3  24 12 o 139.3792 5.783496  13.06660       1.071809      12.99032       1.193539      13.38435       2.436058      138.8064 6.470687  138.2936 13.38660  0.5127411      14.86845  
1 1 1 3  24 13 o 98.37554 2.237455  6.456459       0.2933020     6.472028       0.2944979     4.551171       3.257888      98.49370 2.243883  76.34332 26.36274  22.15038       26.45807  
1 1 1 3  24 14 o 111.4273 5.748303  8.375626       0.8506175     8.442018       0.8576876     4.398292       6.638494      111.8632 5.773517  80.40028 34.51548  31.46288       34.99503  
1 1 1 3  24 15 o 80.51270 13.69388  4.697408       1.416591      4.650556       1.593461      4.874010       3.093660      79.18043 15.65752  76.55508 25.70301  2.625351       30.09656  
1 1 1 3  24 16 o 52.53523 21.25649  1.530746       2.307644      2.286061       3.391145      0.8793372      3.149265      61.28490 25.38927  54.02824 23.48363  7.256657       34.58462  
1 1 1 3  24 17 f 57.23983 21.94049  2.373663       2.343091      -0.4821826     4.585187      3.382995       2.725879      55.83512 25.88224  64.52408 23.89390  -8.688953      35.22511  
1 1 1 3  24 18 o 101.7376 15.53580  7.842546       2.039471      8.220315       2.729664      7.365179       3.068469      99.19867 21.28777  90.15644 24.77889  9.042229       32.66745  
1 1 1 3  24 19 o 64.83646 21.24891  3.606245       2.117648      2.533488       2.402169      7.347123       4.485796      57.02490 22.12047  81.17679 30.53308  -24.15189      37.70390  
1 1 1 3  24 20 o 47.60453 20.27150  1.105815       2.256560      2.893953       3.264560      -0.5302729     3.122680      59.72677 24.84167  46.09119 21.36332  13.63558       32.76432  
1 1 1 3  24 21 o 45.14767 18.34864  1.264143       1.728279      1.330857       3.215381      1.237038       2.049517      51.95321 23.10791  46.60802 19.55556  5.345184       30.27203  
1 1 1 3  24 22 o 56.66615 9.384988  2.326720       0.6838657     1.793637       0.7982062     3.797906       1.326023      48.33438 12.34943  69.14458 14.83630  -20.81021      19.30347  
1 1 1 3  24 23 o 22.33067 9.608580  0.2662252E-01  0.5167168     1.507434       0.6028447     -4.073654      1.003141      44.93870 10.28953  ?        ?         0.000000       10.28953  
1 1 1 3  25 0  f 196.5233 7.645567  25.97525       1.995258      25.97525       1.995258      25.97525       1.995258      196.5233 7.645567  196.5233 7.645567  0.000000       0.000000  
1 1 1 3  25 1  o 297.6681 6.083070  59.40730       2.412841      60.95596       3.117311      57.09303       3.810737      300.8255 7.783175  290.1721 9.869891  10.65338       12.56951  
1 1 1 3  25 2  o 205.4439 5.791823  28.30595       1.583976      25.83434       2.019048      32.26187       2.554351      195.7509 7.755860  218.4267 8.794075  -22.67580      11.72558  
1 1 1 3  25 3  o 193.5741 7.395504  25.24220       1.904096      26.03356       2.658327      24.40841       2.728647      195.6174 10.23388  189.1449 10.87208  6.472534       14.93099  
1 1 1 3  25 4  o 48.15869 17.23767  1.436809       1.401746      1.192321       1.838477      1.776285       2.166374      49.42218 19.30062  55.83314 21.16993  -6.410961      28.64751  
1 1 1 3  25 5  o 121.5866 9.508671  10.07675       1.528316      11.46273       2.335121      9.038170       2.021396      128.1655 13.89505  113.7633 13.60382  14.40218       19.44573  
1 1 1 3  25 6  o 160.3100 7.620854  17.35952       1.623276      19.22017       1.906826      12.46140       3.093817      168.4168 8.524458  131.5068 18.13770  36.91000       20.04103  
1 1 1 3  25 7  o 118.6953 6.539878  9.500182       1.030374      9.179363       1.242349      10.20718       1.844263      116.3049 8.066242  121.5666 11.52260  -5.261703      14.06537  
1 1 1 3  25 8  o 100.7247 0.9338066 6.760854       0.1253333     4.366479       2.199534      6.768654       0.1255372     75.91259 21.02402  100.7827 0.9347874 -24.87015      21.04479  
1 1 1 3  25 9  f 42.16899 13.30139  1.230582       0.8352824     1.347433       1.061993      1.041045       1.352552      44.75392 15.05969  43.78923 16.69806  0.9646873      22.48598  
1 1 1 3  25 10 o 91.44775 11.35210  5.843571       1.353631      7.353122       2.123729      4.810683       1.756717      100.4256 16.43836  80.65205 16.88834  19.77354       23.56769  
1 1 1 3  25 11 o 30.41360 12.13207  0.3621291      0.7404665     0.7734848      0.8216434     -1.416495      1.708507      36.08228 13.15891  33.10808 15.49713  2.974205       20.33022  
1 1 1 3  25 12 o 30.57357 10.80449  0.5761706      0.5490838     0.3736956      0.5807043     2.284936       1.686983      28.14207 10.88708  56.03294 18.98047  -27.89087      21.88120  
1 1 1 3  25 13 o 121.5521 1.162912  9.848854       0.1883575     9.872656       0.1888596     5.390292       2.584822      121.6988 1.164606  80.84476 22.93697  40.85403       22.96651  
1 1 1 3  25 14 f 87.56215 4.269938  5.158797       0.4967068     5.112074       0.4982864     12.49345       6.243140      87.15701 4.303763  104.4877 36.47095  -17.33070      36.72400  
1 1 1 3  25 15 o 86.04465 15.81310  5.618138       1.746277      5.588860       1.814564      5.985323       6.426022      85.33011 16.55604  77.22034 33.55493  8.109772       37.41705  
1 1 1 3  25 16 o 46.04687 20.16324  0.4696720      2.358882      0.4466252      2.442404      0.7894590      9.097942      46.50060 20.43476  68.01746 32.89633  -21.51686      38.72659  
1 1 1 3  25 17 o 37.46175 17.18298  -0.6602634     1.946117      -2.237726      2.515274      1.692590       3.071872      37.31493 17.85215  54.75676 23.49247  -17.44183      29.50585  
1 1 1 3  25 18 o 47.42992 19.56620  1.295424       2.002403      5.977386       3.326308      -1.365617      2.507693      76.83421 26.63291  39.46735 18.56886  37.36686       32.46713  
1 1 1 3  25 19 o 41.00734 18.36187  0.8791956E-01  2.066154      3.660199       3.067638      -2.878197      2.795281      62.48753 24.76921  37.24562 18.06601  25.24191       30.65770  
1 1 1 3  25 20 o 57.46235 21.89333  2.958833       2.323862      3.555438       2.963942      2.006917       3.743911      60.78223 24.26384  55.10267 24.69193  5.679562       34.61828  
1 1 1 3  25 21 o 79.74456 22.36036  6.106316       2.471443      5.874279       2.949317      6.653438       4.528822      74.07671 25.09643  70.72414 29.32388  3.352570       38.59690  
1 1 1 3  26 0  o 18.69759 10.96367  0.2789030      0.4592687     0.2789030      0.4592687     0.2789030      0.4592687     18.69759 10.96367  18.69759 10.96367  -0.000000      0.000000  
1 1 1 3  26 1  o 106.6725 8.140134  7.746338       1.148326      8.703440       1.894434      7.190410       1.443809      111.3571 13.01198  101.9267 10.79421  9.430367       16.90641  
1 1 1 3  26 2  o 112.4774 6.637614  8.549347       0.9904115     8.263394       1.101855      9.752309       2.259975      110.3482 7.538802  117.0756 14.81788  -6.727455      16.62538  
1 1 1 3  26 3  o 163.7655 6.545434  18.09028       1.425472      17.94696       1.659629      18.49341       2.783435      162.7418 7.674742  162.7386 12.94215  0.3143311E-02  15.04663  
1 1 1 3  26 4  o 83.59656 17.66355  5.189469       1.905894      6.870825       2.908053      3.923512       2.523377      93.40652 23.41234  71.59048 23.17701  21.81604       32.94407  
1 1 1 3  26 5  o 167.5676 8.957129  19.16673       1.992744      20.11929       2.421470      17.16798       3.507631      170.8348 10.69084  153.5506 17.45236  17.28421       20.46653  
1 1 1 3  26 6  o 74.80524 18.08512  4.219443       1.782653      4.801770       2.066164      2.523529       3.526007      79.18905 19.66936  65.18196 26.31051  14.00709       32.85007  
1 1 1 3  26 7  o 150.4104 6.595589  15.30039       1.318705      17.12825       1.617095      11.67188       2.278392      158.7496 7.667172  128.2430 13.53682  30.50665       15.55734  
1 1 1 3  26 8  o 194.5395 2.488172  25.26581       0.6450028     26.71618       2.879850      25.18921       0.6618157     196.1029 11.06568  194.2334 2.557052  1.869476       11.35728  
1 1 1 3  26 9  o 65.95878 12.42376  3.139995       1.051891      1.825863       1.354456      5.137117       1.669736      50.53616 17.00739  83.25574 15.62454  -32.71957      23.09497  
1 1 1 3  26 10 o 118.6070 8.097385  9.648426       1.272084      10.59967       1.792764      8.683828       1.805300      122.8614 11.06907  110.3452 12.49763  12.51621       16.69476  
1 1 1 3  26 11 o 76.68320 12.95710  4.280520       1.276859      3.205654       1.759192      5.477219       1.856216      63.70151 19.16680  84.58926 17.05741  -20.88775      25.65778  
1 1 1 3  26 12 o 69.94933 7.362423  3.373573       0.6759649     3.556693       0.7658032     2.727579       1.438344      71.56914 8.176597  59.17937 17.21137  12.38977       19.05487  
1 1 1 3  26 13 o 151.8504 2.101511  15.39613       0.4252273     15.42639       0.4312185     14.32984       2.559832      151.9952 2.129090  139.6807 13.93906  12.31456       14.10072  
1 1 1 3  26 14 o 61.09963 7.632656  2.598109       0.6079065     2.731254       0.6171391     -1.752180      3.527605      62.69851 7.537722  46.05978 21.77768  16.63873       23.04527  
1 1 1 3  26 15 o 78.20981 18.14738  4.956069       1.854633      7.108280       2.321604      1.160066       3.083251      93.06134 19.35327  52.44318 23.00564  40.61816       30.06341  
1 1 1 3  26 16 o 90.94946 10.79683  5.958308       1.282987      5.158673       1.372371      11.50398       3.614120      83.35125 12.76180  111.2292 24.99503  -27.87793      28.06448  
1 1 1 3  26 17 o 38.32505 17.15174  -0.2877134E-01 1.800222      -0.9586282E-01 2.259531      0.8783302E-01  2.978805      41.61897 18.86673  46.70765 21.36185  -5.088684      28.50056  
1 1 1 3  26 18 o 91.21223 17.45224  6.838691       2.043927      6.827326       2.529171      6.860087       3.470231      86.10538 21.97334  78.43481 27.20217  7.670578       34.96836  
1 1 1 3  26 19 o 32.40759 15.20344  -0.9786527     1.660106      -0.9272527     2.655309      -1.011636      2.127080      40.67076 19.12648  36.55885 17.16944  4.111912       25.70237  
1 1 1 3  27 0  o 119.7078 10.44167  9.938643       1.635180      9.938643       1.635180      9.938643       1.635180      119.7078 10.44167  119.7078 10.44167  0.000000       0.000000  
1 1 1 3  27 1  f 60.57906 11.82758  2.641299       0.9204837     5.582366       1.548350      1.033698       1.144737      87.87093 13.66779  41.48357 15.46082  46.38735       20.63603  
1 1 1 3  27 2  o 125.8198 6.860992  10.75353       1.145943      11.80788       1.547562      9.473619       1.705080      131.0133 8.917764  116.2493 11.14359  14.76400       14.27257  
1 1 1 3  27 3  o 40.35558 17.04896  0.3977917      1.574883      1.040116       1.914223      -0.9477645     2.770551      47.35007 19.28561  44.87963 20.55428  2.470436       28.18534  
1 1 1 3  27 4  o 69.64209 16.48702  3.680638       1.506125      3.680444       1.617461      3.681898       4.130958      69.18633 17.52716  70.07256 28.40827  -0.8862228     33.38010  
1 1 1 3  27 5  o 54.42149 17.32887  2.220965       1.414766      2.094169       1.621424      2.625443       2.895947      53.61032 18.59392  61.41423 24.15222  -7.803909      30.48055  
1 1 1 3  27 6  o 54.31508 14.82826  2.213157       1.103095      1.251301       1.735465      2.865184       1.428874      47.19052 18.65408  61.04381 16.96008  -13.85329      25.21149  
1 1 1 3  27 7  o 65.65726 16.37832  3.311357       1.428107      4.443253       3.103019      3.007178       1.608593      71.79726 25.65288  61.94643 18.25310  9.850830       31.48406  
1 1 1 3  27 8  o 83.98254 4.595138  4.757388       0.5122750     6.616317       3.027503      4.702596       0.5197698     86.38203 24.92542  83.47443 4.691758  2.907608       25.36314  
1 1 1 3  27 9  o 87.47736 2.671620  5.120314       0.3110532     1.003657       1.668955      5.268456       0.3166005     44.47437 18.04718  88.73365 2.680699  -44.25928      18.24519  
1 1 1 3  27 10 o 62.70599 15.83855  3.047257       1.323585      4.907685       1.999159      1.595323       1.766096      77.55540 19.39636  49.12676 18.99144  28.42864       27.14578  
1 1 1 3  27 11 o 124.1463 9.350754  10.78494       1.535501      9.489203       2.228607      11.95593       2.118618      112.0725 15.32409  128.3689 12.54562  -16.29637      19.80455  
1 1 1 3  27 12 f 55.46435 9.761466  2.209336       0.6951093     2.650009       0.7570440     -0.1580913     1.754692      60.90783 9.648900  37.90981 16.95202  22.99802       19.50570  
1 1 1 3  27 13 o 31.91444 13.88890  0.4922594E-01  1.104424      -0.8021171     1.468680      1.157155       1.675448      31.68095 14.67263  44.80080 18.11758  -13.11985      23.31379  
1 1 1 3  27 14 o 116.8502 7.552337  9.455388       1.169640      10.17257       1.299799      6.402855       2.681589      120.8661 8.117530  83.04149 23.29405  37.82458       24.66794  
1 1 1 3  27 15 o 43.52201 16.11031  1.356632       1.238980      2.329581       1.406150      -2.020995      2.619947      53.38081 17.30301  37.91015 18.15914  15.47066       25.08283  
1 1 1 3  27 16 o 114.8446 8.683825  9.300677       1.319062      9.119714       1.476827      10.01450       2.933118      112.7757 9.928713  105.7639 21.54471  7.011795       23.72243  
1 1 1 3  27 17 o 51.86184 19.04479  2.235913       1.725600      1.226325       2.537361      3.104642       2.353707      48.12170 20.99529  58.15804 22.06285  -10.03634      30.45606  
1 1 1 3  28 0  o 80.02895 14.01591  4.801764       1.357606      4.801764       1.357606      4.801764       1.357606      80.02895 14.01591  80.02895 14.01591  0.000000       0.000000  
1 1 1 3  28 1  o 68.04218 8.199197  3.222794       0.7284345     4.061038       0.9996365     2.273727       1.063666      75.68430 10.16912  54.81187 14.38482  20.87243       17.61630  
1 1 1 3  28 2  o 46.41656 12.97903  1.598723       0.8339092     3.338557       1.389802      0.6199639      1.042406      65.74891 16.01395  36.12013 14.39921  29.62878       21.53564  
1 1 1 3  28 3  o 49.22203 17.73223  1.737037       1.486009      -2.432491      1.973971      7.190466       2.257524      31.99621 15.43746  95.43050 18.42018  -63.43430      24.03369  
1 1 1 3  28 4  o 32.06865 14.28788  -0.2314780     1.234638      0.8150973      1.598204      -1.780452      1.944326      42.55196 17.50950  33.64005 15.98204  8.911907       23.70671  
1 1 1 3  28 5  o 61.00844 18.93334  2.999730       1.699467      3.196800       1.911023      2.254564       3.716059      62.46732 20.16519  60.13713 25.82033  2.330189       32.76163  
1 1 1 3  28 6  o 34.79068 15.94229  -0.6808178     1.669738      -1.686487      1.811396      5.004954       4.307057      32.43478 15.41419  72.11506 29.08961  -39.68027      32.92116  
1 1 1 3  28 7  o 36.94471 14.86999  0.6452488      1.122763      1.216241       2.048218      0.3999712      1.342425      47.84432 19.76799  37.22330 15.73382  10.62102       25.26513  
1 1 1 3  28 8  o 110.5936 7.975367  8.468535       1.167421      9.854897       2.609869      8.121758       1.305287      111.3018 18.22754  107.6364 9.188454  3.665451       20.41252  
1 1 1 3  28 9  o 95.54200 8.651289  6.383252       1.089484      6.971812       3.037321      6.296342       1.167155      85.98116 25.01225  94.49165 9.393888  -8.510483      26.71812  
1 1 1 3  28 10 o 112.2028 11.07244  9.065001       1.633913      7.743274       2.496573      10.05528       2.160990      95.84846 20.18603  115.4244 14.35980  -19.57596      24.77256  
1 1 1 3  28 11 o 74.96735 13.76243  4.276951       1.324157      1.720756       1.982567      6.335581       1.779180      49.68535 19.84096  90.33611 15.32765  -40.65076      25.07191  
1 1 1 3  28 12 o 116.5872 7.372132  9.415103       1.139431      10.17373       1.434563      8.118578       1.875406      120.0858 9.031262  103.3365 13.97780  16.74928       16.64159  
1 1 1 3  28 13 o 68.25481 8.255391  3.289679       0.7355969     3.516944       0.7733235     1.129453       2.384210      70.53633 8.391967  47.46822 20.53337  23.06811       22.18207  
1 1 1 3  28 14 o 43.17141 17.04411  1.232497       1.447188      1.687160       2.262211      0.9175294      1.882876      49.61829 20.66170  43.52184 18.52449  6.096451       27.75000  
1 1 1 3  29 0  f 23.55453 15.27599  0.6436346E-01  1.139126      0.6436346E-01  1.139126      0.6436346E-01  1.139126      23.55453 15.27599  23.55453 15.27599  0.000000       0.000000  
1 1 1 3  29 1  o 24.49257 10.06129  0.1796415      0.5265474     -0.5761193E-03 0.7336963     0.3710385      0.7561105     26.25681 11.37421  30.12607 12.17536  -3.869265      16.66169  
1 1 1 3  29 2  o 63.63762 13.17623  3.048873       1.080507      1.224116       3.344110      3.261581       1.141748      53.54249 23.70365  65.70190 13.49323  -12.15942      27.27508  
1 1 1 3  29 3  o 28.57055 13.30387  -0.8316216     1.232800      0.2090161      1.967302      -1.504488      1.581923      41.34901 18.24875  30.20543 14.36899  11.14359       23.22681  
1 1 1 3  29 4  o 67.04014 18.97691  3.765339       1.771382      1.609842       2.065393      9.761071       3.444690      49.68544 20.10752  101.4937 25.50464  -51.80829      32.47767  
1 1 1 3  29 5  o 55.47198 18.87866  2.515284       1.669127      5.084572       2.140893      -1.467056      2.665370      76.60888 20.54932  40.26286 19.00457  36.34602       27.99014  
1 1 1 3  29 6  o 51.89080 19.72861  2.068146       1.884534      0.8475166      2.628395      3.359488       2.703457      48.14347 21.17619  61.39389 23.55862  -13.25042      31.67711  
1 1 1 3  29 7  o 47.35252 21.18106  0.5622501      2.741655      3.282856       3.524954      -3.603868      4.362007      61.09375 25.64056  45.30902 22.10964  15.78473       33.85668  
1 1 1 3  29 8  o 24.92412 12.52999  -4.839857      1.859674      -5.557396      2.204884      -3.071282      3.461582      27.12808 13.63871  41.25446 20.03231  -14.12638      24.23443  
1 1 1 3  29 9  o 36.84976 4.219673  0.9270762      0.2034662     -1.466583      2.377580      0.9447353      0.2042154     37.55995 17.79438  37.20925 4.191579  0.3507004      18.28139  
1 1 1 3  29 10 o 39.59422 16.71740  0.6584501      1.512761      -3.435439      2.442675      3.205510       1.926714      33.00254 16.19634  60.17702 20.28460  -27.17448      25.95740  
1 1 1 3  30 0  o 22.58734 14.74989  0.1233196E-01  1.088022      0.1233196E-01  1.088022      0.1233196E-01  1.088022      22.58734 14.74989  22.58734 14.74989  0.000000       0.000000  
1 1 1 3  30 1  o 55.66739 8.403736  2.202830       0.6039741     1.740168       0.7389188     3.134159       1.048374      48.09162 11.65411  64.37618 12.67265  -16.28456      17.21669  
1 1 1 3  30 2  o 76.14370 12.05769  4.310366       1.182703      5.677637       2.309698      3.824450       1.376918      79.32942 21.37262  69.52087 15.28093  9.808556       26.27348  
1 1 1 3  30 3  o 29.63033 14.41471  -2.415942      1.814958      -3.494057      2.229670      -0.2986878     3.124602      31.08805 15.29985  46.01653 21.34296  -14.92849      26.26038  
1 1 1 4  0  0  o 224.3314 6.661476  33.62177       1.987312      33.62177       1.987312      33.62177       1.987312      224.3314 6.661476  224.3314 6.661476  0.000000       0.000000  
1 1 1 4  0  1  o 634.4836 13.64982  268.8520       11.52834      268.8520       11.52834      268.8520       11.52834      634.4836 13.64982  634.4836 13.64982  0.000000       0.000000  
1 1 1 4  0  2  o 1162.577 46.53557  915.0872       71.82792      915.0872       71.82792      915.0872       71.82792      1162.577 46.53557  1162.577 46.53557  0.000000       0.000000  
1 1 1 4  0  3  o 373.7453 17.85791  93.85866       8.847183      93.85866       8.847183      93.85866       8.847183      373.7453 17.85791  373.7453 17.85791  -0.000000      0.000000  
1 1 1 4  0  4  o 696.0451 15.69907  323.7031       14.54406      323.7031       14.54406      323.7031       14.54406      696.0451 15.69907  696.0451 15.69907  0.000000       0.000000  
1 1 1 4  0  5  o 474.1440 12.67993  150.2327       7.998309      150.2327       7.998309      150.2327       7.998309      474.1440 12.67993  474.1440 12.67993  0.000000       0.000000  
1 1 1 4  0  6  o 329.6314 6.076042  72.48176       2.666797      72.48176       2.666797      72.48176       2.666797      329.6314 6.076042  329.6314 6.076042  -0.000000      0.000000  
1 1 1 4  0  7  o 493.9998 11.18823  162.9506       7.356286      162.9506       7.356286      162.9506       7.356286      493.9998 11.18823  493.9998 11.18823  -0.000000      0.000000  
1 1 1 4  0  8  o 650.3586 14.41083  282.5368       12.47481      282.5368       12.47481      282.5368       12.47481      650.3586 14.41083  650.3586 14.41083  -0.000000      0.000000  
1 1 1 4  0  9  o 518.8176 28.91743  181.8594       19.84857      181.8594       19.84857      181.8594       19.84857      518.8176 28.91743  518.8176 28.91743  -0.000000      0.000000  
1 1 1 4  0  10 o 463.5357 14.44280  143.7594       8.901263      143.7594       8.901263      143.7594       8.901263      463.5357 14.44280  463.5357 14.44280  -0.000000      0.000000  
1 1 1 4  0  11 o 276.0485 16.68025  51.42190       6.083837      51.42190       6.083837      51.42190       6.083837      276.0485 16.68025  276.0485 16.68025  -0.000000      0.000000  
1 1 1 4  0  12 o 479.2796 25.54899  155.1368       16.21027      155.1368       16.21027      155.1368       16.21027      479.2796 25.54899  479.2796 25.54899  -0.000000      0.000000  
1 1 1 4  0  13 o 29.12241 17.32048  0.6085686      1.175425      0.6085686      1.175425      0.6085686      1.175425      29.12241 17.32048  29.12241 17.32048  -0.000000      0.000000  
1 1 1 4  0  14 o 401.5889 14.09535  108.0927       7.521680      108.0927       7.521680      108.0927       7.521680      401.5889 14.09535  401.5889 14.09535  0.000000       0.000000  
1 1 1 4  0  15 o 40.35561 12.26111  1.348201       0.5754152     1.348201       0.5754152     1.348201       0.5754152     40.35561 12.26111  40.35561 12.26111  -0.000000      0.000000  
1 1 1 4  0  16 o 498.0287 9.895418  165.6819       6.561076      165.6819       6.561076      165.6819       6.561076      498.0287 9.895418  498.0287 9.895418  0.000000       0.000000  
1 1 1 4  0  17 o 190.6093 8.840607  24.39047       2.234392      24.39047       2.234392      24.39047       2.234392      190.6093 8.840607  190.6093 8.840607  0.000000       0.000000  
1 1 1 4  0  18 o 406.4223 10.85473  110.4789       5.869072      110.4789       5.869072      110.4789       5.869072      406.4223 10.85473  406.4223 10.85473  0.000000       0.000000  
1 1 1 4  0  19 o 150.3443 7.392199  15.18008       1.472726      15.18008       1.472726      15.18008       1.472726      150.3443 7.392199  150.3443 7.392199  0.000000       0.000000  
1 1 1 4  0  20 o 131.5278 7.397295  11.64341       1.287025      11.64341       1.287025      11.64341       1.287025      131.5278 7.397295  131.5278 7.397295  0.000000       0.000000  
1 1 1 4  0  21 o 437.0220 12.23708  127.8021       7.113512      127.8021       7.113512      127.8021       7.113512      437.0220 12.23708  437.0220 12.23708  -0.000000      0.000000  
1 1 1 4  0  22 o 81.73585 33.25998  6.273489       3.554267      6.273489       3.554267      6.273489       3.554267      81.73585 33.25998  81.73585 33.25998  -0.000000      0.000000  
1 1 1 4  0  23 o 187.3405 11.84712  23.71596       2.930010      23.71596       2.930010      23.71596       2.930010      187.3405 11.84712  187.3405 11.84712  0.000000       0.000000  
1 1 1 4  0  24 o 95.30711 20.58673  6.873346       2.293296      6.873346       2.293296      6.873346       2.293296      95.30711 20.58673  95.30711 20.58673  0.000000       0.000000  
1 1 1 4  0  25 o 60.58377 25.02744  3.470634       2.004514      3.470634       2.004514      3.470634       2.004514      60.58377 25.02744  60.58377 25.02744  0.000000       0.000000  
1 1 1 4  0  26 f 200.4013 14.40284  27.35724       3.799556      27.35724       3.799556      27.35724       3.799556      200.4013 14.40284  200.4013 14.40284  -0.000000      0.000000  
1 1 1 4  0  27 o 213.6782 12.91676  30.97061       3.646704      30.97061       3.646704      30.97061       3.646704      213.6782 12.91676  213.6782 12.91676  0.000000       0.000000  
1 1 1 4  0  28 o 40.00182 23.35370  1.344748       2.068766      1.344748       2.068766      1.344748       2.068766      40.00182 23.35370  40.00182 23.35370  -0.000000      0.000000  
1 1 1 4  0  29 o 134.2468 23.12374  13.36967       3.768695      13.36967       3.768695      13.36967       3.768695      134.2468 23.12374  134.2468 23.12374  0.000000       0.000000  
1 1 1 4  0  30 o 52.55899 27.33011  2.858450       2.486662      2.858450       2.486662      2.858450       2.486662      52.55899 27.33011  52.55899 27.33011  0.000000       0.000000  
1 1 1 4  0  31 o 102.2022 25.95764  8.521119       3.056248      8.521119       3.056248      8.521119       3.056248      102.2022 25.95764  102.2022 25.95764  0.000000       0.000000  
1 1 1 4  0  32 o 36.76980 24.59116  -0.6586609     3.326959      -0.6586609     3.326959      -0.6586609     3.326959      36.76980 24.59116  36.76980 24.59116  0.000000       0.000000  
1 1 1 4  0  33 o 70.14435 33.44606  5.682423       3.575168      5.682423       3.575168      5.682423       3.575168      70.14435 33.44606  70.14435 33.44606  -0.000000      0.000000  
1 1 1 4  0  34 o 57.42325 31.58810  4.164458       3.492494      4.164458       3.492494      4.164458       3.492494      57.42325 31.58810  57.42325 31.58810  -0.000000      0.000000  
1 1 1 4  0  35 o 49.10115 29.79607  3.042694       3.620404      3.042694       3.620404      3.042694       3.620404      49.10115 29.79607  49.10115 29.79607  -0.000000      0.000000  
1 1 1 4  0  36 o 32.54010 22.76523  -1.827375      3.670176      -1.827375      3.670176      -1.827375      3.670176      32.54010 22.76523  32.54010 22.76523  -0.000000      0.000000  
1 1 1 4  0  37 o 28.26139 20.22051  -3.376022      3.501581      -3.376022      3.501581      -3.376022      3.501581      28.26139 20.22051  28.26139 20.22051  0.000000       0.000000  
1 1 1 4  0  38 o 30.23170 21.00331  -0.9283547     2.978111      -0.9283547     2.978111      -0.9283547     2.978111      30.23170 21.00331  30.23170 21.00331  -0.000000      0.000000  
1 1 1 4  1  0  o 445.1806 35.65016  135.4275       20.82657      135.4275       20.82657      135.4275       20.82657      445.1806 35.65016  445.1806 35.65016  0.000000       0.000000  
1 1 1 4  1  1  o 754.6471 11.09592  379.9244       11.15786      379.8963       14.64922      379.9633       17.21980      754.2630 14.57533  754.0059 17.13878  0.2571411      22.49840  
1 1 1 4  1  2  o 605.9937 19.47522  245.9030       15.70579      287.8358       27.37058      225.3177       19.17723      653.1088 31.54358  579.1093 24.90970  73.99957       40.19316  
1 1 1 4  1  3  o 1017.670 27.93721  696.2385       37.84883      725.9431       67.46120      682.5931       45.72305      1029.536 49.31779  1005.411 34.17826  24.12543       60.00331  
1 1 1 4  1  4  o 671.0121 14.54807  300.6634       13.00797      306.9792       14.47367      274.1324       29.66490      677.8608 16.02377  636.3533 35.12033  41.50751       38.60309  
1 1 1 4  1  5  o 1486.658 19.33904  1478.411       38.31065      1498.715       46.68455      1436.540       67.03963      1495.444 23.42770  1459.152 34.47923  36.29175       41.68542  
1 1 1 4  1  6  o 512.0385 6.471935  174.7606       4.415809      159.7105       7.849639      181.7284       5.341077      489.2243 12.04115  522.0986 7.677198  -32.87430      14.28036  
1 1 1 4  1  7  o 577.2072 8.484780  222.1486       6.525981      220.0317       11.88641      223.0620       7.808033      573.7161 15.56258  578.2972 10.13251  -4.581116      18.57045  
1 1 1 4  1  8  o 151.7164 4.713015  15.35437       0.9516514     14.84301       1.219590      16.15042       1.521669      149.1012 6.151668  155.4735 7.365921  -6.372284      9.596864  
1 1 1 4  1  9  o 505.5769 13.54798  170.7869       9.118923      176.4603       13.84508      166.4400       12.11884      513.0139 20.29320  498.5132 18.27454  14.50061       27.30884  
1 1 1 4  1  10 o 306.9312 9.328882  62.89308       3.811007      58.12426       5.699716      66.74886       5.125116      294.6118 14.56390  315.9883 12.19481  -21.37653      18.99528  
1 1 1 4  1  11 o 472.1982 11.05881  148.8129       6.958351      144.3009       8.431978      158.4457       12.32021      464.5783 13.63538  486.0503 19.05926  -21.47205      23.43456  
1 1 1 4  1  12 o 356.1213 10.60714  84.72519       5.027884      88.60928       7.224130      81.07621       7.002074      363.7253 14.93701  347.8681 15.14189  15.85718       21.26948  
1 1 1 4  1  13 o 495.2616 12.61068  164.0246       8.315594      163.9967       10.62877      164.0687       13.35157      494.6400 16.14739  493.8842 20.33120  0.7557983      25.96336  
1 1 1 4  1  14 o 286.8090 7.358783  54.91173       2.810046      66.41479       11.22991      54.14336       2.902380      311.8831 27.29645  284.7713 7.655590  27.11176       28.34968  
1 1 1 4  1  15 o 146.5851 5.246262  14.34476       1.023086      14.56194       1.320935      14.01915       1.617391      147.5973 6.734036  144.6778 8.426033  2.919479       10.78635  
1 1 1 4  1  16 o 239.2164 5.856845  38.16404       1.866931      39.51931       3.228714      37.48331       2.288255      242.9943 9.992809  236.9002 7.257346  6.094086       12.35011  
1 1 1 4  1  17 o 722.3237 4.620451  347.8446       4.447231      396.7308       20.74273      345.4892       4.553109      766.6656 20.32214  719.8611 4.746635  46.80457       20.86911  
1 1 1 4  1  18 o 207.5134 8.046772  28.78822       2.220840      32.75059       3.826937      26.77625       2.726999      220.7740 13.06702  199.8987 10.27212  20.87529       16.62118  
1 1 1 4  1  19 o 283.2202 10.75249  53.69242       4.050582      48.66593       6.976549      56.24846       4.974989      268.1230 19.66365  289.5984 12.92463  -21.47540      23.53094  
1 1 1 4  1  20 o 174.4865 9.731354  20.39910       2.253640      16.93111       4.285222      21.72500       2.649657      157.1434 20.98899  179.9375 11.10493  -22.79402      23.74568  
1 1 1 4  1  21 o 263.5408 7.537429  46.38271       2.644224      46.30733       3.396798      46.49865       4.212484      263.1241 9.704658  263.3946 12.03391  -0.2704773     15.45948  
1 1 1 4  1  22 o 97.13026 21.16116  6.607668       2.661204      4.998139       3.516870      8.763914       4.070577      86.24825 27.30479  111.3267 27.58254  -25.07846      38.81170  
1 1 1 4  1  23 o 87.97340 9.576281  5.232720       1.104494      7.181454       1.327002      0.8387153      1.992625      103.2007 9.765911  49.75877 19.88421  53.44196       22.15299  
1 1 1 4  1  24 o 309.4415 9.710018  64.10818       3.998843      62.14971       5.049989      67.40071       6.547826      304.1896 12.48523  316.1021 15.59333  -11.91248      19.97581  
1 1 1 4  1  25 o 40.46240 15.12399  0.8349303      1.096980      1.799397       1.734529      0.1920149      1.416168      54.65374 19.21280  38.93544 16.29045  15.71830       25.18949  
1 1 1 4  1  26 o 92.39853 12.07238  5.840333       1.450872      6.846447       1.971305      4.651180       2.143132      99.44836 15.37104  80.86927 20.00068  18.57909       25.22491  
1 1 1 4  1  27 o 60.74670 18.66550  2.544208       1.656584      2.277877       2.095049      2.988525       2.706013      60.32186 21.12219  68.49905 24.00382  -8.177189      31.97390  
1 1 1 4  1  28 o 103.4032 12.07440  7.329990       1.632415      4.207893       2.749742      9.029171       2.028563      76.96371 24.11412  114.5230 13.55548  -37.55929      27.66300  
1 1 1 4  1  29 o 114.0041 12.12865  8.918098       1.814246      9.181751       2.947863      8.757346       2.301817      112.9238 20.33854  111.8235 15.89487  1.100281       25.81285  
1 1 1 4  1  30 o 154.4135 13.84333  16.48248       2.818197      16.16785       3.536771      17.02971       4.664292      151.1214 17.91121  151.9024 23.82654  -0.7809753     29.80798  
1 1 1 4  1  31 o 84.33057 18.61862  5.238895       2.036187      5.846217       2.993642      4.716039       2.777676      87.00259 24.68437  78.79651 24.16211  8.206085       34.54165  
1 1 1 4  1  32 o 76.64443 22.06766  4.569665       2.375498      4.249608       4.197186      4.720506       2.881406      75.96396 29.30092  77.29284 24.74325  -1.328880      38.35065  
1 1 1 4  1  33 o 70.87407 21.12296  4.014101       2.144296      3.762026       3.180192      4.224239       2.903629      69.02515 25.76082  71.74847 24.88259  -2.723320      35.81569  
1 1 1 4  1  34 o 62.41085 22.21654  3.220080       2.325253      3.759100       3.028620      2.446160       3.629027      66.11460 25.03941  60.64893 25.76242  5.465675       35.92596  
1 1 1 4  1  35 o 46.75160 20.91743  0.5234921      2.675602      -0.9977061     3.742728      2.113469       3.826404      47.51234 22.45470  56.89997 25.26386  -9.387630      33.80053  
1 1 1 4  1  36 o 38.53712 18.61473  -2.250505      2.890363      -3.829875      4.255108      -0.8974782     3.938419      42.95740 21.14026  47.03332 22.45712  -4.075920      30.84206  
1 1 1 4  1  37 o 40.91744 19.07584  -0.1864974     2.546572      -1.192793      3.454211      1.011668       3.769158      42.61848 20.52695  48.94523 22.94475  -6.326752      30.78664  
1 1 1 4  1  38 o 35.56441 17.15779  -1.528487      2.437363      -3.123618      3.006185      1.531914       4.163961      35.60384 17.56864  49.24261 23.39285  -13.63877      29.25547  
1 1 1 4  2  0  o 342.6132 13.26026  78.63130       6.033190      78.63130       6.033190      78.63130       6.033190      342.6132 13.26026  342.6132 13.26026  0.000000       0.000000  
1 1 1 4  2  1  o 380.8136 8.040565  96.68644       4.080117      99.51730       5.260517      92.41221       6.463954      386.1313 10.23300  371.8644 13.06518  14.26691       16.59557  
1 1 1 4  2  2  o 616.8822 10.66271  253.8464       8.764825      257.3445       14.16483      251.6760       11.15729      620.2910 17.15377  614.0046 13.63684  6.286316       21.91381  
1 1 1 4  2  3  o 306.6276 5.412840  62.66153       2.211617      62.01992       2.295519      70.96042       8.255711      305.0495 5.647250  325.1646 19.13825  -20.11508      19.95405  
1 1 1 4  2  4  o 441.1019 8.593584  129.7366       5.051110      135.4268       7.173013      124.1395       7.114049      450.3477 11.96369  431.1220 12.39636  19.22571       17.22787  
1 1 1 4  2  5  o 910.5468 14.20598  553.5822       17.23642      570.3767       23.12031      532.5695       25.86130      923.5127 18.78786  891.8090 21.76231  31.70367       28.75033  
1 1 1 4  2  6  o 310.8189 4.418618  64.37972       1.830068      66.92142       3.914812      63.66896       2.070196      316.6460 9.288231  309.0889 5.026371  7.557129       10.56104  
1 1 1 4  2  7  o 228.2185 4.419043  34.70855       1.343856      28.99929       3.068390      36.06359       1.494849      208.1950 11.10042  232.6261 4.822425  -24.43106      12.10269  
1 1 1 4  2  8  o 365.8123 5.531214  89.18810       2.696201      85.78461       3.748973      92.83445       3.880431      358.7032 7.843385  373.1527 7.804047  -14.44955      11.06444  
1 1 1 4  2  9  o 808.3036 16.73527  436.7497       18.02523      433.6870       25.83354      439.6555       25.16274      803.6712 24.15043  809.3898 23.35506  -5.718628      33.59617  
1 1 1 4  2  10 o 1060.493 18.71541  752.6968       26.44726      717.1055       38.10335      785.7834       36.73816      1031.980 27.73397  1081.469 25.49351  -49.48889      37.67085  
1 1 1 4  2  11 o 245.1755 7.062644  40.11161       2.304969      42.37649       2.903491      36.25164       3.790449      251.9124 8.662519  232.6867 12.26826  19.22563       15.01830  
1 1 1 4  2  12 o 413.0249 9.258905  113.8197       5.095766      116.1786       6.340489      109.5166       8.563551      416.9722 11.42224  404.2670 15.92806  12.70526       19.60028  
1 1 1 4  2  13 o 290.4410 4.713951  56.22765       1.824385      55.17267       3.065609      56.80617       2.270148      287.4732 8.010681  291.8972 5.836475  -4.424011      9.911380  
1 1 1 4  2  14 o 136.2987 9.471614  12.46330       1.709539      11.96931       1.972656      13.95342       3.426123      133.3682 11.20354  142.9921 18.40769  -9.623947      21.54907  
1 1 1 4  2  15 o 153.2022 6.189104  15.67931       1.260873      17.89811       2.044500      14.31745       1.601746      163.4359 9.427861  146.2267 8.253918  17.20917       12.53043  
1 1 1 4  2  16 o 418.5330 8.306611  116.9422       4.632624      108.7301       6.312260      126.5292       6.820227      402.9955 11.76729  434.7539 11.78372  -31.75836      16.65308  
1 1 1 4  2  17 f 459.0175 10.17335  140.8136       6.222527      136.2935       13.07121      142.1381       7.075724      448.5592 21.93519  460.9706 11.51925  -12.41144      24.77591  
1 1 1 4  2  18 o 394.8311 6.560235  103.9960       3.451471      105.5681       4.554064      101.8741       5.290546      397.6240 8.595141  390.3031 10.18113  7.320862       13.32411  
1 1 1 4  2  19 o 130.1129 9.322464  11.36418       1.605598      13.72561       3.973097      10.90326       1.755314      141.0071 21.85186  127.3091 10.43877  13.69802       24.21717  
1 1 1 4  2  20 o 310.4968 8.639089  64.41123       3.570889      65.54241       4.701581      62.86916       5.489470      312.9084 11.29448  306.1428 13.48964  6.765564       17.59363  
1 1 1 4  2  21 f 401.4777 8.007886  107.5762       4.284033      110.7352       6.746777      105.4420       5.545438      406.6423 12.46590  397.0930 10.48940  9.549255       16.29190  
1 1 1 4  2  22 f 137.7221 17.16642  12.93664       3.082132      10.26664       4.704009      14.94514       4.079897      120.2904 29.56122  147.3257 21.40860  -27.03529      36.49923  
1 1 1 4  2  23 o 265.5677 10.40370  47.23269       3.674477      46.41158       3.832948      56.55126       12.91240      263.1716 10.95396  283.6857 34.89251  -20.51407      36.57152  
1 1 1 4  2  24 o 112.6953 6.280041  8.501963       0.9393356     8.642590       0.9989939     7.428932       2.759526      113.5960 6.628531  102.8773 20.84491  10.71874       21.87345  
1 1 1 4  2  25 f 101.6146 9.351586  6.970190       1.252045      7.411012       1.554311      6.155538       2.112964      104.4968 11.34430  93.87991 17.53530  10.61691       20.88492  
1 1 1 4  2  26 o 176.0539 7.795753  20.78019       1.824312      21.92296       2.398525      19.21170       2.809988      180.4810 10.01255  168.4018 12.61396  12.07922       16.10475  
1 1 1 4  2  27 o 125.4556 8.089146  10.59080       1.345072      12.49604       1.848657      8.447575       1.960722      135.9309 10.28248  110.9125 13.54752  25.01837       17.00778  
1 1 1 4  2  28 o 92.12482 14.84592  5.927382       1.760529      7.689591       2.659800      4.553344       2.348657      103.6001 19.99129  79.30017 21.63172  24.29991       29.45476  
1 1 1 4  2  29 o 30.30938 14.27175  -1.548434      1.486713      -2.540164      1.935176      -0.1200129     2.322479      32.71049 15.65186  46.60365 20.21227  -13.89316      25.56397  
1 1 1 4  2  30 o 67.90863 21.11440  3.315625       2.112458      -0.4240355     3.723652      5.090375       2.565202      56.67354 25.05488  82.66373 22.63050  -25.99018      33.76221  
1 1 1 4  2  31 o 145.9105 11.39903  14.64517       2.198720      19.01806       3.293606      11.12971       2.953105      164.4805 15.19924  123.9161 18.44601  40.56441       23.90130  
1 1 1 4  2  32 f 56.36375 20.05999  2.177803       1.895654      4.145027       3.971301      1.597298       2.157290      74.80355 28.59103  53.45669 20.89821  21.34686       35.41444  
1 1 1 4  2  33 o 43.22076 19.14729  -0.1117135     2.185722      2.613101       4.174573      -1.140790      2.565472      65.75935 27.76815  42.41687 19.55503  23.34248       33.96276  
1 1 1 4  2  34 o 42.45570 18.18515  0.5191833      1.835129      0.1899965      2.503986      0.9011642      2.697314      45.80564 20.38169  50.08322 21.75144  -4.277573      29.80836  
1 1 1 4  2  35 o 32.05867 15.40596  -1.967939      1.920238      -5.711432      2.694227      1.896898       2.737545      31.10465 15.55724  52.93951 22.42681  -21.83486      27.29449  
1 1 1 4  2  36 o 37.06083 17.35139  -0.8536744     2.143917      -7.050197      4.231979      1.285662       2.486618      38.38337 19.24127  47.73812 20.80684  -9.354748      28.33991  
1 1 1 4  2  37 o 52.15856 21.15778  2.553798       2.292909      3.965369       3.575595      1.567907       2.988211      58.08717 25.13620  48.62868 21.90284  9.458485       33.34011  
1 1 1 4  3  0  o 433.4769 15.31541  125.8145       8.821356      125.8145       8.821356      125.8145       8.821356      433.4769 15.31541  433.4769 15.31541  0.000000       0.000000  
1 1 1 4  3  1  o 891.8954 28.66907  535.1415       34.02800      524.9933       79.56638      537.4131       37.64427      863.3429 69.75635  892.8377 31.69145  -29.49481      76.61786  
1 1 1 4  3  2  o 279.9931 3.170436  52.23774       1.182877      52.12169       1.647658      52.36117       1.699216      279.6678 4.421311  280.3079 4.549249  -0.6400452     6.343789  
1 1 1 4  3  3  o 615.2865 15.65970  253.0497       12.82866      261.1394       14.53635      224.5596       27.27937      624.8039 17.47692  575.6037 35.74253  49.20020       39.78657  
1 1 1 4  3  4  o 633.2460 20.89001  268.6983       17.60313      258.8656       26.06812      276.9404       23.86649      619.2405 31.69744  641.4575 27.98941  -22.21692      42.28634  
1 1 1 4  3  5  o 953.8382 14.58113  607.5436       18.53273      624.2216       27.15546      593.0032       25.35550      965.6455 21.10406  941.3730 20.21329  24.27246       29.22257  
1 1 1 4  3  6  o 232.1882 4.353957  35.92627       1.347094      39.09612       1.777063      31.64410       2.065455      242.2002 5.506235  217.7581 7.127768  24.44209       9.006869  
1 1 1 4  3  7  o 685.2357 9.826361  313.1667       8.972349      306.5148       11.53244      323.3678       14.28144      677.6761 12.77102  695.7793 15.40377  -18.10315      20.00937  
1 1 1 4  3  8  o 648.5089 9.006720  280.4637       7.783163      293.4219       10.98539      267.4028       11.02884      663.0439 12.43368  632.9049 13.07730  30.13904       18.04473  
1 1 1 4  3  9  o 410.4136 8.880754  112.3327       4.856742      109.9802       7.400280      114.1127       6.436971      405.5924 13.71228  413.3411 11.69867  -7.748627      18.02458  
1 1 1 4  3  10 o 344.8035 8.516920  79.28841       3.913161      73.59385       7.183050      81.69172       4.666409      331.3633 16.31807  349.7817 10.02213  -18.41846      19.15000  
1 1 1 4  3  11 o 283.6280 3.845886  53.60915       1.453513      49.76725       4.474303      54.06244       1.536869      272.7149 12.34441  284.8211 4.049404  -12.10620      12.99162  
1 1 1 4  3  12 o 417.6614 11.56091  116.5840       6.427939      119.4202       7.907081      111.0571       11.03783      422.4030 14.06766  406.2829 20.45413  16.12009       24.82479  
1 1 1 4  3  13 o 117.4490 7.275077  9.235897       1.132983      9.796047       1.487563      8.462069       1.748419      120.7901 9.313983  111.9065 11.90775  8.883530       15.11769  
1 1 1 4  3  14 o 216.3075 8.127512  31.26801       2.338458      31.98392       2.635615      28.61935       5.069470      218.6937 9.063890  205.5467 18.71379  13.14696       20.79326  
1 1 1 4  3  15 o 330.8860 8.023390  73.07664       3.537609      74.66902       4.900182      71.34334       5.112435      334.0265 11.02435  326.3919 11.77408  7.634583       16.12964  
1 1 1 4  3  16 o 377.3910 9.875921  95.22742       4.962144      102.2701       10.02251      92.94050       5.711254      389.1828 19.38737  372.5913 11.51720  16.59149       22.55030  
1 1 1 4  3  17 o 168.8458 9.423501  19.10329       2.111784      17.08983       3.147863      20.75105       2.847677      158.9278 15.04329  175.6696 12.24184  -16.74185      19.39492  
1 1 1 4  3  18 o 258.1120 7.576350  44.49938       2.602984      40.72737       4.443300      46.47028       3.211818      246.2137 13.59594  263.6204 9.157107  -17.40672      16.39214  
1 1 1 4  3  19 o 382.3779 9.364263  97.65105       4.771335      102.2882       5.722283      87.07201       8.643075      391.0207 10.99328  359.4457 18.10347  31.57495       21.17989  
1 1 1 4  3  20 o 203.1026 7.507139  27.56232       2.028222      24.96742       2.728777      30.76547       3.031768      192.9996 10.65187  214.3014 10.65026  -21.30180      15.06288  
1 1 1 4  3  21 o 631.3971 10.62168  266.4225       8.936535      253.2838       20.94597      269.3464       9.880976      610.5846 25.80247  634.6497 11.68402  -24.06506      28.32461  
1 1 1 4  3  22 o 124.5272 15.55367  10.56332       2.524776      7.729672       3.485594      13.69120       3.662087      104.6799 25.27675  141.1648 20.03003  -36.48493      32.25084  
1 1 1 4  3  23 o 151.6749 13.07804  15.53120       2.617410      15.91573       2.822353      13.16822       6.996421      153.4168 13.95859  135.1652 37.51998  18.25156       40.03237  
1 1 1 4  3  24 o 271.0120 12.74734  49.39359       4.590532      53.83533       5.833079      42.16674       7.440384      282.3321 15.56495  247.7670 22.79126  34.56506       27.59908  
1 1 1 4  3  25 o 356.3773 9.993157  85.16829       4.740862      90.73305       6.716005      79.64120       6.693235      366.7923 13.76539  343.3263 14.66415  23.46597       20.11277  
1 1 1 4  3  26 o 206.7502 7.721035  28.64418       2.123398      30.35599       2.527720      24.53993       3.913971      212.6417 8.940817  189.6098 15.62982  23.03194       18.00637  
1 1 1 4  3  27 o 34.22269 10.90193  0.7737041      0.5599024     0.7068642      0.6045241     1.176980       1.484899      33.56937 11.36216  47.10395 17.59815  -13.53458      20.94740  
1 1 1 4  3  28 o 204.2843 8.225384  28.06260       2.234477      28.82025       3.073810      27.21355       3.253932      206.2169 11.22848  200.0412 12.26616  6.175659       16.62942  
1 1 1 4  3  29 o 98.12704 14.83294  6.738808       1.879027      8.892675       2.680474      4.657708       2.634805      111.6383 18.67806  79.73083 23.32500  31.90742       29.88186  
1 1 1 4  3  30 o 110.7567 16.13097  8.674334       2.310803      5.807199       3.257853      11.57736       3.278178      87.45510 26.02932  126.4293 20.13315  -38.97416      32.90697  
1 1 1 4  3  31 o 126.3599 12.48051  11.08645       2.074020      11.34433       2.740947      10.74102       3.172326      125.8707 16.75787  120.4370 20.50094  5.433754       26.47857  
1 1 1 4  3  32 o 54.69048 20.11973  1.962174       1.927299      -1.277212      3.103309      3.996072       2.458999      47.23822 21.67877  71.69177 22.84785  -24.45355      31.49592  
1 1 1 4  3  33 o 127.3608 12.47126  11.54345       2.089408      11.72583       3.056210      11.38339       2.862985      123.3053 19.22763  122.3858 18.10079  0.9195328      26.40720  
1 1 1 4  3  34 o 36.65418 15.18564  0.4996768      1.213195      0.8774602      1.428700      -0.4769539     2.297127      41.45399 16.74246  41.40780 18.86940  0.4619217E-01  25.22626  
1 1 1 4  3  35 o ?        ?         -4.121952      0.8237675     -4.030859      0.8578493     -5.200521      2.951829      ?        ?         33.83514 16.82027  0.000000       16.82027  
1 1 1 4  3  36 o 43.01984 19.65635  0.1397073      2.514227      0.1193378E-01  4.105233      0.2164002      3.180498      49.40066 23.39758  46.52585 21.56319  2.874809       31.81852  
1 1 1 4  3  37 o 50.48730 14.77784  2.125981       1.057367      2.419910       1.122628      -0.1838821     3.147077      53.65725 15.07914  43.52152 20.57517  10.13573       25.50917  
1 1 1 4  4  0  o 621.5243 43.03980  263.5221       35.24596      263.5221       35.24596      263.5221       35.24596      621.5243 43.03980  621.5243 43.03980  0.000000       0.000000  
1 1 1 4  4  1  o 373.0352 12.12335  92.95538       6.018233      93.84003       6.834799      89.90247       12.69686      374.6724 13.71304  365.0812 26.27531  9.591156       29.63848  
1 1 1 4  4  2  o 545.1198 8.705257  198.1418       6.323349      194.8521       8.693814      201.8370       9.213967      540.3753 12.07373  549.9397 12.57355  -9.564392      17.43184  
1 1 1 4  4  3  o 964.8354 14.87593  621.6835       19.12542      628.3535       29.15700      616.6463       25.33813      968.5152 22.59243  960.0494 19.80649  8.465820       30.04521  
1 1 1 4  4  4  o 399.3885 9.383844  106.3755       4.994015      110.0742       5.887538      96.88786       9.429421      406.0612 10.89083  380.1826 18.67023  25.87869       21.61452  
1 1 1 4  4  5  o 391.2967 9.015043  102.1017       4.700537      101.8918       6.250730      102.3749       7.131045      390.5781 12.02450  391.3598 13.69536  -0.7817078     18.22502  
1 1 1 4  4  6  f 805.0490 5.760988  431.9594       6.180061      397.6784       13.64058      440.8136       6.932377      771.8525 13.26249  813.2242 6.397324  -41.37170      14.72479  
1 1 1 4  4  7  o 451.2991 6.005383  135.7524       3.611425      132.5963       5.442998      138.2345       4.826967      445.9029 9.160610  455.3369 7.955508  -9.434052      12.13288  
1 1 1 4  4  8  o 77.87852 0.6446790 4.040928       0.6690133E-01 5.526009       0.2756357     3.947963       0.6896353E-01 91.06902 2.271388  76.97746 0.6723298 14.09156       2.368804  
1 1 1 4  4  9  o 514.1982 11.08019  176.4370       7.591912      161.5929       10.71582      191.3968       10.75748      491.3625 16.38920  534.9807 15.10545  -43.61813      22.28858  
1 1 1 4  4  10 o 187.5115 1.917866  23.42730       0.4792033     22.71747       3.149132      23.44412       0.4848498     183.9846 12.92733  187.5787 1.939769  -3.594101      13.07205  
1 1 1 4  4  11 o 535.3745 11.10323  191.3486       7.921011      198.1569       12.70592      187.0206       10.13054      543.7239 17.55998  528.7332 14.39218  14.99072       22.70436  
1 1 1 4  4  12 o 326.8921 8.120645  71.28393       3.537272      70.55598       4.373716      72.66042       6.014304      324.9513 10.11318  329.3702 13.73350  -4.418945      17.05537  
1 1 1 4  4  13 o 255.0730 8.101713  43.45659       2.750196      41.23438       3.388477      47.74630       4.707878      248.2679 10.26474  266.8389 13.28219  -18.57095      16.78635  
1 1 1 4  4  14 o 130.7500 9.334561  11.47329       1.615634      11.24906       1.959518      11.94936       2.855214      129.2134 11.50073  132.4535 16.53638  -3.240158      20.14245  
1 1 1 4  4  15 o 502.3748 13.89970  169.1997       9.295854      154.2967       13.65176      182.0832       12.69317      477.6460 21.50424  519.9811 18.34806  -42.33511      28.26806  
1 1 1 4  4  16 o 194.6567 9.549153  25.37432       2.469337      25.69567       3.404555      25.01761       3.586916      195.4474 13.14896  192.7061 14.06544  2.741318       19.25440  
1 1 1 4  4  17 o 165.6885 7.861252  18.36490       1.730682      19.98137       2.533014      16.94955       2.370198      172.5144 11.07745  158.8067 11.27393  13.70775       15.80542  
1 1 1 4  4  18 o 61.15125 15.29054  2.606101       1.242562      2.253578       1.379050      4.127215       2.864622      57.45924 16.89261  78.39980 24.61964  -20.94056      29.85778  
1 1 1 4  4  19 o 423.7513 11.39281  120.1437       6.427188      119.6584       7.197998      122.0526       14.27539      422.6611 12.79518  423.5959 25.40759  -0.9347839     28.44753  
1 1 1 4  4  20 o 501.7990 9.263719  168.1466       6.194248      171.4518       7.457645      160.7938       11.12305      506.4643 11.05043  489.0829 17.09370  17.38135       20.35452  
1 1 1 4  4  21 o 414.5926 7.911077  114.7176       4.370495      113.3027       6.536116      115.8619       5.877792      411.4081 11.93528  416.2375 10.60604  -4.829346      15.96681  
1 1 1 4  4  22 o 435.3052 9.317784  126.5849       5.404805      131.3753       8.649206      123.5159       6.922913      442.3572 14.69375  429.4364 12.11018  12.92084       19.04108  
1 1 1 4  4  23 o 571.2266 9.679556  218.1444       7.367791      229.5426       11.23134      209.5339       9.761787      584.7471 14.41418  559.0460 13.10413  25.70111       19.48042  
1 1 1 4  4  24 o 141.6839 12.10176  13.56159       2.262917      15.01995       2.435034      4.325934       6.127845      149.1159 12.36594  92.09438 35.43533  57.02155       37.53104  
1 1 1 4  4  25 o 370.1412 8.937724  91.72168       4.408267      92.85894       5.867317      90.24760       6.679889      371.5641 11.86559  365.7121 13.73183  5.851959       18.14815  
1 1 1 4  4  26 f 186.3901 6.197251  23.24116       1.537061      23.14211       1.801395      23.50632       2.947478      185.8475 7.288222  186.4368 11.92694  -0.5892944     13.97749  
1 1 1 4  4  27 o 118.5429 5.564415  9.410910       0.8765059     10.04774       0.9434569     5.395651       2.369010      122.4704 5.797652  86.55669 20.79924  35.91370       21.59215  
1 1 1 4  4  28 o 212.2275 7.749834  30.25948       2.187951      30.13786       2.606201      30.54983       4.026906      211.4226 9.273439  211.1247 14.40013  0.2978363      17.12777  
1 1 1 4  4  29 o 168.2750 7.187824  19.03520       1.608011      19.53460       1.896982      17.76026       3.030970      170.2003 8.390152  160.4159 14.33024  9.784378       16.60574  
1 1 1 4  4  30 o 171.7527 9.753801  20.03515       2.223116      21.68552       3.135405      18.36664       3.152586      177.2585 13.37298  162.4526 14.72325  14.80589       19.88996  
1 1 1 4  4  31 o 73.09270 13.66768  3.813526       1.282269      3.588303       1.377904      5.269143       3.502966      70.39135 15.13999  82.17234 27.34616  -11.78099      31.25751  
1 1 1 4  4  32 o 87.17948 11.69020  5.351439       1.323835      6.455748       1.451572      -0.1075949     3.227388      95.91620 11.59211  52.04917 23.15078  43.86703       25.89084  
1 1 1 4  4  33 o 58.17067 13.68672  2.511380       1.043081      3.035847       1.134732      -0.3474963     2.649304      64.06438 13.70676  45.69800 20.59952  18.36639       24.74299  
1 1 1 4  4  34 o 19.17098 9.278234  -1.098094      0.7268217     -1.181354      0.7549347     -0.4223619E-01 2.688406      19.33907 9.382361  45.70801 20.66377  -26.36893      22.69406  
1 1 1 4  4  35 o 56.05167 13.80394  2.447457       1.024092      2.304434       1.091950      3.492086       2.951081      53.90701 14.76793  60.96576 24.25265  -7.058750      28.39512  
1 1 1 4  4  36 o 65.14046 24.34451  4.552005       2.842073      6.050921       3.577876      1.988969       4.678579      70.50365 27.08986  55.08072 25.73725  15.42292       37.36666  
1 1 1 4  4  37 o 55.36198 15.34169  2.601415       1.170852      2.870087       1.266520      1.021836       3.070940      57.71535 15.94169  46.58524 21.44715  11.13012       26.72299  
1 1 1 4  5  0  o 175.2635 0.4795952 20.46618       0.1120037     20.46618       0.1120037     20.46618       0.1120037     175.2635 0.4795952 175.2635 0.4795952 0.000000       0.000000  
1 1 1 4  5  1  o 1000.372 27.85065  672.7427       37.08920      669.7861       44.78545      679.1971       66.17139      996.0819 33.79073  995.3781 50.05003  0.7038574      60.38890  
1 1 1 4  5  2  o 601.0587 2.802590  240.7207       2.244657      239.9933       2.264599      281.4775       16.95135      600.1493 2.831773  648.3603 19.64335  -48.21100      19.84641  
1 1 1 4  5  3  o 659.4170 2.147123  289.7244       1.886647      289.8852       1.917788      284.8932       10.51181      659.5994 2.181960  653.4058 12.07316  6.193604       12.26874  
1 1 1 4  5  4  o 813.5078 11.92764  441.5964       12.92973      437.1270       16.71058      448.2638       20.41011      808.9582 15.50214  818.7208 18.70837  -9.762634      24.29650  
1 1 1 4  5  5  o 54.80256 9.447620  2.060031       0.6650090     2.293955       0.8156882     1.596362       1.148397      57.68173 11.01395  49.31335 15.60184  8.368385       19.09776  
1 1 1 4  5  6  o 541.3352 8.948468  195.4184       6.454885      190.4981       10.48242      198.4237       8.192346      533.8641 14.74938  545.3384 11.27376  -11.47430      18.56453  
1 1 1 4  5  7  o 685.8361 8.451216  313.6540       7.723480      321.8760       9.504155      297.6658       13.25322      694.6276 10.26805  667.5341 14.89959  27.09344       18.09505  
1 1 1 4  5  8  o 631.9039 7.797453  266.2438       6.565645      260.6000       9.676387      271.0591       8.937962      624.8774 11.62104  637.3915 10.52346  -12.51416      15.67775  
1 1 1 4  5  9  o 47.88233 1.576329  1.529253       0.1004392     1.744738       0.5685297     1.522311       0.1020442     50.42009 8.780955  47.77240 1.605296  2.647682       8.926486  
1 1 1 4  5  10 o 652.6429 10.39779  284.2629       9.042538      285.5895       11.57283      282.1834       14.48936      653.8192 13.28337  649.1719 16.76407  4.647278       21.38883  
1 1 1 4  5  11 o 484.6112 3.863975  156.5111       2.495176      158.1059       2.643656      143.4984       7.551637      487.0668 4.073267  463.3150 12.24255  23.75183       12.90239  
1 1 1 4  5  12 o 77.66357 6.527048  4.050522       0.6692283     4.847471       0.8895602     3.011286       1.015821      84.87057 7.958685  66.12104 11.96989  18.74953       14.37425  
1 1 1 4  5  13 o 239.6030 8.760319  38.37172       2.792248      39.42851       3.481249      36.46552       4.675457      242.6871 10.79202  232.8169 15.15313  9.870193       18.60336  
1 1 1 4  5  14 o 259.6195 14.14121  45.28336       4.873654      42.27524       6.116291      50.51533       8.066275      250.0724 18.48545  272.6162 22.40232  -22.54387      29.04438  
1 1 1 4  5  15 o 401.9883 10.48176  108.0777       5.609839      107.0727       8.264839      108.9364       7.639081      399.1933 15.56722  402.9310 14.25021  -3.737762      21.10466  
1 1 1 4  5  16 o 242.1259 7.529710  39.16261       2.426414      38.51459       2.680568      42.10201       5.709012      240.0353 8.393577  249.7002 17.26436  -9.664932      19.19662  
1 1 1 4  5  17 o 179.3625 4.741198  21.46320       1.132172      21.64883       1.222291      20.34181       3.004219      180.1181 5.097778  173.8167 13.06645  6.301407       14.02567  
1 1 1 4  5  18 o 66.14806 17.27488  3.047158       1.538942      2.858639       1.828456      3.505124       2.849864      64.88783 19.54421  73.91997 24.66714  -9.032135      31.47132  
1 1 1 4  5  19 o 365.4660 8.672477  89.16753       4.223413      95.45621       4.974041      72.91971       7.995157      377.8926 9.886455  328.8643 18.31707  49.02823       20.81483  
1 1 1 4  5  20 o 611.3671 9.724017  249.6525       7.921752      250.9564       8.943560      244.9043       17.06671      612.7554 10.95342  602.3075 21.29816  10.44794       23.94972  
1 1 1 4  5  21 o 234.0430 6.264751  36.56119       1.952011      36.40875       2.711230      36.72525       2.812686      233.3551 8.734593  234.3410 9.024266  -0.9858551     12.55908  
1 1 1 4  5  22 o 61.25517 15.03202  2.617800       1.217646      3.074607       1.541669      1.860271       1.985291      66.39273 17.26617  57.06714 20.50369  9.325592       26.80526  
1 1 1 4  5  23 o 270.3103 8.343286  48.86090       3.001601      50.77755       3.528475      43.84183       5.709892      275.4004 9.629811  254.5521 16.92984  20.84824       19.47698  
1 1 1 4  5  24 o 207.9012 7.411942  28.91306       2.050063      29.31062       2.878289      28.50373       2.920628      208.9310 10.37093  205.9799 10.67733  2.951080       14.88494  
1 1 1 4  5  25 o 82.16407 9.927151  4.591126       1.064869      3.307438       1.760537      5.331701       1.337211      68.57035 18.73825  88.32751 11.64475  -19.75716      22.06178  
1 1 1 4  5  26 o 22.15425 9.643599  -0.9657482E-01 0.5327109     -0.5342621E-01 0.6608976     -0.1766034     0.9000639     25.25838 10.86753  28.61732 12.49472  -3.358942      16.55962  
1 1 1 4  5  27 o 199.8604 6.757121  26.76616       1.796954      28.63122       2.535102      24.88283       2.547496      206.2072 9.249646  192.0353 9.989752  14.17188       13.61437  
1 1 1 4  5  28 o 97.21262 4.788947  6.329186       0.6184397     6.548751       0.6915737     5.452664       1.381778      98.83522 5.270190  88.93695 11.96265  9.898270       13.07210  
1 1 1 4  5  29 o 145.9744 5.182948  14.26993       1.006554      14.98215       1.196381      12.54437       1.862202      149.4458 6.020080  135.7859 10.37043  13.65985       11.99113  
1 1 1 4  5  30 o 112.0362 7.316514  8.478686       1.086309      9.276978       1.429048      7.385975       1.671934      116.7487 9.261735  103.1854 12.40853  13.56327       15.48391  
1 1 1 4  5  31 o 22.19013 9.610445  -0.5661745E-01 0.5235619     -0.1142592     0.5334808     1.450397       2.727777      21.83433 9.574118  56.60030 23.03360  -34.76597      24.94415  
1 1 1 4  5  32 o 36.91593 12.00577  0.9288626      0.6766533     2.069568       0.7769645     -2.652980      1.376790      53.75138 11.21112  24.57813 12.08153  29.17324       16.48188  
1 1 1 4  5  33 o 64.50150 9.885262  2.945480       0.8225936     3.750429       0.9853321     1.094216       1.494282      72.69643 10.47355  44.18336 17.35722  28.51307       20.27236  
1 1 1 4  5  34 o 36.04013 12.97558  0.8562187      0.7955563     1.889643       1.011179      -0.8227094     1.288857      49.59506 14.43311  29.36720 13.65049  20.22786       19.86581  
1 1 1 4  5  35 o 27.64439 11.52394  0.2252029      0.7048328     0.5795303E-01  0.7288910     2.634050       2.766205      26.44260 11.39531  55.97023 23.03376  -29.52762      25.69839  
1 1 1 4  5  36 o 38.50721 17.90166  -0.4939947     2.217935      1.769353       3.650087      -1.818848      2.792618      52.16713 23.77756  38.45765 18.50609  13.70947       30.13051  
1 1 1 4  5  37 o 25.82925 11.18351  0.7866254E-01  0.7085984     0.2240448E-01  0.7175675     2.287010       4.495770      25.47967 11.13988  52.20552 24.65388  -26.72585      27.05384  
1 1 1 4  6  0  o 405.0236 10.93962  109.6042       5.894393      109.6042       5.894393      109.6042       5.894393      405.0236 10.93962  405.0236 10.93962  0.000000       0.000000  
1 1 1 4  6  1  o 1148.768 20.91799  883.3284       32.02032      902.3832       36.07491      812.5676       69.51830      1160.438 23.32974  1090.128 47.97478  70.30957       53.34657  
1 1 1 4  6  2  o 1370.092 24.71858  1258.799       45.12807      1198.159       126.6963      1267.611       48.29562      1302.613 73.28753  1374.265 26.37326  -71.65186      77.88845  
1 1 1 4  6  3  f 978.1165 12.15942  638.4299       15.84809      638.8494       24.04227      638.1077       21.07489      977.4282 18.45938  977.2726 16.18364  0.1555786      24.54911  
1 1 1 4  6  4  o 497.4424 6.743711  164.9480       4.470080      164.0098       5.523551      166.7286       7.609580      495.9591 8.357935  499.8858 11.42395  -3.926758      14.15492  
1 1 1 4  6  5  o 345.0424 6.635672  79.36107       3.050920      89.08866       5.109359      73.97063       3.803433      365.2886 10.50772  332.9516 8.579919  32.33698       13.56566  
1 1 1 4  6  6  o 575.4680 10.03610  220.9077       7.695903      233.2258       12.25954      212.8965       9.886611      590.5870 15.59182  564.6937 13.13896  25.89337       20.38964  
1 1 1 4  6  7  o 409.1927 5.858678  111.6064       3.194486      116.5638       4.109145      104.0336       5.078708      418.1283 7.375108  394.9185 9.650999  23.20984       12.14636  
1 1 1 4  6  8  o 650.3043 10.06151  282.1519       8.718733      275.1175       11.93970      290.1883       12.76160      641.7323 13.96259  659.0012 14.53267  -17.26892      20.15322  
1 1 1 4  6  9  o 493.6487 6.742337  162.4727       4.435085      168.6909       7.548142      159.1940       5.481022      502.6942 11.26841  488.5477 8.419399  14.14658       14.06639  
1 1 1 4  6  10 o 261.0573 6.253858  45.43681       2.175491      47.99328       3.120473      43.01919       3.034544      268.0724 8.747353  253.7676 8.988145  14.30481       12.54205  
1 1 1 4  6  11 o 358.6986 4.421668  85.75748       2.113437      85.33808       2.332101      87.68455       4.999026      357.8048 4.891339  362.2420 10.36717  -4.437225      11.46313  
1 1 1 4  6  12 o 568.6267 9.936120  215.9249       7.528658      203.2650       9.236037      240.9940       12.99692      551.3227 12.57205  599.3453 16.28894  -48.02258      20.57635  
1 1 1 4  6  13 o 182.3653 6.477851  22.20993       1.571652      22.18338       1.858302      22.27662       2.945456      182.1702 7.672538  182.0968 12.20938  0.7331848E-01  14.42001  
1 1 1 4  6  14 o 260.6236 7.497504  45.36459       2.601072      43.23135       2.865999      55.32924       6.194239      254.3311 8.468550  286.6519 16.28357  -32.32080      18.35404  
1 1 1 4  6  15 o 217.2301 6.494506  31.50728       1.877810      31.30084       2.098328      32.33750       4.207964      216.4568 7.285308  219.1601 14.49042  -2.703232      16.21876  
1 1 1 4  6  16 o 302.4748 7.725528  61.10235       3.111253      58.67104       3.400770      73.58540       7.705794      296.3043 8.622396  330.3979 17.56589  -34.09357      19.56799  
1 1 1 4  6  17 o 333.2725 7.943208  74.13338       3.527515      73.23679       3.880824      78.39578       8.461648      331.0676 8.804799  340.8513 18.70182  -9.783661      20.67082  
1 1 1 4  6  18 o 144.1867 8.909308  13.93370       1.703399      13.41673       1.985357      15.37593       3.316062      141.2962 10.62249  150.4243 16.83188  -9.128128      19.90351  
1 1 1 4  6  19 o 414.7622 7.786455  114.7974       4.303408      117.5722       5.416429      110.0474       7.086709      419.5625 9.688194  405.2868 13.13962  14.27570       16.32516  
1 1 1 4  6  20 o 196.3618 6.751425  25.75116       1.763922      27.18302       1.964494      19.79367       4.007124      201.7121 7.320928  170.7261 17.87889  30.98604       19.31970  
1 1 1 4  6  21 o 594.8856 8.390618  236.2663       6.651214      232.5596       8.751334      241.3355       10.23427      589.7405 11.13627  600.4191 12.79172  -10.67853      16.96009  
1 1 1 4  6  22 o 214.7610 5.866151  30.78853       1.677163      31.84785       2.199389      29.31666       2.592538      218.2892 7.572765  209.2490 9.321369  9.040237       12.00978  
1 1 1 4  6  23 o 228.1887 6.195800  34.77460       1.882188      33.82711       2.348813      36.47475       3.146340      224.8938 7.849896  233.2472 10.14743  -8.353424      12.82931  
1 1 1 4  6  24 o 69.91621 5.559373  3.282896       0.5136755     3.832316       0.5625845     0.5288183      1.259574      75.56798 5.627367  39.53854 15.80607  36.02944       16.77794  
1 1 1 4  6  25 o 150.4448 5.924577  15.14036       1.185382      13.42538       1.464131      18.40318       2.019519      141.4378 7.798758  165.4555 9.196131  -24.01772      12.05775  
1 1 1 4  6  26 o 172.6382 6.311820  19.95285       1.449550      22.26860       1.889471      16.64027       2.259836      182.1706 7.801810  156.8601 10.87903  25.31050       13.38737  
1 1 1 4  6  27 o 174.2338 5.275993  20.30503       1.223516      21.77668       1.431471      16.31485       2.357090      180.3468 5.964833  154.9765 11.49583  25.37029       12.95119  
1 1 1 4  6  28 f 130.1846 4.471130  11.33384       0.7744714     10.88681       0.8517016     13.46886       1.861299      127.5257 5.021876  140.9505 9.974477  -13.42480      11.16734  
1 1 1 4  6  29 o 16.99069 7.966654  -0.4643558     0.4548002     -0.3618875     0.4831500     -1.261434      1.347528      18.51284 8.517197  29.44377 13.77579  -10.93092      16.19614  
1 1 1 4  6  30 o 38.73983 9.399823  1.056973       0.4802356     0.8787581      0.5122074     2.352305       1.380906      35.55000 10.25065  57.24867 16.92330  -21.69867      19.78570  
1 1 1 4  6  31 o 20.73470 9.531705  -0.4272797     0.6034067     -0.4758277E-01 0.6451346     -3.080835      1.705477      24.74498 10.69245  27.88379 13.65300  -3.138811      17.34165  
1 1 1 4  6  32 o 118.7955 5.296912  9.512002       0.8363781     10.27833       0.9151418     5.626235       2.060728      123.4205 5.578944  85.62245 18.59535  37.79800       19.41421  
1 1 1 4  6  33 o 102.7278 5.489777  7.148760       0.7487487     7.413432       0.8034225     5.400275       2.065003      104.5211 5.791184  81.96874 19.23831  22.55238       20.09105  
1 1 1 4  6  34 f 22.57016 10.91283  -1.406866      0.9994171     -2.215051      1.353335      -0.4374173     1.482220      24.93555 12.19944  33.43248 15.20483  -8.496931      19.49393  
1 1 1 4  6  35 o 47.68669 16.39889  1.807612       1.260167      2.775352       1.956790      1.121853       1.647216      56.16537 20.33277  43.31601 17.79481  12.84936       27.01994  
1 1 1 4  6  36 o 34.38901 15.18341  0.1661627      1.363248      -1.491203      2.504452      0.8639970      1.625099      37.15777 17.78685  40.59463 17.24161  -3.436859      24.77186  
1 1 1 4  6  37 o 29.68479 13.92243  -0.7279366     1.390574      2.339056       2.498349      -2.104577      1.673813      50.19598 21.35088  27.97613 13.66127  22.21985       25.34739  
1 1 1 4  7  0  o 73.55038 0.6948493 3.605212       0.6808663E-01 3.605212       0.6808663E-01 3.605212       0.6808663E-01 73.55038 0.6948493 73.55038 0.6948493 0.000000       0.000000  
1 1 1 4  7  1  o 484.8249 18.30300  157.4182       11.80321      0.000000       0.000000      157.4182       11.80321      ?        ?         484.8249 18.30300  0.000000       18.30300  
1 1 1 4  7  2  o 430.9913 12.84612  124.1019       7.369347      128.8025       10.78727      119.9883       10.09118      438.4446 18.50551  423.2235 17.93428  15.22104       25.76999  
1 1 1 4  7  3  o 742.7584 10.06832  368.0016       9.965016      366.0804       13.32834      370.4367       15.00561      740.4688 13.50815  744.6620 15.12241  -4.193237      20.27701  
1 1 1 4  7  4  o 229.8211 4.592766  35.19921       1.406493      33.77596       2.051200      36.46223       1.932286      224.9880 6.849854  233.8013 6.207768  -8.813293      9.244289  
1 1 1 4  7  5  o 1049.862 13.62152  736.0577       19.05598      720.4114       26.16010      753.7454       27.81436      1037.530 18.92192  1061.072 19.67211  -23.54150      27.29525  
1 1 1 4  7  6  o 70.31395 5.475204  3.315277       0.5089566     3.202591       0.8936003     3.369385       0.6192051     68.55737 10.08263  70.78271 6.642610  -2.225342      12.07409  
1 1 1 4  7  7  o 144.5063 3.713296  13.92479       0.7144305     13.87226       0.7861663     14.17388       1.711884      144.2199 4.095015  145.5050 8.871392  -1.285080      9.770913  
1 1 1 4  7  8  o 641.1401 9.346241  274.2446       7.984788      273.6104       9.174049      276.2258       16.21593      640.2581 10.75307  641.8195 18.98161  -1.561340      21.81582  
1 1 1 4  7  9  f 353.6557 6.333917  83.38859       2.984878      79.40688       4.491897      86.53698       3.994293      344.8049 9.786386  360.1792 8.322383  -15.37436      12.84661  
1 1 1 4  7  10 o 316.2777 4.066956  66.66881       1.714003      63.35431       2.757680      68.75524       2.187947      308.2285 6.714252  321.1581 5.112630  -12.92963      8.439204  
1 1 1 4  7  11 o 124.0487 3.754899  10.26519       0.6199602     10.39271       0.8034691     10.07755       0.9746225     124.7668 4.841969  122.7905 5.974529  1.976257       7.690232  
1 1 1 4  7  12 o 48.82999 1.735261  1.590735       0.1127285     3.416768       2.129232      1.585602       0.1128869     70.75356 21.03927  48.75085 1.740545  22.00272       21.11114  
1 1 1 4  7  13 o 287.0325 7.314040  55.00866       2.795168      55.56139       3.616721      54.18886       4.404657      288.2697 9.428164  284.4182 11.64665  3.851501       14.98448  
1 1 1 4  7  14 o 483.8419 12.72197  156.8126       8.195105      157.6276       8.507320      146.3163       30.53022      485.0044 13.17577  449.0810 51.97747  35.92343       53.62144  
1 1 1 4  7  15 o 499.9843 12.00205  167.2539       7.996230      169.7856       10.07019      162.9337       13.15488      502.9341 15.04324  491.2258 20.13975  11.70825       25.13779  
1 1 1 4  7  16 o 75.06889 4.334128  3.769115       0.4317029     3.495690       0.4395688     11.20445       2.292232      72.26736 4.588383  128.6389 13.57708  -56.37151      14.33145  
1 1 1 4  7  17 o 312.3901 7.052759  65.10670       2.935823      63.90427       3.356850      69.01852       6.054654      309.3151 8.151471  320.6671 14.20498  -11.35205      16.37766  
1 1 1 4  7  18 o 452.7296 5.462915  136.6665       3.295618      141.7058       6.465013      134.8972       3.830708      460.5098 10.53554  449.7244 6.392329  10.78540       12.32313  
1 1 1 4  7  19 f 240.0354 6.501447  38.45854       2.077585      43.04999       2.438125      26.28578       3.969861      253.9184 7.213209  197.4555 15.20505  56.46286       16.82926  
1 1 1 4  7  20 o 177.4568 6.262624  21.02978       1.478567      22.08607       1.634946      16.28697       3.464413      181.8304 6.759585  154.8164 17.07682  27.01404       18.36599  
1 1 1 4  7  21 o 278.6039 7.083663  51.82924       2.627642      49.95708       3.769152      53.59948       3.665126      273.1753 10.37334  283.0515 9.731872  -9.876190      14.22376  
1 1 1 4  7  22 o 389.5482 8.201694  101.3591       4.257339      107.6298       5.746656      93.73081       6.338306      400.9093 10.76686  373.7234 12.74634  27.18588       16.68516  
1 1 1 4  7  23 o 169.4135 5.272751  19.16581       1.188857      20.54034       1.535003      17.10532       1.879390      175.2809 6.583757  159.6910 8.866893  15.58994       11.04390  
1 1 1 4  7  24 o 194.9472 5.889494  25.39739       1.528165      28.10301       2.068369      22.14529       2.267655      204.8795 7.589397  181.5848 9.403859  23.29471       12.08435  
1 1 1 4  7  25 o 136.3995 5.098458  12.43773       0.9250392     12.18222       1.084046      13.12213       1.774193      134.8958 6.046175  139.5217 9.601563  -4.625809      11.34664  
1 1 1 4  7  26 o 146.4283 5.603040  14.34864       1.091240      14.41990       1.300151      14.17881       2.007280      146.6577 6.670434  144.7643 10.47662  1.893372       12.41991  
1 1 1 4  7  27 o 163.4207 5.983226  17.89007       1.300715      18.54164       1.825469      17.21810       1.853837      165.9681 8.280375  159.8260 8.737870  6.142059       12.03806  
1 1 1 4  7  28 o 69.61040 7.673899  3.292461       0.7000117     2.444887       0.7955889     6.197944       1.473021      59.30520 10.44912  94.84686 11.91745  -35.54166      15.84960  
1 1 1 4  7  29 o 53.10958 10.89876  1.982961       0.7454254     2.312866       0.8533252     0.9202962      1.531504      57.31438 11.57233  44.91273 17.59344  12.40165       21.05820  
1 1 1 4  7  30 o 124.7456 6.461009  10.48703       1.070327      11.23249       1.181746      7.083672       2.525043      129.0134 6.899192  97.55580 20.09342  31.45760       21.24487  
1 1 1 4  7  31 o 15.75217 7.481249  -0.5187020     0.4253555     -0.7320851     0.4354697     3.915531       1.985122      14.66856 7.118651  71.49002 20.03789  -56.82146      21.26481  
1 1 1 4  7  32 f 61.65894 7.214365  2.615552       0.5815519     2.659913       0.6164058     2.256228       1.754320      62.07807 7.610729  55.49392 19.33542  6.584156       20.77936  
1 1 1 4  7  33 o 96.78407 5.215397  6.344441       0.6701277     7.085705       0.7364439     2.775766       1.615871      102.2295 5.425599  58.88852 18.49035  43.34103       19.26992  
1 1 1 4  7  34 o 53.49092 17.93847  2.334597       1.506907      1.616009       2.377553      2.817077       1.948185      50.36978 21.09341  57.43905 20.34671  -7.069275      29.30735  
1 1 1 4  7  35 o 29.28307 13.76667  -0.9558515     1.373682      -2.112392      2.047786      -0.9627107E-02 1.852257      32.41249 15.65927  38.20098 17.22180  -5.788494      23.27667  
1 1 1 4  7  36 o 21.54755 10.78023  -3.053399      1.297863      0.6166747      2.424930      -4.526775      1.536451      43.29798 19.59471  21.54923 10.90089  21.74875       22.42281  
1 1 1 4  7  37 o 68.10002 19.26743  4.451007       1.826492      2.066625       2.987559      5.874135       2.308078      49.38457 22.09878  75.06760 21.79406  -25.68302      31.03767  
1 1 1 4  8  0  o 315.8018 19.96989  67.40082       8.325592      67.40082       8.325592      67.40082       8.325592      315.8018 19.96989  315.8018 19.96989  0.000000       0.000000  
1 1 1 4  8  1  o 525.7171 8.862756  184.3191       6.208611      0.000000       0.000000      184.3191       6.208611      ?        ?         525.7171 8.862756  0.000000       8.862756  
1 1 1 4  8  2  o 367.3349 9.683980  90.06998       4.735989      93.79771       8.277764      88.25596       5.774468      374.1931 16.64301  363.4366 11.93987  10.75644       20.48293  
1 1 1 4  8  3  o 498.7850 3.338061  165.7802       2.218611      165.4668       2.323279      169.0253       7.475799      498.3097 3.498876  503.2764 11.14750  -4.966675      11.68370  
1 1 1 4  8  4  o 752.1669 8.445913  377.2996       8.465144      383.1405       12.22888      371.9258       11.72976      757.5848 12.11384  746.4532 11.79269  11.13159       16.90600  
1 1 1 4  8  5  o 108.8884 3.931516  7.911639       0.5695104     7.896642       0.9022652     7.921570       0.7342651     108.6581 6.258060  108.9018 5.073877  -0.2436905     8.056521  
1 1 1 4  8  6  o 437.7481 5.549012  127.7301       3.236782      127.4928       5.724234      127.8416       3.924414      437.1252 9.827385  437.8915 6.725658  -0.7663574     11.90848  
1 1 1 4  8  7  o 491.5410 7.594805  161.1286       4.974505      162.1004       7.886445      160.4866       6.410671      492.6723 12.01295  490.4063 9.810112  2.266022       15.50965  
1 1 1 4  8  8  o 371.4395 5.328198  91.96912       2.637193      94.31216       3.100334      85.83678       5.015700      376.1077 6.186183  358.4240 10.51309  17.68372       12.19811  
1 1 1 4  8  9  o 700.4340 12.96531  327.9937       12.10107      337.1641       15.34638      312.9181       19.67661      709.4700 16.23299  681.7202 21.68820  27.74976       27.09037  
1 1 1 4  8  10 o 100.2003 5.144786  6.711031       0.6846259     6.679646       1.023101      6.736480       0.9212962     99.75830 7.757481  100.2579 6.938970  -0.4995575     10.40806  
1 1 1 4  8  11 f 375.1166 7.745562  93.89321       3.871620      101.3856       6.973015      90.55408       4.655082      388.9700 13.47371  368.1242 9.497787  20.84579       16.48481  
1 1 1 4  8  12 o 171.5860 5.785602  19.65619       1.320937      17.58785       2.274111      20.70939       1.622765      161.8803 10.60084  176.0516 6.930931  -14.17122      12.66553  
1 1 1 4  8  13 o 320.6347 8.176963  68.67134       3.490772      68.13348       6.893596      68.85683       4.048159      318.1670 16.31435  320.9272 9.476619  -2.760254      18.86702  
1 1 1 4  8  14 o 367.8404 9.547903  90.44810       4.675991      91.89443       7.101438      89.34105       6.212964      369.9911 14.43162  365.1014 12.79037  4.889740       19.28381  
1 1 1 4  8  15 o 329.3640 10.38322  72.57084       4.551333      70.14046       5.600318      77.29850       7.810853      323.4181 13.02158  338.7219 17.36334  -15.30386      21.70362  
1 1 1 4  8  16 o 35.82442 12.46297  0.7660051      0.7287140     2.146118       0.9825503     -0.9211621     1.086367      55.51714 13.42947  27.28449 12.63044  28.23265       18.43580  
1 1 1 4  8  17 o 239.4023 6.622987  38.25893       2.110757      37.30532       2.535279      40.41304       3.810422      236.2874 8.063962  245.5702 11.67805  -9.282791      14.19170  
1 1 1 4  8  18 o 100.7626 9.267203  6.836556       1.230363      6.290669       1.963067      7.189725       1.578976      95.59096 15.97481  103.0423 11.70698  -7.451378      19.80525  
1 1 1 4  8  19 o 82.38464 12.24726  4.637948       1.303657      4.585928       1.463300      4.838092       2.870257      81.62800 13.95402  83.69882 24.30487  -2.070824      28.02572  
1 1 1 4  8  20 o 192.2445 7.536141  24.70196       1.926789      26.89720       3.263541      23.52732       2.387264      200.1116 12.29834  187.4224 9.590735  12.68916       15.59587  
1 1 1 4  8  21 o 53.39790 17.60887  1.833389       1.453389      -1.433641      4.506252      2.212694       1.535442      61.79154 27.42719  57.56919 18.01685  4.222343       32.81551  
1 1 1 4  8  22 o 385.1629 8.376273  99.13230       4.299013      104.2784       7.576877      96.68909       5.220721      393.6250 14.47018  379.9586 10.32103  13.66641       17.77385  
1 1 1 4  8  23 o 98.75794 7.861117  6.560489       1.025967      1.912990       2.042781      8.128263       1.186462      57.60793 20.78557  109.9581 8.155602  -52.35017      22.32832  
1 1 1 4  8  24 o 123.6832 6.822022  10.25524       1.119984      8.806124       1.458331      12.33892       1.748714      114.2013 9.674157  135.3027 9.764956  -21.10137      13.74568  
1 1 1 4  8  25 o 102.1049 8.250039  7.030611       1.112923      6.796094       1.538743      7.287862       1.611604      99.74210 11.80612  103.3093 11.92564  -3.567223      16.78110  
1 1 1 4  8  26 o 146.6122 7.055079  14.42770       1.374261      15.96423       2.434128      13.70878       1.665007      153.2053 12.01946  142.6076 8.804868  10.59764       14.89943  
1 1 1 4  8  27 o 104.6650 8.760396  7.417295       1.210598      5.789741       1.543762      10.01659       1.950926      91.41242 13.04310  120.9148 12.27851  -29.50239      17.91324  
1 1 1 4  8  28 o 197.5329 7.817689  26.26683       2.053680      25.59364       3.166319      26.75567       2.698206      193.5044 12.34414  198.6447 10.22797  -5.140274      16.03088  
1 1 1 4  8  29 o 169.6385 8.184149  19.44807       1.844541      19.17601       2.462862      19.79561       2.783644      167.4576 11.09992  169.6184 12.40163  -2.160812      16.64358  
1 1 1 4  8  30 o 47.20850 12.26064  1.593617       0.7780610     1.804140       0.9232655     1.077724       1.445295      50.10953 13.51812  44.95462 17.23170  5.154903       21.90139  
1 1 1 4  8  31 o 31.18814 13.31380  0.7348694E-01  0.9776386     -1.547674      1.269910      2.432268       1.531806      26.69733 12.74856  57.29809 18.00462  -30.60076      22.06110  
1 1 1 4  8  32 o 64.09698 6.640274  2.815710       0.5589434     2.681446       0.5828466     4.352640       1.971970      62.39890 7.138070  73.68269 19.70312  -11.28378      20.95626  
1 1 1 4  8  33 o 30.35390 11.67915  0.4912277      0.6656606     0.8456467      0.7306702     -1.238816      1.614327      35.49681 12.47052  31.65249 14.89409  3.844316       19.42544  
1 1 1 4  8  34 o 25.56214 11.64316  -0.3739336     0.8733084     -1.136029      0.9970775     2.136802       1.809775      23.53480 11.25418  51.64231 19.40030  -28.10752      22.42829  
1 1 1 4  8  35 o 16.65076 7.996853  -0.6858245     0.5156347     -0.5157642     0.5378686     -2.616173      1.812144      18.20979 8.577455  28.65641 14.04009  -10.44662      16.45287  
1 1 1 4  8  36 o 47.25673 10.54629  1.697206       0.6472458     1.856396       0.7147266     0.9715963      1.525931      49.13825 11.16961  40.23952 16.87800  8.898724       20.23924  
1 1 1 4  9  0  o 259.0439 15.83630  45.28586       5.419094      45.28586       5.419094      45.28586       5.419094      259.0439 15.83630  259.0439 15.83630  0.000000       0.000000  
1 1 1 4  9  1  o 450.5715 8.567370  135.4019       5.143809      142.6878       9.642710      132.5041       6.081318      461.7034 15.69620  445.6241 10.24131  16.07932       18.74180  
1 1 1 4  9  2  o 35.37647 12.14126  0.7596359      0.6906576     1.603558       1.178371      0.3180179      0.8524217     49.54112 15.81945  32.31018 12.97334  17.23094       20.45880  
1 1 1 4  9  3  o 195.4709 6.084756  25.49575       1.582958      25.96315       1.746979      23.35142       3.741884      197.2270 6.656877  186.2777 15.20717  10.94933       16.60036  
1 1 1 4  9  4  f 692.6097 2.770482  319.6486       2.556921      319.3057       11.33123      319.6670       2.624616      691.4628 12.29800  692.6274 2.843757  -1.164612      12.62251  
1 1 1 4  9  5  o 449.2162 5.984945  134.5279       3.582524      136.5826       5.094934      132.5185       5.038447      452.5004 8.449794  445.7154 8.483315  6.785004       11.97354  
1 1 1 4  9  6  o 874.9776 10.44265  511.0693       12.17534      512.5634       19.04188      510.0362       15.83525      875.0306 16.33101  873.5027 13.60464  1.527832       21.25531  
1 1 1 4  9  7  o 587.4771 7.280877  230.1839       5.699649      232.5401       7.870609      227.5858       8.264881      590.2047 10.00765  583.8111 10.62407  6.393555       14.59534  
1 1 1 4  9  8  o 430.8404 7.233480  123.8152       4.152764      123.9787       5.216733      123.5326       6.861407      430.9822 9.083762  429.7522 11.99351  1.229980       15.04523  
1 1 1 4  9  9  o 226.4249 0.8001009 34.15848       0.2414029     34.15700       0.2422672     34.36452       2.860411      226.4200 0.8029831 226.6684 9.491307  -0.2483978     9.525214  
1 1 1 4  9  10 o 284.4155 6.694054  53.95753       2.536974      54.18915       3.096874      53.48495       4.423662      284.8285 8.167991  282.5835 11.77373  2.245056       14.32958  
1 1 1 4  9  11 o 200.1727 1.985866  26.69934       0.5296981     26.79786       0.5600452     25.86352       1.631289      200.5405 2.095789  196.8222 6.227736  3.718323       6.570923  
1 1 1 4  9  12 o 293.7224 5.567474  57.53096       2.179058      57.32344       4.084176      57.61354       2.576398      292.6766 10.48928  293.8817 6.579108  -1.205078      12.38183  
1 1 1 4  9  13 o 290.1802 8.160624  56.25382       3.152341      54.82960       5.397136      56.99126       3.883635      285.6922 14.22195  291.8810 10.00002  -6.188843      17.38575  
1 1 1 4  9  14 o 229.6427 5.281603  35.16359       1.616188      33.45895       3.153394      35.77088       1.882193      223.4886 10.61924  231.5062 6.106712  -8.017563      12.24990  
1 1 1 4  9  15 o 164.2173 7.309721  18.02883       1.595525      19.25262       2.417224      17.08399       2.123944      169.3847 10.76521  159.5988 10.03795  9.785843       14.71904  
1 1 1 4  9  16 o 557.3143 9.805744  207.4622       7.282061      196.6277       11.34574      215.0521       9.496130      541.2673 15.74742  566.9585 12.56961  -25.69116      20.14886  
1 1 1 4  9  17 o 375.2951 8.954737  94.03337       4.478157      96.78818       7.010149      92.13416       5.820594      379.9585 13.86905  371.0218 11.78816  8.936768       18.20196  
1 1 1 4  9  18 o 427.0481 9.896966  121.8159       5.631868      121.1358       5.970998      127.2985       16.95251      425.7834 10.52409  431.2380 29.68251  -5.454559      31.49298  
1 1 1 4  9  19 o 133.1295 13.91509  11.99947       2.432090      13.08673       3.224861      10.56543       3.703611      138.4139 17.90369  123.0222 23.44846  15.39171       29.50208  
1 1 1 4  9  20 o 377.7925 5.196807  95.17526       2.616155      88.71211       3.342875      105.3900       4.202542      364.6214 6.880256  397.3215 7.937733  -32.70013      10.50455  
1 1 1 4  9  21 o 129.5211 11.02848  11.30941       1.885313      6.801093       4.855671      12.10970       2.045816      99.92360 32.13336  133.9810 11.57241  -34.05740      34.15367  
1 1 1 4  9  22 o 280.2266 7.767889  52.51117       2.897789      53.49741       6.695806      52.28387       3.214404      280.6348 18.00047  279.4977 8.641131  1.137085       19.96712  
1 1 1 4  9  23 o 278.9374 7.961284  52.08295       2.956098      47.89380       5.433222      53.84448       3.523215      265.7529 15.40893  283.3704 9.343408  -17.61749      18.02039  
1 1 1 4  9  24 o 144.5901 6.901284  14.01127       1.325826      15.10316       4.448239      13.90481       1.388957      145.8293 23.70459  143.9931 7.262362  1.836197       24.79212  
1 1 1 4  9  25 o 130.9244 8.815493  11.55418       1.528979      11.12074       2.641193      11.77265       1.875127      126.7636 15.99137  131.7908 10.77144  -5.027153      19.28076  
1 1 1 4  9  26 o 26.31752 11.37453  -0.7817965E-01 0.7303960     1.474918       2.456884      -0.2287473     0.7649819     56.74121 22.26669  25.72291 11.36476  31.01831       24.99926  
1 1 1 4  9  27 o 77.15762 13.31087  4.165853       1.319114      6.162148       2.593041      3.468859       1.532186      91.71239 21.58041  69.55273 16.73586  22.15966       27.30940  
1 1 1 4  9  28 o 56.70230 10.70992  2.249135       0.7795582     5.482802       1.274337      0.3153705      0.9854583     89.24476 10.94474  33.78614 13.80853  55.45862       17.61995  
1 1 1 4  9  29 o 143.2689 9.318088  13.97040       1.769252      14.19482       2.314515      13.65492       2.744204      143.3423 12.23431  139.3339 15.01728  4.008438       19.37000  
1 1 1 4  9  30 o 69.99398 12.87873  3.501276       1.156929      -3.815250      3.239395      4.570948       1.238616      41.62191 20.00374  80.56688 11.89461  -38.94497      23.27298  
1 1 1 4  9  31 o 40.51736 14.03487  1.092556       0.9236538     3.728966       2.594952      0.7100781      0.9883854     68.52061 23.53346  36.87209 14.21980  31.64852       27.49593  
1 1 1 4  9  32 o 26.91297 12.00432  -0.2359816     0.8740731     -2.385319      2.842309      -0.1148876E-01 0.9185870     40.14464 19.14298  29.25451 12.69956  10.89013       22.97243  
1 1 1 4  9  33 o 38.91740 9.174558  1.099915       0.4679610     1.319147       0.4895424     -1.223384      1.593640      42.77185 8.880189  31.27988 14.74330  11.49197       17.21112  
1 1 1 4  9  34 o 65.80965 8.356140  3.070734       0.7162733     3.198528       0.7591466     2.034245       2.161987      67.01570 8.706742  51.29103 20.63790  15.72467       22.39934  
1 1 1 4  9  35 o 33.14586 12.54568  0.7026139      0.7600307     0.6310461      0.8080411     1.251749       2.238279      32.75113 12.79398  45.81309 19.85606  -13.06195      23.62095  
1 1 1 4  9  36 o 45.16230 12.86947  1.635775       0.8119548     1.695103       0.8834001     1.312859       2.060972      45.65377 13.54592  44.32077 19.13107  1.333004       23.44120  
1 1 1 4  10 0  o 121.2456 7.280768  9.904243       1.166487      9.904243       1.166487      9.904243       1.166487      121.2456 7.280768  121.2456 7.280768  0.000000       0.000000  
1 1 1 4  10 1  o 277.4899 8.701725  51.41922       3.213578      0.000000       0.000000      51.41922       3.213578      ?        ?         277.4899 8.701725  0.000000       8.701725  
1 1 1 4  10 2  o 251.4225 3.997755  42.12821       1.339349      40.08947       3.243034      42.54745       1.470626      244.8843 9.959194  252.6636 4.368033  -7.779312      10.87498  
1 1 1 4  10 3  o 277.2408 4.417544  51.22844       1.631968      51.24362       1.838528      51.17205       3.543748      277.2688 4.976176  276.7390 9.624553  0.5297852      10.83487  
1 1 1 4  10 4  o 544.5214 8.126866  197.7964       5.896735      208.4365       8.740851      188.9094       7.988346      558.5945 11.74312  531.8402 11.27203  26.75427       16.27758  
1 1 1 4  10 5  f 317.6488 4.291248  67.25131       1.816370      68.19350       2.398154      65.98357       2.781804      319.8231 5.627217  314.5586 6.636688  5.264496       8.701218  
1 1 1 4  10 6  o 368.1220 6.779840  90.37951       3.325713      88.12696       5.407468      91.74989       4.217719      363.0155 11.19217  370.7917 8.536388  -7.776154      14.07603  
1 1 1 4  10 7  o 505.2769 7.283613  170.3105       4.903993      166.8933       7.315452      173.0995       6.608842      499.7871 10.98456  509.1483 9.741089  -9.361206      14.68160  
1 1 1 4  10 8  o 148.0967 4.225713  14.63121       0.8330567     14.57708       1.147530      14.69153       1.211295      147.7375 5.840584  148.2984 6.143012  -0.5608521     8.476379  
1 1 1 4  10 9  o 296.9118 4.952354  58.77397       1.959353      57.75150       2.538594      60.28059       3.081551      294.2491 6.474474  300.4545 7.703276  -6.205414      10.06277  
1 1 1 4  10 10 o 68.94055 1.618624  3.166827       0.1486943     3.209337       0.1514490     2.030055       0.7831816     69.40165 1.637657  54.11126 11.22995  15.29039       11.34873  
1 1 1 4  10 11 o 66.06944 7.614312  2.951599       0.6581085     3.889260       0.9071346     1.909727       0.9562157     75.76372 9.171895  52.42762 13.57992  23.33610       16.38713  
1 1 1 4  10 12 o 395.5700 8.766894  104.4808       4.621071      101.5758       7.725085      106.0995       5.766579      388.9474 14.93298  398.2420 10.87688  -9.294617      18.47432  
1 1 1 4  10 13 o 145.2664 1.061462  14.06008       0.2054676     17.14901       2.779036      14.04311       0.2060315     159.5082 13.19276  145.1787 1.065019  14.32947       13.23568  
1 1 1 4  10 14 o 523.2566 10.47470  182.9583       7.303479      189.1130       11.64635      178.9692       9.376236      530.5817 16.49270  516.8181 13.62688  13.76367       21.39394  
1 1 1 4  10 15 o 434.6779 7.650683  126.0780       4.431404      125.9416       5.831483      126.2645       6.817250      434.2000 10.07896  434.3878 11.78854  -0.1878052     15.50984  
1 1 1 4  10 16 o 156.7181 7.233582  16.42023       1.506514      15.14804       3.387346      16.73392       1.682023      149.2328 17.35776  158.1505 8.007621  -8.917664      19.11580  
1 1 1 4  10 17 o 212.0427 5.918464  30.00668       1.670632      31.07166       3.281316      29.63401       1.941046      215.2870 11.47968  210.6555 6.924366  4.631516       13.40634  
1 1 1 4  10 18 o 314.3839 9.009806  66.05080       3.770519      66.39685       4.757701      65.46643       6.182588      314.9279 11.35597  312.1706 14.90601  2.757263       18.73892  
1 1 1 4  10 19 o 284.6979 8.797367  54.18108       3.333413      57.38422       4.631999      50.74017       4.800849      292.6064 11.90471  274.9326 13.14249  17.67374       17.73266  
1 1 1 4  10 20 o 182.4889 8.215551  22.28692       1.992653      23.77537       3.404717      21.51146       2.457505      187.7774 13.70135  179.0434 10.34465  8.733994       17.16795  
1 1 1 4  10 21 o 86.44968 9.763345  5.063253       1.105042      6.587053       5.534120      4.999974       1.127753      100.1818 34.36865  85.85858 10.04704  14.32324       35.80709  
1 1 1 4  10 22 o 94.34692 9.844150  6.026554       1.219411      7.104117       3.494072      5.877108       1.301226      99.56062 26.04396  93.02216 10.69185  6.538460       28.15321  
1 1 1 4  10 23 o 241.8637 6.530292  39.11987       2.102709      34.28290       5.933352      39.81460       2.248650      222.8329 20.20166  243.9474 6.924554  -21.11449      21.35548  
1 1 1 4  10 24 o 88.94154 8.436345  5.349382       0.9878903     5.402195       4.007941      5.345966       1.019340      88.09669 29.24892  88.86816 8.720093  -0.7714615     30.52113  
1 1 1 4  10 25 o 93.17112 10.32553  5.916702       1.260444      0.2578814      2.613894      7.631186       1.438771      51.45555 21.86105  105.9530 10.32140  -54.49746      24.17513  
1 1 1 4  10 26 o 193.1037 8.475465  25.10867       2.175547      23.38605       3.428783      26.26950       2.814688      184.6503 14.04056  196.8962 10.76902  -12.24585      17.69489  
1 1 1 4  10 27 f 208.8740 8.840577  29.44473       2.455022      30.04828       3.712363      28.97562       3.272870      209.2990 13.38106  206.1074 11.96834  3.191635       17.95255  
1 1 1 4  10 28 o 111.8607 13.65725  8.726321       1.993543      10.20563       2.580526      6.536642       3.139567      119.9009 16.59596  92.39966 24.92856  27.50121       29.94761  
1 1 1 4  10 29 o 74.28645 11.86225  3.879791       1.134749      3.207618       3.072968      3.985919       1.221049      68.45225 25.36568  75.06113 12.65777  -6.608879      28.34849  
1 1 1 4  10 30 o 62.83239 12.79375  2.848003       1.034717      0.4378281E-01  2.503790      3.425555       1.136286      47.24822 20.72893  69.04903 12.82160  -21.80082      24.37380  
1 1 1 4  10 31 o 26.67567 11.39690  0.4474070E-01  0.7174484     1.883437       1.218091      -0.9319599     0.8877803     50.47739 16.08005  23.11130 10.92666  27.36609       19.44119  
1 1 1 4  10 32 o 69.76569 9.266203  3.440302       0.8401439     2.520912       1.110551      4.670569       1.284660      57.33911 14.52182  79.77385 12.49510  -22.43474      19.15753  
1 1 1 4  10 33 o 40.44100 14.21283  1.175005       0.9491647     1.276018       1.320349      1.066977       1.365429      43.22464 16.49437  41.71587 16.52847  1.508766       23.35069  
1 1 1 4  10 34 o 51.35011 13.44247  2.070138       0.9303952     2.683917       1.344928      1.506832       1.288444      56.58683 16.69458  44.56849 16.44109  12.01834       23.43114  
1 1 1 4  10 35 o ?        ?         -1.950649      0.1948892     -1.977462      0.1957547     1.061382       2.074783      ?        ?         43.69122 19.02497  0.000000       19.02497  
1 1 1 4  11 0  o 304.8917 12.98988  62.38311       5.255605      62.38311       5.255605      62.38311       5.255605      304.8917 12.98988  304.8917 12.98988  0.000000       0.000000  
1 1 1 4  11 1  o 206.8964 6.297289  28.57094       1.734101      29.68331       2.349726      27.24045       2.569801      210.7469 8.383974  201.7744 9.585249  8.972519       12.73452  
1 1 1 4  11 2  o 461.2375 6.955282  141.8923       4.274772      142.0917       5.116024      141.4311       7.780924      461.4549 8.320124  459.7367 12.71352  1.718201       15.19401  
1 1 1 4  11 3  o 505.9208 8.377941  170.8041       5.647983      176.4733       7.416128      162.9750       8.715087      513.9751 10.82833  493.4241 13.26698  20.55103       17.12500  
1 1 1 4  11 4  o 473.7572 5.563392  149.6469       3.512118      150.6233       4.190013      147.3401       6.440175      475.2295 6.616654  469.6829 10.29009  5.546631       12.23381  
1 1 1 4  11 5  o 349.8040 5.914499  81.59428       2.756870      87.04538       3.780513      75.40322       4.028940      361.1834 7.855058  335.9644 9.007745  25.21909       11.95163  
1 1 1 4  11 6  o 179.8824 4.904225  21.58775       1.174430      22.09460       1.514375      20.82291       1.860273      181.9073 6.256863  176.4686 7.931349  5.438766       10.10221  
1 1 1 4  11 7  o 239.1430 5.816497  38.13742       1.853501      40.30187       2.495041      35.47200       2.768768      245.6376 7.631970  230.3116 9.039437  15.32596       11.83040  
1 1 1 4  11 8  o 438.0035 6.916731  127.9864       4.036937      128.0617       5.031805      127.8504       6.762693      437.9746 8.621866  437.1004 11.62119  0.8742065      14.47026  
1 1 1 4  11 9  o 367.5973 5.510624  90.10690       2.699272      89.02037       3.352945      92.10793       4.550253      365.2868 6.888408  371.3745 9.194962  -6.087738      11.48902  
1 1 1 4  11 10 o 159.4727 5.477808  16.97834       1.162309      17.57842       1.796936      16.54668       1.524068      162.0574 8.349433  157.3056 7.290706  4.751831       11.08456  
1 1 1 4  11 11 o 474.1340 8.221533  150.0605       5.194305      151.7722       6.214834      146.0941       9.460583      476.6432 9.785040  466.5109 15.23933  10.13229       18.11033  
1 1 1 4  11 12 o 489.8433 7.907191  160.1408       5.161227      171.7833       6.972001      146.0249       7.676973      507.0320 10.31926  467.0206 12.34700  40.01138       16.09148  
1 1 1 4  11 13 o 686.3475 12.59511  315.1694       11.51913      324.7968       15.23305      302.3120       17.60396      695.7353 16.43120  669.8912 19.74270  25.84406       25.68577  
1 1 1 4  11 14 o 476.3155 7.572102  151.3808       4.806010      157.4090       9.183864      149.1075       5.639915      484.5998 14.23770  472.5870 8.956066  12.01279       16.82032  
1 1 1 4  11 15 f 214.7361 1.077706  30.72319       0.3083749     34.24814       2.980683      30.68505       0.3100386     226.2287 9.911738  214.6027 1.084194  11.62599       9.970860  
1 1 1 4  11 16 o 534.1153 10.26803  190.5796       7.307951      187.4017       11.21812      192.9225       9.632216      528.4103 15.95045  536.7031 13.47915  -8.292725      20.88311  
1 1 1 4  11 17 o 142.2621 8.185135  13.55279       1.545081      12.59687       2.754113      13.99182       1.866468      136.2116 15.44615  144.4045 9.757165  -8.192947      18.26981  
1 1 1 4  11 18 o 161.2785 7.817577  17.40212       1.675046      14.72952       2.700584      19.07318       2.135444      147.6211 13.89222  168.6994 9.538366  -21.07832      16.85153  
1 1 1 4  11 19 o 56.87626 11.76101  2.245201       0.8619013     2.216084       1.845308      2.253325       0.9747627     59.10387 19.85106  56.85946 13.13046  2.244411       23.80070  
1 1 1 4  11 20 o 102.3253 8.754619  7.049418       1.182239      6.600593       3.037456      7.129552       1.283445      96.51051 23.77649  102.8185 9.474152  -6.308037      25.59455  
1 1 1 4  11 21 o 92.91558 10.07480  5.849693       1.227442      0.6471754      2.663680      7.252228       1.383032      54.53381 22.53864  103.5599 10.15261  -49.02608      24.71975  
1 1 1 4  11 22 o 136.2851 9.116163  12.49755       1.645998      7.877890       3.011763      14.46505       1.965502      105.1923 22.18578  146.5064 10.13038  -41.31412      24.38921  
1 1 1 4  11 23 o 140.5442 7.499024  13.25700       1.399317      17.12663       4.016940      12.72257       1.492823      156.8072 19.65516  137.5776 8.179976  19.22961       21.28937  
1 1 1 4  11 24 o 106.7232 8.283685  7.683985       1.168811      11.89960       3.431346      7.130657       1.243154      129.6270 20.55003  102.6342 9.186964  26.99275       22.51009  
1 1 1 4  11 25 o 133.7635 8.843575  12.07920       1.567456      8.338354       2.755957      13.86789       1.905700      107.9450 19.89279  143.1026 10.05792  -35.15764      22.29091  
1 1 1 4  11 26 o 59.90553 15.25808  2.557771       1.221142      0.8702524      2.577497      3.046175       1.386639      53.90351 22.21396  65.25038 16.05856  -11.34687      27.41053  
1 1 1 4  11 27 o 154.9402 8.412201  16.22286       1.730275      13.79350       2.750364      17.81413       2.225955      140.6908 14.89674  161.8015 10.37903  -21.11073      18.15591  
1 1 1 4  11 28 o 84.49277 16.92090  5.186482       1.838610      5.609354       2.770284      4.853571       2.458010      85.51240 23.56059  80.02315 22.24876  5.489250       32.40538  
1 1 1 4  11 29 o 98.47816 9.905921  6.691358       1.282255      7.901663       2.618080      6.309420       1.470725      102.3137 19.92006  94.88720 11.89238  7.426460       23.19995  
1 1 1 4  11 30 o 67.87408 15.31671  3.432684       1.352285      1.069484       2.769851      4.172240       1.549501      53.29911 22.56803  74.64963 16.05441  -21.35052      27.69585  
1 1 1 4  11 31 o 48.76847 15.68309  1.771270       1.156644      -0.2270001     2.266019      2.475332       1.345061      42.65088 19.15328  56.55852 16.69779  -13.90765      25.40993  
1 1 1 4  11 32 o 70.94715 14.52398  3.870008       1.326802      0.7667319E-01  2.557861      5.266380       1.551912      44.83746 20.22361  83.03294 14.55672  -38.19548      24.91771  
1 1 1 4  11 33 o 30.17553 13.67761  -0.3360284     1.187118      1.403321       2.713953      -0.7475551     1.320104      49.99697 21.76503  29.73547 13.81939  20.26150       25.78162  
1 1 1 4  11 34 o 24.13715 11.17420  -0.5062808     0.8505006     5.931435       1.529516      -3.387801      1.023290      87.34013 13.58351  17.27531 8.756317  70.06482       16.16121  
1 1 1 4  11 35 o 16.34478 8.133777  -1.602976      0.6974725     -3.140482      1.145470      -0.6970683     0.8792596     19.33539 9.735258  23.33471 10.98383  -3.999321      14.67719  
1 1 1 4  12 0  o 756.7300 13.14929  382.7004       13.25016      382.7004       13.25016      382.7004       13.25016      756.7300 13.14929  756.7300 13.14929  0.000000       0.000000  
1 1 1 4  12 1  o 421.1233 6.152534  118.2706       3.452525      118.6379       5.012007      117.9389       4.762738      421.5550 8.922446  420.3499 8.503001  1.205078       12.32522  
1 1 1 4  12 2  o 353.9674 5.706120  83.54717       2.691396      85.01423       3.449999      81.26620       4.301857      356.9702 7.252930  348.7423 9.265368  8.227844       11.76656  
1 1 1 4  12 3  o 728.7471 9.673181  354.6987       9.393332      325.4247       20.82281      362.1779       10.52510      693.9273 22.54908  736.1832 10.72919  -42.25586      24.97151  
1 1 1 4  12 4  o 410.3745 4.682338  112.2682       2.560452      112.7515       2.742708      108.9900       7.143130      411.2399 5.005078  403.2940 13.31032  7.945862       14.22025  
1 1 1 4  12 5  o 30.99730 11.51743  0.4901686      0.6343327     0.4230081      0.8083351     0.5978216      1.023405      32.70707 12.79062  37.38268 14.45540  -4.675606      19.30178  
1 1 1 4  12 6  o 560.8515 3.414383  209.6417       2.551723      209.3675       2.700202      211.9311       7.802592      560.4738 3.615491  563.1641 10.39754  -2.690247      11.00820  
1 1 1 4  12 7  o 359.6948 6.689410  86.30857       3.206236      86.70388       3.749813      85.23383       6.182915      360.4362 7.807423  356.5923 13.03404  3.843933       15.19349  
1 1 1 4  12 8  o 68.48286 7.494059  3.166847       0.6727158     3.457559       0.7587084     2.098044       1.454762      71.51780 8.104026  56.11759 17.53332  15.40021       19.31561  
1 1 1 4  12 9  o 39.31280 8.493671  1.071621       0.4319267     1.921471       0.5390729     -0.4523135     0.7218709     53.08750 7.857438  23.33486 10.61191  29.75264       13.20424  
1 1 1 4  12 10 o 623.4397 7.225910  259.3308       6.002892      260.4069       7.935188      257.8911       9.178665      624.4004 9.537192  621.1047 11.09025  3.295715       14.62709  
1 1 1 4  12 11 o 56.90085 6.318508  2.185952       0.4710109     2.463730       0.5372034     1.262536       0.9794651     60.39383 6.792987  44.26683 14.44777  16.12700       15.96505  
1 1 1 4  12 12 o 482.0218 8.866769  155.1157       5.695156      157.1363       7.128792      151.5510       9.468718      484.8824 11.03331  475.3318 14.96795  9.550629       18.59499  
1 1 1 4  12 13 o 229.0011 5.462760  34.96586       1.666953      39.38106       3.730744      33.86452       1.863295      242.4389 11.58183  225.2556 6.213661  17.18335       13.14338  
1 1 1 4  12 14 o 147.2811 4.152474  14.47001       0.8141299     14.73805       2.996066      14.44864       0.8459612     147.4958 15.47409  147.1649 4.318598  0.3309326      16.06542  
1 1 1 4  12 15 o 274.7190 4.773389  50.31194       1.747387      40.79098       4.238265      52.26176       1.917985      246.5774 12.94449  279.9788 5.140986  -33.40138      13.92801  
1 1 1 4  12 16 o 208.9975 1.134112  29.10320       0.3158426     31.49798       2.927013      29.07499       0.3176976     216.8943 10.15572  208.8961 1.141327  7.998123       10.21965  
1 1 1 4  12 17 o 460.8339 8.518916  141.7976       5.231211      140.1606       6.752921      144.2540       8.272270      457.8268 11.06922  463.8829 13.39670  -6.056091      17.37813  
1 1 1 4  12 18 o 246.7132 6.160102  40.60649       2.025134      46.14636       4.559067      39.24471       2.260376      262.0823 13.09613  242.3940 7.005532  19.68837       14.85214  
1 1 1 4  12 19 o 258.0562 7.519779  44.51030       2.583030      42.94222       3.967749      45.66368       3.402876      252.8705 11.80792  261.0927 9.798264  -8.222168      15.34382  
1 1 1 4  12 20 o 432.2558 7.020291  124.8032       4.043612      120.3557       5.982899      128.5432       5.486372      423.7993 10.59444  438.2462 9.394929  -14.44690      14.16004  
1 1 1 4  12 21 o 169.7283 7.922297  19.31124       1.786813      16.36734       3.452398      20.38832       2.088255      154.4313 17.06101  174.2523 9.024300  -19.82109      19.30068  
1 1 1 4  12 22 o 209.0883 10.01635  29.41820       2.782581      27.47842       4.343425      30.76854       3.623909      200.3867 16.40995  213.1826 12.81628  -12.79591      20.82171  
1 1 1 4  12 23 o 48.64839 14.47357  1.629886       1.007453      2.583897       3.231569      1.527184       1.060294      68.48512 25.88111  47.61202 14.98198  20.87310       29.90471  
1 1 1 4  12 24 o 184.3297 7.284694  22.80413       1.785764      22.31163       4.548052      22.89390       1.941701      178.4231 19.44358  184.5719 7.913219  -6.148849      20.99219  
1 1 1 4  12 25 o 288.8224 7.968328  56.06582       3.063772      52.93084       5.247505      57.68719       3.773772      277.9973 14.21289  292.3623 9.700238  -14.36499      17.20758  
1 1 1 4  12 26 o 46.21320 15.78534  1.376881       1.167136      -0.3589120     2.841847      1.729063       1.280075      50.10768 22.03044  50.59966 16.51686  -0.4919815     27.53447  
1 1 1 4  12 27 o 63.89216 21.33180  2.872039       2.131241      1.725918       3.199917      3.785791       2.857180      61.74233 25.01311  72.52286 24.69958  -10.78053      35.15288  
1 1 1 4  12 28 o 96.90514 12.41190  6.579957       1.565974      7.945193       2.970144      6.054336       1.842935      101.6055 22.52863  91.60307 15.66052  10.00238       27.43704  
1 1 1 4  12 29 o 118.0581 10.74971  9.692801       1.672561      7.737697       2.820502      10.75321       2.077194      99.08681 21.94119  123.3369 12.82605  -24.25006      25.41502  
1 1 1 4  12 30 o 51.32862 16.88558  1.947796       1.336737      0.7285262      3.127712      2.220275       1.478577      53.03847 23.22144  54.31366 17.75278  -1.275192      29.23006  
1 1 1 4  12 31 o 77.97725 13.40010  4.528467       1.342187      -0.3042769     2.698743      6.116652       1.547088      44.91238 20.46105  91.03533 13.13285  -46.12295      24.31309  
1 1 1 4  12 32 f 30.41280 13.85802  -0.4379699     1.238715      -0.6017357     2.717451      -0.3950161     1.391716      42.89612 19.89852  32.46398 14.75220  10.43214       24.77051  
1 1 1 4  12 33 o 23.71581 11.44294  -1.388886      1.084920      -0.5337252     2.905926      -1.527391      1.169484      43.28043 20.24308  24.40943 11.80280  18.87100       23.43263  
1 1 1 4  12 34 o 20.05365 9.916677  -1.921784      0.9760488     -3.332197      2.172604      -1.565143      1.092505      30.06223 14.85298  22.94759 11.16818  7.114641       18.58331  
1 1 1 4  13 0  o 347.2896 8.432128  80.57706       3.896940      80.57706       3.896940      80.57706       3.896940      347.2896 8.432128  347.2896 8.432128  0.000000       0.000000  
1 1 1 4  13 1  o 392.5458 5.893762  102.7626       3.082879      101.7903       4.397841      103.7020       4.322826      390.4894 8.451945  394.1591 8.230433  -3.669678      11.79726  
1 1 1 4  13 2  o 447.7278 6.026855  133.6916       3.595658      129.6874       4.558007      140.2891       5.850738      440.8278 7.759478  458.2942 9.580601  -17.46643      12.32872  
1 1 1 4  13 3  o 376.3075 5.713953  94.43221       2.865187      98.46940       5.090257      92.55991       3.466480      383.7872 9.961919  372.4755 6.984213  11.31168       12.16631  
1 1 1 4  13 4  o 528.7473 7.982488  186.5969       5.624189      179.2778       7.882042      194.1888       8.027562      517.7966 11.42368  538.9410 11.17812  -21.14447      15.98283  
1 1 1 4  13 5  o 633.7588 9.883011  268.3239       8.346161      258.4997       11.37765      279.7690       12.28049      621.2701 13.74354  646.1953 14.26193  -24.92517      19.80626  
1 1 1 4  13 6  o 611.2468 7.651017  249.3291       6.231740      248.6774       10.90650      249.6450       7.593324      609.4323 13.43032  611.3969 9.320413  -1.964600      16.34759  
1 1 1 4  13 7  o 295.2036 5.364545  58.10685       2.110222      57.49092       2.995516      58.71365       2.973219      293.4154 7.668097  296.5331 7.530636  -3.117767      10.74757  
1 1 1 4  13 8  o 363.6856 6.508470  88.22473       3.154122      92.63683       4.150777      82.19576       4.852085      372.5307 8.361687  350.5768 10.39805  21.95383       13.34306  
1 1 1 4  13 9  o 373.4905 6.803801  93.05241       3.386138      91.88125       4.480835      94.61170       5.170264      370.9590 9.064829  376.1704 10.32441  -5.211456      13.73916  
1 1 1 4  13 10 o 642.2170 3.660116  274.8882       3.132205      268.0329       8.601016      275.9364       3.363139      633.4245 10.19017  643.4237 3.922602  -9.999207      10.91908  
1 1 1 4  13 11 o 637.1074 8.221701  270.8959       6.979877      277.3761       9.968544      264.6632       9.776338      644.1417 11.61386  629.1987 11.66044  14.94299       16.45745  
1 1 1 4  13 12 o 373.9172 7.655815  93.28674       3.814525      94.67335       6.566406      92.58047       4.686355      375.9354 13.12829  372.2392 9.455647  3.696167       16.17904  
1 1 1 4  13 13 o 442.4387 8.534876  130.6566       5.031805      127.8289       6.350881      135.4250       8.247087      437.3771 10.89694  449.5824 13.78259  -12.20532      17.56995  
1 1 1 4  13 14 o 295.3535 8.787247  58.28582       3.454500      57.21956       4.700486      59.53808       5.094012      292.2644 12.09576  298.0337 12.85713  -5.769287      17.65256  
1 1 1 4  13 15 o 318.6406 5.980280  67.71207       2.539195      69.26006       4.185585      66.81061       3.194088      321.8553 9.770689  316.4198 7.575472  5.435486       12.36342  
1 1 1 4  13 16 o 175.9555 2.634460  20.63194       0.6176863     21.42753       3.003159      20.59680       0.6311812     178.4534 12.71256  175.8047 2.694326  2.648758       12.99495  
1 1 1 4  13 17 o 203.2035 5.642017  27.56281       1.526225      28.15879       2.465434      27.19252       1.943364      205.0909 9.043631  201.7095 7.242019  3.381378       11.58594  
1 1 1 4  13 18 o 239.3257 6.206636  38.24821       1.977664      41.81783       3.831570      36.95187       2.309011      249.5717 11.55281  235.1207 7.379036  14.45110       13.70830  
1 1 1 4  13 19 f 99.26731 8.663591  6.640041       1.134511      6.276495       2.871330      6.707296       1.235002      93.96823 23.09746  99.67244 9.410014  -5.704208      24.94075  
1 1 1 4  13 20 o 292.2635 6.758301  57.07298       2.631999      50.87764       4.990223      59.46062       3.097935      274.4072 13.69067  298.0717 7.806421  -23.66449      15.75991  
1 1 1 4  13 21 o 87.44987 8.879455  5.177155       1.020380      3.801038       3.218135      5.330966       1.075895      76.24088 26.20656  88.69553 9.238459  -12.45465      27.78728  
1 1 1 4  13 22 o 320.5024 8.539471  68.93460       3.643751      74.36992       7.601882      67.31335       4.151766      329.2462 17.38879  316.3293 9.861679  12.91690       19.99057  
1 1 1 4  13 23 o 108.4869 10.66826  8.009341       1.522285      10.25679       3.464211      7.471500       1.694673      119.1859 22.64012  104.3476 12.43213  14.83830       25.82892  
1 1 1 4  13 24 o 89.35430 8.796470  5.419904       1.033798      3.561251       2.627561      5.760315       1.124489      71.65154 23.67854  92.04718 9.295142  -20.39565      25.43762  
1 1 1 4  13 25 o 84.70950 9.010429  4.888494       1.001483      8.393428       3.440754      4.564076       1.046806      105.8142 24.83210  81.64665 9.818560  24.16753       26.70276  
1 1 1 4  13 26 o 143.4317 9.956223  14.00660       1.891077      9.263841       3.644503      15.75403       2.212188      110.0561 25.37104  151.8023 11.01115  -41.74625      27.65746  
1 1 1 4  13 27 o 66.94066 21.09009  3.305573       2.100474      1.639847       3.250149      4.500273       2.752522      60.93856 25.01098  76.77484 24.13644  -15.83628      34.75797  
1 1 1 4  13 28 o 102.2482 11.88817  7.329874       1.589569      1.777089       2.901019      9.712274       1.900214      58.58656 23.78638  117.6710 12.30027  -59.08442      26.77851  
1 1 1 4  13 29 o 64.07582 17.61796  3.156300       1.550849      2.925282       2.640231      3.277996       1.916276      62.76028 23.46227  64.66875 20.11056  -1.908478      30.90166  
1 1 1 4  13 30 o 24.15965 11.58984  -1.361104      1.076083      3.316164       3.030781      -2.035778      1.151079      63.77783 24.81693  22.88008 11.20581  40.89775       27.22958  
1 1 1 4  13 31 o ?        ?         -7.015903      0.9698839     -5.621461      2.831859      -7.201206      1.032317      32.56119 16.23352  ?        ?         0.000000       16.23352  
1 1 1 4  13 32 o 38.50909 16.30649  0.5844610      1.446203      1.290360       3.378291      0.4260729      1.600247      51.86241 23.33004  38.77184 16.79678  13.09056       28.74756  
1 1 1 4  13 33 o 26.67834 12.79299  -1.365219      1.308173      0.3433279      3.996256      -1.570277      1.384452      49.22282 23.24489  26.88932 12.96223  22.33350       26.61474  
1 1 1 4  13 34 o 24.96894 12.02731  -1.338190      1.186544      -3.989117      3.203877      -0.9168025     1.277373      35.86768 17.77772  27.78371 13.12699  8.083977       22.09898  
1 1 1 4  14 0  o 785.5690 14.61105  412.7690       15.28271      412.7690       15.28271      412.7690       15.28271      785.5690 14.61105  785.5690 14.61105  0.000000       0.000000  
1 1 1 4  14 1  o 293.0168 8.858774  57.37736       3.454940      58.74665       4.357183      55.05846       5.670224      296.2485 11.05704  286.2293 14.91812  10.01920       18.56902  
1 1 1 4  14 2  o 271.2555 4.875278  49.05448       1.762185      48.51910       2.227143      49.95077       2.881660      269.7181 6.196758  273.4653 7.916335  -3.747192      10.05327  
1 1 1 4  14 3  o 430.4865 3.071335  123.5017       1.761815      126.7291       4.966638      123.0371       1.884356      435.7022 8.554591  429.6681 3.291217  6.034119       9.165868  
1 1 1 4  14 4  o 183.2290 7.789831  22.44482       1.897595      24.46841       4.441013      21.99285       2.098842      190.0342 17.74295  181.2929 8.713627  8.741333       19.76714  
1 1 1 4  14 5  o 808.8184 6.798702  436.3908       7.327411      438.0225       7.896099      426.2717       19.66386      810.2515 7.313398  796.2696 18.53255  13.98193       19.92338  
1 1 1 4  14 6  o 551.2416 5.110064  202.5913       3.753547      199.1594       5.836785      205.0114       4.901503      546.2830 8.018304  554.3961 6.634919  -8.113037      10.40747  
1 1 1 4  14 7  o 571.7285 6.625273  218.0254       5.047393      213.4511       7.016201      222.9319       7.266563      565.3921 9.312768  577.7949 9.438040  -12.40283      13.25912  
1 1 1 4  14 8  o 477.5086 7.567006  152.1345       4.814806      151.8167       6.107363      152.6564       7.826242      476.8003 9.612662  477.6086 12.30750  -0.8082581     15.61658  
1 1 1 4  14 9  o 296.5686 6.168354  58.65443       2.437631      57.17788       3.453262      60.12088       3.441431      292.5323 8.869193  299.9964 8.617867  -7.464172      12.36650  
1 1 1 4  14 10 o 293.2538 5.512853  57.33910       2.154237      57.99285       2.908363      56.54445       3.206516      294.7404 7.411055  290.9630 8.278733  3.777405       11.11131  
1 1 1 4  14 11 o 256.1067 7.268036  43.79179       2.477834      46.99271       3.884979      41.59681       3.217117      264.9589 11.02775  249.3934 9.699225  15.56543       14.68626  
1 1 1 4  14 12 o 452.2709 9.013430  136.5567       5.432031      141.7684       8.647977      133.1605       6.981053      459.9355 14.12730  446.1451 11.75302  13.79034       18.37700  
1 1 1 4  14 13 o 203.1879 5.130604  27.54302       1.388009      28.61650       1.791176      25.92950       2.195988      207.0310 6.500817  196.9193 8.388113  10.11172       10.61231  
1 1 1 4  14 14 f 329.7957 8.385380  72.65563       3.682042      68.87903       4.676752      78.81362       5.971908      320.8045 10.95641  342.8656 13.09528  -22.06116      17.07423  
1 1 1 4  14 15 o 336.3609 6.541706  75.48119       2.932041      84.24946       4.581968      69.40099       3.815521      354.9444 9.696731  322.2237 8.894848  32.72067       13.15845  
1 1 1 4  14 16 o 134.1850 6.795916  12.04721       1.211181      11.58859       2.824278      12.15056       1.340726      130.2037 16.65952  134.6993 7.499267  -4.495667      18.26961  
1 1 1 4  14 17 o 386.0055 6.557590  99.45689       3.372960      102.3549       6.696159      98.47160       3.904479      390.3474 12.89131  383.9628 7.631333  6.384552       14.98076  
1 1 1 4  14 18 f 76.97257 2.580125  3.953243       0.2642628     1.008897       1.812937      4.017161       0.2671158     49.05773 19.16383  77.59273 2.587097  -28.53500      19.33767  
1 1 1 4  14 19 o 272.5505 6.850519  49.66928       2.485992      42.03819       5.840638      51.35766       2.747274      248.1378 17.78208  277.0577 7.448218  -28.91991      19.27896  
1 1 1 4  14 20 o 178.4979 5.546164  21.29738       1.317565      26.86490       5.516932      20.96063       1.356827      196.4109 21.42646  177.0571 5.758583  19.35384       22.18681  
1 1 1 4  14 21 o 455.1110 8.246398  138.8316       5.000981      135.9577       10.26237      139.7266       5.727007      445.5372 17.31881  456.1585 9.421900  -10.62125      19.71581  
1 1 1 4  14 22 o 41.07164 16.12417  0.7020211      1.288785      6.416356       3.240511      -0.3716646     1.404654      93.44194 25.37578  34.95329 15.42327  58.48865       29.69524  
1 1 1 4  14 23 o 143.2706 10.16547  13.91041       1.928095      15.37759       3.941467      13.44886       2.210658      147.0238 20.69011  140.4158 11.92773  6.607971       23.88203  
1 1 1 4  14 24 o 110.2066 19.06771  8.701248       2.698823      12.15428       3.370631      2.533100       4.504931      130.2491 20.06387  73.52736 29.71782  56.72174       35.85677  
1 1 1 4  14 25 o 70.59242 11.11865  3.464847       1.011324      -1.495921      3.446293      3.932295       1.057899      50.82219 23.14120  75.36953 10.84539  -24.54734      25.55656  
1 1 1 4  14 26 o 53.48005 22.44298  0.8041550      2.700192      -4.227551      4.550210      3.539213       3.354726      51.31358 24.39874  71.78133 26.52054  -20.46775      36.03661  
1 1 1 4  14 27 o 92.50261 16.54555  6.261686       1.964555      10.36472       3.573917      4.485083       2.351727      114.6042 24.16520  76.03715 21.97656  38.56708       32.66383  
1 1 1 4  14 28 o 104.1053 15.64372  7.955018       2.103085      10.85475       4.269957      7.026283       2.416519      110.8451 28.68918  95.25303 19.68976  15.59206       34.79592  
1 1 1 4  14 29 o 150.1109 11.87395  16.03858       2.355762      11.29466       3.456814      20.15220       3.218988      116.0206 23.17135  165.5856 14.74292  -49.56508      27.46389  
1 1 1 4  14 30 o 17.58637 8.865436  -2.923299      0.9659090     -4.400436      2.822325      -2.727333      1.027986      34.82414 17.15310  18.99084 9.514670  15.83331       19.61524  
1 1 1 4  14 31 o 44.13489 16.67168  1.373256       1.340596      -6.260173      3.547817      2.644712       1.447945      36.34564 18.12815  56.54840 17.46394  -20.20276      25.17179  
1 1 1 4  14 32 o 96.40826 15.16219  7.374709       1.883584      2.857660       4.198563      8.512916       2.107578      57.45728 25.91344  102.9086 15.87983  -45.45128      30.39203  
1 1 1 4  14 33 o 20.06872 10.03142  -2.644220      1.112497      -8.722667      5.259095      -2.359478      1.138256      40.02179 20.23644  21.15220 10.50338  18.86959       22.79988  
1 1 1 4  15 0  o 90.00584 18.25893  6.035023       1.938708      6.035023       1.938708      6.035023       1.938708      90.00584 18.25893  90.00584 18.25893  0.000000       0.000000  
1 1 1 4  15 1  f 368.5859 7.267111  90.63480       3.569226      85.76340       4.835523      96.46576       5.290386      358.1773 10.14166  379.8457 10.46214  -21.66840      14.57085  
1 1 1 4  15 2  o 230.3301 5.461436  35.37275       1.676220      35.10114       1.947788      36.14817       3.291083      229.3245 6.380284  232.3558 10.65786  -3.031311      12.42167  
1 1 1 4  15 3  o 485.6154 7.476309  157.3377       4.837859      159.3046       6.668500      155.1523       7.029278      488.3428 10.24778  481.8477 10.94781  6.495087       14.99572  
1 1 1 4  15 4  o 652.2986 11.85641  284.4726       10.30559      272.5670       18.05054      290.2300       12.55251      635.7015 21.33926  658.3472 14.30876  -22.64569      25.69250  
1 1 1 4  15 5  o 356.1595 6.176672  84.59361       2.931383      84.95172       3.903646      84.13055       4.438959      356.7851 8.210890  354.8426 9.396242  1.942444       12.47830  
1 1 1 4  15 6  o 460.3249 6.903519  141.3430       4.234562      151.5039       8.820001      138.2993       4.827313      475.5389 13.93406  455.2552 7.957509  20.28375       16.04618  
1 1 1 4  15 7  o 434.9061 5.997386  126.1271       3.475610      122.9946       4.749183      129.7395       5.100062      429.3024 8.301988  440.8827 8.681182  -11.58035      12.01191  
1 1 1 4  15 8  o 397.5517 5.477653  105.3760       2.901761      103.2032       3.917179      108.0182       4.319705      393.3106 7.474193  402.3375 8.057309  -9.026917      10.99017  
1 1 1 4  15 9  o 300.6410 6.743478  60.28591       2.701505      58.07465       3.478722      63.64563       4.287972      294.8259 8.864906  308.4932 10.44624  -13.66724      13.70075  
1 1 1 4  15 10 o 504.5067 10.23257  170.0163       6.878995      174.7139       8.389309      160.3765       12.01772      511.1353 12.31733  488.2372 18.50566  22.89813       22.23008  
1 1 1 4  15 11 o 327.5300 7.441079  71.57420       3.247585      82.69772       5.443953      65.42864       4.046448      351.5147 11.63849  312.8483 9.718376  38.66641       15.16249  
1 1 1 4  15 12 o 459.5375 7.076685  140.8879       4.333356      139.5201       7.171317      141.6746       5.438548      456.6013 11.79647  460.6418 8.860251  -4.040466      14.75333  
1 1 1 4  15 13 o 323.2054 5.500693  69.66138       2.369024      73.18056       3.206850      65.43358       3.514915      331.1574 7.267258  312.9405 8.436764  18.21698       11.13517  
1 1 1 4  15 14 o 211.7654 6.507707  29.94872       1.834175      30.88593       2.229375      27.98539       3.226728      214.9476 7.796456  204.1199 11.91505  10.82762       14.23914  
1 1 1 4  15 15 o 126.5094 9.330030  10.75684       1.561756      11.21518       1.823635      9.495879       3.024795      129.0179 10.70379  116.8812 20.14868  12.13673       22.81536  
1 1 1 4  15 16 o 54.19776 13.91423  2.049022       1.009952      1.533098       2.337716      2.167414       1.119852      57.13816 21.91183  55.77917 14.81727  1.358994       26.45146  
1 1 1 4  15 17 o 373.2418 8.944754  93.22134       4.448690      96.96154       6.116436      89.02032       6.482288      379.7833 12.10163  363.5126 13.40540  16.27072       18.05974  
1 1 1 4  15 18 o 275.1004 6.379823  50.55616       2.338694      56.87082       6.310358      49.55072       2.518007      289.1878 16.44349  272.1966 6.947936  16.99118       17.85111  
1 1 1 4  15 19 o 168.2336 6.223319  18.93805       1.392705      21.09725       2.941920      18.31439       1.581096      176.4525 12.59489  165.3161 7.194667  11.13641       14.50498  
1 1 1 4  15 20 o 210.2541 1.264943  29.45740       0.3543961     32.11632       4.531229      29.44104       0.3554851     216.6149 15.80715  210.1956 1.269183  6.419357       15.85802  
1 1 1 4  15 21 o 176.4672 7.496575  20.90555       1.758773      19.25016       4.166119      21.26455       1.940135      165.8638 19.20420  177.8459 8.208953  -11.98201      20.88512  
1 1 1 4  15 22 o 92.29967 6.198844  5.726998       0.7579820     6.157598       4.928793      5.716568       0.7671075     92.86280 32.40581  92.20427 6.281054  0.6585312      33.00891  
1 1 1 4  15 23 o 258.3976 9.347784  45.06884       3.213323      44.59963       4.653695      45.49639       4.442320      255.1452 13.73857  258.0941 12.95835  -2.948914      18.88564  
1 1 1 4  15 24 o 54.43792 17.89493  2.019987       1.501431      1.129248       3.366709      2.241120       1.677481      60.39571 25.18216  57.23077 18.91966  3.164940       31.49753  
1 1 1 4  15 25 o 129.4313 9.721219  11.43407       1.664364      4.004139       4.721817      12.48817       1.778513      78.53678 30.85399  135.2244 9.939711  -56.68760      32.41553  
1 1 1 4  15 26 o 40.23045 13.78247  1.057659       0.8898956     1.343892       3.553802      1.038510       0.9191800     60.59223 25.60508  40.20945 13.99673  20.38278       29.18097  
1 1 1 4  15 27 o 63.16749 24.54871  2.703716       2.962728      3.256907       3.923120      1.969452       4.519810      68.93577 27.77849  65.74521 28.35472  3.190559       39.69427  
1 1 1 4  15 28 o 20.74737 10.44591  -3.881744      1.318353      4.392942       3.375512      -5.371163      1.432096      71.54059 26.57101  ?        ?         0.000000       26.57101  
1 1 1 4  15 29 o 70.00952 16.87631  3.882600       1.555822      0.5333739      3.291773      4.845988       1.765461      51.35848 23.07249  78.05951 17.41578  -26.70103      28.90760  
1 1 1 4  15 30 o 69.26543 16.43392  3.858710       1.493824      -1.545284      3.521021      5.044916       1.649648      45.19072 21.48038  79.79223 16.07153  -34.60151      26.82724  
1 1 1 4  15 31 o 40.51756 17.11155  0.7538899      1.585586      5.717013       3.745589      -0.3296799     1.750133      70.10946 27.49895  36.06424 16.44819  34.04522       32.04271  
1 1 1 4  15 32 o 47.82718 18.33935  1.874316       1.637469      -6.056652      4.901120      2.870833       1.737299      41.76732 20.90396  56.04389 19.25540  -14.27657      28.42088  
1 1 1 4  16 0  o 251.3949 10.02735  42.35741       3.346880      42.35741       3.346880      42.35741       3.346880      251.3949 10.02735  251.3949 10.02735  0.000000       0.000000  
1 1 1 4  16 1  o 431.4411 5.727969  124.1145       3.293030      124.3872       6.650072      124.0260       3.790379      431.2457 11.58301  431.2327 6.596255  0.1296997E-01  13.32954  
1 1 1 4  16 2  o 584.5221 8.936821  228.0665       6.960773      224.5210       9.227789      232.7473       10.60288      579.5325 11.94941  589.7822 13.49145  -10.24976      18.02242  
1 1 1 4  16 3  o 606.6125 9.083478  245.6454       7.342384      246.9958       9.667417      243.8047       11.28713      607.8498 11.93550  603.5247 14.03508  4.325134       18.42389  
1 1 1 4  16 4  f 576.3480 9.362545  221.7741       7.190386      228.5311       9.378993      212.1406       11.19880      584.6680 12.03853  562.5960 14.95156  22.07196       19.19571  
1 1 1 4  16 5  o 320.8477 5.721902  68.64011       2.446318      69.19351       4.257989      68.36744       2.988827      321.7343 9.943869  320.1479 7.006105  1.586395       12.16413  
1 1 1 4  16 6  o 410.7883 6.651842  112.5477       3.641107      96.53230       6.355303      120.3734       4.442497      379.7201 12.57763  424.7421 7.849253  -45.02194      14.82591  
1 1 1 4  16 7  o 507.6214 7.037793  171.8865       4.760471      170.4439       6.817574      173.2591       6.650194      505.1642 10.12800  509.3594 9.797977  -4.195190      14.09173  
1 1 1 4  16 8  o 23.99388 10.12899  0.2713746E-01  0.5551997     0.8617842      0.7229200     -1.173036      0.8668840     37.07962 12.42461  22.08432 10.54226  14.99530       16.29449  
1 1 1 4  16 9  o 44.66853 10.49294  1.386785       0.6138712     1.211109       0.9846846     1.498467       0.7851140     43.68681 14.49744  46.53107 12.42765  -2.844269      19.09508  
1 1 1 4  16 10 o 315.9946 6.465145  66.60370       2.722271      66.84283       3.611025      66.28886       4.143394      316.3090 8.575239  314.8526 9.888130  1.456360       13.08854  
1 1 1 4  16 11 o 222.9794 0.5758079 33.12664       0.1710866     33.13650       0.1713856     30.30803       2.897531      223.0126 0.5767285 212.7068 10.25308  10.30580       10.26928  
1 1 1 4  16 12 o 203.0263 6.237466  27.52368       1.685460      27.11149       2.328831      27.97706       2.442426      201.2878 8.703112  204.4528 8.987051  -3.165024      12.51044  
1 1 1 4  16 13 o 262.6844 5.279356  46.02145       1.847943      46.35773       2.310077      45.42382       3.079555      263.5673 6.577508  260.5774 8.882047  2.989899       11.05235  
1 1 1 4  16 14 o 309.9167 5.825342  64.08553       2.405692      63.82650       3.120109      64.46529       3.777776      309.1360 7.574373  310.3732 9.144339  -1.237213      11.87392  
1 1 1 4  16 15 o 303.0354 5.791730  61.28556       2.338704      60.94435       3.291468      61.63348       3.323619      301.8279 8.191405  303.5258 8.225128  -1.697815      11.60827  
1 1 1 4  16 16 o 325.0176 6.815682  70.57267       2.951819      69.82256       5.233826      70.92256       3.574572      322.0956 12.21656  325.5144 8.247651  -3.418762      14.74002  
1 1 1 4  16 17 o 148.0166 9.170753  14.73643       1.799909      19.02838       4.924179      14.07455       1.933719      164.6002 23.08437  144.4927 10.10698  20.10754       25.19998  
1 1 1 4  16 18 o 92.26427 7.222713  5.729481       0.8809159     1.864866       2.833723      6.142909       0.9268381     62.20544 24.05392  95.53981 7.336378  -33.33437      25.14783  
1 1 1 4  16 19 o 40.09385 15.04351  0.8248784      1.087484      -1.110719      2.558501      1.251682       1.201413      45.03678 20.27754  45.46364 15.98928  -0.4268608     25.82316  
1 1 1 4  16 20 o 82.78410 2.645939  4.574023       0.2915024     3.864417       2.332154      4.585285       0.2938066     73.68053 22.04538  82.88509 2.663642  -9.204552      22.20572  
1 1 1 4  16 21 o 218.1059 1.444707  31.70192       0.4198758     23.79123       4.650217      31.76694       0.4215979     184.1159 19.23790  218.3293 1.449148  -34.21339      19.29240  
1 1 1 4  16 22 o 128.8624 6.898449  11.16625       1.180227      12.51133       4.133428      11.04685       1.231495      130.0234 24.76101  128.1092 7.243553  1.914169       25.79878  
1 1 1 4  16 23 o 67.60127 9.178502  3.140030       0.8054621     -1.267598      3.054831      3.469347       0.8350102     48.36176 21.92887  71.15270 9.008581  -22.79094      23.70717  
1 1 1 4  16 24 o 53.64589 8.689103  1.993531       0.5999053     1.526287       2.829336      2.015525       0.6138626     58.24274 23.54732  53.91116 8.852098  4.331581       25.15623  
1 1 1 4  16 25 f 125.0099 13.36532  10.98325       2.191865      10.14146       3.830006      11.39322       2.672834      112.4208 26.07383  125.7961 16.33029  -13.37531      30.76561  
1 1 1 4  16 26 o 15.49358 7.528428  -0.8350931     0.4910994     -2.492350      2.893613      -0.7859411     0.4983288     41.53848 19.66490  15.93750 7.705890  25.60098       21.12082  
1 1 1 4  16 27 o 78.35134 12.56295  4.437358       1.267321      7.257054       3.305273      3.951378       1.372194      90.64811 26.00900  72.86931 14.64043  17.77880       29.84644  
1 1 1 4  16 28 o 59.33907 13.53470  2.650715       1.046425      6.203513       3.571138      2.317011       1.094466      79.45595 27.59270  55.01407 14.66407  24.44188       31.24727  
1 1 1 4  16 29 o 24.24903 11.48202  -0.9704826     0.9873865     5.349771       3.529864      -1.506992      1.028441      71.87181 27.07385  22.63883 10.97562  49.23298       29.21400  
1 1 1 4  16 30 o 35.64998 13.13370  0.8391231      0.8217419     -0.1292337     3.296705      0.9032742      0.8485246     47.05923 21.85961  36.58522 13.36776  10.47401       25.62303  
1 1 1 4  16 31 o 77.66531 15.99661  4.957294       1.600357      -2.300650      4.964309      5.799048       1.690614      47.39814 23.22578  84.57844 15.57439  -37.18030      27.96424  
1 1 1 4  16 32 o 14.49994 7.321905  -2.101290      0.6749166     -0.7656947     3.897113      -2.142586      0.6852714     45.35699 21.83512  14.58153 7.364874  30.77546       23.04374  
1 1 1 4  17 0  o 650.8085 10.97283  282.8395       9.509702      282.8395       9.509702      282.8395       9.509702      650.8085 10.97283  650.8085 10.97283  0.000000       0.000000  
1 1 1 4  17 1  o 95.70300 9.091550  6.169121       1.145502      3.746613       1.607534      8.668160       1.632730      73.29646 16.81672  113.3783 10.94296  -40.08189      20.06366  
1 1 1 4  17 2  o 312.3748 6.424987  65.07697       2.674372      64.34573       3.503965      66.09736       4.139172      310.3854 8.479925  314.4461 9.890861  -4.060730      13.02836  
1 1 1 4  17 3  o 312.9595 7.153060  65.33685       2.983002      68.19592       4.076790      62.04221       4.376322      319.4330 9.588639  304.5356 10.80155  14.89740       14.44352  
1 1 1 4  17 4  o 159.9482 6.944403  17.09735       1.476562      15.05644       2.738562      17.93384       1.753232      149.3361 13.92251  163.7372 8.060379  -14.40112      16.08745  
1 1 1 4  17 5  o 283.7045 5.539781  53.66743       2.094269      53.11869       2.944287      54.22937       2.979513      282.0329 7.842033  284.9674 7.854000  -2.934540      11.09877  
1 1 1 4  17 6  o 321.2679 5.938536  68.82953       2.542262      71.71262       3.579692      65.89559       3.611117      327.6895 8.204484  314.0684 8.636870  13.62112       11.91256  
1 1 1 4  17 7  o 90.31264 7.368258  5.478281       0.8790213     4.543177       1.851368      5.750434       0.9987789     80.68927 17.70609  92.45871 8.191444  -11.76944      19.50912  
1 1 1 4  17 8  o 259.1530 4.516451  44.77231       1.559650      45.02034       2.090744      44.46111       2.341923      259.8102 6.039085  258.0651 6.816324  1.745117       9.106746  
1 1 1 4  17 9  o 259.1064 5.066398  44.76527       1.749246      48.03352       2.218454      39.39353       2.844130      268.3457 6.204151  242.7123 8.808563  25.63338       10.77415  
1 1 1 4  17 10 o 77.17947 9.483855  4.040111       0.9548677     3.134973       2.022365      4.299781       1.083211      67.88766 20.57750  79.50950 10.47883  -11.62184      23.09198  
1 1 1 4  17 11 o 442.6786 9.357768  130.9911       5.519940      127.8407       7.258083      135.3132       8.501229      436.5909 12.48879  448.7399 14.23519  -12.14905      18.93701  
1 1 1 4  17 12 o 289.9461 8.482003  56.22872       3.273574      55.80135       4.980187      56.55385       4.343846      288.0909 13.00661  290.3602 11.24828  -2.269287      17.19581  
1 1 1 4  17 13 o 189.4948 4.461957  23.94732       1.126669      25.48057       1.290063      19.01850       2.312995      195.3822 4.959106  168.2013 10.37024  27.18092       11.49498  
1 1 1 4  17 14 o 132.6240 6.728639  11.77859       1.185227      12.17729       1.496129      11.10674       1.942144      134.6712 8.378712  128.1375 11.49654  6.533722       14.22580  
1 1 1 4  17 15 o 378.0752 6.814996  95.51860       3.433344      95.73227       5.616676      95.39112       4.338224      377.3923 11.18129  377.4868 8.624556  -0.9451294E-01 14.12106  
1 1 1 4  17 16 o 287.2848 6.459077  55.15594       2.472616      53.41977       3.310211      57.34739       3.718992      282.2224 8.812990  292.2540 9.562609  -10.03152      13.00432  
1 1 1 4  17 17 o 128.0437 10.57312  11.09824       1.787929      10.53518       3.190416      11.35604       2.158767      122.1968 20.30596  129.0864 12.71512  -6.889580      23.95843  
1 1 1 4  17 18 o 160.6402 6.510908  17.29075       1.390812      16.07682       3.581215      17.50636       1.509281      152.0314 18.02811  161.5654 7.027295  -9.533920      19.34931  
1 1 1 4  17 19 o 59.84762 16.37096  2.534495       1.343025      2.472800       3.149182      2.548210       1.484822      67.07264 25.50255  60.18684 17.48227  6.885796       30.91940  
1 1 1 4  17 20 o 54.02238 7.286149  1.991492       0.5111399     -4.509970      3.064247      2.177572       0.5184030     39.70228 19.17483  56.57547 7.027498  -16.87319      20.42204  
1 1 1 4  17 21 o 132.4353 2.953279  11.69971       0.5211729     13.67690       2.833936      11.63050       0.5302162     140.2279 15.42058  132.0397 3.013525  8.188202       15.71227  
1 1 1 4  17 22 o 103.5714 2.911359  7.162610       0.4014005     2.757202       3.415614      7.224304       0.4042014     68.69514 26.44941  104.0162 2.919127  -35.32106      26.61001  
1 1 1 4  17 23 o 90.44115 1.969926  5.454009       0.2374048     1.110509       3.131470      5.479117       0.2380900     58.04858 24.25122  90.64906 1.971080  -32.60047      24.33119  
1 1 1 4  17 24 o 151.2879 7.209469  15.48231       1.449204      15.27451       4.517562      15.50614       1.530070      139.3929 25.25095  151.2735 7.615071  -11.88057      26.37422  
1 1 1 4  17 25 o 79.28993 8.026598  4.314517       0.8363848     6.489953       3.169404      4.151681       0.8671227     88.29347 25.51072  77.62060 8.523662  10.67287       26.89702  
1 1 1 4  17 26 o 41.82437 8.875462  1.244385       0.4793163     1.417009       3.907461      1.241748       0.4829637     59.65307 26.03978  41.76285 8.947902  17.89022       27.53425  
1 1 1 4  17 27 o 49.05230 15.32612  1.818043       1.111542      -2.002197      3.889087      2.157869       1.159926      47.80685 22.68089  53.01080 15.46717  -5.203941      27.45280  
1 1 1 4  17 28 o 34.23816 14.17122  0.4398971      1.055137      -4.720483      3.182368      1.077242       1.118399      36.76431 18.12894  40.56146 15.24804  -3.797146      23.68884  
1 1 1 4  17 29 o 27.02986 13.02219  -1.667957      1.392323      -1.159488      5.464365      -1.703261      1.439847      53.03608 25.61244  27.50130 13.24761  25.53478       28.83568  
1 1 1 4  17 30 o 28.83038 13.41192  -0.6950595     1.248168      -6.824166      4.091868      -0.6625493E-01 1.310632      37.81907 18.95290  32.83072 14.66792  4.988342       23.96582  
1 1 1 4  17 31 o 20.99967 10.28355  -1.598794      0.9684656     2.239640       4.530920      -1.782558      0.9913770     53.91282 25.23585  20.73428 10.20384  33.17854       27.22070  
1 1 1 4  18 0  o 631.9116 9.960754  266.6029       8.382601      266.6029       8.382601      266.6029       8.382601      631.9116 9.960754  631.9116 9.960754  0.000000       0.000000  
1 1 1 4  18 1  o 576.2757 5.978699  221.4767       4.591034      221.1614       7.757404      221.6468       5.695608      575.3420 10.11852  576.3453 7.416240  -1.003296      12.54532  
1 1 1 4  18 2  o 163.7176 7.127456  17.91696       1.551178      18.62034       1.964527      16.75234       2.527873      166.7589 8.872814  157.7886 12.11550  8.970367       15.01707  
1 1 1 4  18 3  o 257.3481 6.840806  44.21447       2.343778      39.86733       2.869282      52.93147       4.063080      244.1896 8.832602  281.1851 10.86444  -36.99548      14.00182  
1 1 1 4  18 4  f 154.5057 8.806080  15.99219       1.805504      13.53191       3.739205      16.74021       2.061787      140.2121 20.62946  157.9847 9.842785  -17.77257      22.85728  
1 1 1 4  18 5  o 458.6541 6.590167  140.3403       4.027682      146.9675       6.008457      134.9322       5.427717      469.0126 9.614017  449.4682 9.062430  19.54443       13.21200  
1 1 1 4  18 6  o 437.4471 5.310931  127.6098       3.095778      127.8814       3.848436      127.1119       5.211270      437.8058 6.596738  436.2314 8.965058  1.574371       11.13055  
1 1 1 4  18 7  o 324.8095 5.572802  70.36525       2.411992      72.88204       3.262593      67.33178       3.581860      330.4338 7.409772  317.3994 8.476526  13.03436       11.25861  
1 1 1 4  18 8  o 631.9775 4.349685  266.2857       3.662967      265.7571       4.009358      268.9541       9.008666      631.3062 4.766079  634.0370 10.66283  -2.730774      11.67953  
1 1 1 4  18 9  o 341.5220 6.125544  77.82717       2.787641      79.53488       3.951236      76.13478       3.933464      344.9985 8.594927  337.4125 8.756039  7.585999       12.26951  
1 1 1 4  18 10 o 141.1783 6.436774  13.33127       1.207719      12.79493       1.799651      13.77073       1.629014      137.9356 9.856207  143.2797 8.571492  -5.344131      13.06198  
1 1 1 4  18 11 o 252.9734 6.573866  42.75768       2.214120      44.98977       2.891027      39.59120       3.443377      259.2725 8.379012  242.8541 10.66661  16.41837       13.56408  
1 1 1 4  18 12 o 195.4668 3.249492  25.47102       0.8463736     25.50373       0.8785468     25.04871       3.156419      195.5880 3.370927  192.6898 12.35828  2.898178       12.80977  
1 1 1 4  18 13 o 314.3733 7.014780  66.05073       2.938551      65.94285       3.695936      66.23611       4.845020      313.7072 8.850355  313.7645 11.60828  -0.5722046E-01 14.59729  
1 1 1 4  18 14 o 107.9137 1.139314  7.759549       0.1638300     7.762869       0.1640653     6.604190       3.060374      107.9368 1.140706  95.80111 24.02057  12.13565       24.04764  
1 1 1 4  18 15 o 325.4974 5.834460  70.78083       2.530590      71.88192       2.871293      66.94953       5.355979      327.9003 6.571464  314.6965 12.79913  13.20380       14.38756  
1 1 1 4  18 16 o 213.1780 10.34721  30.63962       2.930489      30.95584       3.289729      29.42431       6.449193      213.9604 11.58177  203.6329 24.24295  10.32753       26.86742  
1 1 1 4  18 17 o 175.9997 9.363904  20.87754       2.188147      20.47259       2.720413      21.61966       3.682728      173.6882 11.82466  177.2880 15.75279  -3.599792      19.69703  
1 1 1 4  18 18 o 296.5091 9.291780  59.19717       3.666689      57.59470       4.847426      61.34029       5.605818      291.2207 12.52078  299.8186 14.07084  -8.597961      18.83503  
1 1 1 4  18 19 o 67.87029 20.97484  3.258936       2.088228      1.971896       2.909420      4.626466       2.999017      62.48166 24.31430  80.03838 25.19834  -17.55671      35.01630  
1 1 1 4  18 20 o 57.59146 19.46439  2.217407       1.774056      0.9245908E-01  2.806594      3.631409       2.289446      51.82359 22.34710  71.05629 21.96262  -19.23270      31.33288  
1 1 1 4  18 21 o 26.25724 10.72958  0.1789220      0.5948623     4.702113       3.969580      0.7501317E-01  0.6016562     81.04857 29.00814  25.24366 10.59376  55.80491       30.88203  
1 1 1 4  18 22 o ?        ?         -1.493767      0.3731461     1.586385       1.956088      -1.610087      0.3801266     52.86060 20.09911  ?        ?         0.000000       20.09911  
1 1 1 4  18 23 o 86.75944 2.497780  5.027261       0.2884643     4.991856       4.343343      5.027418       0.2891026     80.31630 30.07896  86.76034 2.503293  -6.444038      30.18295  
1 1 1 4  18 24 o 52.98155 10.82449  2.004462       0.7383506     -2.814434      3.753535      2.198430       0.7530639     47.35999 22.41382  55.62662 10.54540  -8.266628      24.77065  
1 1 1 4  18 25 o 50.84678 9.975323  1.846578       0.6517178     -1.799967      2.829764      2.050831       0.6697214     42.25635 19.83196  53.73563 9.710461  -11.47928      22.08166  
1 1 1 4  18 26 o 107.2108 5.824952  7.808996       0.8290296     1.251709       3.917854      8.116367       0.8482373     57.13797 25.45498  109.2988 5.845356  -52.16085      26.11751  
1 1 1 4  18 27 o 63.65274 12.63459  3.031497       1.033826      -2.758034      3.731743      3.512774       1.075939      44.16824 21.28906  68.89659 12.16432  -24.72835      24.51927  
1 1 1 4  18 28 o 57.59961 24.86587  2.594045       3.482596      2.536639       4.884893      2.653383       4.966389      59.76799 27.34277  60.19388 27.54977  -0.4258881     38.81516  
1 1 1 4  18 29 o 35.30115 16.75896  -1.358810      2.130258      -1.639642      4.442832      -1.274971      2.427501      47.39130 22.93689  37.87217 17.95342  9.519131       29.12776  
1 1 1 4  18 30 o 24.23401 12.03700  -2.968820      1.498945      1.036005       4.416901      -3.490086      1.593513      51.31712 24.29469  24.16070 12.06595  27.15641       27.12598  
1 1 1 4  19 0  o 93.98592 12.66807  6.213052       1.505505      6.213052       1.505505      6.213052       1.505505      93.98592 12.66807  93.98592 12.66807  0.000000       0.000000  
1 1 1 4  19 1  o 220.5978 4.364599  32.44429       1.282978      35.57071       2.125500      30.65227       1.609197      230.7615 6.920145  214.2969 5.640239  16.46463       8.927526  
1 1 1 4  19 2  o 682.3004 8.722416  311.0128       7.930233      299.6502       12.10722      319.5506       10.49488      668.4226 13.59314  690.9368 11.39897  -22.51422      17.74007  
1 1 1 4  19 3  o 115.2239 9.556172  8.935847       1.454051      9.774252       2.181309      8.265382       1.950647      119.9070 13.90988  110.1920 13.57117  9.714973       19.43351  
1 1 1 4  19 4  o 79.63808 10.27384  4.312006       1.064877      3.267483       1.432781      5.600996       1.591643      68.34609 16.01403  90.37825 13.64054  -22.03216      21.03600  
1 1 1 4  19 5  o 167.2587 4.932526  18.67326       1.098138      17.45791       1.670580      19.59797       1.457200      161.4909 7.786232  171.2487 6.397089  -9.757797      10.07711  
1 1 1 4  19 6  o 384.8334 6.485448  98.84659       3.325724      99.32949       4.370237      98.18216       5.126287      385.5255 8.507039  382.9302 10.05508  2.595276       13.17097  
1 1 1 4  19 7  o 320.3981 4.765700  68.46582       2.034652      68.30443       3.090582      68.58927       2.703063      319.8023 7.252459  320.5601 6.328096  -0.7578125     9.625121  
1 1 1 4  19 8  o 280.4510 4.602320  52.45790       1.719916      52.66521       2.219815      52.14651       2.720505      280.9078 5.930338  279.2999 7.316095  1.607880       9.417758  
1 1 1 4  19 9  o 126.5939 5.831744  10.71974       0.9811071     12.88927       1.463593      8.949275       1.322153      138.6252 7.956697  115.3412 8.665846  23.28399       11.76460  
1 1 1 4  19 10 o 56.79493 8.906831  2.210575       0.6519235     2.736363       0.9770420     1.788635       0.8752519     62.77441 12.11928  50.60427 12.93293  12.17014       17.72393  
1 1 1 4  19 11 o 111.1948 6.118746  8.282779       0.9031152     8.464020       1.103780      7.915709       1.570825      112.2669 7.419918  108.0158 11.07001  4.251144       13.32668  
1 1 1 4  19 12 o 59.19313 4.171128  2.348927       0.3268953     2.292474       0.3306806     4.772525       2.166672      58.46472 4.274176  81.88223 20.02638  -23.41751      20.47742  
1 1 1 4  19 13 o 152.5670 6.946182  15.59967       1.408444      15.50884       1.513649      16.18578       3.845020      152.0483 7.493940  152.5033 19.35654  -0.4549408     20.75657  
1 1 1 4  19 14 o 304.4927 6.728407  62.01954       2.730000      60.52954       2.850882      78.48024       9.475677      300.7423 7.113956  335.9738 21.27490  -35.23141      22.43279  
1 1 1 4  19 15 o 151.9189 6.753415  15.47539       1.363710      15.24945       1.509190      16.48071       3.183488      150.6851 7.540185  154.7046 15.65818  -4.019424      17.37910  
1 1 1 4  19 16 o 161.0222 10.04708  17.52703       2.145013      15.90127       2.517730      21.83126       4.096649      152.7364 12.47936  177.3303 17.56759  -24.59392      21.54889  
1 1 1 4  19 17 o 245.1542 7.948283  40.38253       2.593056      41.77306       2.934477      35.42823       5.539004      249.0923 8.854995  225.3636 18.61057  23.72871       20.60981  
1 1 1 4  19 18 o 51.28456 17.72141  1.683387       1.472245      1.789431       2.299170      1.609685       1.916751      57.39715 21.79841  53.55957 19.99727  3.837574       29.58144  
1 1 1 4  19 19 f 45.41720 17.94863  0.8855298      1.606319      2.915374       2.746969      -0.1692375     1.980162      66.93433 24.10954  42.69008 18.58760  24.24425       30.44287  
1 1 1 4  19 20 o 115.0595 15.67728  9.360248       2.341167      11.01802       2.759545      5.102404       4.422523      124.3388 17.10855  83.72050 30.52952  40.61826       34.99649  
1 1 1 4  19 21 o 43.96657 18.37071  0.4779816      1.797318      -0.1063152     2.663655      0.9663717      2.435256      48.79177 21.39404  52.20116 21.56026  -3.409389      30.37350  
1 1 1 4  19 22 o 183.3205 8.553054  22.88010       2.083564      23.45853       4.143068      22.68429       2.410577      179.6840 17.52623  181.8294 9.987446  -2.145432      20.17220  
1 1 1 4  19 23 o 71.72059 9.698688  3.591734       0.9031621     -0.8604238     4.445354      3.783423       0.9224001     56.47276 25.92764  73.66285 9.627343  -17.19009      27.65734  
1 1 1 4  19 24 o 39.67355 11.58074  1.132493       0.6501262     3.556369       3.729767      1.056541       0.6602336     67.71366 27.15493  38.51994 11.77390  29.19372       29.59755  
1 1 1 4  19 25 o 54.61666 8.553833  2.103999       0.6021098     -3.040102      4.693135      2.190087       0.6071272     49.78274 23.96465  55.78708 8.429880  -6.004341      25.40409  
1 1 1 4  19 26 o 46.68453 7.250257  1.528614       0.4363982     9.688237       4.639143      1.455766       0.4383420     90.89585 31.45538  45.45942 7.497423  45.43643       32.33654  
1 1 1 4  19 27 o 44.90480 10.78030  1.498563       0.6368723     1.119129       4.189959      1.507536       0.6443594     54.54181 25.08898  45.01191 10.86733  9.529892       27.34146  
1 1 1 4  19 28 o 25.29739 10.59676  0.1628232      0.6002976     5.184253       3.723869      0.2885344E-01  0.6082527     66.73692 27.00258  24.07859 10.39332  42.65833       28.93372  
1 1 1 4  19 29 o 24.27580 11.55759  -1.007465      1.027665      -0.2916453     4.335484      -1.050078      1.057812      48.52288 23.27367  24.52820 11.69125  23.99468       26.04513  
1 1 1 4  20 0  o 94.79678 11.91367  6.283944       1.440542      6.283944       1.440542      6.283944       1.440542      94.79678 11.91367  94.79678 11.91367  0.000000       0.000000  
1 1 1 4  20 1  o 267.7563 5.025695  47.82470       1.793120      48.13570       3.007910      47.65325       2.233348      268.1988 8.427015  267.1851 6.272932  1.013672       10.50544  
1 1 1 4  20 2  o 288.0620 5.660723  55.37289       2.172858      52.92253       2.948323      58.28603       3.214699      281.3010 7.873316  295.1781 8.180909  -13.87714      11.35413  
1 1 1 4  20 3  o 258.1719 6.733762  44.53976       2.314565      46.49492       3.266630      42.56858       3.279989      263.4285 9.320701  251.9724 9.787521  11.45616       13.51558  
1 1 1 4  20 4  o 141.1963 6.395999  13.33844       1.200262      14.95942       2.017401      12.45028       1.493311      149.0912 10.21644  136.2079 8.266542  12.88327       13.14197  
1 1 1 4  20 5  o 101.4054 6.505462  6.895062       0.8744112     6.030158       1.570090      7.283929       1.052788      93.85762 12.89443  104.1155 7.641657  -10.25791      14.98871  
1 1 1 4  20 6  o 101.6027 6.847474  6.927546       0.9216487     5.842942       1.429268      7.699562       1.205845      92.53490 11.86397  106.9403 8.532786  -14.40542      14.61377  
1 1 1 4  20 7  o 374.9833 5.043446  93.83042       2.520071      92.00729       3.506876      95.77720       3.623839      371.0403 7.092933  378.5504 7.184088  -7.510162      10.09558  
1 1 1 4  20 8  o 251.8859 4.847509  42.33700       1.627032      41.86164       2.266010      42.84286       2.337601      250.1897 6.803339  253.0881 6.938013  -2.898407      9.717070  
1 1 1 4  20 9  o 80.26000 7.172933  4.341297       0.7590533     5.175643       1.076348      3.515834       1.070602      87.37361 9.392121  71.40738 11.65305  15.96623       14.96681  
1 1 1 4  20 10 o 157.0135 5.830869  16.49036       1.217836      15.64489       1.574820      17.74814       1.920819      152.6936 7.765420  162.4851 8.905598  -9.791534      11.81573  
1 1 1 4  20 11 o 220.8072 5.975307  32.60347       1.756498      31.92652       2.482860      33.28174       2.485269      218.0801 8.560657  222.7001 8.389897  -4.620010      11.98646  
1 1 1 4  20 12 o 130.9553 5.176271  11.47121       0.9014822     11.33703       0.9569671     12.52869       2.686528      130.1494 5.530603  134.9335 15.20613  -4.784042      16.18066  
1 1 1 4  20 13 o 91.09931 1.846585  5.531188       0.2241599     5.534554       0.2243955     3.931473       4.892072      91.12699 1.847965  82.84030 31.71551  8.286690       31.76930  
1 1 1 4  20 14 o 186.9521 5.995847  23.39883       1.491738      24.17055       1.543244      12.41325       5.822596      189.9967 6.103499  126.7068 33.84518  63.28997       34.39111  
1 1 1 4  20 15 o 226.0885 9.981877  34.51218       2.999800      35.85303       3.213847      25.44001       8.359671      230.2858 10.50096  180.2306 36.06855  50.05515       37.56608  
1 1 1 4  20 16 o 144.9581 0.7511663 14.00102       0.1450949     13.99465       0.1451521     22.07520       5.168400      144.9251 0.7516335 175.2057 22.66860  -30.28059      22.68106  
1 1 1 4  20 17 o 126.2273 15.39286  11.12355       2.535602      13.90739       2.969379      3.628337       4.872317      141.0481 16.08603  79.53970 31.31334  61.50841       35.20349  
1 1 1 4  20 18 o 43.25048 16.78252  0.8904602      1.383036      0.9309068      1.404020      -0.4324123     8.029550      43.78583 16.93141  79.04095 35.72429  -35.25512      39.53349  
1 1 1 4  20 19 o 143.4102 13.05198  14.27312       2.466894      15.03320       3.237108      13.22025       3.809888      145.2304 17.05176  133.1364 22.26076  12.09401       28.04111  
1 1 1 4  20 20 o 83.31448 17.14316  5.101386       1.839686      3.415234       2.703147      6.556221       2.510894      68.54324 23.99318  92.96335 20.79127  -24.42010      31.74822  
1 1 1 4  20 21 o 142.2425 14.01652  14.36342       2.622223      15.27877       2.962230      11.04860       5.637083      145.7798 15.48588  108.0368 34.61081  37.74297       37.91729  
1 1 1 4  20 22 o 41.68204 18.41271  -0.1256611     2.007223      -4.421483      3.485656      2.005596       2.455157      41.46404 20.12659  56.62295 22.24727  -15.15891      30.00034  
1 1 1 4  20 23 o 79.45465 10.87512  4.489491       1.121219      6.272429       3.899410      4.328798       1.170656      81.29375 28.78687  77.63432 11.67758  3.659439       31.06525  
1 1 1 4  20 24 o 26.04597 11.89931  -0.4690892     0.9210202     0.5614911      2.070477      -0.7233263     1.028369      44.36949 19.16371  26.30156 12.21450  18.06793       22.72536  
1 1 1 4  20 25 o 40.88673 10.00257  1.223255       0.5404096     -6.973174      3.239379      1.457897       0.5480903     33.71233 16.89030  44.85122 9.468458  -11.13889      19.36321  
1 1 1 4  20 26 o 15.53468 7.571793  -0.8700728     0.5074280     -6.346840      7.155701      -0.8423933     0.5087087     51.47627 25.68591  15.70633 7.638746  35.76994       26.79769  
1 1 1 4  20 27 o 27.64223 10.92907  0.3734441      0.5958247     -5.117485      3.960552      0.5005932      0.6026837     39.63161 19.66458  29.34085 11.15642  10.29076       22.60888  
1 1 1 4  20 28 o 14.26392 7.195856  -1.978161      0.6429821     4.575256       3.737745      -2.178006      0.6527123     62.17537 26.26600  13.93180 7.054032  48.24357       27.19672  
1 1 1 4  21 0  o 36.38691 20.32719  1.214058       1.472205      1.214058       1.472205      1.214058       1.472205      36.38691 20.32719  36.38691 20.32719  0.000000       0.000000  
1 1 1 4  21 1  o 372.0915 6.240550  92.47890       3.094184      90.01546       4.849359      94.17050       4.018492      366.2575 9.945497  375.1666 8.038323  -8.909119      12.78779  
1 1 1 4  21 2  o 442.6662 6.102464  130.8762       3.599607      133.6592       4.973888      127.8157       5.215962      446.8704 8.352970  436.8421 8.960587  10.02832       12.25007  
1 1 1 4  21 3  o 301.2012 6.190965  60.60016       2.484784      57.61869       3.263265      64.71391       3.833157      293.2714 8.358965  310.6257 9.271114  -17.35434      12.48302  
1 1 1 4  21 4  o 434.4812 7.084668  126.2091       4.101701      132.8599       5.933769      120.1232       5.676164      445.0168 10.00647  423.1308 10.06716  21.88605       14.19426  
1 1 1 4  21 5  f 170.6358 6.389905  19.48308       1.450341      19.56361       2.151239      19.41598       1.963744      170.5458 9.503756  170.0299 8.696229  0.5158386      12.88199  
1 1 1 4  21 6  o 91.45782 6.740509  5.621942       0.8156894     7.877823       1.357386      4.346869       1.020499      107.9595 9.533449  79.90349 9.788810  28.05602       13.66409  
1 1 1 4  21 7  o 118.7444 4.908997  9.428316       0.7750714     9.298453       0.9197785     9.746406       1.439510      117.8301 5.876600  120.2256 9.052022  -2.395454      10.79229  
1 1 1 4  21 8  o 349.3162 4.955212  81.46489       2.306506      84.63509       3.000021      76.88211       3.606996      355.8187 6.327352  338.7946 7.989796  17.02405       10.19177  
1 1 1 4  21 9  o 57.70223 9.110395  2.288045       0.6772729     1.300222       1.078115      2.932006       0.8704736     45.09212 15.17357  65.24784 10.35756  -20.15572      18.37161  
1 1 1 4  21 10 o 213.5733 6.370325  30.53429       1.810908      31.69538       2.768834      29.66636       2.393905      216.9567 9.601241  210.1120 8.568300  6.844727       12.86855  
1 1 1 4  21 11 o 118.8031 9.279580  9.541779       1.457380      9.480093       1.984359      9.614015       2.147371      117.6379 12.86871  118.2108 13.89773  -0.5728836     18.94071  
1 1 1 4  21 12 o 109.9697 5.791798  8.108646       0.8457191     7.976020       0.8738843     10.06723       3.358226      109.0340 6.038344  118.1836 22.13783  -9.149559      22.94657  
1 1 1 4  21 13 o 308.9173 5.422888  63.79941       2.232269      63.50467       2.356156      66.38303       6.975969      308.1399 5.738293  310.0781 16.94783  -1.938232      17.89293  
1 1 1 4  21 14 o 80.97235 2.798345  4.377934       0.3014798     4.350613       0.3021703     10.33555       4.462162      80.71803 2.813665  116.3568 28.90795  -35.63882      29.04456  
1 1 1 4  21 15 o 75.82806 17.58109  4.148783       1.741799      3.567509       1.817587      10.68617       6.095466      70.17714 18.98224  114.8190 35.89226  -44.64182      40.60271  
1 1 1 4  21 16 o 128.9663 18.48462  11.89337       3.085881      11.89337       3.085881      0.000000       0.000000      128.9663 18.48462  ?        ?         0.000000       18.48462  
1 1 1 4  21 17 o 128.3313 8.842142  11.18648       1.502799      8.686909       3.124493      11.93874       1.714086      107.4815 22.53709  132.3149 9.791252  -24.83347      24.57212  
1 1 1 4  21 18 o 147.5721 7.501165  14.72954       1.470211      15.42178       1.516319      3.863577       6.007530      150.9906 7.560510  80.77650 33.65606  70.21413       34.49481  
1 1 1 4  21 19 o 82.66678 17.50589  5.076962       1.868246      4.907454       2.134022      5.633170       3.865645      80.16460 20.03481  83.08758 28.71548  -2.922981      35.01389  
1 1 1 4  21 20 o 113.0052 7.553520  8.699776       1.130890      7.876608       1.212123      14.23098       3.142046      107.1642 8.559448  138.8520 17.36022  -31.68778      19.35566  
1 1 1 4  21 21 o 91.70727 15.53479  6.243929       1.830680      5.890270       2.733561      6.531543       2.465140      83.82895 23.52005  90.30181 20.90051  -6.472862      31.46464  
1 1 1 4  21 22 o 49.70856 21.03879  1.065527       2.405493      -0.5770792     3.169140      3.298240       3.694801      47.85815 21.94256  65.23582 26.70870  -17.37767      34.56633  
1 1 1 4  21 23 f 54.73694 20.32279  2.309461       1.974328      -0.5663493     3.304655      3.905673       2.462018      47.76851 22.08331  66.63908 22.92146  -18.87056      31.82870  
1 1 1 4  21 24 o 60.20815 23.53644  3.105376       2.736242      6.875846       3.431580      -3.476911      4.534034      81.74353 27.06167  46.83016 22.78240  34.91337       35.37473  
1 1 1 4  21 25 o 21.68108 9.568487  -0.9931029E-01 0.5408517     -0.8126385     1.610855      -0.8679161E-02 0.5741833     32.85200 15.26702  23.20434 10.05697  9.647657       18.28181  
1 1 1 4  21 26 o 27.16347 9.279799  0.4962673      0.4033610     -1.325228      2.421962      0.5482307      0.4090740     37.70310 17.89065  28.16797 9.344124  9.535130       20.18386  
1 1 1 4  21 27 o 20.30748 9.740382  -0.9257315     0.7593982     -2.801326      3.261270      -0.8182052     0.7808627     39.10227 19.08888  21.22675 10.09707  17.87552       21.59482  
1 1 1 4  22 0  o 237.5594 9.349735  37.91099       2.949249      37.91099       2.949249      37.91099       2.949249      237.5594 9.349735  237.5594 9.349735  0.000000       0.000000  
1 1 1 4  22 1  o 214.0769 5.919009  30.64698       1.686846      29.79209       2.163237      31.97325       2.694402      210.7951 7.714421  218.0812 9.293246  -7.286102      12.07794  
1 1 1 4  22 2  o 53.39410 11.62657  1.994288       0.8037166     2.322139       1.112252      1.636036       1.162678      57.42669 14.52689  49.41584 15.70638  8.010853       21.39441  
1 1 1 4  22 3  o 255.8460 6.384360  43.76517       2.176554      44.68859       3.413676      43.13261       2.825340      257.6959 9.960009  253.5342 8.374463  4.161682       13.01282  
1 1 1 4  22 4  f 61.94326 8.655580  2.622115       0.6949576     2.754845       1.573560      2.589952       0.7745944     62.63229 17.93788  61.34447 9.806079  1.287815       20.44325  
1 1 1 4  22 5  o 162.7596 7.490971  17.77706       1.620288      17.76780       2.354542      17.78539       2.233140      162.0570 10.96810  162.2652 10.38249  -0.2082825     15.10282  
1 1 1 4  22 6  o 272.2622 5.184903  49.51321       1.881055      49.46503       2.635937      49.56320       2.685174      271.6978 7.287318  271.9396 7.417066  -0.2418823     10.39797  
1 1 1 4  22 7  o 249.2064 5.601596  41.50479       1.860135      42.65058       2.620389      40.34092       2.640989      252.1393 7.808645  245.1469 8.095853  6.992325       11.24801  
1 1 1 4  22 8  o 328.5789 5.162488  72.12838       2.260332      72.08565       3.022006      72.18265       3.405415      328.1281 6.911597  328.1334 7.788362  -0.5371094E-02 10.41291  
1 1 1 4  22 9  o 210.0429 5.660496  29.51655       1.582850      31.23874       2.173587      27.57212       2.309574      215.7385 7.572684  202.4514 8.580715  13.28708       11.44440  
1 1 1 4  22 10 o 240.0551 5.469771  38.52552       1.749660      39.62984       2.602354      37.61451       2.363623      242.8582 8.052690  236.7281 7.502458  6.130142       11.00603  
1 1 1 4  22 11 o 100.2611 10.01309  6.844403       1.319874      6.656254       1.487449      7.541131       2.862353      98.51038 11.55060  101.7548 21.76859  -3.244461      24.64322  
1 1 1 4  22 12 o 61.67244 9.236210  2.617570       0.7357020     3.131490       0.7746303     -2.113517      2.350322      67.65735 8.800593  38.85441 18.18345  28.80294       20.20120  
1 1 1 4  22 13 o 215.6583 3.943045  31.05833       1.133108      30.89983       1.166649      33.69661       4.759784      215.0910 4.070467  220.0276 16.35129  -4.936630      16.85032  
1 1 1 4  22 14 o 163.9529 7.550233  18.11759       1.645074      18.37668       1.732512      15.74334       5.244556      165.0337 7.901205  142.4896 28.61657  22.54411       29.68732  
1 1 1 4  22 15 o 100.1027 17.00168  7.205743       2.186797      7.202216       2.269227      7.251666       8.187847      99.77969 17.71612  98.31498 39.94460  1.464706       43.69705  
1 1 1 4  22 16 o 157.3152 8.464052  16.79612       1.767748      16.17074       1.810890      29.45432       8.147139      154.2190 8.849281  186.6439 34.01072  -32.42490      35.14312  
1 1 1 4  22 17 o 94.14091 23.98842  7.013719       3.017427      4.846967       3.527115      12.92797       5.827264      78.57973 27.41391  119.1774 34.63792  -40.59770      44.17361  
1 1 1 4  22 18 o 182.8909 9.328323  22.92809       2.265856      22.53382       2.476927      24.95018       5.609381      180.7392 10.32759  177.4302 24.36844  3.308960       26.46658  
1 1 1 4  22 19 o 55.64951 3.094458  2.076747       0.2285630     2.039631       0.2289444     13.18836       3.961278      55.14447 3.128526  126.7778 24.33330  -71.63332      24.53359  
1 1 1 4  22 20 o 57.36471 1.908770  2.198301       0.1457024     2.201714       0.1457631     -1.899857      5.050462      57.40934 1.908074  55.09482 26.05203  2.314514       26.12181  
1 1 1 4  22 21 o 77.78281 17.90117  4.810671       1.816881      4.707910       2.187436      5.039285       3.262657      74.68704 21.06973  73.58354 26.30297  1.103500       33.70133  
1 1 1 4  22 22 o 36.36317 15.67456  0.2401175      1.379805      0.1817589      1.502923      0.5531684      3.480902      37.23433 16.20306  51.93386 23.49233  -14.69953      28.53820  
1 1 1 4  22 23 o 38.87540 18.19877  -1.116008      2.357259      -1.105263      2.869240      -1.138320      4.134679      42.62576 19.99403  49.36264 23.40939  -6.736877      30.78573  
1 1 1 4  22 24 o 27.96015 13.61326  -2.252618      1.627806      -4.321389      2.584011      -0.8914951     2.095978      32.37062 16.03045  36.99744 17.26747  -4.626820      23.56142  
1 1 1 4  22 25 o 89.83395 11.27734  5.972897       1.320288      1.987890       3.892348      6.491014       1.403496      54.21771 24.65062  93.50247 11.50699  -39.28476      27.20411  
1 1 1 4  23 0  o 206.2379 9.027415  28.61880       2.470033      28.61880       2.470033      28.61880       2.470033      206.2379 9.027415  206.2379 9.027415  0.000000       0.000000  
1 1 1 4  23 1  o 140.5180 9.251316  13.32715       1.722607      12.07934       2.289638      14.95466       2.614905      132.8701 13.10233  147.8826 13.41565  -15.01254      18.75235  
1 1 1 4  23 2  o 304.9104 7.154062  62.27187       2.906688      66.38057       3.778277      56.31401       4.549745      314.1887 9.034016  288.3926 11.86473  25.79611       14.91259  
1 1 1 4  23 3  o 80.79661 9.712840  4.453729       1.024770      5.392765       1.555834      3.734169       1.361933      88.12375 13.69384  72.83715 14.54186  15.28660       19.97466  
1 1 1 4  23 4  o 156.6985 6.048561  16.44814       1.260590      13.79908       2.050847      18.05677       1.598140      142.6119 10.87405  163.9914 7.331958  -21.37952      13.11497  
1 1 1 4  23 5  o 131.6817 6.254755  11.62885       1.094375      9.650582       1.467829      14.10495       1.642163      119.4313 9.296416  144.6680 8.556855  -25.23672      12.63500  
1 1 1 4  23 6  o 31.66040 11.60670  0.5471075      0.6404927     1.236059       1.097866      0.1916342      0.7886031     44.39008 15.30482  29.81858 12.28774  14.57150       19.62718  
1 1 1 4  23 7  f 77.47261 9.482319  4.100162       0.9585130     5.837615       1.758127      3.365316       1.143384      91.29096 14.97120  69.34000 12.84770  21.95097       19.72816  
1 1 1 4  23 8  o 70.66092 7.712876  3.390580       0.7144437     3.550330       0.9452881     3.177757       1.091072      71.84863 10.15640  67.34988 12.62110  4.498756       16.20014  
1 1 1 4  23 9  o 51.27840 11.36306  1.850362       0.7559998     1.284258       1.087626      2.379560       1.051576      44.74768 15.23916  57.89206 13.82301  -13.14437      20.57444  
1 1 1 4  23 10 o 38.00721 12.42617  0.9514390      0.7243904     0.8395201      1.226896      1.011333       0.8975308     41.39780 15.87441  40.11932 13.83791  1.278484       21.05907  
1 1 1 4  23 11 o 44.88456 11.55011  1.422464       0.6948040     1.336392       0.7190365     2.635265       2.699067      43.59622 11.99994  64.74528 23.81125  -21.14906      26.66410  
1 1 1 4  23 12 o 20.61398 9.446136  -0.4024211     0.5862334     -0.3257807     0.6041201     -1.639490      2.427119      21.60228 9.777846  40.95037 18.92924  -19.34809      21.30545  
1 1 1 4  23 13 o 46.89266 9.513814  1.543393       0.5741260     1.406007       0.5832011     5.855164       3.267186      44.63203 10.04892  86.73449 26.12560  -42.10246      27.99157  
1 1 1 4  23 14 o 85.91933 8.295007  5.039972       0.9378943     5.050211       0.9549082     4.760313       4.990686      85.96996 8.444538  81.46622 31.80397  4.503738       32.90597  
1 1 1 4  23 15 o 20.38744 9.540531  -0.6162488     0.6468604     -0.7795327     0.6518529     9.921175       5.236549      19.51611 9.266693  105.0905 33.32430  -85.57438      34.58874  
1 1 1 4  23 16 o 72.73998 18.29675  4.019953       1.771568      3.975784       1.899465      4.315202       4.910938      71.95667 19.37996  76.59051 31.00206  -4.633835      36.56105  
1 1 1 4  23 17 o 33.02205 16.02020  -3.142398      2.200584      -3.142398      2.200584      0.000000       0.000000      33.02205 16.02020  ?        ?         0.000000       16.02020  
1 1 1 4  23 18 o 44.24988 19.78685  -0.1916235     2.390544      -0.1916235     2.390544      0.000000       0.000000      44.24988 19.78685  ?        ?         0.000000       19.78685  
1 1 1 4  23 19 o 112.9457 11.79204  9.136187       1.748615      9.421226       1.874329      7.222609       4.856423      114.2155 12.52033  82.50922 31.59699  31.70629       33.98718  
1 1 1 4  23 20 o 23.18001 9.788943  0.7521101E-01  0.5188517     0.1520349      0.5272419     -2.281133      2.919988      24.21886 10.02021  40.49880 19.33698  -16.27994      21.77896  
1 1 1 4  23 21 o 18.50405 8.760651  -0.6216289     0.5744675     -0.5704707     0.5771502     -6.086536      5.965166      18.88507 8.892326  49.35058 24.42433  -30.46551      25.99271  
1 1 1 4  23 22 o 43.42075 11.19045  1.406986       0.6515309     1.482947       0.6813667     0.5961581      2.226123      44.50592 11.43019  44.47245 19.52737  0.3346252E-01  22.62670  
1 1 1 4  23 23 o 32.33196 14.32348  -0.2764349E-01 1.223154      -1.678139      1.516734      3.042204       2.068525      28.37522 13.65028  58.12381 20.92334  -29.74859      24.98232  
1 1 1 4  23 24 o 54.30820 20.12699  2.618454       1.934851      2.569258       2.052896      3.009694       5.789314      53.91029 20.56835  58.81759 27.83626  -4.907307      34.61090  
1 1 1 4  24 0  o 25.30494 17.03770  -0.6642642     1.646761      -0.6642642     1.646761      -0.6642642     1.646761      25.30494 17.03770  25.30494 17.03770  0.000000       0.000000  
1 1 1 4  24 1  o 40.67678 14.39141  0.9981582      0.9744007     0.6501721      1.189114      1.709400       1.700009      39.38931 15.48077  52.93891 18.97913  -13.54960      24.49207  
1 1 1 4  24 2  o 63.32520 14.15662  2.845198       1.164516      3.271575       1.363325      1.694666       2.239505      67.73419 15.44824  56.37778 21.48936  11.35641       26.46584  
1 1 1 4  24 3  o 151.4242 9.277393  15.50956       1.862967      13.57244       2.288862      19.31167       3.206665      140.7903 12.32453  167.3152 14.52666  -26.52490      19.05040  
1 1 1 4  24 4  o 115.8005 7.180381  9.032109       1.102528      8.295445       1.910414      9.399991       1.350041      109.4828 13.37226  117.8602 8.656580  -8.377426      15.92965  
1 1 1 4  24 5  o 90.54137 8.324767  5.561589       0.9931333     5.676859       1.638657      5.494668       1.248573      90.02956 14.12360  89.47534 10.68300  0.5542221      17.70883  
1 1 1 4  24 6  o 131.8632 6.344732  11.68188       1.111563      11.55360       1.386286      11.91286       1.860189      130.8177 7.990788  132.1805 10.65139  -1.362869      13.31558  
1 1 1 4  24 7  o 134.5422 7.222333  12.19560       1.290075      9.913746       1.868973      14.27223       1.782949      120.0966 11.83233  145.0773 9.271387  -24.98067      15.03206  
1 1 1 4  24 8  o 170.1735 5.527475  19.41582       1.251745      17.37112       1.594081      22.70435       2.021602      160.5315 7.472570  183.3363 8.296607  -22.80482      11.16571  
1 1 1 4  24 9  o 81.09476 10.59215  4.543437       1.117261      3.574300       2.150885      4.901559       1.307495      69.77096 21.23628  83.86483 12.04521  -14.09387      24.41448  
1 1 1 4  24 10 o 151.0519 7.815523  15.43049       1.567755      15.52509       1.904186      15.23144       2.762192      150.9806 9.513231  147.5910 14.22081  3.389603       17.10944  
1 1 1 4  24 11 o 86.42632 10.04509  5.152495       1.135311      5.892887       1.394990      3.700108       1.953807      91.99566 11.63981  70.33427 19.93719  21.66138       23.08628  
1 1 1 4  24 12 o 54.03695 11.79836  2.085659       0.8256698     2.247002       0.8848298     0.9987081      2.296627      56.03193 12.19773  51.02055 20.99138  5.011387       24.27803  
1 1 1 4  24 13 o 51.15268 8.463120  1.822415       0.5567084     1.916897       0.5717425     0.9640275E-01  2.443700      52.49158 8.461690  47.22198 20.60342  5.269600       22.27333  
1 1 1 4  24 14 o 26.92754 10.46620  0.3294101      0.5385886     0.2437112      0.5480552     2.746018       2.910315      25.98116 10.41264  63.41864 24.41553  -37.43748      26.54319  
1 1 1 4  24 15 o 90.02851 7.053058  5.529123       0.8393683     5.843410       0.8703688     1.351457       3.173268      92.54832 7.112175  56.65884 24.07985  35.88949       25.10822  
1 1 1 4  24 16 o 69.43797 16.07894  3.672855       1.458405      4.325546       1.562778      -0.7296657     4.058768      75.52711 16.02502  53.27197 24.57271  22.25515       29.33631  
1 1 1 4  24 17 o 62.10379 24.18318  3.009035       2.879623      1.507534       3.480182      6.268884       5.127880      56.86785 24.70254  78.23473 31.67514  -21.36688      40.16877  
1 1 1 4  24 18 o 40.61798 19.21629  -1.810317      2.754385      -3.371699      3.196689      2.689994       5.427090      40.07094 19.40877  64.97294 29.36751  -24.90200      35.20158  
1 1 1 4  24 19 o 45.78271 21.90460  -2.282912      3.788037      -2.282912      3.788037      0.000000       0.000000      45.78271 21.90460  ?        ?         0.000000       21.90460  
1 1 1 4  24 20 o 28.61207 13.88986  -2.241088      1.661381      -2.691327      1.760913      1.407299       5.012641      28.48469 13.93156  58.29366 27.03569  -29.80897      30.41409  
1 1 1 4  24 21 o 55.04587 10.56011  2.231874       0.7464134     2.259076       0.7718868     1.840024       2.929614      55.23917 10.87385  52.76752 22.79324  2.471649       25.25416  
1 1 1 4  24 22 o 14.36374 7.006651  -0.7599342     0.4369654     -0.7300439     0.4386750     -4.572275      4.954202      14.57075 7.088054  44.97496 22.25874  -30.40421      23.36005  
1 1 1 4  25 0  o 165.2851 11.54909  18.68007       2.514602      18.68007       2.514602      18.68007       2.514602      165.2851 11.54909  165.2851 11.54909  0.000000       0.000000  
1 1 1 4  25 1  o 155.3824 8.577955  16.34716       1.769175      16.49022       2.412196      16.18062       2.602622      154.9837 11.76824  153.0710 12.87917  1.912704       17.44605  
1 1 1 4  25 2  o 133.1863 8.055042  12.00099       1.422873      11.76123       1.622987      12.79736       2.957928      131.5059 9.322246  134.2347 16.91123  -2.728806      19.31046  
1 1 1 4  25 3  o 66.06458 15.43614  3.150918       1.334268      3.303935       1.712478      2.914513       2.128549      67.17506 18.53027  64.21053 21.31518  2.964531       28.24372  
1 1 1 4  25 4  o 135.4249 8.108082  12.41744       1.456455      11.87547       2.336131      12.76203       1.862795      130.5439 13.63032  136.6352 10.30726  -6.091217      17.08875  
1 1 1 4  25 5  o 169.5169 7.129030  19.37554       1.606743      17.86613       2.618235      20.28738       2.034986      160.8810 12.30665  172.9135 8.861553  -12.03253      15.16511  
1 1 1 4  25 6  o 102.1378 7.048800  7.056364       0.9534621     7.210599       1.621190      6.974805       1.178904      101.7749 12.19682  101.1115 8.838700  0.6633987      15.06270  
1 1 1 4  25 7  o 91.62605 8.748054  5.738707       1.055130      8.078817       1.397492      2.636071       1.609150      108.5454 9.766260  60.19901 18.37729  48.34636       20.81117  
1 1 1 4  25 8  o 148.5600 6.485167  14.88192       1.280705      15.90042       1.595212      13.03500       2.148149      153.1521 7.842786  137.0843 11.87695  16.06779       14.23275  
1 1 1 4  25 9  o 182.2164 7.007530  22.43902       1.698305      20.91155       2.400439      23.96987       2.403096      174.4290 10.37444  187.1577 9.668621  -12.72874      14.18137  
1 1 1 4  25 10 o 83.02347 15.74597  5.048190       1.678261      6.225821       2.396015      3.913957       2.351451      89.96211 20.45212  71.05707 22.30456  18.90504       30.26190  
1 1 1 4  25 11 o 40.92630 13.84783  1.127653       0.8979529     1.302877       1.553802      1.039787       1.100294      47.07154 17.90982  41.36414 15.20461  5.707397       23.49344  
1 1 1 4  25 12 o 46.20783 17.57386  1.275791       1.495668      1.409787       1.776814      0.9499880      2.770593      49.07734 19.02810  52.74649 22.46159  -3.669147      29.43793  
1 1 1 4  25 13 f 81.37724 6.077955  4.499639       0.6543133     4.682923       0.6761314     1.796416       2.596627      83.00594 6.156749  55.54444 22.52125  27.46150       23.34764  
1 1 1 4  25 14 o 108.5274 15.35672  8.765268       2.158841      8.885684       2.692111      8.548322       3.613489      105.7962 19.82456  96.76524 27.00293  9.030952       33.49883  
1 1 1 4  25 15 o 25.88059 11.79738  -0.4491188     0.8988162     -0.9847739E-01 0.9350792     -4.708701      3.259119      28.82355 12.65602  38.16657 18.72609  -9.343023      22.60180  
1 1 1 4  25 16 o 30.34765 14.12836  -0.9274625     1.389169      -1.166642      1.426386      3.477395       6.121263      29.79514 14.01393  68.02917 30.92346  -38.23403      33.95071  
1 1 1 4  25 17 o 42.54548 20.09977  -1.620305      2.993628      -2.255537      3.364101      0.7966477      6.562013      43.37070 20.72117  61.94028 29.40799  -18.56958      35.97494  
1 1 1 4  25 18 o 54.55817 26.38335  -1.764936      5.847260      -0.2552740     6.370734      -9.835225      14.72971      58.39067 28.06026  62.67931 31.91412  -4.288643      42.49575  
1 1 1 4  25 19 o 38.88899 18.60960  -1.965093      2.736734      -2.639487      2.871604      4.712642       9.036129      38.20215 18.47756  66.41768 32.27745  -28.21553      37.19212  
1 1 1 4  25 20 o 72.23611 26.75430  5.875126       3.417851      7.830691       3.736267      -4.153201      8.460888      81.70939 28.23124  54.90768 27.47833  26.80170       39.39621  
1 1 1 4  25 21 o 39.14456 17.73250  -0.2779189E-01 1.991772      0.9091654      2.199933      -4.287769      4.690869      44.75821 19.53825  44.15317 21.81677  0.6050415      29.28677  
1 1 1 4  26 0  o 156.9898 14.53547  17.26747       2.977483      17.26747       2.977483      17.26747       2.977483      156.9898 14.53547  156.9898 14.53547  0.000000       0.000000  
1 1 1 4  26 1  o 66.48929 13.43781  3.180515       1.149565      2.695219       1.588430      3.714232       1.665789      60.44819 18.21834  70.53615 17.74193  -10.08796      25.42999  
1 1 1 4  26 2  o 88.40952 10.76842  5.436860       1.242460      4.175194       1.517210      8.005567       2.164865      75.59451 15.58024  105.2234 15.93841  -29.62893      22.28849  
1 1 1 4  26 3  o 46.71469 16.40261  1.433683       1.263973      1.422129       1.438921      1.472720       2.644883      47.67481 17.40970  55.77403 22.68703  -8.099220      28.59719  
1 1 1 4  26 4  o 155.6545 7.742910  16.44843       1.600935      19.07508       2.291770      13.94506       2.237341      166.4442 10.38479  141.4447 11.98324  24.99950       15.85692  
1 1 1 4  26 5  o 65.46905 12.75943  3.079467       1.073099      5.101397       2.138627      2.399102       1.240575      81.51633 19.87165  57.04081 15.78612  24.47552       25.37881  
1 1 1 4  26 6  o 170.9203 6.142401  19.71120       1.396685      17.33642       2.054612      21.75134       1.904357      158.7571 9.759498  178.7818 8.014141  -20.02470      12.62831  
1 1 1 4  26 7  o 68.19490 6.174476  3.161082       0.5550072     2.595854       1.128496      3.341418       0.6374252     59.35924 14.41324  69.95359 6.929215  -10.59435      15.99236  
1 1 1 4  26 8  o 43.97687 13.41668  1.385342       0.8578528     2.297266       1.265481      0.6099852      1.166882      55.49977 16.14484  37.83652 15.18347  17.66324       22.16289  
1 1 1 4  26 9  o 49.51294 19.69823  1.348644       1.946934      2.537547       2.612878      -0.1354594     2.919296      60.26301 23.15141  48.85641 21.85492  11.40660       31.83749  
1 1 1 4  26 10 o ?        ?         -3.686691      0.7050040     -1.892882      1.676915      -4.071819      0.7770087     30.60051 14.62263  ?        ?         0.000000       14.62263  
1 1 1 4  26 11 o 88.37492 10.58219  5.522113       1.221426      9.530916       2.209585      3.758107       1.465728      113.5035 14.97416  70.11125 16.03780  43.39230       21.94166  
1 1 1 4  26 12 o 102.1099 10.78958  7.393201       1.445890      8.989969       1.899872      5.195452       2.228909      111.2041 13.07051  79.10062 20.85391  32.10350       24.61146  
1 1 1 4  26 13 o 128.1248 6.407380  11.18897       1.090453      11.54139       1.176713      9.046206       2.901556      129.9388 6.819952  103.8680 21.66623  26.07083       22.71425  
1 1 1 4  26 14 o 203.1108 1.893285  27.53840       0.5124158     27.75440       0.5187134     18.80444       3.298413      203.9026 1.909111  157.1705 15.97082  46.73206       16.08452  
1 1 1 4  26 15 o 81.49904 5.150675  4.509320       0.5564972     4.669205       0.5604649     -6.663248      4.685134      82.95307 5.094983  43.12263 21.39524  39.83044       21.99352  
1 1 1 4  26 16 o 55.16329 20.05555  2.486954       1.906509      3.692520       2.042544      -5.669957      5.312988      64.88062 20.83871  46.78678 23.13644  18.09384       31.13755  
1 1 1 4  26 17 f 29.61480 14.41010  -2.428684      1.816327      -2.528545      1.905090      -1.431346      6.020608      30.26648 14.73414  54.26628 26.36633  -23.99981      30.20394  
1 1 1 4  26 18 o 84.77618 24.92807  7.298678       3.002832      6.051860       3.216187      15.77172       8.384158      74.62191 26.16747  84.10110 37.36587  -9.479187      45.61738  
1 1 1 4  26 19 o 51.65083 23.83155  1.005858       3.821434      0.5027828      4.290520      2.936530       8.405195      51.71471 24.31783  61.40681 30.11724  -9.692097      38.70923  
1 1 1 4  27 0  o 73.38650 24.08327  4.882331       2.088503      4.882331       2.088503      4.882331       2.088503      73.38650 24.08327  73.38650 24.08327  0.000000       0.000000  
1 1 1 4  27 1  o 46.08852 17.43332  1.301120       1.467034      0.8320647      1.724744      2.528396       2.789867      44.48097 18.23392  60.81466 23.76817  -16.33369      29.95666  
1 1 1 4  27 2  o 59.24614 14.03234  2.600873       1.090630      3.145476       1.287300      1.215715       2.053002      64.81287 15.17456  49.29170 20.01099  15.52116       25.11387  
1 1 1 4  27 3  o 71.07932 13.22813  3.684153       1.206801      4.709254       1.518870      1.929007       1.987440      79.78345 14.83259  53.67765 20.29405  26.10580       25.13671  
1 1 1 4  27 4  o 72.54659 10.18316  3.710508       0.9573374     3.629245       1.727998      3.746496       1.149946      68.09364 18.54637  71.98206 12.43863  -3.888412      22.33131  
1 1 1 4  27 5  o 75.52234 12.31995  4.117887       1.197115      3.666610       1.885175      4.422828       1.549665      67.82887 19.69766  76.62272 15.70576  -8.793854      25.19263  
1 1 1 4  27 6  o 47.05735 14.94850  1.621895       1.053302      2.151527       2.262322      1.475313       1.190167      55.82684 21.51765  45.85946 15.92903  9.967381       26.77206  
1 1 1 4  27 7  o 73.64452 10.12710  3.837536       0.9675131     0.6017477      1.636952      5.574795       1.199439      41.73098 17.49091  88.88751 10.31810  -47.15654      20.30751  
1 1 1 4  27 8  o 45.05448 12.89471  1.498730       0.8134092     -2.302843      1.935332      2.314344       0.8964295     32.01505 15.40587  56.03009 12.34075  -24.01505      19.73917  
1 1 1 4  27 9  o 75.59487 13.93390  4.262362       1.351884      4.583648       1.557495      3.280790       2.722342      77.44806 15.63131  63.21484 23.78410  14.23322       28.46087  
1 1 1 4  27 10 o 26.22269 12.27836  -0.8818788     1.074003      7.096021       3.596220      -1.663110      1.125360      85.03912 27.67922  23.72276 11.49640  61.31635       29.97176  
1 1 1 4  27 11 o 51.87342 14.87539  2.065951       1.081466      -0.7952330     2.006410      3.237597       1.283941      37.56974 17.31074  64.77939 15.14658  -27.20965      23.00175  
1 1 1 4  27 12 o 22.60736 10.96807  -1.550353      1.031746      1.798821       1.737666      -3.373995      1.282234      49.97941 18.95771  21.12781 10.59120  28.85160       21.71562  
1 1 1 4  27 13 o 20.06076 9.801994  -1.484924      0.8655065     -1.674429      0.9369154     -0.3819800     2.260300      20.57949 10.08544  40.91260 18.67208  -20.33311      21.22175  
1 1 1 4  27 14 f 76.03263 19.51682  4.951852       1.987227      3.148958       2.547774      7.752610       3.175511      59.72924 22.88276  88.43420 25.53041  -28.70496      34.28444  
1 1 1 4  27 15 o 112.8904 6.289525  8.745728       0.9423847     8.789709       0.9850638     8.270922       3.236634      113.0262 6.568818  90.38754 25.67398  22.63865       26.50099  
1 1 1 4  27 16 o 26.69856 13.20796  -3.204132      1.737762      -3.058731      1.867389      -4.143701      4.746947      28.40213 13.98263  45.19883 22.25989  -16.79671      26.28719  
1 1 1 4  28 0  f 41.29445 24.84556  1.667473       2.473285      1.667473       2.473285      1.667473       2.473285      41.29445 24.84556  41.29445 24.84556  0.000000       0.000000  
1 1 1 4  28 1  o 34.49160 15.40467  -0.2538059     1.444289      1.195023       1.955040      -1.994504      2.142934      47.53795 19.44157  34.99820 16.67011  12.53975       25.60991  
1 1 1 4  28 2  o 90.97873 9.498955  5.809363       1.134621      5.605918       1.381731      6.230561       1.988122      88.01202 12.10175  89.42452 17.31019  -1.412498      21.12096  
1 1 1 4  28 3  o 30.03371 13.78240  -0.6435663     1.254064      -1.916553      1.535694      1.904545       2.172710      28.50327 13.71786  53.07473 20.90555  -24.57146      25.00444  
1 1 1 4  28 4  o 31.19775 13.04471  0.2549920      0.9071962     1.014850       1.898104      0.3002313E-01  1.032797      45.91718 19.00624  31.09787 13.48303  14.81931       23.30299  
1 1 1 4  28 5  o 79.83543 11.39148  4.596902       1.177524      2.586052       1.762523      6.217999       1.582521      57.05211 19.39992  91.86852 13.31501  -34.81641      23.52969  
1 1 1 4  28 6  o 42.89696 16.87726  1.074433       1.414633      -1.240474      2.365762      2.362816       1.764927      39.22005 18.31809  54.99602 19.37650  -15.77597      26.66461  
1 1 1 4  28 7  o 30.63167 12.63122  0.3110491      0.8340449     3.078283       1.732662      -0.5235425     0.9515418     61.24557 19.13476  26.17225 12.00856  35.07332       22.59081  
1 1 1 4  28 8  o 67.62417 14.38812  3.493415       1.256649      2.976341       2.336656      3.703822       1.490557      59.80453 22.12670  68.36859 16.54238  -8.564060      27.62682  
1 1 1 4  28 9  o 89.68884 10.58793  5.770976       1.241022      5.652030       2.567149      5.807251       1.417686      78.81506 23.01422  88.91515 12.29410  -10.10009      26.09213  
1 1 1 4  28 10 o 38.97034 14.10824  1.034652       0.9421065     3.507574       1.621144      -0.2263786     1.157655      65.05413 18.06172  30.70281 13.74635  34.35132       22.69775  
1 1 1 4  28 11 o 45.89623 16.64100  1.563505       1.311384      3.968538       3.237241      1.091359       1.434343      64.18700 25.44412  42.40912 16.89582  21.77788       30.54296  
1 1 1 4  28 12 o 83.48299 11.48885  5.123519       1.244195      1.782565       1.969380      7.342787       1.605089      49.59496 19.78486  99.43509 12.38143  -49.84013      23.33968  
1 1 1 4  28 13 o 49.29303 10.68836  1.804246       0.6817862     2.242990       0.7913348     0.5404950      1.343030      54.85238 11.20565  37.36760 15.76313  17.48478       19.34018  
1 1 1 4  29 0  o 34.27243 20.93136  1.020032       1.811689      1.020032       1.811689      1.020032       1.811689      34.27243 20.93136  34.27243 20.93136  0.000000       0.000000  
1 1 1 4  29 1  o 42.15544 17.42680  0.8573864      1.592947      -0.1667679E-01 2.018322      2.301208       2.594035      40.63938 18.17617  55.61516 22.52453  -14.97578      28.94353  
1 1 1 4  29 2  o 29.51609 12.82964  0.2151537E-01  0.9400054     0.4354681      0.9942826     -3.462437      2.884500      33.55699 13.80965  37.04942 18.05713  -3.492432      22.73250  
1 1 1 4  29 3  o 35.64753 16.44369  -0.7328631     1.817782      -1.902365      2.244349      1.497338       3.099287      35.59752 16.98464  53.24337 23.21734  -17.64585      28.76670  
1 1 1 4  29 4  o 36.49538 14.16928  0.7677881      0.9862832     0.7522869      2.968601      0.7697114      1.045683      49.58857 22.12041  37.02234 14.52715  12.56622       26.46414  
1 1 1 4  29 5  o 20.00373 9.804412  -1.590121      0.8862113     -1.431146      1.346699      -1.711548      1.176964      27.44651 13.11235  24.10921 11.70087  3.337299       17.57396  
1 1 1 4  29 6  o 41.18813 15.91305  1.084050       1.239412      1.204252       1.818287      0.9797311      1.693903      45.49453 18.69357  43.30568 17.94273  2.188847       25.91122  
1 1 1 4  29 7  o 71.97081 11.11281  3.792908       1.031464      4.087409       1.991072      3.684882       1.205891      68.07436 20.36998  69.49402 13.50899  -1.419655      24.44236  
1 1 1 4  29 8  o 49.79648 15.25181  1.958986       1.107170      1.666295       2.139810      2.065993       1.293825      49.53128 20.30762  50.77789 16.60724  -1.246613      26.23356  
1 1 1 4  29 9  o 32.78673 13.55295  0.4203101      0.9633752     3.561321       2.520341      -0.1171403     1.042543      61.76967 22.95640  29.68963 13.18448  32.08004       26.47313  
1 1 1 4  30 0  o 36.05176 21.33359  1.347938       1.766826      1.347938       1.766826      1.347938       1.766826      36.05176 21.33359  36.05176 21.33359  0.000000       0.000000  
1 1 1 4  30 1  o 50.15738 19.21070  1.930755       1.795375      -0.6565201     3.111199      3.222499       2.198339      44.89091 20.97984  60.01288 21.57411  -15.12197      30.09312  
1 1 1 5  0  1  o 576.4901 16.36169  222.2719       12.54590      222.2719       12.54590      222.2719       12.54590      576.4901 16.36169  576.4901 16.36169  0.000000       0.000000  
1 1 1 5  0  2  o 33.96213 16.65717  1.132145       0.8949207     1.132145       0.8949207     1.132145       0.8949207     33.96213 16.65717  33.96213 16.65717  0.000000       0.000000  
1 1 1 5  0  3  o 547.7140 40.81429  204.8997       29.39882      204.8997       29.39882      204.8997       29.39882      547.7140 40.81429  547.7140 40.81429  0.000000       0.000000  
1 1 1 5  0  4  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 5  0  5  o 136.3381 0.7082933 12.38552       0.1286701     12.38552       0.1286701     12.38552       0.1286701     136.3381 0.7082933 136.3381 0.7082933 0.000000       0.000000  
1 1 1 5  0  6  o 768.9742 15.63922  394.9773       16.01013      394.9773       16.01013      394.9773       16.01013      768.9742 15.63922  768.9742 15.63922  0.000000       0.000000  
1 1 1 5  0  7  o 193.5481 5.966737  25.03455       1.535547      25.03455       1.535547      25.03455       1.535547      193.5481 5.966737  193.5481 5.966737  0.000000       0.000000  
1 1 1 5  0  8  o 40.07106 12.86585  1.355204       0.6059225     1.355204       0.6059225     1.355204       0.6059225     40.07106 12.86585  40.07106 12.86585  0.000000       0.000000  
1 1 1 5  0  9  o 121.8749 7.190629  10.00238       1.158372      10.00238       1.158372      10.00238       1.158372      121.8749 7.190629  121.8749 7.190629  0.000000       0.000000  
1 1 1 5  0  10 o 497.1849 10.82066  165.0599       7.161116      165.0599       7.161116      165.0599       7.161116      497.1849 10.82066  497.1849 10.82066  0.000000       0.000000  
1 1 1 5  0  11 x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 5  0  12 o 344.6047 11.83409  79.49815       5.419581      79.49815       5.419581      79.49815       5.419581      344.6047 11.83409  344.6047 11.83409  0.000000       0.000000  
1 1 1 5  0  13 o 482.2125 11.11924  155.3765       7.136174      155.3765       7.136174      155.3765       7.136174      482.2125 11.11924  482.2125 11.11924  0.000000       0.000000  
1 1 1 5  0  14 o 188.9323 9.749097  23.99964       2.439394      23.99964       2.439394      23.99964       2.439394      188.9323 9.749097  188.9323 9.749097  0.000000       0.000000  
1 1 1 5  0  15 o 38.65061 23.93238  0.7144589      2.445514      0.7144589      2.445514      0.7144589      2.445514      38.65061 23.93238  38.65061 23.93238  0.000000       0.000000  
1 1 1 5  0  16 o 378.4961 23.70070  97.34186       11.84483      97.34186       11.84483      97.34186       11.84483      378.4961 23.70070  378.4961 23.70070  0.000000       0.000000  
1 1 1 5  0  17 o 141.5792 34.53966  15.68859       5.644798      15.68859       5.644798      15.68859       5.644798      141.5792 34.53966  141.5792 34.53966  0.000000       0.000000  
1 1 1 5  0  18 o 34.37337 18.20383  1.139622       1.118701      1.139622       1.118701      1.139622       1.118701      34.37337 18.20383  34.37337 18.20383  0.000000       0.000000  
1 1 1 5  0  19 o 264.2483 9.002685  46.73613       3.161639      46.73613       3.161639      46.73613       3.161639      264.2483 9.002685  264.2483 9.002685  0.000000       0.000000  
1 1 1 5  0  20 f 325.4930 10.88342  70.93397       4.708445      70.93397       4.708445      70.93397       4.708445      325.4930 10.88342  325.4930 10.88342  0.000000       0.000000  
1 1 1 5  0  21 o 437.7612 11.20485  128.1455       6.526393      128.1455       6.526393      128.1455       6.526393      437.7612 11.20485  437.7612 11.20485  0.000000       0.000000  
1 1 1 5  0  22 o 428.0354 13.72659  122.7852       7.810920      122.7852       7.810920      122.7852       7.810920      428.0354 13.72659  428.0354 13.72659  0.000000       0.000000  
1 1 1 5  0  23 o 116.8185 7.423666  9.210537       1.144756      9.210537       1.144756      9.210537       1.144756      116.8185 7.423666  116.8185 7.423666  0.000000       0.000000  
1 1 1 5  0  24 o 41.46296 15.80704  1.559585       0.8223290     1.559585       0.8223290     1.559585       0.8223290     41.46296 15.80704  41.46296 15.80704  0.000000       0.000000  
1 1 1 5  0  25 o ?        ?         -2.294253      0.2146109     -2.294253      0.2146109     -2.294253      0.2146109     ?        ?         ?        ?         0.000000       0.000000  
1 1 1 5  0  26 o 147.9435 10.97861  14.88631       2.136276      14.88631       2.136276      14.88631       2.136276      147.9435 10.97861  147.9435 10.97861  0.000000       0.000000  
1 1 1 5  0  27 o 309.6211 14.77685  64.95103       6.064797      64.95103       6.064797      64.95103       6.064797      309.6211 14.77685  309.6211 14.77685  0.000000       0.000000  
1 1 1 5  0  28 f 46.99855 24.78012  2.216055       2.065602      2.216055       2.065602      2.216055       2.065602      46.99855 24.78012  46.99855 24.78012  0.000000       0.000000  
1 1 1 5  0  29 o 87.32607 26.97083  6.533932       2.746377      6.533932       2.746377      6.533932       2.746377      87.32607 26.97083  87.32607 26.97083  0.000000       0.000000  
1 1 1 5  0  30 o 46.80970 29.61119  1.016604       3.960601      1.016604       3.960601      1.016604       3.960601      46.80970 29.61119  46.80970 29.61119  0.000000       0.000000  
1 1 1 5  0  31 o 86.34791 32.82698  7.242608       3.551018      7.242608       3.551018      7.242608       3.551018      86.34791 32.82698  86.34791 32.82698  0.000000       0.000000  
1 1 1 5  0  32 o 19.32998 14.13784  -5.402018      2.269008      -5.402018      2.269008      -5.402018      2.269008      19.32998 14.13784  19.32998 14.13784  0.000000       0.000000  
1 1 1 5  0  33 o 32.36835 22.57010  -2.481596      3.524512      -2.481596      3.524512      -2.481596      3.524512      32.36835 22.57010  32.36835 22.57010  0.000000       0.000000  
1 1 1 5  0  34 o 44.31641 26.74286  2.078068       2.882696      2.078068       2.882696      2.078068       2.882696      44.31641 26.74286  44.31641 26.74286  0.000000       0.000000  
1 1 1 5  0  35 o 43.05247 27.47286  1.786557       3.497424      1.786557       3.497424      1.786557       3.497424      43.05247 27.47286  43.05247 27.47286  0.000000       0.000000  
1 1 1 5  0  36 o 67.54457 31.89591  6.022982       3.243895      6.022982       3.243895      6.022982       3.243895      67.54457 31.89591  67.54457 31.89591  0.000000       0.000000  
1 1 1 5  0  37 o 41.83615 28.44786  1.429964       4.820712      1.429964       4.820712      1.429964       4.820712      41.83615 28.44786  41.83615 28.44786  0.000000       0.000000  
1 1 1 5  1  0  o 304.3810 25.86385  63.26476       10.30921      63.26476       10.30921      63.26476       10.30921      304.3810 25.86385  304.3810 25.86385  0.000000       0.000000  
1 1 1 5  1  1  o 300.1423 2.217582  60.02340       0.8869117     63.81018       2.605910      59.52729       0.9432219     309.4080 6.320541  298.8983 2.368192  10.50974       6.749635  
1 1 1 5  1  2  o 91.53735 6.663028  5.614813       0.8071597     6.179113       1.210723      5.163351       1.082930      95.77642 9.616639  87.48537 9.438700  8.291046       13.47475  
1 1 1 5  1  3  o 412.4582 17.84288  113.9379       9.783400      99.57567       11.88191      144.1741       17.24004      384.7990 23.28173  462.4170 28.11174  -77.61798      36.50081  
1 1 1 5  1  4  o 886.5036 22.30045  526.6988       26.32223      523.8613       41.49395      528.6096       34.05050      880.1792 35.45109  886.3573 28.86828  -6.178101      45.71824  
1 1 1 5  1  5  o 556.0413 11.30415  206.2760       8.375647      202.1863       9.706497      218.1982       16.57262      550.3627 13.23549  570.4131 21.84397  -20.05042      25.54089  
1 1 1 5  1  6  o 1210.602 15.18801  978.8538       24.50054      972.7073       34.26667      985.2824       35.04441      1205.350 21.33463  1213.021 21.68089  -7.670044      30.41755  
1 1 1 5  1  7  o 722.2926 9.076658  347.9046       8.736001      331.4611       10.81616      378.7596       14.81630      704.8236 11.51647  753.0851 14.76462  -48.26147      18.72493  
1 1 1 5  1  8  f 397.2386 5.921886  105.1776       3.134621      99.56665       4.222821      112.0636       4.678103      386.4254 8.200937  409.9451 8.563880  -23.51971      11.85729  
1 1 1 5  1  9  o 101.1760 4.381624  6.834638       0.5893255     4.212805       1.027208      8.121029       0.7195193     78.83988 10.00258  110.2780 4.908736  -31.43815      11.14214  
1 1 1 5  1  10 o 558.0481 7.300455  207.6373       5.428690      205.7252       8.079653      209.2108       7.329678      555.2208 10.92077  559.9924 9.822664  -4.771545      14.68836  
1 1 1 5  1  11 o 451.7931 13.74579  136.5203       8.265657      133.4701       10.37081      141.8319       13.68569      446.1818 17.47705  459.0540 22.44127  -12.87222      28.44394  
1 1 1 5  1  12 o 216.0931 4.978264  31.12576       1.433483      32.79362       2.645405      30.43245       1.705597      221.5143 8.980866  213.5672 5.999275  7.947052       10.80034  
1 1 1 5  1  13 o 485.4532 7.994164  157.2317       5.171231      140.1747       7.690029      171.3121       6.986884      457.7210 12.62026  506.4864 10.35243  -48.76532      16.32310  
1 1 1 5  1  14 o 265.0307 7.388812  46.89906       2.606876      49.76373       4.579268      45.52557       3.170821      272.4628 12.64742  260.9695 9.132260  11.49326       15.59985  
1 1 1 5  1  15 o 186.2837 13.64012  23.36381       3.362372      22.28536       6.822061      23.70984       3.864331      178.4672 29.73243  187.3645 15.61991  -8.897308      33.58570  
1 1 1 5  1  16 o 366.8854 12.04426  90.16215       5.880242      87.98157       6.869461      96.14036       11.37422      362.0269 14.26788  376.3306 22.78866  -14.30365      26.88672  
1 1 1 5  1  17 o 148.5702 7.175085  14.76296       1.416271      14.20666       1.947597      15.38727       2.063219      145.4566 10.11123  151.3878 10.28891  -5.931213      14.42563  
1 1 1 5  1  18 o 605.2087 4.942253  244.2067       3.985691      243.0059       4.080706      269.0960       18.57823      603.7076 5.072653  630.7382 22.13888  -27.03064      22.71259  
1 1 1 5  1  19 o 346.0421 12.91761  80.25470       5.945953      85.83021       9.641680      76.83295       7.553256      356.3411 20.39061  337.8750 16.82961  18.46613       26.43884  
1 1 1 5  1  20 o 388.4617 7.440591  100.6878       3.851494      101.3825       4.716531      99.29715       6.672585      389.6597 9.083717  384.9709 13.02623  4.688843       15.88070  
1 1 1 5  1  21 o 182.8955 6.360260  22.33824       1.547711      22.63952       2.878049      22.21567       1.835748      183.6124 11.82601  182.3046 7.573363  1.307800       14.04316  
1 1 1 5  1  22 o 214.9371 8.907818  30.90529       2.545739      21.51855       7.484967      32.13316       2.707126      174.1457 33.47124  219.1338 9.292070  -44.98810      34.73710  
1 1 1 5  1  23 o 118.6901 9.690968  9.479222       1.519362      3.800944       3.415669      10.87991       1.696438      78.05631 26.99174  127.1623 10.09443  -49.10599      28.81755  
1 1 1 5  1  24 o 240.3288 6.513680  38.58350       2.084035      39.77336       3.097501      37.59940       2.816974      243.6423 9.559362  236.9647 8.937266  6.677612       13.08649  
1 1 1 5  1  25 o 56.52712 9.632210  2.199395       0.6995432     2.713461       0.7460418     -1.543129      2.012964      63.01736 9.151804  37.51649 17.30516  25.50087       19.57611  
1 1 1 5  1  26 f ?        ?         -1.602596      0.1783895     -1.605760      0.1786125     -0.3377566     3.571434      ?        ?         57.38943 24.97565  0.000000       24.97565  
1 1 1 5  1  27 o 69.43125 11.80341  3.340701       1.052984      4.466091       1.164330      -1.713434      2.467448      80.67304 11.12717  41.79463 19.23546  38.87841       22.22199  
1 1 1 5  1  28 o 226.8470 10.77932  34.81959       3.249029      34.49522       3.750310      35.79550       6.505068      225.1746 12.54860  224.7081 22.00685  0.4664917      25.33316  
1 1 1 5  1  29 o 105.3662 14.21531  7.724477       1.944997      4.950120       2.874755      10.06658       2.641328      82.00972 24.46135  119.5162 17.06959  -37.50648      29.82832  
1 1 1 5  1  30 o 101.2233 25.91506  7.861616       3.510076      7.691371       4.448141      8.142585       5.714400      98.72015 30.62997  100.9280 34.91172  -2.207893      46.44377  
1 1 1 5  1  31 o 88.19574 20.40385  5.842758       2.350248      5.623087       3.000643      6.191413       3.780299      84.96326 24.90164  88.13457 28.35369  -3.171303      37.73624  
1 1 1 5  1  32 f 68.65565 20.04649  3.610195       1.947808      3.628493       2.676815      3.589603       2.839623      69.01517 23.89327  69.00248 24.55238  0.1269531E-01  34.25942  
1 1 1 5  1  33 o 53.29196 20.67587  1.819822       2.098930      2.596864       2.740541      0.7173436      3.264368      60.66306 23.60048  53.99882 23.68036  6.664242       33.43265  
1 1 1 5  1  34 o 34.57500 16.63104  -2.403940      2.250112      -3.862712      3.020470      -0.5848911     3.372896      37.63723 18.37302  48.17933 22.28623  -10.54210      28.88329  
1 1 1 5  1  35 o 49.69525 20.54341  1.662908       2.213616      4.964551       3.679860      -0.2093130     2.771053      67.93059 27.06288  44.30427 20.38833  23.62632       33.88338  
1 1 1 5  1  36 f 44.92512 20.37703  0.4908377      2.640304      3.811015       4.322317      -1.485526      3.334797      60.02620 26.73948  42.67141 20.45242  17.35479       33.66454  
1 1 1 5  1  37 o 43.93019 20.34282  0.4285865      2.821649      -3.698582      4.565015      2.980238       3.589441      42.39320 21.04805  54.07343 24.20796  -11.68023      32.07874  
1 1 1 5  2  0  f 134.9402 11.86435  12.41951       2.093714      12.41951       2.093714      12.41951       2.093714      134.9402 11.86435  134.9402 11.86435  0.000000       0.000000  
1 1 1 5  2  1  o 712.8977 1.650701  338.6183       1.568083      338.6050       1.573575      340.5185       18.78465      712.8835 1.656515  713.1606 19.78619  -0.2770996     19.85541  
1 1 1 5  2  2  o 700.8016 15.50072  328.0472       14.47507      322.4707       18.93900      335.8807       22.44678      693.8616 20.50630  707.5015 23.84373  -13.63995      31.44888  
1 1 1 5  2  3  o 163.3446 0.6947066 17.77686       0.1512097     11.56989       3.127138      17.79141       0.1513868     130.2514 18.54027  163.4114 0.6952357 -33.16000      18.55330  
1 1 1 5  2  4  o 656.9132 16.87116  288.5721       14.75594      277.0811       18.03617      311.8323       25.66104      643.0277 21.07795  680.6539 28.35479  -37.62622      35.33092  
1 1 1 5  2  5  f 305.8687 6.219720  62.35808       2.535008      69.14935       3.380961      53.63765       3.831189      322.0539 7.878401  283.3976 10.16173  38.65631       12.85807  
1 1 1 5  2  6  o 362.5899 4.649560  87.61443       2.246473      88.62578       2.576491      84.40781       4.587792      364.6639 5.302275  355.6235 9.690468  9.040405       11.04623  
1 1 1 5  2  7  o 525.5308 7.325960  184.1191       5.130222      188.9869       6.973600      178.3770       7.573991      532.3055 9.831562  517.0782 10.99246  15.22729       14.74767  
1 1 1 5  2  8  o 414.3913 5.403157  114.4497       2.983540      114.0642       4.092134      114.8873       4.359246      413.6293 7.424462  415.1019 7.881032  -1.472595      10.82743  
1 1 1 5  2  9  o 215.3879 5.397168  30.93995       1.547813      29.42612       2.251383      32.29675       2.131416      209.9159 8.063787  219.9751 7.281487  -10.05919      10.86484  
1 1 1 5  2  10 o 360.9151 7.484142  86.85547       3.599321      86.49194       4.405052      87.58572       6.243283      359.9699 9.191084  361.9125 12.96696  -1.942596      15.89397  
1 1 1 5  2  11 o 353.4984 9.407285  83.43345       4.427301      80.64056       5.386759      89.24723       7.771935      347.3281 11.65547  364.8978 16.02303  -17.56964      19.81382  
1 1 1 5  2  12 o 452.8889 8.044035  136.8203       4.854441      149.4042       10.56741      133.4544       5.465232      472.0038 16.82848  447.2028 9.171293  24.80096       19.16534  
1 1 1 5  2  13 o 511.8001 7.760487  174.7558       5.292525      174.0979       7.172309      175.5423       7.841961      510.5442 10.54271  512.5389 11.48218  -1.994720      15.58811  
1 1 1 5  2  14 o 480.6260 4.663220  153.9923       2.986529      155.3267       3.111020      138.3122       10.66406      482.6939 4.836793  453.4851 17.68150  29.20874       18.33113  
1 1 1 5  2  15 o 102.2201 25.83036  7.364254       3.519236      4.922802       4.752241      10.32906       5.236883      90.04787 31.78916  120.6383 32.04041  -30.59047      45.13467  
1 1 1 5  2  16 o 256.5440 6.048039  43.89738       2.067521      39.21788       4.255318      45.34343       2.365497      241.6278 13.26727  260.6082 6.817638  -18.98048      14.91646  
1 1 1 5  2  17 o 370.9489 9.486912  91.98123       4.685501      92.80590       8.707853      91.64517       5.558816      371.1176 17.65931  370.0181 11.28740  1.099487       20.95845  
1 1 1 5  2  18 o 536.0902 4.616275  191.5939       3.297638      190.4536       3.411114      207.8815       12.89221      534.4802 4.789510  555.9266 17.42501  -21.44635      18.07126  
1 1 1 5  2  19 o 348.4486 10.76480  81.22527       4.992260      84.78172       6.295026      75.19752       8.195335      355.6248 13.30757  333.9151 18.49082  21.70975       22.78161  
1 1 1 5  2  20 o 300.9002 8.667854  60.49329       3.471801      52.10371       5.144615      67.50907       4.704577      278.5972 13.90199  317.6040 11.13354  -39.00687      17.81070  
1 1 1 5  2  21 o 227.0353 6.605905  34.41217       1.996352      35.56989       3.989809      34.02551       2.305748      230.1580 13.06289  225.6745 7.678721  4.483536       15.15262  
1 1 1 5  2  22 o 447.1724 10.50311  133.6738       6.258445      135.7997       9.616178      132.1116       8.243169      449.4256 16.08318  443.7694 13.95737  5.656189       21.29500  
1 1 1 5  2  23 o 131.1272 11.16437  11.58972       1.932211      11.74447       3.314137      11.51003       2.378230      130.4625 19.67515  130.2552 13.91744  0.2072449      24.09994  
1 1 1 5  2  24 o 264.3318 6.781294  46.68169       2.386584      48.37209       3.503998      45.21893       3.259525      268.6768 9.803677  259.8167 9.430501  8.860077       13.60318  
1 1 1 5  2  25 o 153.1328 6.621979  15.69364       1.348037      14.68549       1.552939      18.77568       2.715260      147.9791 7.904217  166.6742 12.31251  -18.69507      14.63128  
1 1 1 5  2  26 o 21.59292 8.851322  0.1034397      0.4064145     0.1300753      0.4106365     -1.171914      2.841460      22.05661 8.951326  47.75257 21.44576  -25.69596      23.23891  
1 1 1 5  2  27 o 126.5723 5.948735  10.73331       1.000507      11.21325       1.057960      6.670986       3.077935      129.3524 6.155583  95.63651 24.15103  33.71592       24.92315  
1 1 1 5  2  28 o 130.9028 10.34921  11.62853       1.790541      12.97132       2.041594      7.153763       3.726927      138.0927 11.19076  97.80762 27.47058  40.28504       29.66253  
1 1 1 5  2  29 o 203.0476 9.081781  27.83489       2.450992      29.73698       3.023878      24.19177       4.184901      209.2928 10.88003  186.1645 17.05945  23.12828       20.23363  
1 1 1 5  2  30 o 142.7984 16.21964  14.34851       3.031683      10.45214       5.218771      16.33316       3.724602      113.2168 32.74252  151.0856 18.91375  -37.86882      37.81273  
1 1 1 5  2  31 o 82.46120 18.58159  5.042515       1.992682      4.067610       3.846962      5.400015       2.329566      75.72384 28.31845  84.50457 20.82457  -8.780731      35.15107  
1 1 1 5  2  32 o 68.18817 19.41113  3.553952       1.848126      2.719102       2.332498      4.962106       3.029301      61.72196 22.21836  78.27455 25.39860  -16.55259      33.74529  
1 1 1 5  2  33 o 38.70058 17.61632  -0.6849155     1.995195      2.341147       2.696307      -4.347178      2.966233      58.87214 23.25782  37.11132 18.13593  21.76082       29.49302  
1 1 1 5  2  34 o 63.60189 22.94436  3.491356       2.489014      4.174053       3.499487      2.792416       3.540874      67.42725 26.53992  60.96129 25.64858  6.465958       36.90822  
1 1 1 5  2  35 f 51.47430 21.21532  1.909158       2.351325      -0.7185837     3.161900      5.160096       3.516909      44.86726 21.02736  69.11158 26.77735  -24.24432      34.04668  
1 1 1 5  2  36 o 32.51924 15.93663  -3.019699      2.339220      0.1347930      3.874209      -4.829517      2.934511      48.73820 22.97675  33.61002 16.71873  15.12819       28.41561  
1 1 1 5  2  37 o 32.11860 15.88720  -3.508078      2.511294      -6.336485      3.277812      0.5117043      3.907639      32.83842 16.52539  47.54484 22.60781  -14.70641      28.00360  
1 1 1 5  3  0  o 90.10381 9.719163  5.597961       1.132626      5.597961       1.132626      5.597961       1.132626      90.10381 9.719163  90.10381 9.719163  0.000000       0.000000  
1 1 1 5  3  1  o 555.5785 1.839543  205.6601       1.361849      0.000000       0.000000      205.6601       1.361849      ?        ?         555.5785 1.839543  0.000000       1.839543  
1 1 1 5  3  2  o 509.8517 7.060409  173.2847       4.796751      181.9923       7.753537      167.8857       6.105346      522.2996 11.14055  501.7571 9.131524  20.54248       14.40474  
1 1 1 5  3  3  o 176.7431 4.249927  20.81668       1.000915      19.94515       2.041637      21.09243       1.148391      172.7191 8.900862  177.8386 4.850604  -5.119537      10.13675  
1 1 1 5  3  4  o 931.1467 28.24977  583.0927       35.01096      591.7639       42.36843      564.4232       62.16834      936.0980 34.02284  906.2739 51.69415  29.82404       61.88569  
1 1 1 5  3  5  o 302.4669 6.199393  60.97860       2.498622      60.86023       3.022004      61.23438       4.442139      302.1443 7.505975  302.7662 11.02904  -0.6218567     13.34089  
1 1 1 5  3  6  o 362.1891 6.270769  87.43794       3.026424      85.87051       3.506114      92.01941       5.994245      358.9001 7.331266  371.1418 12.13684  -12.24176      14.17922  
1 1 1 5  3  7  o 173.5933 3.912154  20.08101       0.9049454     21.19572       1.416340      19.31202       1.176380      178.2257 5.972245  170.1465 5.194696  8.079224       7.915339  
1 1 1 5  3  8  f 564.0605 7.278870  212.1173       5.470956      204.7865       7.306083      221.4753       8.254671      554.0759 9.895593  576.1484 10.75207  -22.07251      14.61265  
1 1 1 5  3  9  o 425.9849 7.209217  120.9849       4.092190      127.8348       6.190589      115.6688       5.453666      437.7020 10.61402  416.3976 9.828942  21.30441       14.46601  
1 1 1 5  3  10 o 594.9081 9.256054  236.0981       7.337520      239.2611       12.76347      234.5368       8.967501      597.9120 16.03431  592.7488 11.35343  5.163147       19.64687  
1 1 1 5  3  11 o 316.4817 11.69393  66.97752       4.923059      68.40263       5.808399      63.34215       9.276994      319.6236 13.66936  306.1518 22.90640  13.47180       26.67498  
1 1 1 5  3  12 o 125.5348 9.533653  10.57866       1.582841      11.42781       2.022748      9.237358       2.542205      130.2613 11.78062  116.2284 16.90996  14.03286       20.60897  
1 1 1 5  3  13 o 309.4517 6.471318  63.86422       2.668450      62.51113       4.334138      64.69025       3.386380      305.7141 10.65561  311.2486 8.172044  -5.534424      13.42849  
1 1 1 5  3  14 o 356.3677 6.264277  84.70110       2.974697      80.23653       3.763979      92.12888       4.854970      346.7247 8.146835  371.2565 9.822470  -24.53180      12.76134  
1 1 1 5  3  15 o 240.5972 7.563107  38.66854       2.421724      39.90280       4.114705      38.01440       2.995484      243.8398 12.70755  238.3764 9.449123  5.463425       15.83565  
1 1 1 5  3  16 o 77.96963 4.134754  4.063798       0.4280487     3.809823       1.110633      4.108105       0.4638859     74.60753 11.54401  78.37367 4.460301  -3.766144      12.37572  
1 1 1 5  3  17 o 398.0692 9.382300  105.8467       4.976699      104.1731       6.682778      107.9307       7.456918      394.2805 12.73645  401.1030 13.97313  -6.822479      18.90676  
1 1 1 5  3  18 o 142.4875 7.452823  13.58470       1.410129      17.67372       2.202531      10.74441       1.835669      162.3137 10.23554  126.3016 11.01732  36.01204       15.03821  
1 1 1 5  3  19 o 290.1798 14.55484  56.56000       5.609954      58.97976       8.699949      54.83775       7.339708      294.7571 22.31606  284.8054 19.45688  9.951721       29.60704  
1 1 1 5  3  20 o 777.7374 17.61808  406.3148       18.25850      438.2868       31.33676      389.8820       22.46592      801.4555 29.39256  759.7129 22.21610  41.74261       36.84396  
1 1 1 5  3  21 o 226.0503 9.164524  34.17968       2.754781      35.22060       4.909658      33.70139       3.328028      228.5271 16.22836  224.2448 11.17277  4.282242       19.70255  
1 1 1 5  3  22 o 126.7705 9.390245  10.79506       1.574977      8.047483       3.210983      11.66552       1.807321      107.0129 23.18896  131.6959 10.38279  -24.68295      25.40728  
1 1 1 5  3  23 o 254.2203 9.987197  43.28722       3.376614      43.96949       4.089994      41.82682       5.983868      255.9172 12.02725  248.3636 18.20745  7.553635       21.82122  
1 1 1 5  3  24 o 302.3811 8.048791  61.15102       3.240205      62.69106       4.606565      59.64294       4.558497      305.6023 11.33183  298.0367 11.49990  7.565613       16.14491  
1 1 1 5  3  25 o 200.6074 8.409284  26.97779       2.242928      25.99127       2.790369      28.77892       3.770353      196.5244 10.69576  206.1628 13.80410  -9.638351      17.46288  
1 1 1 5  3  26 o 301.1205 9.955739  60.95292       3.989236      56.65420       4.888913      69.51759       6.900772      289.4850 12.70491  319.2850 16.27348  -29.80002      20.64560  
1 1 1 5  3  27 o 120.4866 5.896943  9.728206       0.9438826     9.641028       0.9804382     10.83231       3.489173      119.9131 6.156536  122.9602 22.10802  -3.047134      22.94924  
1 1 1 5  3  28 o 165.9252 7.735105  18.51322       1.705513      18.30393       1.945729      19.20730       3.543372      164.7382 8.896695  166.4987 16.17459  -1.760452      18.45992  
1 1 1 5  3  29 o 125.3239 7.168749  10.57386       1.192162      10.05276       1.289026      13.65541       3.134623      122.0357 7.970482  139.3449 17.24990  -17.30929      19.00230  
1 1 1 5  3  30 o 118.7298 18.13134  10.11530       2.777737      8.543661       4.261649      11.27619       3.662666      103.7626 29.45585  122.8893 23.21773  -19.12669      37.50614  
1 1 1 5  3  31 o 76.74145 13.41148  4.189465       1.321555      2.703174       1.506972      9.138994       2.750016      60.75064 17.60224  111.2679 19.24392  -50.51722      26.08002  
1 1 1 5  3  32 o 63.04964 19.80359  3.008874       1.853396      5.806073       2.313993      -1.996944      3.095551      86.51107 20.40613  44.72622 20.91076  41.78485       29.21763  
1 1 1 5  3  33 o 99.89886 16.32935  7.511661       2.098690      9.944878       2.929072      4.944667       3.008514      111.8891 20.39703  75.38628 25.34714  36.50287       32.53485  
1 1 1 5  3  34 o 65.13160 22.74745  3.734401       2.428913      0.8945670      3.507802      6.350138       3.366554      53.22949 23.87288  79.91281 26.81252  -26.68332      35.90022  
1 1 1 5  3  35 o 49.12123 20.71426  1.523818       2.317943      1.044049       3.384189      1.947797       3.181340      51.17317 23.15445  53.85993 23.50379  -2.686760      32.99328  
1 1 1 5  3  36 o 38.76544 18.51830  -1.472678      2.684835      -0.3045622     4.042766      -2.394365      3.591097      48.05832 22.89248  41.80335 20.32291  6.254967       30.61186  
1 1 1 5  3  37 o 49.00030 20.51803  2.086273       2.249301      4.760403       3.238322      -0.4065313     3.126604      61.55341 25.07899  42.59634 20.24558  18.95707       32.23103  
1 1 1 5  4  0  o 240.7668 21.61615  39.63968       6.800269      39.63968       6.800269      39.63968       6.800269      240.7668 21.61615  240.7668 21.61615  0.000000       0.000000  
1 1 1 5  4  1  o 727.6299 15.54897  353.6505       15.07599      312.9616       39.70437      360.5052       16.29648      677.0345 44.25281  734.5103 16.65031  -57.47577      47.28154  
1 1 1 5  4  2  o 306.4690 5.196810  62.59516       2.122252      65.53476       3.047170      59.82607       2.957474      313.5391 7.293424  299.5692 7.408840  13.96988       10.39639  
1 1 1 5  4  3  f 640.4036 10.78310  273.5817       9.201765      274.9956       15.30814      272.7817       11.51413      641.1102 17.93673  639.2415 13.51738  1.868652       22.45987  
1 1 1 5  4  4  o 959.0651 17.86815  614.9139       22.83501      607.3066       30.30271      624.9104       34.73665      951.5435 23.91794  964.3476 27.05891  -12.80414      36.11444  
1 1 1 5  4  5  o 330.4301 9.677447  72.88102       4.256433      74.96220       6.260409      71.09196       5.804430      334.7759 14.06512  326.0647 13.38773  8.711182       19.41801  
1 1 1 5  4  6  o 663.6010 10.45993  293.7621       9.249310      279.7782       13.30075      306.8565       12.87084      647.1432 15.42419  677.8706 14.24907  -30.72736      20.99861  
1 1 1 5  4  7  o 490.0108 6.393985  160.0543       4.174945      166.0615       5.430455      151.3720       6.528585      499.0446 8.166263  476.3498 10.28536  22.69482       13.13303  
1 1 1 5  4  8  o 708.4747 8.673986  334.7429       8.188731      311.6513       11.36088      359.7116       11.81361      683.2493 12.47841  734.0900 12.07703  -50.84076      17.36563  
1 1 1 5  4  9  f 248.5110 4.044869  41.15615       1.339441      40.84203       1.505589      42.34842       2.933187      247.5531 4.564198  251.8266 8.754384  -4.273560      9.872747  
1 1 1 5  4  10 o 379.7935 6.965700  96.17683       3.525216      96.57628       4.968962      95.77206       5.002019      380.3123 9.813293  378.7154 9.920486  1.596893       13.95409  
1 1 1 5  4  11 o 216.7786 6.014881  31.35405       1.735789      32.00919       2.265729      30.42320       2.700718      218.9300 7.778931  213.3019 9.525947  5.628128       12.29859  
1 1 1 5  4  12 o 159.8555 2.067785  17.02700       0.4404599     20.25827       1.986663      16.85996       0.4517014     174.0245 8.593805  159.0690 2.131044  14.95558       8.854086  
1 1 1 5  4  13 o 285.9401 3.956127  54.49547       1.507366      54.25271       4.096937      54.53348       1.621076      284.7449 10.81734  286.0312 4.253205  -1.286346      11.62345  
1 1 1 5  4  14 o 185.8716 6.104184  23.06654       1.509819      24.40599       2.339954      22.11113       1.976242      190.9481 9.223693  181.8224 8.177716  9.125702       12.32686  
1 1 1 5  4  15 f 268.5750 7.765777  48.18288       2.776308      47.71475       3.460075      49.02906       4.651926      267.0689 9.739046  270.3108 12.95273  -3.241882      16.20562  
1 1 1 5  4  16 o 483.8116 13.30626  156.8860       8.570248      158.8982       10.91063      153.6443       13.84827      486.0326 16.87213  476.3801 21.87404  9.652496       27.62504  
1 1 1 5  4  17 o 193.0745 10.74402  24.99595       2.753272      23.62835       3.610822      26.89555       4.255566      187.1861 14.59155  199.5294 16.14353  -12.34335      21.76067  
1 1 1 5  4  18 o 322.0568 12.82260  69.52503       5.491778      73.19792       9.513103      67.68921       6.725652      328.6145 21.84921  317.2409 15.96134  11.37360       27.05831  
1 1 1 5  4  19 o 275.7506 13.17947  51.00911       4.828685      51.27712       8.364603      50.87516       5.913527      274.5632 23.07615  274.9073 16.21511  -0.3441467     28.20352  
1 1 1 5  4  20 o 526.9959 14.70510  186.2413       10.31630      185.1384       17.67507      186.8111       12.70488      522.0685 25.48439  526.9207 18.12169  -4.852234      31.27059  
1 1 1 5  4  21 o 177.4342 9.146504  21.08069       2.155251      21.90573       3.477330      20.56606       2.746384      180.2032 14.60649  174.9504 11.85068  5.252777       18.80926  
1 1 1 5  4  22 o 551.3240 13.42270  203.6973       9.860987      204.7506       12.04842      201.5602       17.16200      551.7203 16.40666  544.5989 23.70605  7.121338       28.82976  
1 1 1 5  4  23 o 235.8159 8.967423  37.22223       2.812692      37.52899       3.324019      36.44884       5.277990      236.5748 10.57109  231.9144 17.20166  4.660385       20.19022  
1 1 1 5  4  24 o 398.8967 9.190801  106.4693       4.885256      104.4498       7.149673      108.2379       6.690731      393.8547 13.64372  401.2704 12.52839  -7.415710      18.52328  
1 1 1 5  4  25 f 124.5565 11.40413  10.50987       1.871805      8.952271       2.282030      13.71249       3.272251      114.0464 15.41038  140.9492 17.82011  -26.90276      23.55920  
1 1 1 5  4  26 o 101.5023 15.40236  7.147066       2.017896      7.472707       3.028430      6.887043       2.706157      101.8532 22.87442  98.08025 21.31611  3.773003       31.26685  
1 1 1 5  4  27 o 234.5209 11.94053  37.26961       3.719178      34.42307       4.361684      44.85325       7.119243      224.4022 14.66697  252.8830 21.32570  -28.48079      25.88253  
1 1 1 5  4  28 o 49.60910 19.22033  1.173530       1.811902      0.2877193      2.742697      1.859501       2.413573      52.46664 22.34552  58.73392 22.32757  -6.267284      31.58864  
1 1 1 5  4  29 o 140.7409 6.414406  13.30363       1.199795      13.62475       1.357562      12.15794       2.564271      142.2895 7.183238  132.2409 14.80594  10.04863       16.45645  
1 1 1 5  4  30 o 130.2440 12.61069  11.72931       2.161269      10.79856       2.961146      12.79041       3.161693      122.2906 18.77028  133.5434 18.24391  -11.25272      26.17563  
1 1 1 5  4  31 o 38.92935 13.05685  1.001226       0.7983449     1.162302       0.8643965     0.6646062E-01  2.082331      41.44221 13.57548  44.23746 19.16257  -2.795254      23.48399  
1 1 1 5  4  32 o 120.5722 9.814187  10.04711       1.563169      10.31978       1.836873      9.331140       2.976479      121.4141 11.49039  109.4459 21.17506  11.96822       24.09175  
1 1 1 5  4  33 o 29.25671 12.83680  -0.1059526     0.9603909     0.4084197      1.012101      -4.757320      3.043515      34.03283 13.96129  36.71938 18.03224  -2.686554      22.80525  
1 1 1 5  4  34 o 57.09398 19.10570  2.672861       1.709492      3.274472       2.216804      1.790204       2.685131      61.62749 21.71555  53.25286 22.36604  8.374638       31.17378  
1 1 1 5  4  35 o 46.94540 19.10700  1.479435       1.877313      1.726447       2.233133      0.8842206      3.466505      49.77402 20.61026  50.74059 23.14448  -0.9665642     30.99113  
1 1 1 5  4  36 o 40.99525 19.59533  -1.309829      3.015914      -3.019577      3.913549      1.190348       4.732495      41.98960 20.58508  52.75074 25.02443  -10.76114      32.40321  
1 1 1 5  4  37 o 60.29325 14.86340  3.043371       1.186437      4.475121       1.330882      -2.499256      2.618567      74.46487 13.92443  34.77689 17.00471  39.68798       21.97840  
1 1 1 5  5  0  o 450.5770 18.35566  136.1758       10.97913      136.1758       10.97913      136.1758       10.97913      450.5770 18.35566  450.5770 18.35566  0.000000       0.000000  
1 1 1 5  5  1  o 636.1133 21.98088  271.2944       18.60373      263.1797       31.02178      275.8517       23.24811      622.7787 37.55626  640.3569 27.30803  -17.57813      46.43491  
1 1 1 5  5  2  o 809.1274 13.97250  437.0958       15.06485      410.2696       19.47642      477.0494       23.76884      783.2703 18.66053  843.9109 21.15340  -60.64063      28.20783  
1 1 1 5  5  3  o 1039.217 15.75227  721.4562       21.81337      756.4015       40.83669      707.5045       25.80295      1060.370 28.92847  1028.534 18.82682  31.83569       34.51530  
1 1 1 5  5  4  o 500.5443 8.234405  167.0526       5.492224      160.6579       7.546416      174.2543       8.008520      490.6938 11.54135  511.0213 11.76088  -20.32755      16.47790  
1 1 1 5  5  5  o 173.8357 7.981818  20.19066       1.843969      20.07827       2.165590      20.48700       3.516493      173.2538 9.415753  174.4592 15.28076  -1.205353      17.94876  
1 1 1 5  5  6  o 1056.036 17.53228  745.7616       24.67122      788.5894       38.14583      714.9642       32.34752      1083.407 26.42298  1032.487 23.51164  50.92053       35.36906  
1 1 1 5  5  7  o 497.9785 8.126774  165.3599       5.392651      156.3339       7.383836      175.6773       7.894466      483.9968 11.44896  513.0591 11.54734  -29.06238      16.26099  
1 1 1 5  5  8  o 293.7297 5.661996  57.50840       2.216108      59.46289       4.815624      56.98328       2.496124      298.1964 12.14469  292.3674 6.407132  5.828949       13.73116  
1 1 1 5  5  9  o 245.2480 3.803946  40.08209       1.243121      38.17356       2.501957      40.70769       1.432446      239.1228 7.862782  247.1461 4.349615  -8.023331      8.985683  
1 1 1 5  5  10 o 324.9847 3.911500  70.38564       1.693869      64.93874       3.434860      72.13589       1.947089      311.9048 8.271741  328.9880 4.441525  -17.08319      9.388762  
1 1 1 5  5  11 o 331.5132 6.583349  73.28587       2.908179      72.31290       4.856300      73.82990       3.631303      328.8578 11.09804  332.6625 8.191909  -3.804657      13.79398  
1 1 1 5  5  12 o 202.0009 6.030891  27.23367       1.621518      25.85575       2.334532      28.51808       2.253936      196.6101 8.934224  206.5644 8.204978  -9.954285      12.13021  
1 1 1 5  5  13 f 243.5472 7.492452  39.61431       2.428644      41.48720       3.222216      37.15088       3.695457      249.0424 9.728457  235.4160 11.81816  13.62637       15.30724  
1 1 1 5  5  14 o 309.7670 9.121534  64.13631       3.760999      71.52210       8.238902      62.19207       4.227138      325.4342 19.08282  304.8819 10.42030  20.55228       21.74251  
1 1 1 5  5  15 o 286.6151 7.679448  54.86645       2.930293      51.71981       3.845982      59.22087       4.524274      277.9802 10.40127  297.3455 11.43997  -19.36533      15.46155  
1 1 1 5  5  16 o 166.8551 8.635369  18.63874       1.913436      16.93869       2.511390      20.99121       2.954241      158.6728 11.96604  176.6450 12.63421  -17.97221      17.40142  
1 1 1 5  5  17 o 84.92224 19.58786  5.048388       2.171381      2.909953       2.492427      11.78219       4.422874      68.03156 23.07059  129.4493 26.53289  -61.41776      35.16029  
1 1 1 5  5  18 o 488.4999 20.19975  161.0032       13.12037      193.0589       29.35933      153.0038       14.66636      524.2985 42.38470  475.2286 23.23080  49.06992       48.33356  
1 1 1 5  5  19 o 556.9099 4.660031  206.7570       3.458177      206.2701       3.522833      219.6555       18.13330      556.2474 4.752810  569.4404 23.95112  -13.19299      24.41813  
1 1 1 5  5  20 o 140.1198 9.265529  13.16787       1.720278      14.69866       2.132378      10.31456       2.911262      147.9000 10.89638  122.5529 18.39453  25.34711       21.37966  
1 1 1 5  5  21 o 197.8778 13.20511  26.33515       3.461944      26.33515       3.461944      0.000000       0.000000      197.8778 13.20511  ?        ?         0.000000       13.20511  
1 1 1 5  5  22 o 180.7237 8.725178  21.86790       2.094970      25.88986       3.375993      19.34922       2.671586      196.1372 12.99039  169.5945 11.89728  26.54276       17.61521  
1 1 1 5  5  23 o 451.2811 10.56523  136.3346       6.353305      136.4559       6.771719      135.4423       18.35886      451.3364 11.25965  440.6581 31.47307  10.67828       33.42655  
1 1 1 5  5  24 o 366.9289 8.458198  90.05579       4.135550      91.40015       5.954669      88.80317       5.747911      368.6992 12.13680  363.4863 11.88318  5.212982       16.98563  
1 1 1 5  5  25 o 173.5656 9.633636  20.26295       2.219322      20.11426       3.064495      20.42694       3.218345      172.1522 13.46604  173.3529 14.05286  -1.200699      19.46323  
1 1 1 5  5  26 o 114.7856 14.00976  9.053970       2.098501      9.496679       2.353927      7.339724       4.632024      117.2271 15.44459  100.2750 31.27965  16.95214       34.88484  
1 1 1 5  5  27 o 185.3368 13.66347  23.46410       3.350672      28.92332       3.967022      9.874922       6.258869      205.5334 14.57930  113.2725 36.48725  92.26091       39.29218  
1 1 1 5  5  28 f 46.61346 17.54477  1.151863       1.481688      2.450552       1.950813      -0.6187318     2.277837      60.54026 20.41107  43.88164 19.48754  16.65862       28.22014  
1 1 1 5  5  29 o 84.79469 14.17518  5.057433       1.545166      2.399000       2.232947      7.500026       2.140382      61.07057 21.76772  102.9891 16.12519  -41.91850      27.08977  
1 1 1 5  5  30 o 151.3891 9.975224  15.62827       2.001078      17.32854       3.197801      14.53396       2.565452      156.9996 15.48695  144.6100 13.46835  12.38966       20.52418  
1 1 1 5  5  31 o 80.41652 8.117616  4.423505       0.8579609     4.400401       0.8802124     4.863233       3.839984      80.14020 8.365642  78.99718 28.49875  1.143013       29.70122  
1 1 1 5  5  32 o 53.15770 12.57597  2.058583       0.8767884     1.787018       0.9299101     4.233814       2.631824      49.40756 13.66495  72.32777 23.68764  -22.92021      27.34658  
1 1 1 5  5  33 o 48.82029 11.01881  1.736724       0.6997529     1.692351       0.7297050     2.244185       2.467704      48.03945 11.54338  56.61237 22.28553  -8.572922      25.09770  
1 1 1 5  5  34 o 37.54402 12.89757  0.9905984      0.7794371     0.7262690      0.8062758     4.763895       3.046291      34.47533 12.94951  69.79615 25.35488  -35.32082      28.47033  
1 1 1 5  5  35 o 23.85105 10.59564  -0.1342013     0.6739500     -0.1840029     0.6959967     0.6147474      2.699053      23.84546 10.66867  46.35609 20.85311  -22.51063      23.42377  
1 1 1 5  5  36 o 64.58396 24.34814  4.667513       2.856175      4.750329       3.309258      4.425664       5.655163      63.38351 25.52277  59.64820 28.00750  3.735306       37.89237  
1 1 1 5  5  37 o 38.25775 18.71657  -2.352935      3.184729      -6.260978      4.635935      1.139526       4.382515      39.12518 19.68435  49.29240 23.57758  -10.16722      30.71442  
1 1 1 5  6  0  o 278.4802 3.634442  51.69941       1.348152      51.69941       1.348152      51.69941       1.348152      278.4802 3.634442  278.4802 3.634442  0.000000       0.000000  
1 1 1 5  6  1  o 275.6789 4.046763  50.64417       1.486568      48.00902       1.860192      55.30125       2.472937      268.3951 5.201274  288.0353 6.443083  -19.64029      8.280493  
1 1 1 5  6  2  o 791.0850 17.20918  418.3424       18.14082      421.2531       25.84654      415.5164       25.46764      792.1108 24.51693  786.7411 24.32234  5.369690       34.53485  
1 1 1 5  6  3  o 538.1896 7.502525  193.1054       5.380421      188.2173       10.36113      194.9102       6.295845      530.6504 14.66702  540.6365 8.739269  -9.986084      17.07326  
1 1 1 5  6  4  o 1055.942 14.05384  744.6223       19.77464      716.3649       26.87987      777.9553       29.19441      1034.599 19.49762  1077.949 20.32488  -43.34973      28.16483  
1 1 1 5  6  5  o 100.9507 3.678601  6.800029       0.4940136     6.902012       0.5667998     6.477686       1.007684      101.6835 4.192161  98.26102 7.759006  3.422516       8.819092  
1 1 1 5  6  6  o 650.6771 11.67489  282.5804       10.12260      285.9289       14.46335      279.3654       14.17213      653.7205 16.61711  646.1927 16.47228  7.527771       23.39795  
1 1 1 5  6  7  f 1031.476 14.98519  711.0805       20.59656      752.0607       32.43893      683.4010       26.65991      1058.546 22.99763  1010.024 19.80858  48.52234       30.35245  
1 1 1 5  6  8  o 479.1839 7.647927  153.1211       4.883368      145.4856       5.887461      169.9577       8.742512      466.9733 9.461554  504.2486 13.02212  -37.27527      16.09648  
1 1 1 5  6  9  o 289.2872 5.361451  55.78460       2.066736      58.41670       2.807062      52.66872       3.054161      295.9782 7.117358  280.8830 8.168731  15.09518       10.83443  
1 1 1 5  6  10 o 206.7161 2.140888  28.47284       0.5897146     31.65026       0.8615999     25.67249       0.8088611     217.9364 2.966896  196.2782 3.092633  21.65825       4.285656  
1 1 1 5  6  11 o 582.8569 3.924366  226.4226       3.047930      225.5685       3.128980      242.2724       13.47866      581.7507 4.036383  600.8458 16.85153  -19.09509      17.32820  
1 1 1 5  6  12 o 334.5704 6.108755  74.64906       2.723415      74.22964       3.646586      75.17807       4.095334      333.5040 8.205629  335.4331 9.171021  -1.929047      12.30610  
1 1 1 5  6  13 o 376.9779 8.110577  94.85630       4.074189      95.42805       6.049787      94.38179       5.511329      377.5094 12.04189  375.5844 11.02416  1.925049       16.32603  
1 1 1 5  6  14 o 177.0147 3.568519  20.88437       0.8417261     17.69274       4.335343      21.00939       0.8580540     160.6902 20.72944  177.5426 3.626924  -16.85245      21.04434  
1 1 1 5  6  15 o 311.4941 7.641928  64.75671       3.171950      62.47291       3.827256      69.76649       5.668490      305.6742 9.407462  322.5049 13.21840  -16.83075      16.22426  
1 1 1 5  6  16 o 285.3981 8.366779  54.42368       3.178438      54.07286       3.780590      55.26945       5.870109      284.3024 9.994971  286.6353 15.42573  -2.332855      18.38077  
1 1 1 5  6  17 o 179.1511 10.42725  21.51896       2.478458      21.18292       3.025780      22.20415       4.320648      177.4464 12.88444  180.8581 18.17433  -3.411743      22.27813  
1 1 1 5  6  18 o 154.4658 15.76065  16.16325       3.198587      19.17803       4.260755      12.27031       4.841700      167.7455 19.42003  131.8936 28.38999  35.85197       34.39665  
1 1 1 5  6  19 o 150.2614 10.70963  15.16421       2.130293      13.58751       2.335824      22.95930       5.193694      141.9774 12.47326  183.2802 21.68566  -41.30289      25.01700  
1 1 1 5  6  20 o 133.9189 8.421068  12.01906       1.495128      10.60311       1.738919      16.03364       2.928031      125.5299 10.49168  154.0287 14.43410  -28.49877      17.84429  
1 1 1 5  6  21 o 89.77725 18.52496  5.622479       2.142596      6.758518       2.712901      3.739122       3.493041      98.18319 21.34598  78.14268 27.27986  20.04051       34.63873  
1 1 1 5  6  22 o 296.8514 9.452252  58.96433       3.734170      59.73716       3.917731      51.29206       12.34394      298.7368 9.855238  269.3942 35.23017  29.34265       36.58266  
1 1 1 5  6  23 o 259.5337 9.086944  45.10471       3.137722      44.19515       3.721264      47.34203       5.836318      256.6149 10.90754  264.3598 16.65261  -7.744904      19.90687  
1 1 1 5  6  24 o 261.7246 7.953913  45.85353       2.770732      51.69668       3.906453      39.93832       3.930472      277.4255 10.58669  243.4637 12.15381  33.96179       16.11810  
1 1 1 5  6  25 o 195.8020 6.991813  25.67057       1.821305      25.28279       2.400518      26.19659       2.795879      193.9426 9.316012  197.1547 10.68225  -3.212051      14.17387  
1 1 1 5  6  26 o 46.67726 18.77907  0.7512009      1.789825      1.625918       2.106349      -1.520978      3.394829      55.45009 20.90825  51.35556 23.21836  4.094532       31.24496  
1 1 1 5  6  27 o 256.1290 8.935730  44.15682       3.045064      46.77752       3.675761      38.42401       5.436538      263.1227 10.50483  235.5294 17.44609  27.59325       20.36461  
1 1 1 5  6  28 o 156.9942 9.505788  16.67804       1.979272      17.37805       2.433892      15.31120       3.401010      159.7017 11.51446  147.6469 17.63490  12.05482       21.06116  
1 1 1 5  6  29 o 146.3700 9.599411  14.54694       1.861944      14.52382       2.174399      14.61047       3.605106      145.7354 11.28483  142.6940 19.46712  3.041428       22.50147  
1 1 1 5  6  30 o 81.28468 11.25426  4.596819       1.186321      4.625920       1.347028      4.496222       2.504463      81.02751 12.90858  77.01094 22.79741  4.016571       26.19835  
1 1 1 5  6  31 o 106.9761 10.38651  7.919605       1.461961      8.819065       1.670327      4.974065       3.022686      112.5704 11.28747  78.82969 25.35320  33.74076       27.75233  
1 1 1 5  6  32 o 101.5054 5.812243  6.972806       0.7828658     7.775370       0.8320513     0.7803075      2.311232      107.1955 5.847195  48.60360 20.59908  58.59191       21.41288  
1 1 1 5  6  33 o 58.87872 13.47162  2.603312       1.033990      3.382616       1.145831      -0.8142519     2.399525      67.44286 13.22285  41.14336 18.94773  26.29950       23.10542  
1 1 1 5  6  34 o 65.48118 9.444358  3.070274       0.8002762     3.066516       0.8286598     3.122329       3.084115      65.25586 9.835047  59.87859 24.44515  5.377266       26.34945  
1 1 1 5  6  35 o 33.37847 11.75595  0.7661591      0.6496253     0.6117442      0.6753429     2.678564       2.376674      31.53410 11.85007  55.15159 21.82078  -23.61749      24.83084  
1 1 1 5  6  36 o 42.87767 13.37356  1.457297       0.8467498     1.512472       0.8736945     0.6039168      3.436041      43.56487 13.58417  47.19452 22.05365  -3.629650      25.90161  
1 1 1 5  6  37 o 24.65427 11.15930  -0.2191053     0.7868890     -0.1579468     0.8076816     -1.361281      3.490423      25.39898 11.41803  41.52378 20.15204  -16.12479      23.16195  
1 1 1 5  7  0  o 324.8900 23.84660  71.69004       10.19312      71.69004       10.19312      71.69004       10.19312      324.8900 23.84660  324.8900 23.84660  0.000000       0.000000  
1 1 1 5  7  1  o 641.0852 23.50995  276.0127       20.04956      290.1230       40.81728      271.5255       23.01781      649.5264 47.48815  634.9777 27.26750  14.54871       54.75985  
1 1 1 5  7  2  o 650.8797 14.51150  282.9832       12.58597      268.1919       18.07911      296.8928       17.53198      632.3157 21.48825  665.6614 19.78730  -33.34570      29.21099  
1 1 1 5  7  3  o 652.4022 3.423851  283.6207       2.976485      283.3273       3.073177      288.0647       11.96001      652.0614 3.536923  656.7752 13.66599  -4.713806      14.11627  
1 1 1 5  7  4  o 516.2274 7.555424  177.6834       5.197248      167.9648       7.985592      184.8250       6.845462      501.6331 11.94668  526.3695 9.759746  -24.73639      15.42647  
1 1 1 5  7  5  o 752.3995 10.06342  377.6927       10.08945      383.6506       11.96740      363.0509       18.76092      758.1094 11.84662  736.1014 19.14308  22.00800       22.51221  
1 1 1 5  7  6  o 242.2207 6.780494  39.14666       2.186344      38.57355       3.392533      39.55377       2.859312      240.1848 10.62628  243.3559 8.832162  -3.171143      13.81756  
1 1 1 5  7  7  o 536.9293 9.201540  192.3338       6.583415      198.5826       9.565195      186.7092       9.074855      545.2025 13.16626  528.6830 12.88163  16.51941       18.41974  
1 1 1 5  7  8  o 480.0801 8.858980  153.7662       5.667232      153.0681       6.981487      155.1151       9.704113      478.8183 10.94218  481.3176 15.14927  -2.499298      18.68774  
1 1 1 5  7  9  o 396.5721 8.541902  104.9314       4.513883      110.3208       5.323638      91.14648       8.514104      406.5355 9.827353  368.3813 17.39387  38.15421       19.97808  
1 1 1 5  7  10 o 120.2282 4.253930  9.646648       0.6804329     9.862020       0.7804801     8.964418       1.389096      121.5360 4.828907  115.5315 9.096489  6.004509       10.29876  
1 1 1 5  7  11 o 221.2413 3.414066  32.62126       1.006495      34.30019       2.000560      32.05228       1.164623      226.6765 6.630383  219.2920 3.985556  7.384476       7.736060  
1 1 1 5  7  12 o 258.7974 2.041645  44.62853       0.7040665     46.82536       2.275699      44.39600       0.7403924     264.9555 6.445674  258.1206 2.152612  6.834869       6.795620  
1 1 1 5  7  13 o 244.5862 5.841561  39.89578       1.903857      36.80854       3.455793      41.24112       2.281271      234.3776 11.09668  248.5335 6.895065  -14.15584      13.06439  
1 1 1 5  7  14 o 219.7396 8.034914  32.27390       2.348720      32.54191       2.802694      31.64171       4.304552      220.5052 9.561294  216.7095 14.99907  3.795746       17.78736  
1 1 1 5  7  15 o 461.2287 9.757996  142.1217       5.997227      143.7245       8.012128      140.0794       9.044037      463.1553 12.99503  456.8428 14.87653  6.312561       19.75302  
1 1 1 5  7  16 o 550.5938 10.10127  202.5460       7.411070      203.5980       9.015981      200.3544       13.01334      551.6556 12.26511  545.6829 17.92109  5.972778       21.71631  
1 1 1 5  7  17 o 436.2993 10.62267  127.2061       6.175780      125.2294       6.918443      134.9586       13.70138      432.5516 12.01483  446.3500 23.11519  -13.79843      26.05126  
1 1 1 5  7  18 o 195.4236 10.43466  25.58839       2.707392      23.55074       3.051534      33.12464       5.868543      187.2452 12.29829  220.9282 20.15627  -33.68300      23.61193  
1 1 1 5  7  19 o 175.7357 10.27067  20.70309       2.394613      20.34242       2.949482      21.40054       4.101557      173.8932 12.81897  177.6587 17.55483  -3.765488      21.73702  
1 1 1 5  7  20 o 402.5692 9.222952  108.2376       4.947480      104.9713       5.837778      116.5638       9.320703      396.0843 11.07166  416.2598 16.83867  -20.17557      20.15248  
1 1 1 5  7  21 o 229.8615 12.04854  35.46798       3.677521      38.55799       5.726174      33.29876       4.797734      238.5993 18.14643  221.9939 16.33326  16.60547       24.41451  
1 1 1 5  7  22 o 180.7825 9.403521  21.91185       2.257485      21.80258       2.316054      23.99076       10.10222      180.2969 9.675659  179.8735 42.77596  0.4233551      43.85660  
1 1 1 5  7  23 o 107.5921 7.183287  7.767411       1.023958      9.617451       1.371772      5.439523       1.538765      119.6036 8.666017  88.98238 13.39239  30.62125       15.95167  
1 1 1 5  7  24 o 172.8988 7.577710  20.03063       1.741596      22.48872       2.436447      17.46244       2.490416      182.8441 10.03857  160.7538 11.70641  22.09030       15.42119  
1 1 1 5  7  25 o 442.5531 7.522321  131.0953       4.435993      128.5445       5.976816      134.2239       6.619123      437.3590 10.25553  446.5794 11.12316  -9.220367      15.12946  
1 1 1 5  7  26 o 146.4655 8.355846  14.43873       1.624029      15.02843       1.807611      11.96991       3.698559      149.2918 9.130140  129.2806 22.27353  20.01123       24.07217  
1 1 1 5  7  27 o 176.2656 8.424596  20.92363       1.973019      21.85299       2.276198      18.11536       3.956738      179.8811 9.530230  160.5374 18.85544  19.34369       21.12706  
1 1 1 5  7  28 o 71.22512 8.812457  3.467299       0.8185565     3.523011       0.8434599     2.565417       3.393645      71.76116 9.019418  68.10043 26.32603  3.660728       27.82822  
1 1 1 5  7  29 o 32.45433 15.61783  -2.780339      1.989376      -2.963082      3.358119      -2.681530      2.469316      45.65747 21.48334  38.06916 18.06446  7.588318       28.06881  
1 1 1 5  7  30 o 25.93310 11.77374  -0.4761836     0.8839914     -0.7829828     0.9317507     2.288452       2.796995      24.95048 11.60051  61.86910 23.90461  -36.91862      26.57070  
1 1 1 5  7  31 o 29.60410 11.31011  0.4381428      0.6212704     0.9079441E-01  0.6440936     5.080473       2.354693      25.99874 10.93889  80.35851 21.54917  -54.35976      24.16663  
1 1 1 5  7  32 o 26.38445 11.66675  -0.1742146     0.8077930     -0.2750306     0.8469810     0.8402498      2.686751      26.31098 11.77064  50.96627 21.91991  -24.65529      24.88032  
1 1 1 5  7  33 o 86.46941 3.946776  5.033788       0.4535570     5.133526       0.4631701     2.705606       2.237792      87.31330 3.991507  58.02887 21.61877  29.28443       21.98416  
1 1 1 5  7  34 o 41.77016 9.304943  1.273140       0.5046351     1.201496       0.5134231     3.312422       2.739191      40.45884 9.657619  60.20743 23.54534  -19.74859      25.44902  
1 1 1 5  7  35 o 60.15286 12.21645  2.763608       0.9457458     3.142816       0.9956730     -0.7355977     3.024564      64.35043 12.05445  43.02822 20.28997  21.32222       23.60069  
1 1 1 5  7  36 o ?        ?         -3.842049      0.3239763     -3.825052      0.3261435     -5.108208      2.815005      ?        ?         31.67473 15.85123  0.000000       15.85123  
1 1 1 5  8  0  o 774.4208 15.86984  400.7523       16.36106      400.7523       16.36106      400.7523       16.36106      774.4208 15.86984  774.4208 15.86984  0.000000       0.000000  
1 1 1 5  8  1  o 90.46597 9.371063  5.517522       1.113320      6.489937       1.272395      2.341608       2.299485      98.13890 9.863488  62.99982 22.12354  35.13908       24.22270  
1 1 1 5  8  2  o 665.9916 10.14256  295.9340       9.000979      295.3615       12.82226      296.4902       12.63835      664.8608 14.47305  666.1609 14.23763  -1.300110      20.30220  
1 1 1 5  8  3  o 505.1051 14.40079  170.6198       9.682737      152.2190       24.90780      173.8956       10.50934      471.0812 40.05909  509.7865 15.48879  -38.70535      42.94920  
1 1 1 5  8  4  o 337.4969 5.567875  75.92445       2.503991      73.69833       3.005488      80.97616       4.527499      332.4755 6.783937  348.2423 9.766352  -15.76682      11.89132  
1 1 1 5  8  5  o 785.5238 10.81201  411.8645       11.31721      407.3831       12.50853      432.0863       26.57098      781.0709 12.01828  801.0583 24.92290  -19.98743      27.66930  
1 1 1 5  8  6  o 759.5996 10.64270  385.1568       10.77234      383.1715       13.75299      388.3084       17.32782      757.1797 13.63091  761.5651 17.07511  -4.385376      21.84859  
1 1 1 5  8  7  o 140.3806 3.156588  13.13219       0.5904711     13.23147       0.7321057     12.94738       0.9987971     140.8495 3.904490  139.2608 5.392577  1.588638       6.657697  
1 1 1 5  8  8  o 512.7181 8.685531  175.4162       5.934014      171.5392       7.567100      181.6081       9.562880      506.7614 11.20605  520.8993 13.78934  -14.13794      17.76855  
1 1 1 5  8  9  o 107.6747 1.183520  7.724752       0.1698098     7.728988       0.1704290     7.144915       1.993924      107.7042 1.187510  102.2093 15.09364  5.494904       15.14028  
1 1 1 5  8  10 o 298.9505 6.341817  59.60399       2.526309      59.97404       2.717890      57.25322       6.850194      299.8546 6.802172  291.4835 17.72034  8.371155       18.98104  
1 1 1 5  8  11 o 367.3784 6.404562  90.02326       3.135281      90.27677       3.587757      89.20408       6.449399      367.8326 7.319801  364.7935 13.29000  3.039032       15.17246  
1 1 1 5  8  12 o 197.2558 2.413835  25.92830       0.6344695     25.02921       1.605350      26.09473       0.6907026     193.6161 6.230467  197.8850 2.619417  -4.268875      6.758703  
1 1 1 5  8  13 o 556.9688 9.361963  207.2057       6.948183      201.5536       9.589900      213.4514       10.08091      548.6539 13.11723  564.5546 13.40047  -15.90063      18.75192  
1 1 1 5  8  14 f 576.6031 9.773195  222.1166       7.509086      223.6970       8.545717      216.7623       15.72972      578.4249 11.08736  566.5026 20.87319  11.92236       23.63513  
1 1 1 5  8  15 f 582.8966 11.00724  227.1319       8.549558      231.8688       11.71009      221.7244       12.51146      587.9268 14.95947  574.5313 16.35924  13.39551       22.16778  
1 1 1 5  8  16 o 85.95570 6.829069  4.959643       0.7757604     4.343989       0.8856283     6.989428       1.608081      80.23434 8.408315  101.5131 12.12774  -21.27879      14.75743  
1 1 1 5  8  17 o 191.9392 7.345135  24.61536       1.875145      24.85210       2.109375      23.72342       4.094300      192.7918 8.229849  187.3209 16.57370  5.470886       18.50454  
1 1 1 5  8  18 o 170.4613 8.579257  19.44533       1.942453      19.52108       2.244777      19.21955       3.875466      170.6680 9.913362  168.2848 17.53959  2.383255       20.14726  
1 1 1 5  8  19 o 202.6030 4.208419  27.36181       1.136157      27.36300       1.168955      27.34152       4.830224      202.6046 4.329873  200.8643 18.24528  1.740295       18.75202  
1 1 1 5  8  20 o 397.6148 7.516510  105.5169       3.982468      105.3181       4.353552      106.5364       9.857814      397.1719 8.226056  397.3301 18.67119  -0.1582031     20.40297  
1 1 1 5  8  21 o 277.1989 5.810552  51.25862       2.146260      51.86962       2.258884      45.58558       6.883061      278.8297 6.079690  258.9050 20.10869  19.92465       21.00767  
1 1 1 5  8  22 o 202.4055 4.044561  27.31581       1.090855      27.30349       1.097298      28.35639       10.08152      202.3589 4.069385  196.2811 39.90672  6.077774       40.11367  
1 1 1 5  8  23 o 129.6765 5.244444  11.24005       0.9043519     11.41454       0.9184921     5.703597       5.173814      130.6775 5.285647  94.05042 33.17212  36.62709       33.59059  
1 1 1 5  8  24 o 99.26875 3.826377  6.582306       0.5051959     6.401464       0.5359954     8.021576       1.512111      97.87341 4.119029  108.7817 10.56457  -10.90827      11.33916  
1 1 1 5  8  25 o 22.76606 8.478832  0.2640677      0.3441619     0.3234701      0.4093524     0.1208312      0.6356564     24.96851 9.256932  26.49615 10.98597  -1.527643      14.36602  
1 1 1 5  8  26 o 248.2266 6.183611  41.22400       2.045333      43.17818       2.465015      36.90521       3.664531      253.7317 7.298318  233.2931 11.82666  20.43855       13.89731  
1 1 1 5  8  27 o 191.2424 5.261151  24.47218       1.339447      23.85224       1.440220      28.44284       3.644907      188.7267 5.733580  203.8389 13.49515  -15.11220      14.66264  
1 1 1 5  8  28 o 89.60573 4.826052  5.383995       0.5741109     5.277736       0.5887337     7.443693       2.592022      88.69334 5.001702  101.1592 19.93834  -12.46584      20.55613  
1 1 1 5  8  29 o 97.99433 15.96967  6.858401       2.013563      9.344714       2.492114      2.183227       3.417346      114.3100 16.86716  65.07188 26.02767  49.23811       31.01517  
1 1 1 5  8  30 o 79.08964 16.67646  4.602450       1.702066      2.714088       2.280961      6.975055       2.556748      62.15845 22.01622  95.79485 20.63925  -33.63639      30.17769  
1 1 1 5  8  31 o 64.23121 19.00295  3.170251       1.740566      2.760917       2.234680      3.801598       2.775303      61.17938 21.77940  69.40667 24.31014  -8.227287      32.63932  
1 1 1 5  8  32 o 46.23103 17.11394  1.426101       1.398189      2.188506       1.740787      0.4016116E-01  2.347065      54.15940 19.22849  44.54714 19.78236  9.612259       27.58762  
1 1 1 5  8  33 o 38.90488 16.62911  0.4416038      1.528633      0.9280757      1.831198      -0.6766196     2.776328      44.21439 18.51351  43.62762 20.19435  0.5867729      27.39638  
1 1 1 5  8  34 o 35.13930 11.52941  0.8889498      0.6233640     0.8021413      0.6368402     2.875213       3.046266      33.92039 11.65803  57.52648 23.96729  -23.60609      26.65222  
1 1 1 5  8  35 o 28.35782 11.66902  0.3130947      0.7098448     0.2280913      0.7271154     2.038973       3.276350      27.74757 11.64539  52.32153 23.29553  -24.57395      26.04413  
1 1 1 5  8  36 f 43.16349 15.25144  1.512712       1.094054      3.501882       1.325976      -2.729456      1.936394      64.21589 15.64274  29.02561 14.27960  35.19028       21.18023  
1 1 1 5  9  0  o 643.3391 47.99655  285.2025       40.60688      285.2025       40.60688      285.2025       40.60688      643.3391 47.99655  643.3391 47.99655  0.000000       0.000000  
1 1 1 5  9  1  o 358.7700 23.56374  86.87441       11.20271      0.000000       0.000000      86.87441       11.20271      ?        ?         358.7700 23.56374  0.000000       23.56374  
1 1 1 5  9  2  o 193.5129 1.191629  24.95016       0.3072731     25.05439       0.3112983     20.99753       1.916972      193.9167 1.204726  177.2453 8.138194  16.67140       8.226881  
1 1 1 5  9  3  o 664.8672 13.10003  295.3617       11.60595      307.7698       16.96943      284.4567       15.90846      677.4059 18.81767  651.3315 18.34786  26.07440       26.28210  
1 1 1 5  9  4  o 458.9108 6.112370  140.4051       3.737760      137.9306       4.888417      143.8880       5.799593      454.7391 8.067378  464.3635 9.372726  -9.624390      12.36651  
1 1 1 5  9  5  o 812.5315 10.41505  440.7569       11.27653      439.3878       14.57840      442.7963       17.79234      810.7147 13.49486  813.1940 16.41970  -2.479370      21.25366  
1 1 1 5  9  6  o 536.1681 7.680399  191.7615       5.487295      192.9850       8.458068      190.8723       7.210739      537.4404 11.81047  534.6898 10.12055  2.750610       15.55355  
1 1 1 5  9  7  o 429.2152 5.051034  122.8121       2.888876      125.6269       4.434076      120.7361       3.807997      433.9447 7.668232  425.4789 6.716530  8.465790       10.19380  
1 1 1 5  9  8  o 320.5137 6.841539  68.52024       2.921958      66.62175       4.096239      70.48703       4.169275      315.7126 9.748562  324.7612 9.645046  -9.048645      13.71355  
1 1 1 5  9  9  o 390.2845 6.447308  101.5936       3.352998      102.0674       3.796858      99.91508       7.146378      391.1362 7.284886  386.0531 13.91478  5.083099       15.70639  
1 1 1 5  9  10 o 483.0624 8.765253  155.7956       5.642105      150.8025       6.637493      168.7994       10.71167      475.0454 10.48565  501.3394 16.05506  -26.29401      19.17587  
1 1 1 5  9  11 o 416.0137 8.436350  115.5381       4.676660      119.7500       5.829654      107.9335       7.833210      423.3176 10.33482  401.0163 14.68379  22.30127       17.95612  
1 1 1 5  9  12 o 326.9870 4.736772  71.28257       2.063889      71.45514       3.054818      71.13765       2.799435      327.2578 7.005219  326.5659 6.433186  0.6919556      9.510993  
1 1 1 5  9  13 o 227.9063 3.628635  34.61929       1.101979      32.26258       2.247401      35.36526       1.264412      219.7357 7.687337  230.3363 4.119579  -10.60060      8.721588  
1 1 1 5  9  14 o 368.5649 6.968857  90.62570       3.422544      105.9899       5.602355      81.47729       4.323039      398.1003 10.57034  349.1626 9.299823  48.93774       14.07902  
1 1 1 5  9  15 o 264.3220 7.213976  46.64783       2.538489      44.99923       3.471397      48.54263       3.721577      259.3427 10.06426  269.3389 10.38890  -9.996185      14.46439  
1 1 1 5  9  16 o 164.3308 4.361877  18.01354       0.9542930     17.26295       2.138548      18.20016       1.066349      160.4463 10.05319  165.1573 4.850638  -4.710968      11.16223  
1 1 1 5  9  17 o 195.3788 7.169933  25.50073       1.863498      24.28582       2.113301      29.74763       3.951163      190.5699 8.342323  210.2904 14.18338  -19.72047      16.45487  
1 1 1 5  9  18 o 482.0552 10.08116  155.2428       6.475612      152.6222       8.160879      159.6977       10.64057      477.3983 12.84036  487.5709 16.40108  -10.17255      20.82955  
1 1 1 5  9  19 o 847.0618 26.85150  488.6129       30.26971      488.6129       30.26971      0.000000       0.000000      847.0618 26.85150  ?        ?         0.000000       26.85150  
1 1 1 5  9  20 o 320.6318 10.63119  68.83382       4.535874      68.83382       4.535874      0.000000       0.000000      320.6318 10.63119  ?        ?         0.000000       10.63119  
1 1 1 5  9  21 o 28.43024 12.15177  -0.2961619E-01 0.8162696     -0.4472490     0.8623285     3.569541       2.531488      26.08481 11.75594  72.91479 23.17583  -46.82998      25.98695  
1 1 1 5  9  22 o 264.0217 8.432275  46.66499       2.962788      46.50161       3.377363      47.21061       6.172018      263.3668 9.639990  263.4595 17.68326  -0.9271240E-01 20.14018  
1 1 1 5  9  23 o 247.9568 8.643996  41.21631       2.851671      40.47488       3.679213      42.33191       4.513084      245.1823 11.29172  250.1765 13.58898  -4.994217      17.66814  
1 1 1 5  9  24 o 40.59365 10.82802  1.146994       0.5964831     2.036005       0.7772737     -0.1265592     0.9303135     54.03239 11.16503  29.51051 12.79569  24.52188       16.98198  
1 1 1 5  9  25 o 129.8106 7.890625  11.33717       1.358436      10.30590       1.704553      13.13225       2.248874      123.2730 10.47607  138.8417 12.28201  -15.56870      16.14298  
1 1 1 5  9  26 o 151.4067 8.419260  15.44744       1.691917      16.77466       3.278307      14.96559       1.975311      155.5795 16.04313  148.6671 10.02990  6.912354       18.92038  
1 1 1 5  9  27 f 151.7300 7.473263  15.49342       1.506319      14.16733       1.767291      19.01538       2.880147      144.6933 9.214001  166.5054 13.08623  -21.81212      16.00460  
1 1 1 5  9  28 o 82.58323 7.336902  4.620183       0.7989852     4.629076       0.8401470     4.536032       2.584285      82.58995 7.723624  78.09203 23.16810  4.497925       24.42162  
1 1 1 5  9  29 o 117.8127 5.708704  9.334438       0.8935284     10.29275       0.9550593     2.607919       2.530299      123.7056 5.810088  62.88687 23.06699  60.81871       23.78746  
1 1 1 5  9  30 o 84.39429 6.852051  4.839376       0.7639381     4.658342       0.7977808     6.838370       2.650991      82.67749 7.316860  93.67976 21.66825  -11.00227      22.87028  
1 1 1 5  9  31 o 92.52441 6.949307  5.839078       0.8505232     6.130838       0.8701990     -0.3947404     4.022373      94.82418 6.934887  54.62922 24.92319  40.19496       25.87002  
1 1 1 5  9  32 o 43.59203 11.51009  1.398669       0.6783417     1.907031       0.7157652     -3.084952      2.125684      51.15350 10.83817  31.72681 15.47142  19.42668       18.88996  
1 1 1 5  9  33 f 50.92126 7.356865  1.819719       0.4847353     1.793555       0.4926351     2.615955       2.717654      50.47938 7.555838  56.83471 23.04169  -6.355331      24.24892  
1 1 1 5  9  34 o 46.73770 17.79637  1.659184       1.534910      0.1960481      2.076935      3.419953       2.278409      40.89153 18.35211  60.30186 21.92444  -19.41033      28.59163  
1 1 1 5  9  35 o 53.52127 21.21032  2.686822       2.248963      2.550043       2.903826      2.891840       3.555137      53.05836 22.80353  54.89538 24.36406  -1.837013      33.37077  
1 1 1 5  9  36 o 18.21805 8.987737  -1.507116      0.7853072     -1.619698      0.8070199     0.5010579      3.408402      18.20359 9.004602  45.75728 21.56525  -27.55369      23.36970  
1 1 1 5  10 0  o 639.9363 17.48861  274.2531       14.88784      274.2531       14.88784      274.2531       14.88784      639.9363 17.48861  639.9363 17.48861  0.000000       0.000000  
1 1 1 5  10 1  o 384.4706 5.798468  98.54888       2.970639      91.02785       12.32840      99.01247       3.060825      366.5057 25.40081  385.3667 5.960611  -18.86102      26.09081  
1 1 1 5  10 2  o 372.8948 8.602301  92.77918       4.274394      97.16793       9.199583      91.57089       4.827066      380.2206 18.21056  370.2501 9.792555  9.970581       20.67652  
1 1 1 5  10 3  o 381.6335 7.522539  97.14957       3.825467      92.51932       5.108063      103.0633       5.772768      372.0962 10.31208  392.6601 11.04397  -20.56387      15.10988  
1 1 1 5  10 4  o 576.0240 4.568235  221.1674       3.506409      222.3245       3.623989      204.1992       13.87796      577.5207 4.709186  551.1602 18.92427  26.36053       19.50140  
1 1 1 5  10 5  o 297.7579 5.059096  59.10480       2.007288      58.03710       2.914973      60.06767       2.768180      294.8643 7.424795  300.0974 6.922431  -5.233124      10.15124  
1 1 1 5  10 6  o 843.3859 7.196779  474.4929       8.087942      481.6845       16.82190      472.3306       9.224059      848.0483 14.88610  841.3034 8.228031  6.744873       17.00872  
1 1 1 5  10 7  o 184.8267 5.100403  22.79222       1.254953      21.85142       1.712256      23.88416       1.844674      180.8452 7.119308  189.0665 7.335951  -8.221375      10.22256  
1 1 1 5  10 8  o 397.3029 6.520418  105.2885       3.452000      102.0834       4.450531      110.1285       5.469136      391.0502 8.540942  406.0086 10.10904  -14.95844      13.23406  
1 1 1 5  10 9  o 306.2977 6.726922  62.58466       2.745577      62.88729       3.538396      62.12676       4.352473      306.7911 8.664137  304.6968 10.73678  2.094269       13.79658  
1 1 1 5  10 10 o 160.1521 6.927182  17.14371       1.474804      17.99199       1.771431      15.22762       2.662341      163.9768 8.132524  150.2061 13.44355  13.77072       15.71200  
1 1 1 5  10 11 o 479.1361 9.414907  153.3384       6.011023      157.7521       6.752196      136.4801       13.19633      485.8445 10.42976  448.9721 22.12586  36.87241       24.46086  
1 1 1 5  10 12 o 76.42368 11.19369  3.986967       1.106132      4.477065       1.227714      1.873699       2.549372      80.99198 11.71575  61.17187 23.01598  19.82011       25.82623  
1 1 1 5  10 13 o 117.4671 4.939192  9.215691       0.7713925     12.19084       1.883585      8.616151       0.8455518     134.6527 10.58275  113.5332 5.606465  21.11951       11.97610  
1 1 1 5  10 14 o 99.59405 3.172721  6.617055       0.4205178     3.697658       1.860594      6.774211       0.4316880     72.82030 18.98336  100.7691 3.219041  -27.94881      19.25436  
1 1 1 5  10 15 o 251.8257 1.966038  42.25581       0.6597288     40.85686       4.115727      42.29270       0.6683713     246.8245 12.55491  251.9353 1.990927  -5.110840      12.71179  
1 1 1 5  10 16 o 261.6664 8.783426  45.75865       3.058225      49.94782       5.123297      43.43967       3.811836      272.7505 14.14480  254.6864 11.25978  18.06412       18.07921  
1 1 1 5  10 17 o 532.9285 11.09940  189.8364       7.882102      180.5707       10.29850      202.9399       12.24694      518.8793 14.91024  549.6403 16.74103  -30.76105      22.41824  
1 1 1 5  10 18 o 573.7695 12.30426  220.2824       9.407328      218.1485       12.03465      223.6347       15.08380      569.9621 15.86121  575.8767 19.68551  -5.914612      25.28038  
1 1 1 5  10 19 o 225.4451 6.678130  33.94196       2.003965      38.34002       3.549729      31.88457       2.427856      239.1408 11.17042  218.3521 8.359783  20.78874       13.95221  
1 1 1 5  10 20 o 179.3017 13.32032  21.68547       3.159796      24.78219       4.122305      17.27425       4.920037      191.1857 16.33764  157.5172 24.21454  33.66852       29.21066  
1 1 1 5  10 21 o 90.67901 14.34702  5.664517       1.675956      6.653677       1.966190      3.036146       3.205055      98.19990 15.54274  72.02817 26.02938  26.17173       30.31674  
1 1 1 5  10 22 o 205.7971 9.400413  28.42955       2.571055      28.34368       3.134578      28.60609       4.494514      205.1041 11.51539  204.8366 16.60888  0.2675171      20.21037  
1 1 1 5  10 23 o 208.5906 8.998117  29.21992       2.495154      30.90569       3.179385      26.51683       4.026000      214.0806 11.18410  197.1531 15.44815  16.92747       19.07169  
1 1 1 5  10 24 o 258.0976 8.163624  44.69720       2.804103      45.25113       3.407425      43.53497       4.935675      259.2710 9.880856  252.7225 14.72018  6.548462       17.72893  
1 1 1 5  10 25 o 174.8738 7.305138  20.52925       1.698514      22.29603       2.743333      19.43097       2.162945      181.2971 11.41363  169.6542 9.606957  11.64288       14.91860  
1 1 1 5  10 26 o 260.3246 7.082401  45.47372       2.454514      42.63362       3.927067      47.29453       3.144374      250.4823 11.79886  264.9427 8.919249  -14.46043      14.79074  
1 1 1 5  10 27 o 134.8214 6.691594  12.22228       1.198402      15.47928       2.133004      10.71994       1.448662      150.7618 10.68688  125.8347 8.693015  24.92709       13.77599  
1 1 1 5  10 28 o 100.9030 9.804239  6.968779       1.301632      6.000837       1.650054      8.563377       2.117868      92.32986 13.83739  110.2404 14.79013  -17.91054      20.25393  
1 1 1 5  10 29 o 160.3214 7.599225  17.40777       1.618812      17.10343       2.141390      17.81364       2.472924      157.8735 10.23434  160.4523 11.64548  -2.578812      15.50351  
1 1 1 5  10 30 o 62.06717 9.490353  2.696965       0.7600102     3.942003       0.8712830     -1.264905      1.554240      75.48840 8.828279  31.67464 14.81146  43.81376       17.24291  
1 1 1 5  10 31 o 54.61586 16.40592  2.272939       1.289672      -2.539611      2.874908      3.485403       1.443014      40.29831 19.22630  67.38364 16.25908  -27.08533      25.17952  
1 1 1 5  10 32 o 34.84482 13.16153  0.7240934      0.8354781     2.081403       1.109871      -1.050830      1.269178      51.82456 15.13221  28.10566 13.21924  23.71889       20.09309  
1 1 1 5  10 33 o 57.96476 19.55330  2.896655       1.790291      1.858816       2.219512      4.829398       3.028861      50.82661 20.74212  68.74526 25.23384  -17.91866      32.66469  
1 1 1 5  10 34 o 22.80669 10.90013  -1.031465      0.9326320     -1.080868      0.9734240     -0.4787935     3.255796      23.22917 11.11124  44.80474 21.10419  -21.57558      23.85050  
1 1 1 5  10 35 o 20.34115 9.337985  -0.3144851     0.5764053     -0.2586804     0.5914183     -1.371989      2.574546      21.06690 9.590164  37.50894 17.97604  -16.44204      20.37423  
1 1 1 5  11 0  o 23.22404 15.14277  -0.1215406     1.140551      -0.1215406     1.140551      -0.1215406     1.140551      23.22404 15.14277  23.22404 15.14277  0.000000       0.000000  
1 1 1 5  11 1  o 440.6835 10.19105  129.7031       5.984380      0.000000       0.000000      129.7031       5.984380      ?        ?         440.6835 10.19105  0.000000       10.19105  
1 1 1 5  11 2  o 122.9966 7.520695  10.13033       1.226715      8.963381       1.566347      11.98151       1.972818      115.3890 10.29510  133.4392 11.19828  -18.05019      15.21153  
1 1 1 5  11 3  o 459.6186 7.886560  140.9586       4.830130      137.0917       6.237094      146.7522       7.634492      453.0269 10.33201  468.3151 12.24450  -15.28824      16.02118  
1 1 1 5  11 4  o 203.1046 5.627101  27.52697       1.521456      28.01384       1.736113      25.91524       3.158769      204.8500 6.367900  196.4930 12.12320  8.357071       13.69387  
1 1 1 5  11 5  o 247.2313 5.281217  40.75348       1.739846      41.37735       2.657344      40.28538       2.301805      248.8701 8.023605  245.6379 7.039599  3.232193       10.67400  
1 1 1 5  11 6  o 270.5711 4.809539  48.80605       1.734037      51.03566       2.617969      47.06329       2.314561      276.4903 7.111672  265.6270 6.539176  10.86328       9.661092  
1 1 1 5  11 7  f 167.3533 5.806410  18.69951       1.292877      19.22173       1.873040      18.22426       1.786814      169.4915 8.318678  165.0390 8.150135  4.452530       11.64582  
1 1 1 5  11 8  o 193.0462 6.466132  24.88617       1.660986      23.18178       3.363309      25.43595       1.910180      185.5485 13.69965  195.1042 7.360608  -9.555695      15.55181  
1 1 1 5  11 9  f 258.5003 3.910299  44.54019       1.346928      44.63020       1.473735      44.08367       3.319075      258.7505 4.274297  256.7045 9.720651  2.046051       10.61888  
1 1 1 5  11 10 o 512.2956 7.967415  175.1654       5.438906      168.0602       7.852248      181.7180       7.540755      501.2801 11.75547  521.3980 10.85355  -20.11789      15.99971  
1 1 1 5  11 11 o 306.9529 6.417163  62.84606       2.624752      70.97608       3.524059      52.71698       3.933526      326.0935 8.110123  280.6659 10.53636  45.42761       13.29620  
1 1 1 5  11 12 o 75.57199 16.27529  3.977524       1.590458      4.100780       1.867528      3.652108       3.034468      76.59386 18.50631  75.72346 25.45621  0.8703995      31.47225  
1 1 1 5  11 13 o 205.5841 4.962901  28.17717       1.359561      28.21475       1.441670      27.87519       4.086905      205.6457 5.265382  203.3858 15.18966  2.259888       16.07639  
1 1 1 5  11 14 o 199.0864 5.915140  26.45391       1.567467      27.47968       2.889452      26.02616       1.865877      202.5125 10.74602  197.3915 7.105426  5.120941       12.88270  
1 1 1 5  11 15 o 300.7271 6.533305  60.31906       2.618056      64.26873       5.691824      59.25919       2.948475      309.5346 13.83463  298.0267 7.424527  11.50790       15.70097  
1 1 1 5  11 16 o 356.2151 7.163105  84.65381       3.400064      93.43797       6.249166      80.96000       4.052368      373.5147 12.57362  348.1343 8.742431  25.38034       15.31425  
1 1 1 5  11 17 o 666.0765 13.26967  297.0486       11.77762      305.9782       13.43411      267.3898       24.48338      675.5751 14.92319  625.3070 29.46646  50.26813       33.02989  
1 1 1 5  11 18 o 482.6731 9.004993  155.6218       5.791753      157.8231       8.889481      153.9982       7.634551      485.0479 13.76759  479.6794 11.94425  5.368500       18.22667  
1 1 1 5  11 19 o 46.47578 15.96334  1.325481       1.194010      -1.560005      1.848264      3.392239       1.564226      35.50443 16.44916  69.60423 17.01134  -34.09979      23.66348  
1 1 1 5  11 20 o 237.5693 16.91100  38.28701       5.318439      0.000000       0.000000      38.28701       5.318439      ?        ?         237.5693 16.91100  0.000000       16.91100  
1 1 1 5  11 21 o 237.2452 7.489793  37.65990       2.364810      29.35244       3.888856      42.53439       2.978872      208.2353 14.09814  251.9350 8.887318  -43.69963      16.66560  
1 1 1 5  11 22 o 253.9308 8.965189  43.26020       3.028771      42.07993       4.708586      44.09324       3.955759      249.1273 14.24325  255.7652 11.63735  -6.637909      18.39288  
1 1 1 5  11 23 o 215.5771 7.832676  31.16709       2.246279      35.70027       4.503641      29.66591       2.591657      228.8676 14.84760  210.0347 9.282973  18.83286       17.51071  
1 1 1 5  11 24 o 105.0079 10.33677  7.496768       1.427642      5.302067       3.253829      8.019990       1.588730      85.63586 26.13051  108.4723 11.15013  -22.83640      28.41001  
1 1 1 5  11 25 o 214.7634 7.715172  30.98872       2.204313      29.51627       3.970331      31.64483       2.650309      207.4281 14.45479  216.6484 9.201477  -9.220322      17.13499  
1 1 1 5  11 26 o 201.1531 7.314933  27.19633       1.957432      27.18108       3.625808      27.20260       2.325421      198.9127 13.76434  200.8104 8.711163  -1.897720      16.28930  
1 1 1 5  11 27 o 110.1104 7.604047  8.195987       1.108846      8.424487       1.916326      8.080975       1.359565      110.0459 13.34046  108.9031 9.462688  1.142845       16.35575  
1 1 1 5  11 28 o 89.25495 10.13571  5.492214       1.184157      4.920917       1.639673      6.115000       1.711968      82.63867 15.45831  92.80244 14.30293  -10.16377      21.06023  
1 1 1 5  11 29 f 84.49257 10.40052  4.969963       1.146292      5.240481       1.507207      4.598801       1.765452      85.52579 13.68649  78.45563 17.34843  7.070160       22.09724  
1 1 1 5  11 30 f 81.96473 11.99239  4.800931       1.271050      6.814506       1.679964      2.105116       1.943843      97.20430 13.31998  54.85492 20.20149  42.34938       24.19757  
1 1 1 5  11 31 o 51.39444 13.53469  1.988328       0.9395500     1.241525       1.143757      3.537934       1.647561      42.83035 15.53942  66.39484 18.12024  -23.56449      23.87083  
1 1 1 5  11 32 o 38.59493 12.84626  1.075188       0.7730237     0.1280764      0.8986936     3.769155       1.515679      29.69214 12.72218  68.28111 16.78000  -38.58896      21.05759  
1 1 1 5  11 33 o 26.88390 12.83645  -1.305851      1.286848      1.040198       3.056242      -1.811405      1.418741      49.53717 22.24484  26.76533 12.95591  22.77184       25.74273  
1 1 1 5  11 34 o 60.07761 11.41347  2.736187       0.8803025     2.175411       1.024455      4.318864       1.721053      51.73360 14.35600  69.74171 18.29529  -18.00811      23.25537  
1 1 1 5  11 35 o 66.06356 11.39653  3.332911       0.9670128     3.135513       1.241422      3.637508       1.542092      60.95030 15.30800  63.53179 17.60705  -2.581490      23.33117  
1 1 1 5  12 0  o 239.4468 7.782269  38.35112       2.477122      38.35112       2.477122      38.35112       2.477122      239.4468 7.782269  239.4468 7.782269  0.000000       0.000000  
1 1 1 5  12 1  o 609.3370 12.80391  248.4483       10.39618      0.000000       0.000000      248.4483       10.39618      ?        ?         609.3370 12.80391  0.000000       12.80391  
1 1 1 5  12 2  o 539.1874 9.798929  194.1911       7.040312      174.6057       15.67486      199.1406       7.879847      507.7925 23.22712  545.8613 10.83333  -38.06879      25.62928  
1 1 1 5  12 3  o 282.3791 6.431527  53.18488       2.420027      52.05955       3.034158      55.15243       4.012017      279.1628 8.165338  287.1005 10.50481  -7.937714      13.30503  
1 1 1 5  12 4  o 619.3709 9.638680  256.2321       7.955031      251.4137       11.05618      261.4042       11.45462      612.7734 13.54041  624.7797 13.75879  -12.00635      19.30407  
1 1 1 5  12 5  o 238.1732 4.871387  37.81920       1.546034      39.99321       2.032172      34.83192       2.382138      244.7932 6.235071  228.3211 7.841378  16.47208       10.01815  
1 1 1 5  12 6  f 93.70154 7.720359  5.899010       0.9554128     6.155590       1.298366      5.595999       1.410961      95.41931 10.37846  90.69170 11.96723  4.727608       15.84068  
1 1 1 5  12 7  o 333.3204 5.708374  74.08984       2.535408      77.21143       2.975054      65.80695       4.846154      340.2205 6.562372  313.4800 11.62161  26.74048       13.34641  
1 1 1 5  12 8  o 172.0431 7.315005  19.78494       1.673143      16.17175       2.364264      23.40987       2.368104      155.0917 11.52253  186.9727 9.536432  -31.88101      14.95701  
1 1 1 5  12 9  o 370.4167 6.012267  91.50665       2.967579      92.83708       4.040899      89.94910       4.372238      372.9475 8.131241  367.0319 8.939774  5.915588       12.08456  
1 1 1 5  12 10 o 325.4741 5.335845  70.63225       2.314158      72.06741       3.002430      68.53188       3.632198      328.6837 6.855218  320.2993 8.517764  8.384308       10.93372  
1 1 1 5  12 11 o 273.4506 3.379711  49.83437       1.231493      49.55490       1.320515      51.69995       3.411811      272.6765 3.634312  278.1071 9.219344  -5.430573      9.909820  
1 1 1 5  12 12 o 340.4138 6.251891  77.28294       2.835907      76.54463       3.161150      80.32713       6.418951      338.7415 7.003308  346.1030 13.94683  -7.361481      15.60642  
1 1 1 5  12 13 o 276.1198 6.836194  50.85564       2.515275      51.11343       2.778273      49.68415       5.922578      276.6818 7.542687  271.6877 16.43628  4.994110       18.08434  
1 1 1 5  12 14 o 513.4575 11.71351  176.2529       8.014291      176.0693       10.29404      176.5354       12.76977      512.3953 15.09318  512.1748 18.74237  0.2204590      24.06409  
1 1 1 5  12 15 o 432.2507 9.365023  124.7669       5.394089      123.5928       7.209486      126.2600       8.129983      429.6348 12.60670  433.9865 14.07715  -4.351654      18.89696  
1 1 1 5  12 16 o 184.6076 8.581317  22.80164       2.105170      22.45082       3.138820      23.08847       2.838152      182.6835 12.97869  185.4558 11.54197  -2.772263      17.36846  
1 1 1 5  12 17 o 316.9619 9.144468  67.16908       3.858201      67.90442       5.374506      66.38720       5.541987      318.1823 12.70172  314.5086 13.25360  3.673676       18.35734  
1 1 1 5  12 18 o 333.8579 9.535500  74.57616       4.237733      80.64072       6.781264      70.69029       5.428185      346.1842 14.73412  324.5269 12.57631  21.65729       19.37157  
1 1 1 5  12 19 o 342.2181 7.533501  78.22879       3.435368      81.03278       5.865411      76.76463       4.238431      347.2504 12.69738  338.6292 9.402164  8.621277       15.79950  
1 1 1 5  12 20 o 268.4116 6.973264  48.16327       2.491970      45.92264       6.909389      48.49831       2.671794      258.8714 20.18961  269.2795 7.453221  -10.40814      21.52141  
1 1 1 5  12 21 o 318.4771 8.608843  67.96899       3.650043      68.55347       5.577725      67.53124       4.827132      318.6212 13.16575  316.7469 11.45564  1.874329       17.45189  
1 1 1 5  12 22 o 342.7332 9.472535  78.90026       4.321945      88.53399       9.494603      76.38236       4.853995      358.1890 19.97166  336.7978 10.82983  21.39124       22.71898  
1 1 1 5  12 23 o 116.4887 6.634583  9.109056       1.025584      17.31561       4.371383      8.631026       1.055032      156.4223 21.54390  113.3290 7.020833  43.09332       22.65903  
1 1 1 5  12 24 o 26.96786 11.89535  -0.2337653     0.8348302     7.630032       4.149248      -0.5655349     0.8522589     100.7132 29.21576  24.99276 11.42889  75.72043       31.37164  
1 1 1 5  12 25 o 30.15197 13.84962  -0.8800950     1.270383      3.613858       3.955161      -1.397057      1.341464      76.37363 28.68228  28.83006 13.56945  47.54356       31.73016  
1 1 1 5  12 26 o 122.5144 8.605325  10.16642       1.395909      8.517263       2.914303      10.65743       1.590194      107.7852 21.04634  125.2055 9.604656  -17.42032      23.13434  
1 1 1 5  12 27 o 235.1633 8.511793  37.42803       2.662852      37.57050       4.521074      37.35235       3.295026      232.0819 14.69476  233.9278 10.59822  -1.845978      18.11790  
1 1 1 5  12 28 o 72.08114 11.19575  3.649346       1.040469      4.140527       3.190694      3.590900       1.100632      73.81509 26.04883  71.22179 12.02499  2.593300       28.69045  
1 1 1 5  12 29 o 104.8604 13.11525  7.848627       1.792609      8.249280       2.955786      7.615524       2.254562      101.5313 22.44485  100.8444 17.40681  0.6869507      28.40367  
1 1 1 5  12 30 f 50.45559 15.80909  1.907250       1.181843      1.898737       1.490624      1.921659       1.939305      50.99598 17.81947  52.79158 20.02674  -1.795601      26.80679  
1 1 1 5  12 31 o ?        ?         -4.949032      0.8430321     -7.484633      1.005145      1.065566       1.548074      ?        ?         43.42829 17.46733  0.000000       17.46733  
1 1 1 5  12 32 o 28.17302 12.47786  -0.1111801     0.9276748     -1.114387      1.182458      1.494658       1.496033      26.37762 12.51195  45.76547 17.53431  -19.38785      21.54068  
1 1 1 5  12 33 o 36.69053 15.09306  0.6782045      1.187050      0.4303996      2.904852      0.7278808      1.300600      46.03719 21.07021  37.96274 15.72505  8.074448       26.29127  
1 1 1 5  12 34 o ?        ?         -3.278170      0.5478664     -3.620435      0.5770081     -0.1442177     1.746011      ?        ?         35.87811 16.38832  0.000000       16.38832  
1 1 1 5  13 0  o 858.7157 25.99337  497.1693       29.68132      497.1693       29.68132      497.1693       29.68132      858.7157 25.99337  858.7157 25.99337  0.000000       0.000000  
1 1 1 5  13 1  o 847.6299 16.04210  482.0688       18.11929      487.8085       24.38731      474.9962       27.07145      850.0080 21.54853  837.2726 24.29016  12.73535       32.47077  
1 1 1 5  13 2  o 418.5588 7.115132  116.8850       3.968377      115.3623       7.602962      117.4552       4.652395      414.8092 13.77411  419.4713 8.323400  -4.662079      16.09364  
1 1 1 5  13 3  o 555.4117 7.771488  205.8685       5.751654      210.2931       7.314723      198.7017       9.309448      561.0781 9.783652  544.8856 12.82168  16.19244       16.12809  
1 1 1 5  13 4  o 775.2169 11.44244  401.8221       11.81994      384.7398       16.30298      420.7518       17.16192      757.2257 16.15728  791.8343 16.26515  -34.60858      22.92625  
1 1 1 5  13 5  o 414.9933 6.656290  114.8807       3.680839      116.6907       4.270868      109.6538       7.257655      418.1680 7.664641  404.4690 13.48482  13.69894       15.51087  
1 1 1 5  13 6  o 377.0620 5.483212  94.80289       2.754998      91.57127       3.571333      99.55232       4.329538      370.4683 7.234456  386.1794 8.413545  -15.71109      11.09617  
1 1 1 5  13 7  o 353.8395 5.336030  83.48047       2.515927      81.95170       3.689661      84.80904       3.439603      350.4266 7.901615  356.5307 7.239988  -6.104126      10.71695  
1 1 1 5  13 8  o 264.4921 6.760055  46.69444       2.380567      45.07319       3.433866      48.19465       3.303196      259.5769 9.945990  268.4986 9.246287  -8.921661      13.58000  
1 1 1 5  13 9  o 420.5265 7.456269  117.9896       4.178193      116.5288       5.591472      119.8366       6.287254      417.6749 10.04649  423.2898 11.15651  -5.614929      15.01332  
1 1 1 5  13 10 o 133.6832 5.184212  11.93270       0.9217415     12.18087       1.033384      10.96671       2.038771      135.0347 5.756259  127.4924 12.14745  7.542274       13.44229  
1 1 1 5  13 11 o 467.8112 2.264907  145.8274       1.411869      144.2316       4.184472      146.0324       1.499820      465.0148 6.753057  468.1361 2.404326  -3.121368      7.168303  
1 1 1 5  13 12 o 423.1592 6.890286  119.4415       3.885211      122.9906       4.632926      111.0300       7.132299      429.3052 8.098707  407.1518 13.16348  22.15335       15.45530  
1 1 1 5  13 13 o 446.3941 8.693458  133.0136       5.171119      132.7115       5.752875      134.2848       11.80071      445.7861 9.684673  446.3226 19.89199  -0.5365295     22.12429  
1 1 1 5  13 14 o 112.6986 6.024494  8.494322       0.9014291     8.330415       0.9877041     9.311492       2.205385      111.5540 6.675120  117.0273 14.44896  -5.473267      15.91633  
1 1 1 5  13 15 o 73.13767 6.750658  3.598806       0.6504813     4.648776       2.034472      3.479248       0.6865175     81.49947 19.07343  71.84428 7.271091  9.655190       20.41236  
1 1 1 5  13 16 o 117.4996 7.432795  9.251533       1.157792      10.96035       2.236333      8.625795       1.353271      127.2014 13.39465  113.2765 9.040399  13.92496       16.15999  
1 1 1 5  13 17 o 523.9352 12.83160  184.0399       8.958428      181.9802       13.00934      185.8974       12.35429      518.8002 18.84969  524.8158 17.69125  -6.015625      25.85133  
1 1 1 5  13 18 f 241.2193 7.653217  38.90988       2.456856      40.68643       4.220602      37.99936       3.021554      245.8492 12.92889  238.1347 9.541452  7.714554       16.06846  
1 1 1 5  13 19 o 220.4844 1.303274  32.39219       0.3829016     36.53831       4.842457      32.36611       0.3841043     232.0721 15.75255  220.3955 1.307895  11.67657       15.80676  
1 1 1 5  13 20 o 440.3949 10.93830  130.2616       6.418977      130.9541       14.40337      130.0900       7.170412      433.6467 25.03251  439.4909 12.25589  -5.844208      27.87173  
1 1 1 5  13 21 o 172.9170 5.117557  19.98067       1.177866      23.26556       3.206872      19.46841       1.266379      185.1562 13.08203  170.6362 5.577028  14.51991       14.22120  
1 1 1 5  13 22 o 185.9163 7.561305  23.19208       1.869307      24.69958       3.747163      22.69263       2.156852      189.9911 14.92080  183.6633 8.838959  6.327728       17.34236  
1 1 1 5  13 23 o 45.05431 13.36976  1.399820       0.8605284     -2.616896      2.730362      1.842812       0.9067402     41.42275 19.45332  51.14625 13.21171  -9.723499      23.51554  
1 1 1 5  13 24 o 181.0738 6.646286  21.99702       1.600924      24.70207       3.742764      21.39128       1.771124      189.3343 14.95647  178.3979 7.467016  10.93640       16.71683  
1 1 1 5  13 25 o 68.03095 15.41856  3.312668       1.365317      9.171321       3.614326      2.337509       1.474572      110.3027 25.15047  57.62350 17.59224  52.67925       30.69256  
1 1 1 5  13 26 o 98.37578 9.388807  6.610298       1.215846      14.01037       4.054427      5.879061       1.274502      137.0576 23.01493  92.42322 10.53668  44.63438       25.31223  
1 1 1 5  13 27 o 39.02007 13.14104  1.002147       0.8086235     1.831705       3.268025      0.9480458      0.8345751     61.62629 25.16162  38.52087 13.34106  23.10542       28.47966  
1 1 1 5  13 28 o 77.27464 10.93019  4.196709       1.094099      6.321351       2.452268      3.668676       1.222519      90.06524 20.84594  71.27051 13.36360  18.79473       24.76165  
1 1 1 5  13 29 o 75.98395 15.24840  4.318739       1.490175      1.153954       2.584620      5.894606       1.823830      51.95341 21.88905  88.61938 16.03493  -36.66597      27.13392  
1 1 1 5  13 30 o 40.49804 17.56972  0.3030968      1.756018      -0.5348642     2.672428      0.9398049      2.329508      44.06542 20.18350  48.01737 20.52620  -3.951946      28.78712  
1 1 1 5  13 31 o 40.91629 17.01092  0.7861260      1.529890      -1.290757      2.666283      1.805540       1.867994      40.57195 19.10667  49.82256 19.45553  -9.250607      27.26871  
1 1 1 5  13 32 o 39.86937 17.06409  0.6174796      1.613549      0.5794048      2.716862      0.6382276      2.005561      46.30838 20.86885  42.63972 18.63345  3.668667       27.97704  
1 1 1 5  13 33 o 29.21223 13.89356  -1.200302      1.477385      -0.2038706     3.009773      -1.516598      1.695732      43.75311 20.50844  30.42620 14.58358  13.32691       25.16500  
1 1 1 5  13 34 o 67.26433 14.30223  3.684269       1.242425      4.006763       1.625750      3.231487       1.926361      66.62640 17.92280  57.33426 20.23954  9.292133       27.03452  
1 1 1 5  14 0  f 247.4363 11.40662  41.12068       3.742655      41.12068       3.742655      41.12068       3.742655      247.4363 11.40662  247.4363 11.40662  0.000000       0.000000  
1 1 1 5  14 1  o 89.93830 8.147829  5.442796       0.9658895     5.154375       1.803798      5.558742       1.143673      86.26527 16.28891  90.72738 9.605697  -4.462105      18.91026  
1 1 1 5  14 2  o 227.8340 6.581437  34.65260       1.995986      34.07486       2.253234      36.75825       4.301627      225.8587 7.497188  233.8907 13.86434  -8.031998      15.76159  
1 1 1 5  14 3  o 398.8127 7.509782  106.1257       3.990891      103.9560       4.800480      110.9810       7.181149      394.5762 9.130198  406.9879 13.25925  -12.41168      16.09870  
1 1 1 5  14 4  o 589.1987 8.349222  231.7110       6.555130      231.7349       9.512985      231.6894       9.045388      588.6433 12.12805  588.6924 11.53095  -0.4913330E-01 16.73477  
1 1 1 5  14 5  o 728.0718 11.15519  354.2928       10.82242      359.4145       13.18202      343.7020       18.95580      732.7794 13.50004  714.3747 19.93276  18.40472       24.07417  
1 1 1 5  14 6  f 351.2709 7.278347  82.31989       3.406814      85.25632       4.908103      79.58968       4.732613      357.0932 10.32559  345.0141 10.30571  12.07910       14.58854  
1 1 1 5  14 7  o 89.48643 10.04903  5.415442       1.177589      5.892116       1.490810      4.624566       1.920283      93.06489 12.32426  81.40212 18.16476  11.66277       21.95099  
1 1 1 5  14 8  o 429.4621 7.064034  123.0333       4.042511      127.0863       5.772527      119.1328       5.662994      436.2190 9.930883  422.3348 10.06273  13.88419       14.13793  
1 1 1 5  14 9  o 510.9715 8.735226  174.2751       5.947636      179.3569       7.550074      165.9638       9.655501      518.0980 10.93618  497.6135 14.57732  20.48453       18.22356  
1 1 1 5  14 10 o 345.1326 6.358044  79.43995       2.924038      77.97272       3.653508      82.05447       4.877053      341.8320 8.020912  350.3202 10.45937  -8.488190      13.18080  
1 1 1 5  14 11 o 550.5987 4.948525  202.1034       3.630651      201.5112       3.857565      206.6979       10.74428      549.7696 5.265735  555.3709 14.53095  -5.601318      15.45563  
1 1 1 5  14 12 o 664.7051 8.613763  294.9281       7.629488      294.6160       9.257844      295.5888       13.46946      664.0575 10.46239  664.1296 15.22032  -0.7208252E-01 18.46942  
1 1 1 5  14 13 o 229.3317 4.598796  35.06063       1.405341      35.72144       1.783752      33.97918       2.281922      231.4444 5.783814  225.5279 7.604112  5.916412       9.553797  
1 1 1 5  14 14 o 142.4413 6.284889  13.56023       1.189971      14.71345       1.495903      11.57287       1.963744      148.2849 7.595954  131.0581 11.35666  17.22679       13.66281  
1 1 1 5  14 15 o 575.7220 10.49233  221.6593       8.049301      216.5725       10.47236      229.0031       12.58291      568.2997 13.82908  583.4646 16.19994  -15.16486      21.29981  
1 1 1 5  14 16 o 199.0566 7.940877  26.50761       2.102065      25.99541       2.897861      27.07643       3.053802      196.7368 11.09899  200.7456 11.46385  -4.008881      15.95642  
1 1 1 5  14 17 o 181.8034 7.622395  22.12041       1.842479      21.08177       4.522039      22.32716       2.017540      175.2420 19.70638  182.5754 8.314724  -7.333405      21.38869  
1 1 1 5  14 18 o 191.0782 8.263546  24.46534       2.099052      23.82906       3.248009      24.92167       2.750623      187.7674 13.06292  192.4756 10.76755  -4.708206      16.92867  
1 1 1 5  14 19 o 281.6710 5.328551  52.96224       1.999976      46.75197       6.853150      53.54038       2.090998      260.7206 19.87591  283.1819 5.541337  -22.46136      20.63391  
1 1 1 5  14 20 o 175.9619 1.422027  20.63247       0.3334264     17.39397       3.817376      20.65737       0.3347057     158.4602 18.42188  176.0679 1.426623  -17.60773      18.47704  
1 1 1 5  14 21 o 81.97448 5.983732  4.515872       0.6491168     3.519566       2.026016      4.629843       0.6852388     70.47614 20.40661  82.97678 6.243221  -12.50065      21.34028  
1 1 1 5  14 22 o 161.0863 5.347807  17.36152       1.146319      14.02576       2.792053      18.03781       1.257161      142.6534 14.90801  164.1430 5.756623  -21.48965      15.98085  
1 1 1 5  14 23 o 36.46449 10.03238  0.9248145      0.5027032     -0.4138479     2.958275      0.9646199      0.5101225     51.22242 22.50032  37.19772 10.05399  14.02470       24.64441  
1 1 1 5  14 24 o 130.8739 8.626735  11.58373       1.496044      10.52399       3.307341      11.85634       1.677471      120.2508 21.42609  132.1830 9.588896  -11.93222      23.47391  
1 1 1 5  14 25 o 164.1801 7.769333  18.19187       1.694899      11.71754       3.649964      19.97173       1.913743      125.5410 22.65200  171.8638 8.381803  -46.32280      24.15301  
1 1 1 5  14 26 o 39.26353 13.68604  0.9760087      0.8789862     -0.8474756     3.836628      1.077023       0.9030043     54.86218 24.75461  40.67389 13.88495  14.18829       28.38279  
1 1 1 5  14 27 o 42.69050 14.82385  1.198175       1.030709      1.976253       3.363877      1.117557       1.082790      61.81891 25.41637  42.16673 15.14326  19.65218       29.58564  
1 1 1 5  14 28 o 101.1904 10.17401  7.147429       1.353248      4.767299       3.200132      7.665730       1.493339      75.03493 26.11641  104.4926 10.88441  -29.45768      28.29376  
1 1 1 5  14 29 o 26.60573 12.93268  -2.188496      1.452843      -1.507289      2.961661      -2.404368      1.667227      43.38714 20.33913  28.62413 13.90001  14.76301       24.63515  
1 1 1 5  14 30 o 71.40516 17.97521  4.183290       1.708880      0.7056936      2.888060      6.056787       2.119792      49.17154 21.88364  85.39133 19.10784  -36.21980      29.05173  
1 1 1 5  14 31 o 35.23523 15.83930  -0.1606885     1.554121      4.121080       2.653292      -2.396895      1.917474      65.16776 23.66446  30.68668 14.90279  34.48108       27.96605  
1 1 1 5  14 32 o 32.33535 15.17653  -0.9279439     1.657509      -3.070068      3.190304      -0.1359416     1.939871      38.38775 18.77013  38.04791 17.33901  0.3398438      25.55306  
1 1 1 5  14 33 o 23.87738 11.92646  -3.398766      1.559765      0.6505398      2.928876      -5.001812      1.842823      45.44669 20.93103  23.94287 12.09124  21.50382       24.17243  
1 1 1 5  15 0  o 430.5405 11.64481  123.9763       6.669622      123.9763       6.669622      123.9763       6.669622      430.5405 11.64481  430.5405 11.64481  0.000000       0.000000  
1 1 1 5  15 1  o 418.3171 6.470819  116.7075       3.606936      113.6630       4.915122      120.2603       5.309648      412.6333 8.939156  424.3969 9.389013  -11.76361      12.96388  
1 1 1 5  15 2  o 378.9304 7.194685  95.78756       3.632827      93.66090       4.089587      103.7445       7.910497      374.6304 8.192245  393.2243 15.12518  -18.59390      17.20127  
1 1 1 5  15 3  o 506.3195 7.325918  171.0241       4.942654      178.7536       7.550927      165.2294       6.537934      517.2194 10.95600  497.4054 9.864078  19.81396       14.74225  
1 1 1 5  15 4  o 516.8328 8.163592  178.2545       5.622182      175.7046       8.425707      180.3010       7.548377      512.5958 12.33553  519.4647 10.90496  -6.868835      16.46461  
1 1 1 5  15 5  o 585.6088 9.696953  228.9995       7.566873      228.9382       9.566959      229.1020       12.36627      585.1358 12.26998  584.4228 15.89431  0.7130127      20.07937  
1 1 1 5  15 6  f 501.7735 6.491105  167.9164       4.340101      163.0418       7.479081      170.3913       5.329177      493.9276 11.36348  505.3350 7.914205  -11.40744      13.84787  
1 1 1 5  15 7  o 304.1554 5.651747  61.68291       2.290614      63.22459       3.055582      59.70498       3.460999      307.8468 7.448792  298.9581 8.697204  8.888702       11.45102  
1 1 1 5  15 8  o 490.3105 7.133667  160.3670       4.660769      164.1775       7.245456      157.6772       6.087406      495.6900 10.96938  485.9634 9.400592  9.726654       14.44640  
1 1 1 5  15 9  o 119.6810 5.891382  9.574332       0.9366543     9.997872       1.089672      8.375934       1.832945      122.2482 6.715079  111.2074 12.59044  11.04077       14.26925  
1 1 1 5  15 10 o 42.45657 14.94403  1.057220       1.049625      2.205943       1.621165      0.2281384      1.377267      57.97000 18.55979  38.84375 16.14392  19.12625       24.59862  
1 1 1 5  15 11 o 728.0180 5.302894  353.3880       5.144327      360.5295       5.473132      299.2521       15.06902      735.3073 5.585905  667.4352 16.95720  67.87201       17.85354  
1 1 1 5  15 12 o 369.7907 5.878658  91.19840       2.896728      90.52480       3.030312      98.33731       9.865054      368.4037 6.172907  381.6279 19.46357  -13.22415      20.41899  
1 1 1 5  15 13 o 99.21371 4.036820  6.572483       0.5325699     6.531425       0.5699442     6.855091       1.495307      98.88626 4.335907  100.5978 11.35306  -1.711548      12.15286  
1 1 1 5  15 14 o 216.0614 6.787405  31.18554       1.951711      31.54594       2.616395      30.73339       2.930508      217.0828 9.064860  214.1159 10.30140  2.966934       13.72190  
1 1 1 5  15 15 o 122.7635 5.450572  10.07348       0.8894074     9.989399       2.601372      10.08461       0.9464433     120.6511 16.62195  122.8054 5.800063  -2.154289      17.60483  
1 1 1 5  15 16 o 339.8050 8.276500  77.19580       3.747573      83.76955       7.561670      75.05544       4.314745      351.9282 16.16784  334.7117 9.684285  17.21655       18.84633  
1 1 1 5  15 17 o 172.1702 6.392264  19.82468       1.463968      19.41233       2.358180      20.08326       1.867388      169.8248 10.47176  173.0914 8.118900  -3.266617      13.25045  
1 1 1 5  15 18 o 143.7550 7.952835  13.87136       1.517479      10.72585       3.478240      14.61082       1.686440      123.1251 22.00799  147.4547 8.620589  -24.32961      23.63612  
1 1 1 5  15 19 o 50.65068 8.531666  1.765705       0.5553856     3.313364       3.605683      1.728094       0.5620936     74.75840 27.51661  50.05919 8.744660  24.69921       28.87270  
1 1 1 5  15 20 o 76.53712 2.687523  3.910385       0.2736675     6.559632       4.046914      3.898214       0.2742954     94.83371 29.18020  76.41720 2.697963  18.41651       29.30466  
1 1 1 5  15 21 f 85.20576 2.535872  4.844725       0.2875983     5.018410       4.063567      4.843851       0.2883213     85.17880 29.44127  85.19772 2.542503  -0.1892090E-01 29.55085  
1 1 1 5  15 22 o 126.2448 6.040698  10.69041       1.013240      9.053035       2.638787      10.97358       1.097362      113.0625 18.12744  127.8482 6.462377  -14.78577      19.24490  
1 1 1 5  15 23 o 78.48490 5.585897  4.143008       0.5803697     4.800439       2.381800      4.101510       0.5984065     80.77251 21.67844  78.06091 5.794249  2.711609       22.43944  
1 1 1 5  15 24 o 174.5340 5.993318  20.44617       1.391797      16.59601       4.586797      20.83662       1.460665      149.2914 23.85983  176.1418 6.233036  -26.85039      24.66054  
1 1 1 5  15 25 o 62.02518 20.07193  2.769413       1.892660      9.416954       5.015578      1.665644       2.043759      105.3471 32.49778  53.89312 20.53200  51.45398       38.44046  
1 1 1 5  15 26 o 74.22867 14.80945  4.008325       1.413446      17.35054       4.843139      2.766118       1.477781      147.5708 25.55446  61.01541 17.35376  86.55534       30.88986  
1 1 1 5  15 27 o 41.21115 14.69521  1.098529       1.017765      3.625671       2.629906      0.6533785      1.103770      67.81086 23.67082  37.52261 14.86267  30.28825       27.95007  
1 1 1 5  15 28 o 26.98872 11.77042  -0.6257915E-01 0.7968124     -1.308722      3.486620      0.6090805E-02  0.8184726     47.79250 22.29420  27.89996 12.04960  19.89254       25.34214  
1 1 1 5  15 29 o 43.76689 17.29739  1.155595       1.491944      -0.1145444     3.970572      1.364405       1.609918      52.03293 24.10773  46.04604 18.03796  5.986889       30.10898  
1 1 1 5  15 30 o 86.17023 21.54625  6.642577       2.467278      3.116490       4.619220      8.050138       2.918473      61.31059 27.45384  92.73222 23.57157  -31.42163      36.18470  
1 1 1 5  15 31 o 42.33904 18.52041  0.6491755      1.985606      -3.142966      3.014013      3.557001       2.639290      37.47293 18.30592  60.35284 23.24679  -22.87991      29.58919  
1 1 1 5  15 32 o 41.23248 18.40896  0.5135986      2.060698      0.8649222      3.035313      0.2132176      2.806635      46.95714 21.50884  43.89990 20.31473  3.057243       29.58578  
1 1 1 5  16 0  o 302.4580 9.076375  61.17316       3.650601      61.17316       3.650601      61.17316       3.650601      302.4580 9.076375  302.4580 9.076375  0.000000       0.000000  
1 1 1 5  16 1  o 573.8970 3.169689  219.4895       2.423953      216.0639       8.382683      219.8021       2.532125      568.6526 11.06273  574.2994 3.308820  -5.646790      11.54696  
1 1 1 5  16 2  o 214.5508 5.834458  30.71638       1.666482      30.06696       2.076684      31.89099       2.792884      212.1720 7.356417  218.3350 9.623307  -6.162964      12.11301  
1 1 1 5  16 3  o 426.2050 6.675968  121.1535       3.791458      124.0941       5.021688      117.2546       5.782259      431.1851 8.740020  418.9822 10.35687  12.20291       13.55185  
1 1 1 5  16 4  o 494.2495 9.803742  163.1248       6.456716      165.6929       10.07335      161.3339       8.411935      497.1024 15.22534  490.9609 12.86916  6.141449       19.93555  
1 1 1 5  16 5  o 212.5310 7.553509  30.17319       2.135765      28.54405       2.999249      31.84916       3.042061      206.4031 10.94404  218.1033 10.49807  -11.70020      15.16514  
1 1 1 5  16 6  o 362.5753 7.263735  87.69820       3.509391      88.98317       4.779965      86.19564       5.168877      364.8973 9.839593  359.0175 10.81690  5.879730       14.62268  
1 1 1 5  16 7  o 452.3070 6.497911  136.4461       3.916342      134.8687       5.331591      138.2946       5.771632      449.4804 8.901691  455.0901 9.517606  -5.609650      13.03169  
1 1 1 5  16 8  o 245.4196 6.048256  40.16696       1.977939      39.78780       3.270048      40.38572       2.483826      243.8485 10.08553  245.9044 7.589299  -2.055847      12.62202  
1 1 1 5  16 9  o 35.88543 15.08420  0.1062482      1.222902      -0.9772831     1.461795      2.632787       2.232177      32.85180 15.00189  64.65440 21.83345  -31.80259      26.49068  
1 1 1 5  16 10 o 431.4200 7.509085  124.2089       4.316789      124.9103       5.239240      122.7263       7.617610      432.4720 9.091526  427.8741 13.37714  4.597961       16.17417  
1 1 1 5  16 11 o 432.2010 9.580456  124.8170       5.517540      130.7252       7.403967      117.4381       8.274340      441.6704 12.59320  418.1199 14.87481  23.55054       19.48971  
1 1 1 5  16 12 o 235.0715 4.029206  36.83786       1.262098      37.17397       1.368520      34.92544       3.264371      236.1302 4.349366  228.2337 10.76395  7.896469       11.60946  
1 1 1 5  16 13 o 197.2795 5.745594  25.98682       1.508785      26.74053       1.899911      24.69990       2.482608      200.0052 7.140289  191.9303 9.738966  8.074921       12.07606  
1 1 1 5  16 14 o 397.1618 6.805161  105.3213       3.601467      107.0552       4.818111      103.1258       5.421623      400.0883 9.037481  392.3044 10.38041  7.783997       13.76332  
1 1 1 5  16 15 o 185.9662 4.840537  23.08661       1.198483      23.93400       1.595281      21.98866       1.815889      189.2207 6.335897  181.2315 7.535820  7.989120       9.845414  
1 1 1 5  16 16 o 178.4583 6.788815  21.31122       1.611430      25.16885       2.444929      18.34842       2.142679      193.5770 9.507570  165.1652 9.779429  28.41183       13.63932  
1 1 1 5  16 17 o 276.5781 7.296594  51.19979       2.686779      54.06093       3.538953      47.30679       4.128075      283.7892 9.371336  264.8827 11.72460  18.90646       15.00960  
1 1 1 5  16 18 o 119.5149 7.318110  9.594998       1.159865      11.13276       2.713442      9.251211       1.282982      126.8453 16.43995  117.2123 8.267397  9.632950       18.40168  
1 1 1 5  16 19 f 126.4968 6.638322  10.73588       1.115035      5.837253       3.109843      11.45854       1.194454      89.50676 25.07720  130.6626 6.884621  -41.15579      26.00507  
1 1 1 5  16 20 o 202.6024 6.274520  27.49286       1.691901      26.13318       5.318305      27.64597       1.784616      192.4226 21.08661  203.1092 6.602663  -10.68655      22.09616  
1 1 1 5  16 21 o 199.0090 4.158148  26.44344       1.102672      22.42335       5.147549      26.63679       1.128876      176.9446 22.32797  199.7265 4.241671  -22.78198      22.72730  
1 1 1 5  16 22 o 104.9172 2.713620  7.346602       0.3790571     11.80582       4.734776      7.317837       0.3802777     123.6286 29.20859  104.7105 2.727765  18.91805       29.33569  
1 1 1 5  16 23 o 127.7932 1.725679  10.88637       0.2938605     14.33513       3.539559      10.86244       0.2948785     141.1310 19.32874  127.6523 1.733569  13.47876       19.40632  
1 1 1 5  16 24 o 71.82391 8.296515  3.531881       0.7794536     -2.133447      3.130502      3.906312       0.8047993     45.60523 21.22395  75.62270 8.113303  -30.01746      22.72184  
1 1 1 5  16 25 o 27.22968 12.83525  -1.220908      1.208247      1.748245       4.643315      -1.436551      1.251354      67.07636 28.83207  26.96629 12.81429  40.11007       31.55145  
1 1 1 5  16 26 o 102.0489 6.316871  7.058978       0.8547705     -2.544434      3.835649      7.560822       0.8768200     48.28990 22.79484  105.6437 6.256662  -57.35377      23.63791  
1 1 1 5  16 27 o 70.02077 12.94686  3.593086       1.163510      1.979157       3.552341      3.787031       1.231436      59.66649 25.42195  71.72231 13.37694  -12.05581      28.72661  
1 1 1 5  16 28 o 72.59244 11.25842  3.820473       1.053787      -3.568319      3.556090      4.531769       1.103344      41.91095 20.34012  79.47015 10.69005  -37.55920      22.97820  
1 1 1 5  16 29 o 37.58146 14.20113  0.8943092      0.9729086     1.461665       4.404624      0.8652084      0.9975478     56.62601 25.92736  37.46735 14.32728  19.15866       29.62261  
1 1 1 5  16 30 o 45.10837 19.51793  0.9526151      2.155414      6.217270       3.674377      -1.809432      2.661426      73.03612 27.59819  38.36880 18.35827  34.66731       33.14644  
1 1 1 5  16 31 o 42.67507 18.89873  0.6896854      2.127460      0.8795803      3.564364      0.5845964      2.651575      49.11848 22.78644  44.81883 20.36494  4.299656       30.56064  
1 1 1 5  17 0  o 175.8605 9.796526  20.82040       2.279285      20.82040       2.279285      20.82040       2.279285      175.8605 9.796526  175.8605 9.796526  0.000000       0.000000  
1 1 1 5  17 1  o 575.1683 6.210687  220.6198       4.760012      210.9110       8.361790      225.2742       5.789648      561.7768 11.17023  581.0804 7.477259  -19.30359      13.44185  
1 1 1 5  17 2  o 378.1611 7.377628  95.40743       3.717638      93.71316       5.584799      96.75558       4.981790      374.2926 11.21018  380.4986 9.833836  -6.205994      14.91216  
1 1 1 5  17 3  o 333.7515 5.793464  74.27716       2.576530      74.83301       3.102442      73.04165       4.625377      334.9361 6.951334  330.4796 10.51676  4.456482       12.60648  
1 1 1 5  17 4  o 270.9955 4.933865  48.95959       1.781652      49.14322       3.323009      48.88550       2.110665      271.1387 9.210802  270.7563 5.850154  0.3824463      10.91161  
1 1 1 5  17 5  o 373.8915 9.329049  93.35271       4.647897      86.81129       8.682948      95.97983       5.502631      358.9553 18.21272  378.8014 10.91285  -19.84604      21.23190  
1 1 1 5  17 6  f 578.0499 13.00003  223.6533       10.01344      228.7753       15.69727      220.1388       13.00259      582.3831 20.25834  572.2908 17.06967  10.09235       26.49102  
1 1 1 5  17 7  o 542.7009 8.783195  196.6665       6.351649      196.0119       9.353476      197.2265       8.652589      541.0875 12.97275  542.9584 11.95931  -1.870911      17.64418  
1 1 1 5  17 8  o 377.9435 5.832329  95.26841       2.937260      94.92822       4.546407      95.51213       3.848182      376.9923 9.050285  378.2864 7.634161  -1.294067      11.84011  
1 1 1 5  17 9  o 454.2434 7.403159  137.7251       4.481044      134.1338       5.613069      144.0360       7.440763      448.0317 9.401955  463.6830 12.05289  -15.65128      15.28623  
1 1 1 5  17 10 o 303.1467 10.59861  61.55348       4.274712      67.52560       6.192803      56.11811       5.907961      316.7712 14.71146  288.5688 15.42037  28.20242       21.31232  
1 1 1 5  17 11 o 57.12484 0.8082991 2.174228       0.6152768E-01 2.175941       0.6154460E-01 -0.9396345     2.624200      57.14733 0.8082030 46.90957 20.86952  10.23776       20.88516  
1 1 1 5  17 12 o 158.1118 9.993990  16.79870       2.094830      16.14265       2.259374      20.81706       5.591678      154.8366 11.02276  172.6520 25.03452  -17.81535      27.35376  
1 1 1 5  17 13 o 288.2396 3.704038  55.39433       1.422665      55.78011       1.512539      52.43440       4.189608      289.2287 3.924565  279.3750 11.27732  9.853699       11.94069  
1 1 1 5  17 14 o 296.4793 5.878665  58.68674       2.322452      57.29790       2.837459      61.50570       4.042485      292.7881 7.272818  302.7492 10.03442  -9.961121      12.39288  
1 1 1 5  17 15 f 112.8957 6.537676  8.545060       0.9792929     5.489910       1.457828      11.05733       1.321976      89.44261 12.57881  128.3275 7.767272  -38.88486      14.78368  
1 1 1 5  17 16 f 164.2347 7.156381  18.07671       1.562386      17.45441       2.311991      18.59976       2.119616      160.7627 10.85630  166.2128 9.611149  -5.450134      14.49943  
1 1 1 5  17 17 o 180.7911 6.847110  21.89860       1.646540      21.41804       2.918522      22.12296       1.994213      177.6699 12.40545  181.4866 8.267909  -3.816635      14.90817  
1 1 1 5  17 18 o 174.4755 6.256309  20.38796       1.452187      16.08978       2.755263      22.04123       1.708801      153.4038 13.62030  181.2897 7.087323  -27.88594      15.35392  
1 1 1 5  17 19 o 99.39851 8.145236  6.675121       1.069386      3.886710       2.766448      7.164977       1.159520      74.57518 24.27708  102.9377 8.529898  -28.36249      25.73200  
1 1 1 5  17 20 f 301.5593 8.395317  61.17550       3.370238      60.10015       5.650274      61.76937       4.198978      296.1759 14.35960  302.2301 10.44204  -6.054199      17.75484  
1 1 1 5  17 21 o 138.9311 5.727930  12.94383       1.058128      17.57157       5.463049      12.76345       1.078552      152.1849 27.96991  137.9337 5.881598  14.25124       28.58162  
1 1 1 5  17 22 o 81.41972 5.471364  4.459836       0.5901605     19.94528       6.528156      4.332237       0.5925869     157.4008 32.21125  80.22588 5.577984  77.17492       32.69065  
1 1 1 5  17 23 o 172.9702 8.034381  20.25533       1.846754      18.45436       5.831267      20.45610       1.946972      150.7210 30.08903  173.6857 8.437686  -22.96477      31.24970  
1 1 1 5  17 24 o 126.1101 2.300600  10.61119       0.3866024     10.32006       3.384295      10.61504       0.3891498     115.2187 22.85031  126.1318 2.315361  -10.91308      22.96731  
1 1 1 5  17 25 o 150.7229 7.075062  15.42533       1.416998      15.49669       3.722581      15.41324       1.532355      142.1185 20.22753  150.4171 7.670525  -8.298599      21.63308  
1 1 1 5  17 26 o 48.62352 10.60359  1.708691       0.6676242     -2.119075      3.021756      1.905129       0.6845408     42.59943 20.14585  51.48544 10.33742  -8.886013      22.64327  
1 1 1 5  17 27 o 74.51897 7.819561  3.857009       0.7649143     2.007702       3.803312      3.934963       0.7808698     58.75093 25.66729  75.24192 7.906331  -16.49099      26.85740  
1 1 1 5  17 28 o 64.65559 7.276456  2.908527       0.6160299     3.646327       4.593949      2.895017       0.6216443     63.91422 28.05835  64.46940 7.368457  -0.5551834     29.00974  
1 1 1 5  17 29 o 40.43799 13.33862  1.219536       0.8339326     0.7448678      4.460814      1.236726       0.8488986     53.58610 25.06894  40.69502 13.45922  12.89108       28.45352  
1 1 1 5  17 30 o 34.11105 16.20240  -1.300409      1.996241      -3.233387      3.113357      0.4907373E-01  2.601353      37.51117 18.38353  42.90145 19.74691  -5.390285      26.97952  
1 1 1 5  17 31 o 52.84501 20.94858  2.595998       2.194413      4.709305       4.051770      1.718817       2.610406      60.96154 26.56519  48.73674 21.27889  12.22480       34.03675  
1 1 1 5  18 0  o 377.4876 10.90976  95.34176       5.477337      95.34176       5.477337      95.34176       5.477337      377.4876 10.90976  377.4876 10.90976  0.000000       0.000000  
1 1 1 5  18 1  o 298.7536 5.269424  59.51451       2.097731      60.60432       4.952438      59.27623       2.315732      300.6727 12.38747  298.1279 5.829243  2.544830       13.69049  
1 1 1 5  18 2  o 332.4677 7.728383  73.77514       3.423826      68.23788       6.733699      75.70586       3.976177      318.4489 15.91914  336.5795 8.873266  -18.13062      18.22509  
1 1 1 5  18 3  o 261.8863 7.840465  45.82088       2.732995      43.51532       3.381803      50.16154       4.640211      254.9869 9.972293  273.4189 12.77136  -18.43201      16.20353  
1 1 1 5  18 4  o 293.8420 6.098019  57.59362       2.387680      57.07495       3.840641      57.92038       3.048368      292.0755 9.882366  294.4657 7.775699  -2.390167      12.57468  
1 1 1 5  18 5  o 471.4904 7.920447  148.4164       4.976180      150.1693       6.094199      144.9095       8.619994      474.0312 9.647976  464.6830 13.93695  9.348145       16.95058  
1 1 1 5  18 6  o 182.9678 8.723819  22.41364       2.120811      18.04451       3.865732      24.29489       2.536633      162.6741 18.14205  190.3639 10.03543  -27.68983      20.73268  
1 1 1 5  18 7  o 311.8772 6.286732  64.90025       2.612655      61.26617       3.811676      68.12061       3.588152      302.5932 9.464936  319.2231 8.442760  -16.62994      12.68326  
1 1 1 5  18 8  o 327.0607 6.504867  71.38924       2.834917      66.57484       4.166860      75.53808       3.868140      315.3325 9.929062  336.1034 8.644033  -20.77084      13.16456  
1 1 1 5  18 9  o 265.7279 6.000692  47.11945       2.124770      48.15800       2.921848      45.95384       3.095415      268.3360 8.181119  262.0274 8.878228  6.308594       12.07285  
1 1 1 5  18 10 o 479.6187 7.579535  153.6905       4.844090      155.8322       6.137316      150.1517       7.889047      482.5554 9.544600  472.7621 12.53406  9.793335       15.75443  
1 1 1 5  18 11 o 154.6357 7.730415  16.02299       1.587840      15.39570       1.852339      17.76110       3.083363      151.3851 9.226374  161.7335 14.45945  -10.34833      17.15231  
1 1 1 5  18 12 o 241.0331 5.326014  38.77416       1.710616      39.49608       2.096838      37.33762       2.957886      243.0810 6.479297  235.9095 9.428403  7.171432       11.44011  
1 1 1 5  18 13 o 341.4731 6.217906  77.89226       2.829268      77.26351       2.971394      83.99714       9.258903      340.0422 6.557736  349.8558 19.94342  -9.813599      20.99390  
1 1 1 5  18 14 f 207.8374 6.199852  28.88930       1.715113      27.32524       2.123659      31.82292       2.908443      201.8855 7.909469  217.4880 10.06307  -15.60251      12.79942  
1 1 1 5  18 15 o 131.1092 5.630439  11.50463       0.9813762     11.52718       1.792507      11.49498       1.172754      130.5349 10.39100  130.9259 6.744879  -0.3909912     12.38815  
1 1 1 5  18 16 o 199.3815 4.667466  26.54082       1.240051      25.86704       1.489591      28.06189       2.238123      196.6539 5.690464  204.4061 8.233913  -7.752167      10.00893  
1 1 1 5  18 17 o 66.93346 7.464841  3.039032       0.6544712     2.844555       1.382995      3.095151       0.7429233     63.27661 16.30187  67.38837 8.459349  -4.111763      18.36604  
1 1 1 5  18 18 o 234.2858 6.934613  36.80808       2.162536      33.81834       3.592615      38.50688       2.708107      223.0728 12.13188  239.2495 8.508111  -16.17671      14.81791  
1 1 1 5  18 19 o 162.0765 6.486548  17.62685       1.398071      15.62011       3.143728      18.12157       1.560920      149.8426 15.99164  164.2145 7.150527  -14.37187      17.51749  
1 1 1 5  18 20 o 68.41577 5.918818  3.158391       0.5342891     -0.2968768     3.465483      3.242522       0.5407546     55.33730 24.32887  69.32890 5.909741  -13.99161      25.03635  
1 1 1 5  18 21 o 182.5500 7.961178  22.50380       1.931912      17.87935       6.050800      23.02874       2.038613      148.9324 31.47618  184.5606 8.310705  -35.62827      32.55485  
1 1 1 5  18 22 o 44.15152 10.02712  1.379058       0.5764256     1.037180       3.720685      1.387466       0.5834702     60.88152 25.98085  44.27545 10.11218  16.60607       27.87940  
1 1 1 5  18 23 o 65.75187 9.005894  2.995963       0.7683446     10.48804       9.693413      2.948594       0.7707697     100.8953 42.44293  65.18906 9.122526  35.70624       43.41224  
1 1 1 5  18 24 o 47.92482 11.65741  1.662371       0.7372140     -0.5029098     4.883865      1.712859       0.7457592     59.35334 27.22284  48.64987 11.65664  10.70348       29.61351  
1 1 1 5  18 25 o 60.04077 10.23937  2.570409       0.7898445     2.968988       2.169764      2.509524       0.8480278     61.36245 21.49487  58.95383 11.20452  2.408627       24.23985  
1 1 1 5  18 26 o 49.24303 9.821591  1.749763       0.6218553     -0.5171077     2.394671      1.913684       0.6439466     41.98655 19.18388  51.58737 9.724262  -9.600819      21.50773  
1 1 1 5  18 27 o 13.61115 6.784098  -1.236059      0.4931891     1.463434       3.033018      -1.309375      0.4998415     52.69455 22.97307  13.48840 6.739455  39.20616       23.94122  
1 1 1 5  18 28 o 65.58618 6.614174  2.979383       0.5701568     -1.942367      4.486981      3.060157       0.5748163     48.16087 23.24599  66.49242 6.573512  -18.33155      24.15754  
1 1 1 5  18 29 o 20.42717 9.248484  -0.2274358     0.5409198     2.065959       3.346175      -0.2889743     0.5481290     53.08498 23.59450  20.07909 9.175726  33.00588       25.31589  
1 1 1 5  18 30 o 24.59998 11.01590  -0.1621950     0.7437897     -1.018452      4.472744      -0.1378430     0.7542923     47.16393 22.87120  24.95332 11.13944  22.21061       25.43971  
1 1 1 5  19 0  o 241.1687 8.401408  38.94431       2.692455      38.94431       2.692455      38.94431       2.692455      241.1687 8.401408  241.1687 8.401408  0.000000       0.000000  
1 1 1 5  19 1  o 433.0050 6.705595  125.1358       3.869045      124.7238       7.909799      125.2654       4.435951      430.8726 13.79441  433.1116 7.686230  -2.238953      15.79126  
1 1 1 5  19 2  o 213.2854 8.069064  30.42876       2.289149      30.57995       3.244457      30.27888       3.230279      213.3900 11.45218  212.3329 11.45938  1.057098       16.20093  
1 1 1 5  19 3  o 203.5555 6.727026  27.68643       1.822144      28.52159       2.304740      26.29413       2.975783      206.4418 8.395719  197.8308 11.33589  8.610962       14.10640  
1 1 1 5  19 4  o 444.7931 8.014016  132.1659       4.749871      137.6733       6.027781      123.1442       7.714840      453.6344 9.971902  428.0773 13.54185  25.55707       16.81726  
1 1 1 5  19 5  o 186.8365 6.016429  23.31868       1.495917      26.85412       2.274480      20.62357       1.985862      200.2621 8.542967  175.4542 8.519455  24.80789       12.06497  
1 1 1 5  19 6  o 167.0443 8.665039  18.70578       1.922156      18.16862       3.500893      18.93759       2.299803      163.3471 16.30145  167.8637 10.33165  -4.516617      19.29975  
1 1 1 5  19 7  f 222.7625 7.235417  33.18258       2.144878      25.34925       3.643390      37.33732       2.653408      193.5798 14.22378  236.1604 8.445457  -42.58061      16.54211  
1 1 1 5  19 8  o 320.8783 5.787918  68.72438       2.474778      65.55341       3.678639      71.34601       3.344853      312.8894 8.831967  326.7162 7.683036  -13.82675      11.70610  
1 1 1 5  19 9  o 160.5660 5.139885  17.22127       1.098299      16.66901       1.198574      20.11366       2.742973      157.9203 5.705157  172.6167 11.99990  -14.69644      13.28708  
1 1 1 5  19 10 o 50.03351 17.59754  1.506675       1.455268      3.020285       2.170791      0.2711796      1.961244      66.96985 21.48034  45.63741 19.13784  21.33244       28.76912  
1 1 1 5  19 11 o 93.60487 9.685515  5.937303       1.190645      5.354539       1.416141      7.342740       2.199208      88.34994 12.36722  102.7634 16.62797  -14.41343      20.72288  
1 1 1 5  19 12 o 48.06802 13.47504  1.604612       0.8976519     0.5083771      1.981138      1.887807       1.006946      47.14909 19.45734  51.98760 14.15679  -4.838516      24.06248  
1 1 1 5  19 13 o 222.0140 3.955788  32.88348       1.170272      33.71749       1.267486      28.06369       3.046989      224.7904 4.231476  203.8450 11.26129  20.94542       12.03005  
1 1 1 5  19 14 o 63.65720 1.391187  2.700331       0.1180067     2.701684       0.1184148     2.505072       1.422555      63.67311 1.395650  59.74265 17.03783  3.930458       17.09490  
1 1 1 5  19 15 o 261.8247 6.121299  45.84923       2.135638      47.83130       2.528081      40.90993       3.990839      267.1530 7.107934  245.6257 12.23166  21.52733       14.14695  
1 1 1 5  19 16 o 245.2739 6.250513  40.28296       2.041204      41.89080       2.457454      36.70546       3.665669      249.8776 7.388596  232.6002 11.86607  17.27734       13.97838  
1 1 1 5  19 17 o 267.2846 7.104320  47.93007       2.528044      50.92340       3.559769      44.88428       3.590822      274.6809 9.741100  257.5942 10.48316  17.08664       14.31034  
1 1 1 5  19 18 o 306.9131 6.691818  63.15648       2.736737      60.21371       4.048508      65.63275       3.713780      298.2705 10.20119  311.9776 8.942680  -13.70706      13.56598  
1 1 1 5  19 19 o 40.21621 12.25912  1.111198       0.7164083     0.1106155      2.365836      1.212210       0.7517008     47.80169 20.56416  41.83846 12.51535  5.963226       24.07319  
1 1 1 5  19 20 o 51.69027 4.798771  1.803426       0.3267569     1.301022       2.241906      1.814330       0.3302838     53.03148 21.12477  51.84231 4.836941  1.189175       21.67145  
1 1 1 5  19 21 o 153.7747 5.335758  15.88098       1.091682      8.730083       4.692276      16.29020       1.122484      101.0935 31.47427  155.7267 5.417583  -54.63314      31.93712  
1 1 1 5  19 22 o 100.8203 7.141348  6.906239       0.9531955     6.627299       6.477340      6.912413       0.9636873     87.73796 35.57178  100.8443 7.219282  -13.10629      36.29696  
1 1 1 5  19 23 o 76.77365 9.990037  4.127738       0.9977896     -1.860294      6.844759      4.257747       1.008563      64.03058 30.29271  78.01385 9.926400  -13.98328      31.87760  
1 1 1 5  19 24 o 70.68970 7.413816  3.444808       0.6879693     -0.6285156     5.226557      3.516628       0.6940079     58.24789 27.21243  71.43514 7.397810  -13.18726      28.20008  
1 1 1 5  19 25 o 26.02033 11.62043  -0.2236158     0.8217031     -3.405551      4.315276      -0.1039021     0.8370178     46.77330 22.62994  27.15852 11.94779  19.61478       25.59031  
1 1 1 5  19 26 o 24.87815 10.85531  -0.4332809E-01 0.6784480     4.674384       4.063617      -0.1786029     0.6881061     67.96205 27.93783  23.92147 10.66174  44.04058       29.90309  
1 1 1 5  19 27 o 28.45224 10.75001  0.4638784      0.5574566     1.349556       2.730572      0.4253590      0.5694498     50.01155 21.80057  28.08204 10.80294  21.92951       24.33040  
1 1 1 5  19 28 o 56.56511 6.267285  2.222059       0.4644745     -0.9568540     3.269939      2.287519       0.4692324     43.67502 20.74279  57.41343 6.233304  -13.73841      21.65912  
1 1 1 5  19 29 o 44.60868 11.34018  1.525381       0.6754427     3.639218       3.991847      1.463077       0.6853245     58.01725 25.77957  43.59058 11.59688  14.42667       28.26789  
1 1 1 5  20 0  o 131.9391 8.201359  11.75232       1.428982      11.75232       1.428982      11.75232       1.428982      131.9391 8.201359  131.9391 8.201359  0.000000       0.000000  
1 1 1 5  20 1  o 533.7440 6.664888  190.2528       4.740230      183.0724       8.042321      194.0752       5.867829      522.3461 11.55446  538.7603 8.173506  -16.41418      14.15315  
1 1 1 5  20 2  o 124.2995 8.871803  10.38921       1.459789      11.90166       2.315737      9.391888       1.880472      132.3804 13.30816  117.6507 12.17048  14.72972       18.03407  
1 1 1 5  20 3  o 302.0771 6.294708  60.92877       2.533769      60.71058       3.183247      61.30603       4.185720      301.2397 7.937124  302.2673 10.40768  -1.027527      13.08884  
1 1 1 5  20 4  o 305.0496 8.404535  62.29425       3.413057      60.78417       5.307959      63.35872       4.456503      300.2565 13.29966  307.1514 10.90581  -6.894928      17.19935  
1 1 1 5  20 5  o 182.0285 6.157360  22.15087       1.491358      22.01340       2.012950      22.31814       2.220487      181.2045 8.359155  182.3429 9.168146  -1.138412      12.40687  
1 1 1 5  20 6  o 383.4780 6.988217  98.27515       3.570921      98.13778       4.914568      98.42878       5.197382      382.5651 9.648353  382.9904 10.19317  -0.4253235     14.03537  
1 1 1 5  20 7  f 106.5805 9.132693  7.664737       1.284541      8.383844       1.693867      6.691461       1.970608      111.0943 11.61368  98.29116 15.56347  12.80318       19.41904  
1 1 1 5  20 8  o 354.4921 6.736942  83.99171       3.182313      81.86980       3.789537      89.06763       5.861119      349.7323 8.131618  363.5653 12.11523  -13.83307      14.59116  
1 1 1 5  20 9  o 165.4770 5.948336  18.31582       1.309482      17.66254       1.466043      20.89377       2.912273      162.3977 6.789728  175.6255 12.52656  -13.22777      14.24833  
1 1 1 5  20 10 f 120.5010 8.572492  9.780291       1.367496      9.684223       1.713836      9.948629       2.268689      119.5101 10.88115  120.3696 14.43180  -0.8594818     18.07419  
1 1 1 5  20 11 o 113.1191 8.667452  8.630925       1.296522      7.281697       2.600685      9.077156       1.495633      101.1605 20.00220  115.8344 9.781110  -14.67384      22.26562  
1 1 1 5  20 12 o 181.2907 6.762804  22.02282       1.630849      21.50414       1.856026      23.77979       3.416001      178.9712 7.801392  186.7507 13.82525  -7.779480      15.87449  
1 1 1 5  20 13 o 288.8594 4.846529  55.72652       1.865481      56.70622       2.071759      51.52862       4.288526      291.3130 5.337105  275.9360 11.68991  15.37695       12.85063  
1 1 1 5  20 14 o 89.26143 1.728622  5.310248       0.2056067     5.452528       0.2083372     -0.1133150E-01 1.274135      90.44934 1.728574  35.40993 15.15967  55.03941       15.25790  
1 1 1 5  20 15 o 72.78994 0.9118021 3.530450       0.8843933E-01 3.527279       0.8857261E-01 4.581847       1.612787      72.75723 0.9135867 80.47807 15.60255  -7.720848      15.62928  
1 1 1 5  20 16 o 91.87532 8.455585  5.725017       1.023577      6.986631       1.832158      5.152581       1.234136      100.1555 14.11955  86.58797 10.94001  13.56750       17.86185  
1 1 1 5  20 17 o 150.7651 9.271039  15.40277       1.853520      18.51958       3.354080      14.03248       2.223951      162.9794 15.63583  143.1368 11.76378  19.84264       19.56695  
1 1 1 5  20 18 o 32.08914 12.43994  0.4653530      0.7593586     -0.8753701     2.131083      0.6603384      0.8127029     40.78444 18.42159  34.99598 13.03014  5.788464       22.56412  
1 1 1 5  20 19 o ?        ?         -3.523943      0.5528541     -3.916712      1.950554      -3.489634      0.5764952     28.91753 14.24685  ?        ?         0.000000       14.24685  
1 1 1 5  20 20 o 47.29758 14.71581  1.580414       1.025933      0.8134935      2.406933      1.750684       1.134116      50.71848 21.23028  49.63243 15.47695  1.086044       26.27281  
1 1 1 5  20 21 o 83.41119 12.25073  4.940140       1.321087      0.6340300      3.322994      5.748499       1.439757      55.29348 24.07703  90.05761 12.32028  -34.76413      27.04613  
1 1 1 5  20 22 o 106.9356 12.72175  8.179842       1.777277      1.830624       5.241308      9.004737       1.889205      66.22549 29.47658  112.1652 12.87305  -45.93974      32.16496  
1 1 1 5  20 23 o 45.13347 11.66169  1.495064       0.7063317     -3.878699      3.509261      1.721959       0.7210891     41.72216 20.23849  48.51370 11.35632  -6.791534      23.20695  
1 1 1 5  20 24 o 33.29541 11.12972  0.7616457      0.5801304     -2.651527      4.707693      0.8142763      0.5845860     49.94259 24.03145  34.14357 11.16285  15.79902       26.49755  
1 1 1 5  20 25 o 22.99751 9.580805  0.1208031      0.4867324     1.881364       3.201580      0.7914897E-01  0.4924567     54.98693 23.78994  22.62062 9.543870  32.36632       25.63293  
1 1 1 5  20 26 o 25.94857 11.15463  0.5997824E-01  0.6951104     1.429851       9.026669      0.5180648E-01  0.6971806     62.04335 30.58253  25.90800 11.15460  36.13535       32.55329  
1 1 1 5  20 27 o 65.55602 9.639734  3.122511       0.8169515     -1.807158      5.394404      3.238229       0.8264843     49.88757 24.39616  66.82624 9.552907  -16.93867      26.19982  
1 1 1 5  20 28 o 70.95328 4.593671  3.428017       0.4319817     1.817834       2.360104      3.483831       0.4394048     49.10935 20.81467  71.51672 4.635859  -22.40736      21.32468  
1 1 1 5  21 0  o 29.77577 18.23556  0.5062353      1.383639      0.5062353      1.383639      0.5062353      1.383639      29.77577 18.23556  29.77577 18.23556  0.000000       0.000000  
1 1 1 5  21 1  o 236.6530 6.087764  37.43438       1.918150      36.95307       2.710713      37.91709       2.714640      234.7343 8.681250  237.7982 8.581094  -3.063934      12.20653  
1 1 1 5  21 2  f 245.8247 7.401206  40.45327       2.421623      37.08012       4.516836      41.81396       2.868767      233.7372 14.57469  249.7168 8.634314  -15.97964      16.94028  
1 1 1 5  21 3  o 181.8816 7.804261  22.17705       1.887045      20.69139       2.178756      26.63757       3.775211      175.4322 9.354028  197.9809 14.40878  -22.54874      17.17879  
1 1 1 5  21 4  o 265.4594 6.293381  47.08775       2.226156      49.87472       3.070012      43.99737       3.232814      272.7532 8.457106  255.9523 9.495144  16.80089       12.71536  
1 1 1 5  21 5  o 202.0371 6.545454  27.31357       1.759830      26.51715       2.730909      27.87917       2.301399      198.4212 10.36464  203.8229 8.492153  -5.401703      13.39934  
1 1 1 5  21 6  o 328.1764 5.719459  71.94387       2.501127      75.33209       3.598327      68.77673       3.478950      335.3857 8.051606  320.3374 8.156811  15.04825       11.46132  
1 1 1 5  21 7  o 253.8222 4.906148  43.01107       1.659372      43.47186       2.199303      42.40208       2.528369      254.9053 6.480150  251.5599 7.551226  3.345383       9.950546  
1 1 1 5  21 8  o 151.0599 7.042624  15.30319       1.413710      13.91087       1.775608      17.71406       2.336495      143.6459 9.326849  161.8491 10.89733  -18.20319      14.34370  
1 1 1 5  21 9  o 355.6168 6.012015  84.54350       2.848891      80.33538       3.912545      89.29247       4.156384      346.0733 8.484332  364.8376 8.549535  -18.76431      12.04485  
1 1 1 5  21 10 o 72.95825 14.44766  3.740290       1.354871      3.619972       1.828720      3.886698       2.017282      71.19145 18.94558  73.68359 20.02625  -2.492142      27.56783  
1 1 1 5  21 11 o 326.0487 7.192526  71.21586       3.124910      72.46089       3.999024      69.26346       5.007806      328.2103 9.152768  319.8864 11.76844  8.323853       14.90870  
1 1 1 5  21 12 o 122.6215 7.326152  10.11395       1.191602      9.145498       1.328092      14.11243       2.698584      116.3606 8.626781  143.2203 14.33262  -26.85963      16.72858  
1 1 1 5  21 13 o 63.10600 5.311731  2.681138       0.4425209     2.986877       0.4668247     -0.2790245E-01 1.389588      66.63207 5.301391  36.77639 15.78976  29.85568       16.65597  
1 1 1 5  21 14 o 50.28343 7.332835  1.731763       0.4768703     1.815900       0.5147700     1.222673       1.266247      51.43692 7.750934  45.42307 16.36797  6.013851       18.11042  
1 1 1 5  21 15 o 152.8987 5.523652  15.66923       1.123542      14.67317       1.279159      19.03207       2.350369      147.7790 6.511871  167.2519 10.60063  -19.47292      12.44098  
1 1 1 5  21 16 o 45.01385 4.348675  1.367020       0.2575975     1.370167       0.2604735     1.226883       1.738280      45.06025 4.393818  48.93312 18.86129  -3.872875      19.36631  
1 1 1 5  21 17 o 43.51066 2.730253  1.268234       0.1574988     1.270617       0.1599376     1.191871       0.9053470     43.54817 2.770543  42.18427 13.89726  1.363903       14.17074  
1 1 1 5  21 18 o 31.99549 12.86815  0.3655510      0.8401241     -0.5153617     2.729906      0.4577096      0.8829769     47.42444 21.17986  33.49290 13.28473  13.93154       25.00141  
1 1 1 5  21 19 o ?        ?         -3.760494      0.8885443     2.253223       3.085535      -4.304290      0.9278488     61.91433 24.74289  ?        ?         0.000000       24.74289  
1 1 1 5  21 20 o 179.8646 10.08067  22.37161       2.406397      23.66016       3.600186      21.33101       3.235302      181.0164 15.06200  172.5718 14.19464  8.444626       20.69666  
1 1 1 5  21 21 f ?        ?         -4.145683      0.7297735     -1.185413      2.013333      -4.593447      0.7830226     36.81446 17.09464  ?        ?         0.000000       17.09464  
1 1 1 5  21 22 o 78.19710 16.25146  4.720904       1.638045      5.635221       2.833831      4.262124       2.007374      79.14288 24.42990  71.72919 20.16594  7.413696       31.67783  
1 1 1 5  21 23 o 21.75934 9.622539  -0.1233497     0.5496446     0.4108449      5.616765      -0.1285147     0.5522954     58.98425 27.76337  21.76698 9.634857  37.21726       29.38767  
1 1 1 5  21 24 o 55.60368 17.44764  2.517041       1.438997      2.998124       3.606091      2.425925       1.569363      60.31471 25.65291  54.53773 18.30663  5.776985       31.51515  
1 1 1 5  21 25 o 43.39314 12.95560  1.439335       0.8061056     -1.145350      3.623446      1.573919       0.8268260     45.87270 21.80053  45.23891 13.01738  0.6337852      25.39125  
1 1 1 5  21 26 o 15.73030 7.826982  -1.517109      0.6450049     7.625196       5.146457      -1.663004      0.6501311     71.38860 30.51280  15.34684 7.670772  56.04176       31.46223  
1 1 1 5  22 0  o 180.0057 10.79341  21.92960       2.567394      21.92960       2.567394      21.92960       2.567394      180.0057 10.79341  180.0057 10.79341  -0.000000      0.000000  
1 1 1 5  22 1  o 130.8251 8.637343  11.52759       1.497297      9.531504       2.293375      13.01052       1.976729      117.5535 14.98073  138.6215 10.78630  -21.06800      18.45986  
1 1 1 5  22 2  o 74.41697 12.31280  3.834768       1.178302      4.074887       1.753752      3.637180       1.590872      75.68954 17.70530  71.58115 16.94349  4.108391       24.50632  
1 1 1 5  22 3  o 272.1031 6.191213  49.50232       2.244826      48.97976       3.183400      50.01919       3.165999      270.0290 8.859222  272.9174 8.716926  -2.888458      12.42862  
1 1 1 5  22 4  o 148.1755 7.972426  14.75673       1.568333      13.63332       2.265505      15.79053       2.173285      141.5844 12.12476  152.7644 10.74484  -11.18005      16.20065  
1 1 1 5  22 5  o 166.4259 4.705563  18.50765       1.042485      18.82234       1.170771      17.30313       2.290534      167.7773 5.243228  159.9067 10.81330  7.870575       12.01744  
1 1 1 5  22 6  o 205.9795 7.846577  28.48045       2.149725      32.70279       3.475130      25.86312       2.736049      219.7019 11.91495  195.6786 10.53199  24.02330       15.90248  
1 1 1 5  22 7  o 270.5621 6.238198  48.96748       2.249053      49.87735       3.101712      47.95871       3.265919      272.4569 8.553986  266.9856 9.193748  5.471344       12.55769  
1 1 1 5  22 8  o 198.0815 4.825008  26.20676       1.273549      25.98742       1.604034      26.58085       2.094784      197.0082 6.117616  198.9174 7.918844  -1.909134      10.00666  
1 1 1 5  22 9  o 107.5525 6.437356  7.770386       0.9183529     7.420362       1.082877      8.666972       1.733109      104.8892 7.803645  112.6040 11.72182  -7.714813      14.08183  
1 1 1 5  22 10 o 242.1431 5.677046  39.21684       1.831758      36.95397       2.948253      40.63953       2.337706      234.0612 9.472396  246.1187 7.135600  -12.05746      11.85930  
1 1 1 5  22 11 o 93.30862 9.548467  5.928576       1.170490      6.774530       1.515386      4.677426       1.842911      99.31323 11.67363  80.72025 17.62852  18.59299       21.14329  
1 1 1 5  22 12 o 117.6753 8.688474  9.374509       1.352785      9.628181       1.919185      9.124013       1.907126      118.3295 12.35342  115.0721 12.64573  3.257439       17.67828  
1 1 1 5  22 13 o 140.5571 5.272579  13.23948       0.9857776     12.90862       1.119872      14.37819       2.077539      138.6551 6.075956  145.1755 10.81720  -6.520416      12.40682  
1 1 1 5  22 14 o 36.40969 11.69262  0.8866408      0.6430792     1.444307       0.7206500     -1.293460      1.424870      45.16988 11.83355  30.33173 14.18289  14.83815       18.47125  
1 1 1 5  22 15 o 107.9539 5.284524  7.827831       0.7578726     8.918406       0.8297450     2.338243       1.861601      115.2223 5.419426  58.32276 19.93558  56.89952       20.65908  
1 1 1 5  22 16 o 87.55351 12.22822  5.378605       1.387766      4.576180       1.791137      6.583793       2.195097      78.69006 17.53097  94.51958 18.08713  -15.82952      25.18887  
1 1 1 5  22 17 o 96.09346 6.649744  6.256630       0.8462242     5.913276       1.026991      6.982747       1.493478      92.94823 8.381819  99.99944 11.41204  -7.051208      14.15943  
1 1 1 5  22 18 o 99.00531 1.462670  6.535290       0.1929649     6.582857       0.1942534     2.985348       1.678136      99.36475 1.467111  62.62174 18.69194  36.74302       18.74943  
1 1 1 5  22 19 o 60.59342 3.551986  2.466467       0.2855364     2.270059       0.2916129     7.032468       1.406034      58.08850 3.788075  100.0462 10.71345  -41.95770      11.36343  
1 1 1 5  22 20 o 68.73607 12.65586  3.460977       1.116477      2.137465       1.681520      4.504491       1.493095      53.54177 18.90883  77.35196 15.02748  -23.81019      24.15303  
1 1 1 5  22 21 o 84.73668 13.05714  5.295769       1.427037      2.354935       3.908804      5.748017       1.532841      60.48473 26.22719  88.06416 13.49159  -27.57944      29.49387  
1 1 1 5  22 22 o 37.01963 14.81446  0.6959333      1.107659      2.114250       3.760163      0.5611629      1.159091      58.07790 25.44364  36.37034 14.93274  21.70756       29.50196  
1 1 1 5  22 23 f 36.13289 15.23431  0.4447528      1.253374      1.657140       2.461889      0.2056194E-01  1.456225      50.98526 21.41503  35.44482 15.66915  15.54044       26.53537  
1 1 1 5  22 24 o 70.31293 15.91504  4.005043       1.456263      1.389845       3.343796      4.617171       1.617741      51.76695 23.25520  75.06236 16.61356  -23.29541      28.57997  
1 1 1 5  22 25 o 16.25351 8.224017  -2.834738      0.8778303     -2.343785      4.211334      -2.857038      0.8975456     44.92765 21.87931  16.51217 8.350400  28.41548       23.41866  
1 1 1 5  23 0  o 151.1180 13.15901  15.69492       2.601609      15.69492       2.601609      15.69492       2.601609      151.1180 13.15901  151.1180 13.15901  0.000000       0.000000  
1 1 1 5  23 1  o 204.7434 7.434565  28.13233       2.024964      30.49186       3.616044      27.05434       2.444143      211.6727 12.88120  200.3974 9.177310  11.27531       15.81608  
1 1 1 5  23 2  o 55.40265 14.07715  2.168428       1.041190      2.762972       1.541611      1.669755       1.411859      62.47939 17.70935  50.97795 17.36265  11.50145       24.80086  
1 1 1 5  23 3  f 149.5354 6.505520  14.99582       1.293180      14.81627       1.514069      15.48005       2.486438      148.4452 7.680424  150.6399 12.49938  -2.194687      14.67049  
1 1 1 5  23 4  o 115.2854 8.321796  8.969769       1.269791      10.35280       1.933786      7.921439       1.683607      123.1161 11.93708  107.5442 11.94997  15.57187       16.89070  
1 1 1 5  23 5  o 114.1045 7.812328  8.776395       1.180670      8.112846       1.674877      9.431832       1.664610      108.8782 11.72914  117.7236 10.72924  -8.845421      15.89621  
1 1 1 5  23 6  o 59.60919 15.46454  2.525784       1.238725      2.043311       2.199308      2.749954       1.499127      58.70273 21.50981  62.18469 17.40719  -3.481960      27.67096  
1 1 1 5  23 7  o 138.8952 7.737004  12.99082       1.426310      13.59576       2.071012      12.44500       1.967202      141.3313 11.08556  135.2002 11.01474  6.131149       15.62736  
1 1 1 5  23 8  o 210.8251 5.251681  29.72398       1.475347      30.92298       1.753207      26.81479       2.730928      214.8042 6.131429  198.9251 10.33808  15.87904       12.01958  
1 1 1 5  23 9  o 124.5409 5.848140  10.40811       0.9678065     9.423376       1.079993      14.42296       2.180698      118.3232 6.879461  145.3531 11.34885  -27.02985      13.27114  
1 1 1 5  23 10 o 85.54539 8.707936  4.983240       0.9788027     4.692582       1.629799      5.147218       1.224154      81.12688 15.64334  86.45084 10.86603  -5.323967      19.04691  
1 1 1 5  23 11 o 126.1572 9.493142  10.82830       1.584156      10.90047       2.049033      10.72107       2.497665      125.6759 12.39680  123.4407 15.52730  2.235191       19.86901  
1 1 1 5  23 12 o 52.62346 14.85692  1.978899       1.087182      2.303777       1.702251      1.755087       1.412881      57.57713 19.05979  51.19328 17.36992  6.383842       25.78740  
1 1 1 5  23 13 o 71.81136 8.199545  3.529323       0.7705694     3.700289       0.8481235     2.720667       1.844533      73.39587 8.850334  61.47436 19.80833  11.92151       21.69559  
1 1 1 5  23 14 o 92.69053 2.394349  5.736116       0.2954830     5.693160       0.2988678     7.600411       1.968900      92.33961 2.431059  103.2077 14.73431  -10.86812      14.93352  
1 1 1 5  23 15 o 35.73964 12.63875  0.7953214      0.7514456     0.8598416      0.8317839     0.5088875      1.752568      37.26358 13.28516  43.28148 18.11649  -6.017895      22.46559  
1 1 1 5  23 16 o 42.20527 9.049628  1.262415       0.4936669     0.3399897      0.5641250     4.278667       1.020102      27.45793 10.70039  78.29936 10.00545  -50.84143      14.64948  
1 1 1 5  23 17 o 52.71220 14.33617  2.063166       1.033383      6.731352       2.049673      0.4721611      1.196593      94.52078 16.89369  36.87492 15.15964  57.64586       22.69827  
1 1 1 5  23 18 o 151.7547 12.05173  16.40369       2.417053      15.97485       4.958488      16.53735       2.768209      131.1880 29.12441  150.7664 13.93679  -19.57832      32.28724  
1 1 1 5  23 19 o 51.81544 16.28773  2.058508       1.253482      3.011899       2.846044      1.829064       1.396191      61.51704 24.01682  49.64507 17.25222  11.87196       29.57104  
1 1 1 5  23 20 o ?        ?         -3.428532      0.6184861     -1.243494      0.8782811     -5.578013      0.8711060     21.30307 10.28297  ?        ?         0.000000       10.28297  
1 1 1 5  23 21 o 42.86048 20.13309  -1.202750      2.927403      -0.8969126     3.400711      -2.077811      5.752323      46.56051 21.81645  53.85498 26.07337  -7.294472      33.99673  
1 1 1 5  23 22 o 17.34427 8.784268  -3.362010      1.016617      1.247368       1.747579      -5.719734      1.249862      45.08958 18.40362  ?        ?         0.000000       18.40362  
1 1 1 5  23 23 o 61.17564 16.08015  3.081169       1.327804      5.696914       2.467448      2.014932       1.575350      76.72717 22.60628  49.76240 18.20935  26.96478       29.02799  
1 1 1 5  23 24 o 23.10361 11.16702  -1.373404      1.044340      0.6786669      2.881947      -1.683603      1.120496      46.66548 21.21467  23.09244 11.25468  23.57304       24.01521  
1 1 1 5  24 0  o 185.4885 12.21162  23.45309       2.987866      23.45309       2.987866      23.45309       2.987866      185.4885 12.21162  185.4885 12.21162  0.000000       0.000000  
1 1 1 5  24 1  o 105.9691 9.900213  7.647144       1.381788      7.395663       1.639124      8.264802       2.568820      103.6465 12.09526  107.4823 18.60952  -3.835838      22.19481  
1 1 1 5  24 2  o 52.57640 15.28590  1.944507       1.134695      2.097750       1.905227      1.860273       1.412535      57.23741 20.13478  52.62723 17.35983  4.610176       26.58521  
1 1 1 5  24 3  o 27.54009 11.78272  -0.1150188E-01 0.7687926     -0.2930941     0.8850038     0.8544798      1.551991      27.36107 12.14914  44.73514 17.65389  -17.37407      21.43039  
1 1 1 5  24 4  o 131.6262 7.002346  11.65973       1.223753      9.989271       1.573470      14.21703       1.946842      121.1962 9.827312  144.6266 10.16681  -23.43035      14.14002  
1 1 1 5  24 5  o 34.82203 14.72607  0.1170902      1.176919      -2.009961      1.641729      2.365908       1.688067      30.62533 14.58830  58.48713 18.95837  -27.86180      23.92151  
1 1 1 5  24 6  f 112.9049 10.41599  8.712479       1.549409      10.44142       2.051886      6.418770       2.363372      122.9767 12.70419  93.75771 19.55104  29.21902       23.31608  
1 1 1 5  24 7  o 71.83231 13.76539  3.658911       1.269650      2.930733       1.664898      4.670944       1.962755      63.66296 18.51788  79.85205 18.76575  -16.18909      26.36409  
1 1 1 5  24 8  o 92.54747 10.50626  5.893010       1.272744      5.943142       1.616063      5.811130       2.065340      91.99892 13.59127  89.37574 17.96569  2.623177       22.52751  
1 1 1 5  24 9  o 140.2722 6.746379  13.25941       1.257306      12.00193       1.501471      16.21049       2.300159      132.9866 8.517749  153.6293 11.31536  -20.64275      14.16296  
1 1 1 5  24 10 o 41.19013 14.97517  1.010402       1.062946      0.9461110      1.231777      1.197897       2.103547      42.04435 15.95819  51.12294 20.42988  -9.078590      25.92381  
1 1 1 5  24 11 f 193.2118 6.864711  25.18651       1.764569      24.50060       2.667755      25.72002       2.352775      188.9150 10.64058  194.3326 9.111124  -5.417587      14.00837  
1 1 1 5  24 12 o 91.27294 10.28373  5.774076       1.228993      5.790617       2.227942      5.766840       1.473453      87.35696 19.62043  90.37509 12.57546  -3.018127      23.30458  
1 1 1 5  24 13 o 93.13238 8.240152  5.940733       1.012068      4.914626       1.212851      8.293465       1.836526      83.67200 11.15584  108.1786 13.00058  -24.50665      17.13090  
1 1 1 5  24 14 o 80.69918 4.771267  4.387619       0.5107800     4.115642       0.5271714     8.558297       2.064373      78.08761 5.094172  108.6736 14.62682  -30.58595      15.48853  
1 1 1 5  24 15 o 50.95770 12.29125  1.899316       0.8248803     1.729122       0.9266032     2.549297       1.810808      48.45515 13.72819  58.01622 19.66463  -9.561066      23.98251  
1 1 1 5  24 16 o 69.51665 6.678969  3.311361       0.6110843     2.280226       0.6981863     6.687806       1.263408      56.67616 9.586252  97.69298 9.839131  -41.01682      13.73698  
1 1 1 5  24 17 o 86.69812 11.99343  5.440441       1.348495      8.539261       2.921577      4.601544       1.520105      100.2113 22.43849  77.80444 15.20743  22.40687       27.10630  
1 1 1 5  24 18 o 65.45819 13.65155  3.230018       1.152140      0.3924414      2.674459      3.876624       1.276680      47.41021 21.08175  71.75455 13.85409  -24.34434      25.22650  
1 1 1 5  24 19 o 93.09137 13.16812  6.442903       1.587902      1.938098       3.537813      7.579363       1.776945      56.65618 24.75361  100.7493 13.58166  -44.09311      28.23478  
1 1 1 5  24 20 o 65.27180 7.965234  2.992375       0.6784510     3.036379       0.6815076     -1.880105      7.171369      65.76766 7.936809  56.90509 27.89074  8.862568       28.99804  
1 1 1 5  24 21 o 26.07782 11.16830  0.8407652E-01  0.6919704     1.073085       0.8494954     -1.866180      1.192908      38.58596 13.45420  23.64704 11.54418  14.93892       17.72804  
1 1 1 5  24 22 o 50.39971 2.222733  1.702086       0.1489085     1.704413       0.1495748     1.442656       1.579341      50.43312 2.231236  45.01819 17.79528  5.414928       17.93462  
1 1 1 5  25 0  o 55.76564 27.46890  3.265347       2.437882      3.265347       2.437882      3.265347       2.437882      55.76564 27.46890  55.76564 27.46890  -0.000000      0.000000  
1 1 1 5  25 1  o 116.7917 9.640940  9.312283       1.487040      7.155000       2.069248      11.61626       2.138443      100.0722 16.06082  129.5128 12.54818  -29.44064      20.38153  
1 1 1 5  25 2  o 124.9113 11.04051  10.72269       1.818756      10.28622       2.305032      11.44268       2.960477      120.9669 14.59464  125.9721 18.16041  -5.005219      23.29816  
1 1 1 5  25 3  o 157.4047 6.909699  16.69834       1.445742      14.81715       2.102760      18.38486       1.990992      147.0281 10.80841  164.4933 9.119074  -17.46516      14.14140  
1 1 1 5  25 4  o 77.78478 12.61924  4.260533       1.263198      3.630680       1.584720      5.358132       2.091968      70.37954 17.07435  85.07480 18.94050  -14.69526      25.50051  
1 1 1 5  25 5  o 158.2222 7.100995  16.89576       1.493317      15.81992       1.759951      19.66154       2.821857      152.6030 8.690873  168.4339 12.66558  -15.83095      15.36060  
1 1 1 5  25 6  o 93.84931 13.26159  6.208320       1.612281      6.647635       1.902067      5.086985       3.038824      96.33210 15.33099  80.79887 25.35494  15.53323       29.62958  
1 1 1 5  25 7  o 181.1438 6.269870  22.09815       1.511125      20.68896       1.766522      25.94223       2.917631      174.8257 7.601149  193.9949 11.33608  -19.16920      13.64860  
1 1 1 5  25 8  o 155.8385 9.164895  16.59002       1.894761      19.54280       2.499116      12.59793       2.905832      168.1763 11.21599  131.8112 16.93497  36.36507       20.31235  
1 1 1 5  25 9  o 120.6219 6.935237  9.856791       1.110008      9.501905       1.200427      11.94987       2.915315      118.2077 7.662368  127.5588 17.62170  -9.351089      19.21552  
1 1 1 5  25 10 o 97.35281 14.95560  6.870472       1.878150      6.129692       2.507639      7.816957       2.834505      88.27817 21.51651  99.71516 21.93019  -11.43699      30.72285  
1 1 1 5  25 11 o 105.9312 8.709206  7.716589       1.218504      6.631705       2.076070      8.286715       1.504996      94.06702 17.19618  109.0570 10.48545  -14.99003      20.14084  
1 1 1 5  25 12 o 77.66562 11.88618  4.312259       1.191043      2.688042       2.801477      4.670611       1.315890      61.67931 23.89868  80.52804 12.68207  -18.84873      27.05516  
1 1 1 5  25 13 o 44.90017 10.88027  1.462314       0.6440686     2.559547       0.6961956     -5.052620      1.696433      60.40533 8.917104  23.27087 11.73329  37.13446       14.73719  
1 1 1 5  25 14 o 100.8978 4.973350  6.876087       0.6665979     6.988399       0.7019960     5.845939       2.126039      101.6566 5.199609  85.49889 19.13904  16.15771       19.83277  
1 1 1 5  25 15 o 29.92207 10.80993  0.5493921      0.5527306     0.8499577      0.5865067     -1.837006      1.652627      34.80572 11.16540  30.15030 14.43684  4.655420       18.25071  
1 1 1 5  25 16 o 65.80070 11.45510  3.157699       0.9679226     2.525147       1.067467      6.082605       2.295422      57.55008 14.04534  85.09720 20.48964  -27.54712      24.84144  
1 1 1 5  25 17 o 19.73314 9.549713  -1.147202      0.7696750     0.9291119      1.557509      -1.818078      0.8853300     42.42806 17.35239  19.24688 9.504216  23.18118       19.78473  
1 1 1 5  25 18 o 25.32826 12.11645  -1.305489      1.158110      0.5779785      3.723519      -1.507204      1.218548      51.88000 23.78577  25.40521 12.22499  26.47479       26.74347  
1 1 1 5  25 19 f 42.17229 15.56999  1.268920       1.155939      -1.723444      3.859719      1.563759       1.211549      45.79183 21.96264  45.32003 16.04617  0.4717979      27.19994  
1 1 1 5  25 20 o 47.43739 21.99543  0.1542661      3.314832      -0.6334820     3.557044      5.354700       9.139351      46.34681 21.89988  64.52476 31.59630  -18.17794      38.44386  
1 1 1 5  26 0  o 57.44244 27.95312  3.561975       2.512907      3.561975       2.512907      3.561975       2.512907      57.44244 27.95312  57.44244 27.95312  -0.000000      0.000000  
1 1 1 5  26 1  o 84.41191 13.91949  5.111979       1.511147      6.063130       1.957132      3.707780       2.377988      90.74332 16.80443  69.55419 22.49791  21.18913       28.08104  
1 1 1 5  26 2  o 44.07986 17.41775  0.9369404      1.512515      1.215775       2.090719      0.6307624      2.190830      50.48893 20.30196  47.80642 20.14786  2.682507       28.60255  
1 1 1 5  26 3  o 93.17167 10.14504  6.019211       1.239220      6.961776       1.500822      3.999873       2.196737      99.74677 11.50202  71.82304 21.37334  27.92373       24.27172  
1 1 1 5  26 4  o 104.5175 8.245245  7.468918       1.139033      5.811810       1.586835      9.230220       1.635962      90.08472 13.64610  115.2704 10.77567  -25.18568      17.38767  
1 1 1 5  26 5  o 142.4666 8.668917  13.88557       1.637913      12.84540       2.051865      15.71254       2.719346      135.6920 11.45493  148.6505 13.88934  -12.95850      18.00359  
1 1 1 5  26 6  o 89.11147 11.81019  5.613100       1.367881      5.355691       1.827483      5.941056       2.062767      84.67153 16.79054  88.57217 18.08971  -3.900642      24.68117  
1 1 1 5  26 7  o 78.95794 14.54335  4.568754       1.473785      5.499926       1.724278      2.044021       2.839227      86.28093 15.57029  58.68919 23.63789  27.59174       28.30519  
1 1 1 5  26 8  o 101.8465 11.67653  7.338315       1.556028      7.021061       2.039492      7.780206       2.407003      97.00954 16.35862  100.7151 18.62102  -3.705551      24.78602  
1 1 1 5  26 9  o 55.10005 9.198706  2.140834       0.6515922     2.001651       0.6787282     3.777778       2.327666      52.99765 9.976930  68.18033 22.27365  -15.18268      24.40604  
1 1 1 5  26 10 o 48.64199 14.08736  1.756950       0.9654268     6.028320       1.936088      0.3433935      1.113777      88.76954 16.98631  34.72743 14.48220  54.04211       22.32194  
1 1 1 5  26 11 o 22.93057 11.04643  -1.381240      1.001426      1.434246       2.054040      -2.259140      1.146977      49.83520 20.09356  22.17204 10.92379  27.66316       22.87095  
1 1 1 5  26 12 f 170.7886 7.755054  20.04417       1.760283      21.51088       2.338098      18.12501       2.674514      175.1431 10.06068  158.3199 12.78625  16.82314       16.26978  
1 1 1 5  26 13 o 24.91474 11.22833  -0.2980407     0.7866077     -0.7439914     0.9499191     0.6749427      1.403123      24.94807 11.63743  39.76281 16.38851  -14.81474      20.10007  
1 1 1 5  26 14 o 39.68646 16.44238  0.6656814      1.422363      2.296648       2.184205      -0.5352195     1.874237      54.98987 21.15651  37.27964 17.00975  17.71023       27.14644  
1 1 1 5  26 15 o 61.31825 7.303753  2.616667       0.5850573     2.835749       0.6061062     -0.3742428     2.239478      63.88417 7.247975  40.82695 18.61489  23.05722       19.97617  
1 1 1 5  26 16 o 44.68880 14.69389  1.516340       1.012299      0.8998076      1.095006      5.141300       2.655156      38.49524 14.93424  73.18462 23.78082  -34.68938      28.08129  
1 1 1 5  26 17 o 41.77225 14.23631  1.300241       0.9492146     3.442102       1.994005      0.6726618      1.079356      61.94170 20.63249  36.10814 14.56334  25.83356       25.25451  
1 1 1 5  26 18 o 38.51703 14.85165  0.9542387      1.078043      -1.026178      1.955219      1.819269       1.292210      35.11713 16.48250  47.81479 16.59843  -12.69766      23.39189  
1 1 1 5  27 0  o 31.68743 21.25410  -0.5359582     2.518037      -0.5359582     2.518037      -0.5359582     2.518037      31.68743 21.25410  31.68743 21.25410  -0.000000      0.000000  
1 1 1 5  27 1  o 64.89996 18.08438  3.276610       1.622008      6.070031       2.963449      2.081829       1.938088      83.99104 24.78180  54.47827 20.15228  29.51278       31.94138  
1 1 1 5  27 2  o 102.4118 13.06851  7.557523       1.742829      7.108722       2.082226      8.607592       3.185001      97.07660 16.69885  101.0935 24.00364  -4.016884      29.24083  
1 1 1 5  27 3  o 62.54737 11.74088  2.827953       0.9426215     1.876954       1.074892      5.994413       1.961381      50.23527 14.95126  88.55872 17.24140  -38.32345      22.82117  
1 1 1 5  27 4  o 45.90438 17.60682  1.286158       1.509548      1.867836       1.865626      0.1832616      2.568920      52.32980 19.68908  47.12952 20.82418  5.200275       28.65845  
1 1 1 5  27 5  o 65.29565 16.02522  3.264679       1.383759      2.964019       1.673396      3.914845       2.460783      61.35701 18.74247  68.53250 22.92253  -7.175491      29.60950  
1 1 1 5  27 6  o 42.71888 16.00200  1.150362       1.229409      0.9493335      1.666234      1.390575       1.821401      44.25380 18.00479  48.34645 19.11056  -4.092655      26.25616  
1 1 1 5  27 7  o 36.82721 15.28700  0.4643272      1.232786      -0.3086959     1.364806      3.890099       2.873120      33.31772 14.92073  67.50740 24.60872  -34.18968      28.77876  
1 1 1 5  27 8  o 83.36555 13.37650  5.121513       1.435704      4.957394       1.885356      5.348049       2.215040      78.87047 18.29457  80.27559 20.60476  -1.405121      27.55444  
1 1 1 5  27 9  o 65.00902 15.01203  3.235301       1.274169      4.100033       1.736501      2.226701       1.875399      71.44232 18.19433  54.28286 19.86723  17.15946       26.93957  
1 1 1 5  27 10 o 31.71885 13.40586  0.2208767      0.9744107     3.181314       2.280863      -0.4400588     1.077707      61.72591 22.00017  28.59900 12.99031  33.12691       25.54909  
1 1 1 5  27 11 o 80.79132 11.00326  4.704198       1.153813      6.127299       1.956552      3.945411       1.428676      87.96975 17.30786  71.34866 15.47348  16.62109       23.21617  
1 1 1 5  27 12 o 79.37875 11.31820  4.578809       1.163300      7.327178       1.723662      2.279761       1.576481      99.21720 13.37799  53.52433 18.34410  45.69287       22.70411  
1 1 1 5  27 13 o 91.36053 8.399627  5.847601       1.011131      5.599317       1.261784      6.293165       1.690303      87.88130 11.01634  90.75130 14.46281  -2.870003      18.18056  
1 1 1 5  27 14 o 103.3569 5.493801  7.279506       0.7539163     7.518088       0.8167317     5.905024       1.960335      104.8786 5.867514  84.55085 17.95488  20.32771       18.88929  
1 1 1 5  27 15 f 33.23112 15.43323  -0.7759973     1.642022      3.884175       2.925542      -2.919247      1.984000      62.94393 24.41293  29.96816 14.68444  32.97578       28.48902  
1 1 1 5  27 16 o 59.98207 7.444008  2.526313       0.5822172     2.565004       0.6028662     1.990347       2.243793      60.35347 7.669221  51.17234 20.86581  9.181133       22.23059  
1 1 1 5  28 0  o 34.79380 23.86307  -1.271267      3.553548      -1.271267      3.553548      -1.271267      3.553548      34.79380 23.86307  34.79380 23.86307  -0.000000      0.000000  
1 1 1 5  28 1  o 50.59719 17.59476  1.912253       1.452303      1.748087       1.793336      2.225078       2.475543      50.36759 19.22233  56.05368 22.24058  -5.686092      29.39628  
1 1 1 5  28 2  o 91.82711 14.36035  6.296536       1.699631      6.762054       2.234452      5.657400       2.618180      91.80354 18.89600  80.17244 23.19306  11.63110       29.91617  
1 1 1 5  28 3  o 98.24366 8.768264  6.727204       1.135815      6.961783       1.246314      5.577506       2.759147      99.57527 9.508281  78.71881 24.07061  20.85646       25.88053  
1 1 1 5  28 4  o 102.3179 14.00971  7.773869       1.859983      6.610229       2.129932      11.51145       3.817264      91.15611 18.17299  112.0013 26.06788  -20.84515      31.77722  
1 1 1 5  28 5  o 28.04709 13.40236  -1.553997      1.408659      -2.724831      1.853855      0.4557295E-01  2.166854      29.71860 14.48243  42.54113 18.94267  -12.82253      23.84461  
1 1 1 5  28 6  o 38.24373 15.51027  0.6880255      1.231933      1.759027       1.402616      -2.926628      2.576779      48.71455 17.26351  36.10899 17.47436  12.60556       24.56383  
1 1 1 5  28 7  o 49.58628 18.13425  1.818306       1.562036      -0.2310894E-01 2.121037      4.000586       2.309020      41.63216 18.62564  67.42432 22.19312  -25.79217      28.97325  
1 1 1 5  28 8  o 71.52534 14.33517  3.909441       1.318640      3.707900       1.504351      4.577889       2.739689      68.11621 16.70378  70.04253 24.17590  -1.926323      29.38520  
1 1 1 5  28 9  o 80.27557 17.86239  5.254517       1.861461      6.759917       2.144765      0.6586004      3.747485      90.94955 18.33117  52.64545 24.03281  38.30409       30.22595  
1 1 1 5  28 10 o 36.69724 16.38372  -0.7154040E-01 1.632122      -0.3734303     1.915352      0.7288384      3.118690      37.86020 17.24404  49.84669 22.42015  -11.98648      28.28462  
1 1 1 5  28 11 o 51.84035 16.16305  2.155305       1.236946      -2.701432      2.652313      3.505233       1.398324      36.49265 17.67642  65.98385 16.05792  -29.49120      23.88122  
1 1 1 5  28 12 o 38.40654 16.19378  0.5932337      1.416342      5.311060       3.319716      -0.4566408     1.566025      70.42686 26.31267  33.90488 15.49977  36.52198       30.53849  
1 1 1 5  28 13 o 36.46586 14.92101  0.6451746      1.152295      1.936628       1.766404      -0.3115163     1.520326      49.82636 19.06227  34.05649 15.45333  15.76987       24.53926  
1 1 1 5  29 0  o 90.80254 21.70290  6.939103       2.278167      6.939103       2.278167      6.939103       2.278167      90.80254 21.70290  90.80254 21.70290  0.000000       0.000000  
1 1 1 5  29 1  o 63.55301 18.31546  3.358525       1.635637      0.7742345      2.514166      5.254930       2.153718      47.35104 20.77300  77.95264 20.47432  -30.60160      29.16703  
1 1 1 5  29 2  f 40.58757 17.75460  0.3271036      1.824866      -1.381783      3.088809      1.243411       2.261804      43.32559 20.45274  48.25715 20.41150  -4.931561      28.89539  
1 1 1 5  29 3  o 47.52180 18.07249  1.620534       1.581686      4.120630       2.071269      -1.876721      2.449750      68.40735 20.84321  37.30277 17.78341  31.10458       27.39870  
1 1 1 5  29 4  f 24.66714 12.09345  -2.283668      1.351218      -2.294896      1.620860      -2.258086      2.446512      27.95989 13.60661  36.16626 17.38235  -8.206377      22.07455  
1 1 1 5  29 5  o 34.17013 15.35794  -0.2214059     1.460414      -1.720897      1.612946      6.600778       3.440405      29.61119 14.20092  78.84359 27.09664  -49.23240      30.59238  
1 1 1 5  29 6  o 25.05985 12.10079  -1.593075      1.218976      -1.410403      1.562070      -1.877548      1.949327      30.06315 14.29482  32.63259 15.63978  -2.569441      21.18832  
1 1 1 5  29 7  o 37.25385 16.30168  0.2185148      1.539535      -0.9548672     1.794974      3.483637       2.994250      34.20361 15.96882  61.28500 24.41307  -27.08139      29.17192  
1 1 1 5  29 8  o 44.87723 17.57103  1.372373       1.526987      2.439503       1.989975      -0.1557260     2.381302      54.18443 20.34577  42.01961 19.17272  12.16482       27.95611  
1 1 1 6  0  0  o 246.9623 18.10073  41.32083       5.881502      41.32083       5.881502      41.32083       5.881502      246.9623 18.10073  246.9623 18.10073  -0.000000      0.000000  
1 1 1 6  0  1  o 656.1539 18.18603  288.0094       15.87312      288.0094       15.87312      288.0094       15.87312      656.1539 18.18603  656.1539 18.18603  0.000000       0.000000  
1 1 1 6  0  2  f 422.5634 10.43873  119.2531       5.869674      119.2531       5.869674      119.2531       5.869674      422.5634 10.43873  422.5634 10.43873  0.000000       0.000000  
1 1 1 6  0  3  o 244.1761 10.22585  39.95416       3.313878      39.95416       3.313878      39.95416       3.313878      244.1761 10.22585  244.1761 10.22585  0.000000       0.000000  
1 1 1 6  0  4  o 322.4264 23.72838  70.58435       10.06494      70.58435       10.06494      70.58435       10.06494      322.4264 23.72838  322.4264 23.72838  0.000000       0.000000  
1 1 1 6  0  5  o 812.3599 22.59635  441.8975       24.41742      441.8975       24.41742      441.8975       24.41742      812.3599 22.59635  812.3599 22.59635  0.000000       0.000000  
1 1 1 6  0  6  o 816.2672 31.04703  448.2178       33.65850      448.2178       33.65850      448.2178       33.65850      816.2672 31.04703  816.2672 31.04703  0.000000       0.000000  
1 1 1 6  0  7  o 90.53082 0.9711185 5.462465       0.1171196     5.462465       0.1171196     5.462465       0.1171196     90.53082 0.9711185 90.53082 0.9711185 -0.000000      0.000000  
1 1 1 6  0  8  o 893.8052 16.99630  533.8105       20.22630      533.8105       20.22630      533.8105       20.22630      893.8052 16.99630  893.8052 16.99630  0.000000       0.000000  
1 1 1 6  0  9  o 458.3110 9.064760  140.1903       5.531039      140.1903       5.531039      140.1903       5.531039      458.3110 9.064760  458.3110 9.064760  0.000000       0.000000  
1 1 1 6  0  10 f 679.9631 15.94528  309.1544       14.42950      309.1544       14.42950      309.1544       14.42950      679.9631 15.94528  679.9631 15.94528  0.000000       0.000000  
1 1 1 6  0  11 o 772.3372 14.76994  398.6255       15.18801      398.6255       15.18801      398.6255       15.18801      772.3372 14.76994  772.3372 14.76994  0.000000       0.000000  
1 1 1 6  0  12 o 128.6083 9.789527  11.22105       1.654748      11.22105       1.654748      11.22105       1.654748      128.6083 9.789527  128.6083 9.789527  0.000000       0.000000  
1 1 1 6  0  13 o 303.0615 15.26412  61.82798       6.128334      61.82798       6.128334      61.82798       6.128334      303.0615 15.26412  303.0615 15.26412  0.000000       0.000000  
1 1 1 6  0  14 o 154.0756 12.99838  16.18665       2.623334      16.18665       2.623334      16.18665       2.623334      154.0756 12.99838  154.0756 12.99838  0.000000       0.000000  
1 1 1 6  0  15 o 281.5407 8.066816  52.99031       3.020715      52.99031       3.020715      52.99031       3.020715      281.5407 8.066816  281.5407 8.066816  -0.000000      0.000000  
1 1 1 6  0  16 o 35.23939 21.47083  0.7380371      1.896328      0.7380371      1.896328      0.7380371      1.896328      35.23939 21.47083  35.23939 21.47083  0.000000       0.000000  
1 1 1 6  0  17 o 411.6858 13.75370  113.6077       7.525891      113.6077       7.525891      113.6077       7.525891      411.6858 13.75370  411.6858 13.75370  0.000000       0.000000  
1 1 1 6  0  18 o 234.8267 18.67106  37.60298       5.754894      37.60298       5.754894      37.60298       5.754894      234.8267 18.67106  234.8267 18.67106  0.000000       0.000000  
1 1 1 6  0  19 o 220.7491 46.00396  37.09529       11.93047      37.09529       11.93047      37.09529       11.93047      220.7491 46.00396  220.7491 46.00396  0.000000       0.000000  
1 1 1 6  0  20 o 179.2991 19.44121  22.26482       4.506644      22.26482       4.506644      22.26482       4.506644      179.2991 19.44121  179.2991 19.44121  0.000000       0.000000  
1 1 1 6  0  21 o 293.3676 10.78983  57.66594       4.204972      57.66594       4.204972      57.66594       4.204972      293.3676 10.78983  293.3676 10.78983  0.000000       0.000000  
1 1 1 6  0  22 o 189.8931 9.537026  24.24074       2.399257      24.24074       2.399257      24.24074       2.399257      189.8931 9.537026  189.8931 9.537026  0.000000       0.000000  
1 1 1 6  0  23 o 411.7759 14.82213  113.8904       8.108960      113.8904       8.108960      113.8904       8.108960      411.7759 14.82213  411.7759 14.82213  0.000000       0.000000  
1 1 1 6  0  24 o 200.5811 12.29311  27.20533       3.257106      27.20533       3.257106      27.20533       3.257106      200.5811 12.29311  200.5811 12.29311  0.000000       0.000000  
1 1 1 6  0  25 f 13.22068 9.175151  -0.4916465     0.5643569     -0.4916465     0.5643569     -0.4916465     0.5643569     13.22068 9.175151  13.22068 9.175151  -0.000000      0.000000  
1 1 1 6  0  26 o 11.18673 8.252032  -2.843400      0.9103823     -2.843400      0.9103823     -2.843400      0.9103823     11.18673 8.252032  11.18673 8.252032  -0.000000      0.000000  
1 1 1 6  0  27 o 162.4601 10.96683  17.92828       2.348892      17.92828       2.348892      17.92828       2.348892      162.4601 10.96683  162.4601 10.96683  0.000000       0.000000  
1 1 1 6  0  28 o 99.95214 11.31907  6.956954       1.457779      6.956954       1.457779      6.956954       1.457779      99.95214 11.31907  99.95214 11.31907  -0.000000      0.000000  
1 1 1 6  0  29 o 20.84173 12.58647  0.2860566      0.6395305     0.2860566      0.6395305     0.2860566      0.6395305     20.84173 12.58647  20.84173 12.58647  -0.000000      0.000000  
1 1 1 6  0  30 o 38.26198 23.93660  0.7432085      2.510817      0.7432085      2.510817      0.7432085      2.510817      38.26198 23.93660  38.26198 23.93660  -0.000000      0.000000  
1 1 1 6  0  31 o 44.04146 24.45886  1.958299       2.116587      1.958299       2.116587      1.958299       2.116587      44.04146 24.45886  44.04146 24.45886  0.000000       0.000000  
1 1 1 6  0  32 o 35.85143 22.69307  0.6231594      2.330207      0.6231594      2.330207      0.6231594      2.330207      35.85143 22.69307  35.85143 22.69307  0.000000       0.000000  
1 1 1 6  0  33 o 63.59018 32.92316  4.966915       3.597771      4.966915       3.597771      4.966915       3.597771      63.59018 32.92316  63.59018 32.92316  -0.000000      0.000000  
1 1 1 6  0  34 o 54.86964 29.08452  3.762704       2.857803      3.762704       2.857803      3.762704       2.857803      54.86964 29.08452  54.86964 29.08452  0.000000       0.000000  
1 1 1 6  0  35 o 57.21640 31.09587  4.540613       3.341970      4.540613       3.341970      4.540613       3.341970      57.21640 31.09587  57.21640 31.09587  -0.000000      0.000000  
1 1 1 6  0  36 o 33.18768 22.83412  -0.7263087     3.314019      -0.7263087     3.314019      -0.7263087     3.314019      33.18768 22.83412  33.18768 22.83412  -0.000000      0.000000  
1 1 1 6  0  37 o 38.37119 26.38565  0.3912441      4.410528      0.3912441      4.410528      0.3912441      4.410528      38.37119 26.38565  38.37119 26.38565  -0.000000      0.000000  
1 1 1 6  1  0  o 42.72990 12.00615  1.471668       0.5916847     1.471668       0.5916847     1.471668       0.5916847     42.72990 12.00615  42.72990 12.00615  -0.000000      0.000000  
1 1 1 6  1  1  f 478.3503 8.814890  152.5779       5.618708      152.3018       6.337240      153.5927       12.14848      477.8635 9.952284  478.8408 19.07775  -0.9773254     21.51764  
1 1 1 6  1  2  f 82.70152 7.467192  4.596689       0.8140395     3.735792       1.024090      6.074240       1.341633      74.07796 10.68305  94.81211 10.81234  -20.73415      15.19981  
1 1 1 6  1  3  o 866.7717 28.75331  505.4778       33.16383      514.1385       55.33887      500.6242       41.42709      866.6597 48.10781  860.1433 36.22542  6.516418       60.22161  
1 1 1 6  1  4  o 504.5901 24.30852  171.0895       16.29638      0.000000       0.000000      171.0895       16.29638      ?        ?         504.5901 24.30852  0.000000       24.30852  
1 1 1 6  1  5  o 939.7280 29.17640  594.2969       36.49059      590.6238       40.37555      610.6751       85.25857      935.7189 32.43072  931.5804 69.17586  4.138550       76.40060  
1 1 1 6  1  6  o 211.6516 0.7569016 29.84624       0.2134689     29.83940       0.2140292     31.14605       2.952058      211.6274 0.7589752 215.8392 10.29377  -4.211838      10.32171  
1 1 1 6  1  7  o 341.1634 4.715337  77.56805       2.143625      74.51752       3.000475      80.74828       3.063597      334.3418 6.734816  348.0428 6.605802  -13.70093      9.433681  
1 1 1 6  1  8  o 311.6598 5.044929  64.73592       2.095122      63.58571       2.445938      67.90519       4.060096      308.8593 5.943076  318.9213 9.564676  -10.06192      11.26069  
1 1 1 6  1  9  o 363.6496 5.242453  88.14048       2.540336      96.14926       4.255579      83.70669       3.166380      379.6978 8.410989  354.3421 6.706050  25.35565       10.75713  
1 1 1 6  1  10 o 853.7690 12.35687  486.8035       14.05797      489.1883       20.08153      484.5117       19.68629      854.8104 17.63005  850.7756 17.36502  4.034729       24.74596  
1 1 1 6  1  11 o 383.2171 8.935074  97.98292       4.562644      95.43080       5.691435      102.5730       7.632786      377.8633 11.31627  391.3491 14.66270  -13.48581      18.52168  
1 1 1 6  1  12 o 509.2567 8.199749  173.0336       5.564304      164.9590       7.152844      185.4090       8.855143      496.9746 10.80118  526.6450 12.61839  -29.67038      16.60991  
1 1 1 6  1  13 o 424.9849 10.45733  120.6543       5.921992      118.2384       8.434143      123.0034       8.317008      419.8389 15.10055  428.3206 14.59350  -8.481689      20.99992  
1 1 1 6  1  14 o 255.2156 7.209164  43.49296       2.449234      41.37090       4.544503      44.36166       2.907650      248.1654 13.79700  257.6453 8.480834  -9.479965      16.19511  
1 1 1 6  1  15 o 91.45473 7.997239  5.625246       0.9647896     6.499341       1.483588      4.984705       1.270011      97.90217 11.59725  85.58854 11.42048  12.31363       16.27647  
1 1 1 6  1  16 o 298.8673 7.245740  59.60340       2.885590      57.62153       4.101683      61.54549       4.060314      293.4208 10.50750  303.3152 10.05989  -9.894379      14.54678  
1 1 1 6  1  17 o 636.1787 10.91990  270.5832       9.257020      265.9414       14.14363      274.0617       12.24375      628.9705 16.89080  639.4496 14.36926  -10.47906      22.17600  
1 1 1 6  1  18 o 785.5248 19.21906  415.2871       20.11711      398.5320       27.31809      435.1382       29.73513      765.4387 26.82491  799.1516 27.96643  -33.71283      38.75174  
1 1 1 6  1  19 o 552.8071 25.73181  207.5993       18.90272      169.8159       30.10371      232.1938       24.28787      489.0513 46.76358  581.9911 31.43507  -92.93985      56.34710  
1 1 1 6  1  20 o 219.0533 8.301511  32.07403       2.418766      29.70020       3.512329      34.21523       3.335796      210.3216 12.59014  225.9754 11.11217  -15.65384      16.79261  
1 1 1 6  1  21 o 604.4621 16.03907  245.3520       12.90737      268.6039       21.85206      232.8926       15.99600      628.4547 26.15140  587.4587 20.46559  40.99591       33.20747  
1 1 1 6  1  22 o 71.19292 8.623631  3.434144       0.8014324     3.810462       1.142489      3.069573       1.124518      74.54311 11.90199  66.54567 13.14803  7.997437       17.73494  
1 1 1 6  1  23 o 454.6722 9.426154  138.2150       5.710925      137.8393       9.495973      138.4279       7.148088      452.3705 15.77746  454.4199 11.81483  -2.049438      19.71087  
1 1 1 6  1  24 o 240.2951 7.681088  38.62370       2.456308      40.77162       3.900084      37.21157       3.162289      246.2184 11.92265  235.5150 10.09997  10.70340       15.62559  
1 1 1 6  1  25 o 90.50104 10.19499  5.561831       1.208092      10.45897       2.493223      4.059247       1.381050      123.4107 15.50246  76.39675 14.08509  47.01391       20.94555  
1 1 1 6  1  26 o 129.3960 6.449567  11.22095       1.108546      10.41084       1.265470      13.89323       2.298369      124.4709 7.666958  143.0394 12.17400  -18.56847      14.38709  
1 1 1 6  1  27 o 125.0307 5.902715  10.47515       0.9806499     10.33063       1.131286      10.91200       1.966895      124.0373 6.871430  126.5634 11.79864  -2.526093      13.65373  
1 1 1 6  1  28 o 146.5565 7.295870  14.43842       1.420326      13.74470       1.597240      17.05988       3.104909      142.7689 8.433385  157.2163 15.00273  -14.44740      17.21057  
1 1 1 6  1  29 o 68.01054 12.57401  3.245969       1.097561      3.209290       1.170314      3.513767       3.162266      67.39648 13.50237  72.53738 25.89894  -5.140900      29.20735  
1 1 1 6  1  30 o 103.0597 9.671399  7.256155       1.312645      8.408141       1.488509      3.226863       2.783826      110.8590 10.19036  68.62363 24.32076  42.23534       26.36936  
1 1 1 6  1  31 o 49.40252 16.38596  1.679205       1.257976      2.115564       1.320971      -2.571291      4.122788      54.27588 16.66612  51.71666 24.16366  2.559219       29.35374  
1 1 1 6  1  32 o 55.16912 20.54966  2.017496       2.021758      1.549247       2.679549      2.636407       3.080616      55.63803 22.75820  63.35261 24.91164  -7.714581      33.74204  
1 1 1 6  1  33 o 63.46565 21.49664  3.237078       2.163900      3.951866       3.756756      2.882178       2.647140      69.18826 27.41520  61.53331 23.38503  7.654942       36.03405  
1 1 1 6  1  34 f 68.50347 23.13368  4.256215       2.505956      1.201341       3.148308      9.538134       4.139771      52.58014 23.15013  94.22073 29.59740  -41.64058      37.57571  
1 1 1 6  1  35 o 42.19606 18.69299  0.4072405      2.083140      0.7421846      4.139838      0.2936765      2.410557      52.61302 24.45867  43.75890 19.69405  8.854122       31.40195  
1 1 1 6  1  36 o 51.33727 21.13029  2.205344       2.328364      2.288108       3.341377      2.127223       3.246290      53.35772 23.65420  52.59708 23.31619  0.7606468      33.21394  
1 1 1 6  1  37 o 52.74868 22.24497  2.788866       2.673376      3.469606       3.799570      2.121466       3.762157      55.19249 24.79214  51.05994 23.58988  4.132553       34.22182  
1 1 1 6  2  0  o 392.9537 20.58558  103.9507       10.71105      103.9507       10.71105      103.9507       10.71105      392.9537 20.58558  392.9537 20.58558  -0.000000      0.000000  
1 1 1 6  2  1  o 172.8073 1.768177  19.89673       0.4071564     22.77681       1.861153      19.75197       0.4172636     184.6837 7.578860  172.1773 1.818700  12.50638       7.794023  
1 1 1 6  2  2  o 235.6422 2.545082  36.99811       0.7991504     37.17014       0.8439876     35.50686       2.484898      236.1886 2.681660  230.6306 8.098277  5.557968       8.530732  
1 1 1 6  2  3  o 215.2867 6.786902  30.92578       1.944552      32.49789       2.728288      29.30259       2.772262      220.5575 9.304037  209.3694 9.965429  11.18810       13.63359  
1 1 1 6  2  4  o 886.5635 22.71524  526.8884       26.81284      484.5793       49.10478      544.8617       32.00526      843.1801 43.85561  900.5253 26.70127  -57.34521      51.34464  
1 1 1 6  2  5  o 631.2022 15.81220  266.3391       13.28900      270.9974       16.21724      256.8180       23.18508      636.2072 19.15136  617.5411 28.25017  18.66602       34.12985  
1 1 1 6  2  6  o 1290.928 22.09162  1116.515       38.00171      1046.402       51.59546      1199.648       56.18210      1246.362 31.06659  1334.259 31.59981  -87.89624      44.31344  
1 1 1 6  2  7  o 582.2137 10.31148  226.1341       7.999759      227.0646       12.14164      225.4203       10.63434      582.7148 15.65096  581.0054 13.73590  1.709473       20.82372  
1 1 1 6  2  8  o 573.6993 7.109066  219.4304       5.434635      220.8094       7.759181      218.1024       7.614336      575.3057 10.12147  571.7778 9.993813  3.527832       14.22394  
1 1 1 6  2  9  o 526.9731 7.801147  185.1811       5.477979      185.3035       7.684831      185.0546       7.810768      526.9263 10.94488  526.5568 11.13204  0.3695068      15.61130  
1 1 1 6  2  10 o 685.6622 10.17373  313.7496       9.295316      314.8551       14.13314      312.9069       12.33974      686.1267 15.45827  684.3054 13.53264  1.821350       20.54484  
1 1 1 6  2  11 o 806.5397 10.86625  434.3457       11.67829      435.3948       15.82402      433.0908       17.30656      806.7850 14.71924  804.3233 16.14754  2.461670       21.84947  
1 1 1 6  2  12 o 598.0732 7.978112  238.6458       6.358109      235.0869       9.397754      241.6498       8.634150      593.0958 11.89120  601.4831 10.77265  -8.387268      16.04527  
1 1 1 6  2  13 o 260.8719 8.510296  45.47097       2.954363      47.76768       4.003866      42.72593       4.377258      267.1047 11.27463  252.3700 13.06084  14.73470       17.25407  
1 1 1 6  2  14 o 401.9887 10.50872  108.0675       5.624249      126.0930       9.176348      97.22186       7.117907      433.2252 15.92290  380.6989 14.05541  52.52634       21.23895  
1 1 1 6  2  15 o 431.0995 9.799118  124.1669       5.629089      134.1413       9.194926      118.1878       7.119060      446.8954 15.46407  420.0005 12.73507  26.89487       20.03296  
1 1 1 6  2  16 o 490.4222 3.549983  160.3041       2.319903      164.8710       3.560585      156.9352       3.058119      497.2402 5.373801  485.1719 4.730262  12.06824       7.159129  
1 1 1 6  2  17 o 203.4312 8.497189  27.67766       2.298312      26.03873       3.490577      28.93199       3.053672      196.7373 13.39476  207.7286 11.07195  -10.99130      17.37837  
1 1 1 6  2  18 o 617.9310 18.23253  256.9317       14.99634      244.6836       18.37831      281.3353       25.94166      601.2672 22.98077  641.0726 30.45515  -39.80536      38.15274  
1 1 1 6  2  19 o 150.5689 8.224561  15.17659       1.643877      14.14153       2.537445      15.92521       2.157969      144.7502 13.30410  154.0172 10.57909  -9.267044      16.99753  
1 1 1 6  2  20 o 147.2026 9.503876  14.53127       1.854226      13.43297       2.459602      15.97724       2.822171      141.0539 13.24080  153.8441 13.91705  -12.79018      19.20945  
1 1 1 6  2  21 o 315.8102 9.537056  66.68142       4.008815      74.26907       6.626008      62.30042       5.034832      332.4858 14.99423  304.8759 12.41934  27.60992       19.46964  
1 1 1 6  2  22 o 96.15241 5.440690  6.185392       0.6942438     9.213595       1.570390      5.449805       0.7739844     116.9610 10.17734  90.14767 6.486606  26.81335       12.06874  
1 1 1 6  2  23 o 201.0386 7.301990  27.02110       1.952865      28.31568       3.109571      26.17797       2.509466      205.3041 11.41147  197.6276 9.557618  7.676498       14.88521  
1 1 1 6  2  24 o 303.3617 8.219886  61.57323       3.319706      56.99281       4.710347      66.09357       4.679353      291.1156 12.16950  313.7494 11.21058  -22.63376      16.54611  
1 1 1 6  2  25 o 127.8360 8.020853  10.97712       1.359418      11.95849       2.158700      10.33217       1.750008      132.7456 12.34540  123.6027 10.73149  9.142906       16.35768  
1 1 1 6  2  26 o 105.6775 12.44565  7.636310       1.718994      8.086813       2.038347      6.526892       3.198724      108.3195 14.48479  94.82112 24.97442  13.49839       28.87093  
1 1 1 6  2  27 o 77.59560 14.43832  4.221436       1.437961      3.803241       1.589178      6.110464       3.377555      73.12196 16.68012  91.29300 26.32228  -18.17104      31.16230  
1 1 1 6  2  28 o 89.09970 5.397765  5.327588       0.6378548     5.358947       0.6518167     4.619009       3.098375      89.35011 5.501332  80.17030 25.65726  9.179802       26.24042  
1 1 1 6  2  29 f 16.02464 7.972779  -1.674047      0.6686934     -1.817325      0.6751994     5.653419       4.828583      15.68768 7.837502  88.78717 31.96685  -73.09949      32.91361  
1 1 1 6  2  30 o 47.38862 14.67214  1.559874       1.021256      1.447766       1.037037      5.159577       5.876367      46.10079 14.85239  87.14704 34.36397  -41.04625      37.43629  
1 1 1 6  2  31 o 100.8525 11.79759  7.090721       1.555529      8.126554       1.702725      1.864764       3.824570      107.9547 12.04144  64.48333 26.85955  43.47141       29.43522  
1 1 1 6  2  32 o 30.98026 13.48281  -0.7080216E-01 1.040858      0.3939107E-02  1.178275      -0.3363371     2.220891      33.39706 14.44069  42.89594 19.13408  -9.498878      23.97178  
1 1 1 6  2  33 o 47.58737 18.53922  1.380479       1.692987      -0.6140433     2.362449      3.486114       2.427362      42.05919 19.15447  65.21910 22.74269  -23.15991      29.73422  
1 1 1 6  2  34 o 85.05875 21.34347  6.291877       2.414891      8.649037       3.342416      3.717694       3.492896      94.87930 25.77402  64.18673 26.08547  30.69257       36.67086  
1 1 1 6  2  35 o 70.65176 22.84140  4.824573       2.451346      1.346757       4.493235      6.298371       2.924992      54.99137 25.53594  78.39074 24.91157  -23.39937      35.67450  
1 1 1 6  2  36 o 41.81035 18.55725  0.5767002      2.062642      2.577439       3.010902      -1.192590      2.831398      53.93095 23.19989  40.21914 19.15826  13.71181       30.08777  
1 1 1 6  2  37 o 31.21136 15.45226  -3.467809      2.395103      0.4276640      3.987339      -5.666752      2.995781      47.19576 22.55151  31.84554 15.99514  15.35021       27.64805  
1 1 1 6  3  0  o 804.7313 75.87256  455.4171       79.59914      455.4171       79.59914      455.4171       79.59914      804.7313 75.87256  804.7313 75.87256  0.000000       0.000000  
1 1 1 6  3  1  o 1476.362 33.49957  1469.435       65.90307      1392.624       89.97031      1558.363       96.80677      1428.210 47.34064  1510.253 48.16573  -82.04297      67.53573  
1 1 1 6  3  2  o 1027.249 15.88880  704.9432       21.74905      728.6682       30.63968      680.8488       30.87730      1043.107 22.04356  1008.074 22.98654  35.03339       31.84807  
1 1 1 6  3  3  o 965.0996 15.08339  622.0638       19.39745      654.6499       34.31267      606.7588       23.51562      987.3488 26.10306  952.5700 18.52618  34.77881       32.00921  
1 1 1 6  3  4  o 550.1184 11.02410  201.8963       8.081141      200.7338       9.126903      206.1152       17.38658      548.4299 12.48903  554.0364 23.60471  -5.606506      26.70502  
1 1 1 6  3  5  o 72.32686 1.054149  3.485365       0.1015957     3.688207       0.1117688     2.520796       0.2437292     74.40169 1.127364  61.43459 2.986235  12.96709       3.191951  
1 1 1 6  3  6  o 276.6905 8.326107  51.09507       3.066305      53.67269       4.283464      48.38595       4.391371      283.3851 11.36650  268.9688 12.28493  14.41629       16.73669  
1 1 1 6  3  7  o 509.2383 8.005184  172.9154       5.432077      176.7947       6.409845      163.0293       10.23257      514.8442 9.343254  493.6732 15.57454  21.17099       18.16212  
1 1 1 6  3  8  o 645.2783 9.944525  277.7904       8.550757      277.5531       11.32669      278.1049       13.03835      644.6768 13.18523  645.0729 15.16842  -0.3961182     20.09804  
1 1 1 6  3  9  o 422.7995 6.268098  119.1700       3.531375      119.2405       7.319115      119.1485       4.031695      422.3161 13.02167  422.7239 7.157433  -0.4078369     14.85909  
1 1 1 6  3  10 o 352.6942 7.108397  82.94868       3.340747      79.54410       4.232048      88.57819       5.441940      345.1585 9.209726  364.0626 11.23114  -18.90405      14.52438  
1 1 1 6  3  11 o 25.44398 3.430034  0.4392414      0.1133346     2.768754       0.9068177     0.4022767      0.1142302     63.46725 11.12803  24.30091 3.639506  39.16634       11.70807  
1 1 1 6  3  12 o 213.6348 3.926271  30.41879       1.117701      32.11479       2.449488      29.97280       1.256089      219.2100 8.401290  212.0523 4.445331  7.157761       9.504875  
1 1 1 6  3  13 o 65.19395 11.75736  2.928319       0.9838182     2.306111       1.328115      3.684902       1.464523      57.90935 16.44528  72.77336 15.57305  -14.86401      22.64877  
1 1 1 6  3  14 o 237.7535 9.076192  37.80289       2.870157      37.80289       2.870157      0.000000       0.000000      237.7535 9.076192  ?        ?         0.000000       9.076192  
1 1 1 6  3  15 o 476.0468 10.36776  151.4635       6.576703      152.9526       10.74918      150.5725       8.314551      476.8398 16.94417  474.0072 13.17655  2.832550       21.46454  
1 1 1 6  3  16 o 137.7181 7.890033  12.70065       1.441857      15.94489       3.700715      12.12004       1.565572      152.8516 18.54860  134.4387 8.787437  18.41295       20.52485  
1 1 1 6  3  17 o 388.2818 10.79028  100.8548       5.577403      120.7962       12.80804      96.18858       6.195685      422.1014 22.85680  378.9573 12.28570  43.14413       25.94941  
1 1 1 6  3  18 o 243.3391 7.692697  39.55412       2.491254      38.58535       4.143348      40.10266       3.117774      239.7560 13.01789  244.8496 9.574359  -5.093582      16.15963  
1 1 1 6  3  19 o 318.4034 8.654671  67.72793       3.668587      68.81922       4.520605      65.62294       6.278421      320.7469 10.59148  312.5461 15.12005  8.200836       18.46064  
1 1 1 6  3  20 o 59.82426 9.585011  2.449923       0.7382987     1.965091       1.097847      2.850227       0.9975662     53.38899 14.87858  64.24269 12.09691  -10.85370      19.17570  
1 1 1 6  3  21 o 238.8520 9.332417  38.16322       2.964558      39.24781       4.681161      37.43695       3.830623      241.5347 14.61292  236.2262 12.21080  5.308472       19.04314  
1 1 1 6  3  22 o 316.9571 10.85881  67.27746       4.579460      76.74062       9.446117      64.37000       5.235906      336.2115 21.19251  309.7288 12.71338  26.48270       24.71341  
1 1 1 6  3  23 o 121.0820 8.728203  9.849381       1.398793      11.38510       3.394329      9.535230       1.535213      128.0691 20.58766  118.9987 9.767625  9.070435       22.78724  
1 1 1 6  3  24 o 62.90460 10.67836  2.724923       0.8631059     1.900634       1.201326      3.604366       1.240866      52.77930 15.82941  72.07625 13.41341  -19.29695      20.74825  
1 1 1 6  3  25 o 364.3701 10.21452  89.16323       4.954564      84.69134       5.730188      102.4093       9.862031      354.5243 12.14762  386.7157 19.19822  -32.19138      22.71864  
1 1 1 6  3  26 o 143.5954 9.533406  13.90498       1.813828      13.34833       2.503785      14.51973       2.631237      139.8041 13.61231  145.8395 13.70021  -6.035477      19.31297  
1 1 1 6  3  27 o 43.24593 15.80940  1.052013       1.187024      0.4543996      1.320197      3.573921       2.712023      39.41177 16.02960  72.29151 24.06173  -32.87975      28.91220  
1 1 1 6  3  28 o 112.8740 17.89266  9.018227       2.601521      7.636706       2.888862      14.94492       5.983486      102.3075 21.85468  138.2577 32.94774  -35.95020      39.53708  
1 1 1 6  3  29 f 142.5912 13.60213  14.03891       2.553200      13.02107       2.948672      17.08838       5.103860      136.1226 16.59921  150.8945 26.34134  -14.77193      31.13519  
1 1 1 6  3  30 o 133.3816 6.788685  11.98755       1.202609      11.76831       1.224924      17.84085       6.329270      132.1102 6.983041  146.9885 33.11191  -14.87833      33.84024  
1 1 1 6  3  31 o 107.0210 8.387341  7.811294       1.186550      8.078520       1.261112      5.749811       3.502708      108.7286 8.778936  84.39588 27.30533  24.33272       28.68189  
1 1 1 6  3  32 o ?        ?         -3.270334      0.2295949     -3.268924      0.2306988     -3.416592      2.349796      ?        ?         33.92366 16.48004  0.000000       16.48004  
1 1 1 6  3  33 o 23.59733 11.28409  -1.226719      1.002387      -1.460080      1.049495      1.199031       3.383681      23.39524 11.27985  55.46169 24.22053  -32.06645      26.71832  
1 1 1 6  3  34 o 76.88772 13.51610  4.457092       1.334262      6.411335       1.732614      1.609374       2.091516      91.62058 14.68781  49.68055 20.18713  41.94003       24.96501  
1 1 1 6  3  35 o 43.19006 18.96032  0.6241831      2.097718      0.8929847      3.174517      0.4158316      2.794860      49.50902 22.41120  46.15409 20.94653  3.354935       30.67603  
1 1 1 6  3  36 o 38.74232 17.80194  -0.1696073     2.101563      -3.780374      2.572712      7.071605       3.643318      32.53880 16.09237  74.20323 27.59635  -41.66443      31.94562  
1 1 1 6  3  37 o 39.60658 18.65832  -0.4173598     2.546450      0.3267063      4.613120      -0.7434394     3.053872      48.24102 23.35395  41.20371 19.70130  7.037308       30.55402  
1 1 1 6  4  0  o 278.3467 31.91162  53.88349       11.43334      53.88349       11.43334      53.88349       11.43334      278.3467 31.91162  278.3467 31.91162  -0.000000      0.000000  
1 1 1 6  4  1  o 439.5680 13.59224  129.1107       7.951855      133.3286       11.22997      124.8694       11.26133      446.0934 18.93513  431.5920 19.63277  14.50143       27.27609  
1 1 1 6  4  2  o 657.8667 9.926006  288.6561       8.701337      283.2688       15.26533      291.2488       10.59020      650.7201 17.62132  660.6503 12.02982  -9.930176      21.33606  
1 1 1 6  4  3  o 215.9301 3.746781  31.06969       1.078065      32.05289       1.728539      30.44377       1.379173      219.2148 5.922895  213.7329 4.842546  5.481842       7.650551  
1 1 1 6  4  4  o 1098.041 15.60727  805.5229       22.83596      813.2070       27.95033      790.0953       39.60381      1102.529 19.02494  1084.023 27.43937  18.50623       33.38963  
1 1 1 6  4  5  o 527.8420 11.74777  185.9329       8.262909      192.2827       12.05573      180.3074       11.34745      536.0516 16.89881  519.1368 16.42440  16.91479       23.56546  
1 1 1 6  4  6  o 538.3187 12.20848  193.4292       8.757387      194.0788       11.15311      192.3847       14.14200      538.6909 15.55385  535.6929 19.84600  2.997986       25.21480  
1 1 1 6  4  7  o 604.7665 9.861765  243.9922       7.947232      251.0621       9.703919      229.5916       13.84935      613.2890 11.87431  585.5396 17.77062  27.74945       21.37274  
1 1 1 6  4  8  f 632.7855 8.640799  267.0679       7.285912      277.8046       9.877987      254.2573       10.78998      645.1143 11.49101  616.9907 13.12407  28.12360       17.44375  
1 1 1 6  4  9  f 446.0286 8.018412  132.6826       4.765677      132.8701       6.085187      132.3853       7.664080      446.1998 10.23460  444.9766 12.93930  1.223267       16.49766  
1 1 1 6  4  10 o 120.8712 1.016291  9.734140       0.1636872     8.391191       0.4228678     9.970829       0.1775267     112.1813 2.831117  122.3318 1.089058  -10.15046      3.033359  
1 1 1 6  4  11 o 344.9148 6.377584  79.33028       2.931174      78.75191       4.211648      79.87358       4.082003      343.3727 9.213093  345.8430 8.865005  -2.470306      12.78551  
1 1 1 6  4  12 o 63.89573 1.577838  2.720277       0.1343408     2.920637       1.063635      2.717029       0.1354253     64.97005 12.74137  63.85754 1.591527  1.112518       12.84038  
1 1 1 6  4  13 o 442.6788 8.562616  130.8192       5.050900      129.2224       9.808223      131.3955       5.892250      438.4296 16.81989  443.4984 9.970469  -5.068787      19.55298  
1 1 1 6  4  14 o 285.6696 8.490394  54.53038       3.228369      55.97403       3.797436      50.76705       6.131176      289.2834 9.865736  274.4327 16.84739  14.85062       19.52351  
1 1 1 6  4  15 o 276.3993 8.356264  51.05038       3.074140      37.04003       6.845217      54.58993       3.440617      233.0728 22.31265  285.7581 9.047150  -52.68532      24.07707  
1 1 1 6  4  16 o 209.8474 4.261251  29.35475       1.191555      24.92122       3.867316      29.81977       1.252488      192.1707 15.22689  211.4982 4.444198  -19.32750      15.86219  
1 1 1 6  4  17 o 236.4466 6.959692  37.33059       2.190401      34.60715       3.166896      39.82835       3.032842      227.3245 10.48298  244.0257 9.344238  -16.70119      14.04306  
1 1 1 6  4  18 o 268.3426 7.921256  48.09749       2.829317      54.85685       4.883289      44.68185       3.471332      286.0309 12.84504  258.4209 10.10025  27.60999       16.34044  
1 1 1 6  4  19 o 166.4545 7.262320  18.52059       1.606934      18.69667       2.199450      18.31898       2.353455      167.0101 9.928008  165.2218 10.74802  1.788330       14.63166  
1 1 1 6  4  20 o 584.5718 20.33332  230.4726       15.81459      218.5725       25.54098      237.8717       20.13968      563.0482 34.20360  591.8073 25.59924  -28.75909      42.72244  
1 1 1 6  4  21 o 150.9058 12.59405  15.34820       2.509404      15.59443       3.458539      15.07447       3.646591      151.3306 17.47155  148.4869 18.85454  2.843643       25.70503  
1 1 1 6  4  22 o 224.1994 10.86767  33.70670       3.237045      46.15778       6.487958      29.57994       3.735161      260.9459 18.78452  209.6189 13.44314  51.32698       23.09926  
1 1 1 6  4  23 o 473.1316 17.23771  151.2915       10.84947      0.000000       0.000000      151.2915       10.84947      ?        ?         473.1316 17.23771  0.000000       17.23771  
1 1 1 6  4  24 o 49.39819 14.93130  1.658551       1.065847      16.62435       7.958286      1.385206       1.075536      148.8056 39.48674  46.20922 15.14332  102.5964       42.29093  
1 1 1 6  4  25 o 141.3973 9.421523  13.46446       1.765026      11.99335       3.066150      14.19354       2.158534      131.5144 17.96549  144.8664 11.27057  -13.35196      21.20812  
1 1 1 6  4  26 o 234.2613 9.018738  36.88364       2.810010      37.69551       3.302956      34.75623       5.346688      236.4642 10.50872  224.4877 18.02526  11.97655       20.86488  
1 1 1 6  4  27 o 129.0342 13.83194  11.44669       2.341199      11.23124       2.894504      11.85435       3.981464      126.6050 17.63533  127.5353 24.31545  -0.9303284     30.03741  
1 1 1 6  4  28 o 118.7178 16.18833  9.867345       2.494247      7.362036       3.284426      13.28074       3.833737      99.35813 24.86843  135.5962 21.96890  -36.23806      33.18240  
1 1 1 6  4  29 o 70.98550 27.32730  2.955348       3.645740      1.141399       5.300841      4.583575       5.022151      71.62290 30.79639  83.78967 32.12047  -12.16677      44.49879  
1 1 1 6  4  30 o 54.48648 22.70603  0.9289399      2.735017      -0.6206875     3.023628      7.903462       6.414635      49.96445 22.30384  98.16435 36.59613  -48.19990      42.85718  
1 1 1 6  4  31 o 46.87045 6.503564  1.507274       0.3952556     1.473182       0.3967285     6.073243       4.591264      46.30425 6.617831  85.67039 31.12649  -39.36615      31.82222  
1 1 1 6  4  32 f 75.78855 8.471943  3.969215       0.8409597     3.762249       0.8765051     6.366831       2.983279      73.54814 9.140164  87.05508 24.62207  -13.50694      26.26383  
1 1 1 6  4  33 o 81.32293 11.86069  4.778585       1.247452      5.155485       1.321521      1.696252       3.779207      84.39209 12.09713  58.56018 25.58486  25.83191       28.30062  
1 1 1 6  4  34 o 66.94553 12.64702  3.361176       1.086858      4.236383       1.272446      1.000041       2.089991      74.98593 13.21741  45.92900 19.53176  29.05693       23.58367  
1 1 1 6  4  35 o 82.99655 14.90359  5.429636       1.587683      4.554454       1.846076      7.916061       3.111630      72.28540 18.94118  87.66861 25.26101  -15.38321      31.57352  
1 1 1 6  4  36 o 96.29166 14.93033  7.467911       1.853733      10.18911       2.120035      -1.368517      3.820335      113.3192 14.36207  44.17877 21.35474  69.14046       25.73508  
1 1 1 6  4  37 o 86.62498 19.90248  7.126145       2.248991      14.24913       4.095290      4.050382       2.691102      106.7792 28.32184  59.13441 23.27422  47.64480       36.65810  
1 1 1 6  5  0  o 154.3305 17.27074  16.48111       3.437722      16.48111       3.437722      16.48111       3.437722      154.3305 17.27074  154.3305 17.27074  0.000000       0.000000  
1 1 1 6  5  1  o 686.3197 29.17828  317.3918       26.62365      308.9976       56.06689      319.8357       30.25195      663.1195 64.25571  687.8593 33.10220  -24.73981      72.28106  
1 1 1 6  5  2  o 1008.992 21.67914  681.9298       29.14763      672.4059       61.99678      684.6323       33.02518      991.1266 47.07710  1010.234 24.53294  -19.10773      53.08595  
1 1 1 6  5  3  o 93.56351 0.8160256 5.832569       0.1017381     5.907744       0.1099212     5.383323       0.2687123     94.16449 0.8760340 89.88572 2.243486  4.278770       2.408457  
1 1 1 6  5  4  o 159.1379 2.886021  16.87463       0.6119933     17.09547       0.6613585     15.55880       1.614355      160.1747 3.098629  152.5495 7.969364  7.625198       8.550570  
1 1 1 6  5  5  o 538.6627 10.63790  193.5939       7.635653      195.2588       9.536274      190.6197       12.74582      540.7648 13.23417  533.5143 17.95424  7.250488       22.30467  
1 1 1 6  5  6  o 198.8523 7.964037  26.40969       2.105998      25.83635       3.121464      26.88874       2.853240      196.3717 11.98614  200.4547 10.72090  -4.082993      16.08121  
1 1 1 6  5  7  o 757.2416 11.75766  382.7957       11.86393      385.5973       16.24178      379.5908       17.37140      759.3632 16.05131  753.2015 17.30813  6.161682       23.60542  
1 1 1 6  5  8  o 639.6035 13.99268  273.3947       11.92574      299.1216       19.90981      258.9993       14.89306      667.0605 22.43089  621.6616 17.99757  45.39893       28.75861  
1 1 1 6  5  9  o 924.6997 12.30839  571.2025       15.16616      572.6326       21.96431      569.8992       20.96682      924.5208 17.82902  922.5271 17.05611  1.993713       24.67356  
1 1 1 6  5  10 o 228.7873 3.558770  34.88326       1.084939      31.61753       2.737706      35.49170       1.181692      217.4427 9.471338  230.7691 3.842848  -13.32637      10.22124  
1 1 1 6  5  11 o 325.4810 4.571012  70.61626       1.982492      68.74385       3.671131      71.38709       2.355481      320.8258 8.595053  327.2212 5.402124  -6.395386      10.15174  
1 1 1 6  5  12 o 470.3115 7.032594  147.5571       4.407320      143.5463       6.649367      150.6998       5.885998      463.4849 10.76642  475.0706 9.297975  -11.58572      14.22561  
1 1 1 6  5  13 o 150.2312 4.096484  15.05525       0.8192931     16.74732       1.908736      14.67309       0.9071069     158.1034 9.098484  148.2873 4.596272  9.816132       10.19353  
1 1 1 6  5  14 f 227.3693 6.594506  34.51585       1.995853      39.76184       2.845625      29.43654       2.800052      243.8646 8.771287  209.6488 10.05235  34.21582       13.34111  
1 1 1 6  5  15 o 592.7779 9.087436  234.6737       7.178057      229.0705       12.21149      237.6319       8.872780      584.0703 15.70450  596.1393 11.16962  -12.06909      19.27153  
1 1 1 6  5  16 o 443.8496 6.316711  131.4034       3.735944      130.4226       4.526226      133.4998       6.617570      442.0701 7.683720  446.8469 11.11389  -4.776764      13.51141  
1 1 1 6  5  17 o 126.5621 7.837126  10.73061       1.315220      12.05802       1.856653      9.393579       1.863367      133.9237 10.48758  117.9042 12.02862  16.01957       15.95860  
1 1 1 6  5  18 o 260.7366 8.003305  45.41314       2.777349      48.19090       3.733637      41.97184       4.155706      268.3573 10.46111  250.1706 12.50588  18.18672       16.30435  
1 1 1 6  5  19 o 355.0192 9.185439  84.21552       4.341705      84.06354       5.316671      84.51978       7.522345      354.4421 11.27129  354.6399 15.95902  -0.1978149     19.53797  
1 1 1 6  5  20 o 130.4518 24.16875  11.87105       4.046566      10.89445       6.714249      12.42812       5.071010      124.6372 37.43206  132.5144 29.47912  -7.877159      47.64639  
1 1 1 6  5  21 o 415.7710 16.37331  116.3077       9.053452      113.2053       9.820090      133.8823       23.37263      409.7546 18.02946  435.5748 40.74178  -25.82022      44.55282  
1 1 1 6  5  22 o 128.4280 16.67549  11.28407       2.786407      10.54247       3.619148      12.36348       4.366342      122.6898 22.98160  132.4729 25.66239  -9.783073      34.44869  
1 1 1 6  5  23 o 360.4247 13.11825  87.36907       6.289832      81.50947       9.619535      91.74519       8.313117      345.5855 20.98831  368.1973 16.98955  -22.61182      27.00286  
1 1 1 6  5  24 o 220.3356 11.45866  32.69094       3.352717      34.26386       4.201908      29.93492       5.562043      224.9898 14.08623  208.4529 20.28016  16.53696       24.69224  
1 1 1 6  5  25 o 45.35300 15.64420  1.273284       1.147143      -0.8463573     2.896828      1.667495       1.249270      49.53829 21.98932  50.25325 16.31080  -0.7149544     27.37832  
1 1 1 6  5  26 o 57.70881 12.86844  2.340138       0.9643291     2.165138       1.982032      2.394411       1.103780      58.73028 20.54604  58.24999 14.32236  0.4802856      25.04535  
1 1 1 6  5  27 o 135.2334 10.37299  12.40447       1.854955      14.86525       3.364291      11.32962       2.223463      145.8349 17.67260  128.4982 13.17174  17.33673       22.04122  
1 1 1 6  5  28 o 61.74973 20.70048  2.579194       2.006689      0.9506515      2.544416      5.258861       3.263841      54.05716 22.15173  84.48160 26.24159  -30.42444      34.34123  
1 1 1 6  5  29 o 50.06425 23.78403  -4.319395      4.305152      -10.93967      6.447960      1.005799       5.782986      53.15787 26.13316  73.23402 31.82718  -20.07615      41.18145  
1 1 1 6  5  30 o 135.8954 15.56166  13.07660       2.767190      11.82462       3.140130      17.42818       5.854264      127.3017 19.10012  145.7298 31.09542  -18.42814      36.49302  
1 1 1 6  5  31 o 80.11057 21.28098  4.992819       2.309957      8.452311       3.411911      2.065174       3.138707      102.0639 25.23202  61.29703 24.79441  40.76684       35.37538  
1 1 1 6  5  32 o 62.07710 22.03294  2.944065       2.285449      1.210031       3.843191      3.892791       2.842717      59.03630 25.79654  69.27223 24.57412  -10.23594      35.62792  
1 1 1 6  5  33 o 81.03888 6.415613  4.492887       0.6871468     4.669394       0.7043970     1.020978       3.124068      82.61306 6.449837  52.75718 23.14998  29.85588       24.03169  
1 1 1 6  5  34 o 89.84795 10.34800  5.809956       1.216305      6.782748       1.337748      1.170141       2.921560      97.03568 10.51370  50.51160 22.26772  46.52407       24.62497  
1 1 1 6  5  35 o ?        ?         -1.240083      0.2416320     -1.204254      0.2426673     -5.412053      2.618574      ?        ?         30.53367 15.28138  0.000000       15.28138  
1 1 1 6  5  36 o 14.60075 7.224178  -1.114042      0.5205815     -1.017189      0.5288494     -4.139175      2.955603      15.20233 7.475766  34.30677 17.01642  -19.10444      18.58617  
1 1 1 6  6  0  o 491.0201 25.12502  162.4968       16.34039      162.4968       16.34039      162.4968       16.34039      491.0201 25.12502  491.0201 25.12502  0.000000       0.000000  
1 1 1 6  6  1  o 167.1754 0.6600913 18.62047       0.1470449     23.12176       5.433526      18.61717       0.1470988     184.3722 22.58758  167.1606 0.6603917 17.21158       22.59723  
1 1 1 6  6  2  o 450.6048 11.03133  135.4821       6.623646      139.6306       12.07222      133.6955       7.922641      456.2588 19.90438  447.2757 13.30774  8.983124       23.94327  
1 1 1 6  6  3  o 232.8755 3.049020  36.13615       0.9461450     34.30295       1.079899      42.19191       1.962738      226.8868 3.571911  251.5935 5.854495  -24.70674      6.858109  
1 1 1 6  6  4  o 399.0416 6.558935  106.1507       3.487586      103.8803       6.264311      107.1705       4.198433      394.3169 11.93589  400.9050 7.859089  -6.588135      14.29093  
1 1 1 6  6  5  f 270.9841 6.746606  48.95549       2.436143      45.53744       3.050020      54.97877       4.048838      261.1499 8.777219  286.8445 10.61108  -25.69461      13.77079  
1 1 1 6  6  6  o 961.4603 18.95992  619.1199       24.29077      619.1199       24.29077      0.000000       0.000000      961.4603 18.95992  ?        ?         0.000000       18.95992  
1 1 1 6  6  7  o 550.9782 11.23763  202.6649       8.250547      206.1362       10.84367      197.8926       12.71442      555.0955 14.67291  543.3890 17.58264  11.70642       22.90073  
1 1 1 6  6  8  o 812.0245 9.018051  439.9431       9.757877      418.5031       20.25238      446.4250       11.13565      790.0095 19.23846  817.8204 10.21843  -27.81097      21.78382  
1 1 1 6  6  9  o 102.3717 5.525879  7.006876       0.7510039     6.843214       1.024860      7.196680       1.103674      100.9981 7.672544  103.5527 8.061932  -2.554588      11.12936  
1 1 1 6  6  10 o 512.0660 8.269090  174.9724       5.642313      174.1039       8.596248      175.6298       7.478811      510.2644 12.64271  512.7278 10.94642  -2.463440      16.72310  
1 1 1 6  6  11 o 344.0604 5.145160  78.92179       2.358887      84.94937       3.803308      75.15365       3.007142      356.7921 7.999683  335.6687 6.723101  21.12338       10.44964  
1 1 1 6  6  12 o 53.44503 1.917188  1.905724       0.1363143     0.2509095      1.510296      1.919315       0.1368729     40.65516 16.90193  53.63548 1.918191  -12.98032      17.01043  
1 1 1 6  6  13 o 366.0197 9.446951  89.54380       4.603694      104.3683       6.946345      77.93192       6.147767      394.5927 13.22965  340.8555 13.56255  53.73724       18.94641  
1 1 1 6  6  14 o 473.4851 7.633360  149.6201       4.816101      154.4595       6.855613      144.9046       6.767238      480.6898 10.70306  465.5548 10.90855  15.13492       15.28241  
1 1 1 6  6  15 o 366.2173 7.479627  89.49844       3.649995      96.27175       6.008563      85.53726       4.594968      379.1735 11.90687  357.7025 9.649034  21.47098       15.32571  
1 1 1 6  6  16 o 50.21774 13.87767  1.739895       0.9595234     2.973802       1.217523      -0.2826859     1.558795      65.36349 14.37092  37.89972 16.49694  27.46378       21.87858  
1 1 1 6  6  17 o 255.2075 8.530208  43.52569       2.896782      42.42369       3.837511      44.98537       4.416593      251.6422 11.47459  258.9680 12.83879  -7.325806      17.21919  
1 1 1 6  6  18 f 122.2840 11.44108  10.08292       1.842632      10.93384       2.062351      6.715623       4.102583      127.2687 12.31462  98.53736 29.18020  28.73137       31.67229  
1 1 1 6  6  19 o 284.1276 10.09918  53.99809       3.817525      55.50724       6.097364      53.02512       4.895850      287.2360 15.99366  281.1745 13.10312  6.061554       20.67581  
1 1 1 6  6  20 o 158.5985 11.88931  16.91971       2.494346      16.10958       3.926701      17.46776       3.229656      153.4439 19.65534  160.6752 15.26785  -7.231247      24.88855  
1 1 1 6  6  21 f 502.1864 19.98306  170.5185       13.34543      167.2180       14.49259      188.9251       34.22532      496.5432 21.95790  508.8736 51.16734  -12.33044      55.67986  
1 1 1 6  6  22 o 393.7791 27.77854  107.0487       14.48237      112.6549       21.60082      102.4708       19.51932      395.7205 41.58524  378.7781 39.24058  16.94232       57.17653  
1 1 1 6  6  23 o 195.3732 10.46369  25.64840       2.714165      26.90357       3.051070      20.88790       5.941911      199.9373 11.50062  172.0749 26.78539  27.86235       29.14998  
1 1 1 6  6  24 o 167.3586 19.28079  19.35159       4.221292      24.12307       5.333320      11.34928       6.906829      186.1875 21.91610  123.7262 38.13020  62.46124       43.97986  
1 1 1 6  6  25 o 114.0707 9.603871  8.795529       1.446257      7.978626       2.168391      9.450130       1.941069      107.3082 15.62300  117.6907 12.57175  -10.38254      20.05311  
1 1 1 6  6  26 o 233.3419 9.526447  36.66790       2.955855      34.82014       3.614954      40.39560       5.134534      226.6619 12.01169  242.6480 15.96877  -15.98607      19.98205  
1 1 1 6  6  27 f 150.8427 9.361339  15.37666       1.872364      16.84233       3.365680      14.71976       2.253215      155.6882 16.47304  147.0174 11.59546  8.670715       20.14487  
1 1 1 6  6  28 o 133.1301 9.379797  12.01279       1.653311      12.52734       2.612745      11.66916       2.135161      134.2988 14.84759  130.3651 12.44198  3.933655       19.37147  
1 1 1 6  6  29 o 184.4962 13.63138  23.53301       3.327536      25.47032       4.027248      19.36474       5.907267      190.7012 15.99551  157.5129 29.22034  33.18839       33.31193  
1 1 1 6  6  30 o 68.20163 27.27524  2.681712       3.752202      1.768358       3.929508      12.12293       12.63376      64.93218 27.14943  109.7075 47.36084  -44.77531      54.59067  
1 1 1 6  6  31 o 53.92920 21.81927  1.461213       2.431301      -1.944840      4.082488      3.333184       3.026556      51.99061 24.20959  67.51421 25.14385  -15.52360      34.90440  
1 1 1 6  6  32 o 42.19001 19.39256  -0.9541872     2.496750      -0.1579695     2.747675      -4.725916      5.980255      47.12704 21.13285  54.54629 26.44995  -7.419247      33.85553  
1 1 1 6  6  33 o 66.66985 15.48683  3.451873       1.349464      3.980218       1.654018      2.400030       2.333762      70.31390 17.67528  56.14004 21.79603  14.17385       28.06212  
1 1 1 6  6  34 o 55.61300 8.570184  2.204643       0.6147240     2.287707       0.6282213     0.3336358      2.981568      56.66231 8.589372  47.32312 21.53882  9.339184       23.18832  
1 1 1 6  6  35 o 71.30763 10.49912  3.738092       0.9677850     3.779588       1.005865      3.220963       3.550888      71.45203 10.90989  57.92697 25.05804  13.52506       27.33004  
1 1 1 6  6  36 o 24.22421 10.93221  -0.2110962     0.7486372     -0.1911120     0.7798867     -0.4455812     2.671441      24.86795 11.19611  40.64621 19.13654  -15.77826      22.17116  
1 1 1 6  7  0  o 510.7445 36.76470  178.0078       24.71733      178.0078       24.71733      178.0078       24.71733      510.7445 36.76470  510.7445 36.76470  0.000000       0.000000  
1 1 1 6  7  1  o 240.8578 10.55772  38.78282       3.380243      37.18213       4.216897      41.66026       5.653833      235.5667 13.49042  248.9868 17.14560  -13.42009      21.81657  
1 1 1 6  7  2  o 969.6826 25.84561  632.5877       33.36588      634.8820       60.42786      631.5815       40.01963      960.6005 47.35453  966.8209 31.10420  -6.220337      56.65618  
1 1 1 6  7  3  o 902.4839 20.11955  545.7195       24.19532      525.3768       51.30702      551.5372       27.43782      875.1595 44.13879  906.2979 22.73778  -31.13843      49.65118  
1 1 1 6  7  4  o 1086.170 18.87561  790.1060       27.31949      0.000000       0.000000      790.1060       27.31949      ?        ?         1086.170 18.87561  0.000000       18.87561  
1 1 1 6  7  5  o 107.4750 4.051355  7.708750       0.5791659     8.039026       1.200845      7.608636       0.6611432     109.4743 8.293619  106.7447 4.659326  2.729645       9.512803  
1 1 1 6  7  6  o 383.8788 5.963336  98.23972       3.050401      101.0329       3.892428      93.79398       4.910731      389.2310 7.504809  374.7739 9.841908  14.45709       12.37681  
1 1 1 6  7  7  o 324.9179 8.320309  70.47174       3.599392      76.78949       4.697720      61.48998       5.601273      339.0022 10.41181  302.9517 13.91236  36.05048       17.37698  
1 1 1 6  7  8  o 270.3073 7.487140  48.77300       2.694193      49.33062       5.272610      48.57596       3.134265      271.1310 14.64834  269.6684 8.733842  1.462677       17.05444  
1 1 1 6  7  9  o 212.6727 5.233438  30.15348       1.483106      32.00814       2.355008      28.93442       1.909290      218.8723 8.088645  208.1681 6.892607  10.70421       10.62705  
1 1 1 6  7  10 o 476.2218 9.236383  151.4155       5.861176      153.7940       8.413813      149.1732       8.169496      479.2490 13.18776  472.0223 13.00089  7.226685       18.51864  
1 1 1 6  7  11 o 97.47985 5.722339  6.358361       0.7400271     6.186157       1.063645      6.519926       1.030266      95.90128 8.408350  98.52483 7.913991  -2.623550      11.54693  
1 1 1 6  7  12 o 250.4694 4.112642  41.81747       1.372616      39.73806       2.176248      43.19117       1.768823      243.9757 6.700383  254.5135 5.215547  -10.53784      8.490999  
1 1 1 6  7  13 o 132.1293 1.273196  11.63220       0.2241650     11.06251       2.268099      11.63782       0.2252679     127.8183 13.52142  132.1612 1.279152  -4.342873      13.58179  
1 1 1 6  7  14 o 128.6691 4.552859  11.05073       0.7793760     11.26340       1.299627      10.93130       0.9739392     129.6968 7.552643  127.9020 5.729079  1.794815       9.479702  
1 1 1 6  7  15 o 154.1529 4.763075  15.85745       0.9772174     16.23408       1.930762      15.72774       1.133062      155.6288 9.353502  153.4770 5.549483  2.151794       10.87588  
1 1 1 6  7  16 o 386.0372 10.60577  99.66057       5.450461      95.09631       6.482131      110.6750       10.06962      376.7426 12.93135  405.2721 18.69670  -28.52945      22.73293  
1 1 1 6  7  17 o 482.4504 9.864527  155.4666       6.341653      159.8893       10.18395      152.6653       8.104841      488.0869 15.67868  477.5161 12.74887  10.57080       20.20779  
1 1 1 6  7  18 o 357.7438 10.04615  85.55769       4.784262      90.38850       8.132124      83.00063       5.916498      366.6385 16.68909  352.0050 12.63419  14.63351       20.93200  
1 1 1 6  7  19 o 296.2756 13.04454  58.86509       5.137269      56.71507       9.949824      59.64659       5.998699      287.9732 26.21635  297.9031 15.16139  -9.929962      30.28473  
1 1 1 6  7  20 f 334.1240 13.06413  74.88006       5.805289      68.85253       7.301019      85.24228       9.572834      319.5773 17.20833  354.8991 20.32743  -35.32181      26.63327  
1 1 1 6  7  21 o 202.3796 10.52480  27.47142       2.828519      29.93755       4.207427      25.43777       3.820734      210.5777 15.09458  194.0592 14.88912  16.51849       21.20218  
1 1 1 6  7  22 o 264.3202 17.51474  47.39209       6.134104      47.39209       6.134104      0.000000       0.000000      264.3202 17.51474  ?        ?         0.000000       17.51474  
1 1 1 6  7  23 o 202.0540 10.68917  27.45454       2.867724      29.43509       3.981198      25.31875       4.134282      208.4641 14.42095  192.8287 16.24078  15.63545       21.71927  
1 1 1 6  7  24 o 337.6988 14.65059  77.30538       6.576935      73.17860       7.866152      86.89216       11.98927      327.0615 18.12008  351.9384 25.74348  -24.87689      31.48117  
1 1 1 6  7  25 o 244.4439 11.05999  40.32443       3.593198      40.09062       3.862374      41.82860       9.796630      243.4766 11.94127  238.6764 31.57700  4.800201       33.75946  
1 1 1 6  7  26 o 155.2106 8.987306  16.24329       1.850815      13.72734       2.485030      19.37743       2.773571      141.5969 13.32728  168.7032 12.42511  -27.10632      18.22086  
1 1 1 6  7  27 o 106.9289 10.27470  7.787923       1.445992      6.649542       2.498464      8.361275       1.773128      95.83793 20.20197  110.3363 12.26716  -14.49832      23.63478  
1 1 1 6  7  28 o 102.6761 10.89433  7.225747       1.467819      8.221462       2.482039      6.690238       1.820222      107.2311 18.00830  97.73687 14.40798  9.494209       23.06271  
1 1 1 6  7  29 o 100.6068 27.98118  8.024451       3.887077      7.026455       6.129692      8.695715       5.027135      94.78359 35.68312  102.7035 32.66114  -7.919861      48.37392  
1 1 1 6  7  30 o 41.15916 14.92129  1.027450       1.054296      1.034806       1.078762      0.8707784      4.978625      41.43542 15.08293  66.18851 29.12785  -24.75309      32.80132  
1 1 1 6  7  31 o 69.41683 14.46906  3.541862       1.294929      3.747340       1.401652      2.344613       3.383373      71.12321 15.24754  62.70142 25.60135  8.421791       29.79793  
1 1 1 6  7  32 o 92.92807 12.85411  6.264888       1.549128      5.958576       1.739229      7.440803       3.407706      89.22341 15.17123  90.17491 26.56613  -0.9514999     30.59290  
1 1 1 6  7  33 o 15.13568 7.352119  -0.7702701     0.4673463     -0.8980203     0.4878952     0.6511970      1.627475      14.97000 7.324112  41.07325 17.34065  -26.10325      18.82395  
1 1 1 6  7  34 o 57.26813 13.20305  2.529940       0.9869148     2.797996       1.047259      0.4029651      2.950005      60.18188 13.40310  47.10055 21.43246  13.08133       25.27832  
1 1 1 6  7  35 o 21.65919 9.899624  -0.3162415     0.6384131     -0.3684309     0.6632786     0.3409324      2.353667      21.75831 9.999012  42.55896 19.27804  -20.80065      21.71688  
1 1 1 6  7  36 o 28.69260 12.03805  0.2880378      0.7765818     0.4653773      0.8130596     -1.556346      2.622077      30.80441 12.56054  37.12127 17.88054  -6.316856      21.85133  
1 1 1 6  8  0  f 199.6442 9.504766  26.75383       2.515437      26.75383       2.515437      26.75383       2.515437      199.6442 9.504766  199.6442 9.504766  0.000000       0.000000  
1 1 1 6  8  1  o 158.9314 0.5767476 16.82927       0.1221431     16.83143       0.1222661     15.75682       2.724463      158.9416 0.5772910 152.9819 13.50343  5.959717       13.51577  
1 1 1 6  8  2  o 547.1117 16.05480  200.4040       11.69188      192.2061       20.91801      204.1288       14.10004      532.6978 29.58525  551.6022 19.21253  -18.90442      35.27617  
1 1 1 6  8  3  o 264.5077 4.520591  46.62975       1.593335      46.97950       2.206419      46.24859       2.303336      265.4584 6.237607  263.3764 6.563069  2.081970       9.054370  
1 1 1 6  8  4  o 365.2536 6.077745  88.94113       2.958084      92.98802       5.053982      86.83237       3.648269      373.1239 10.17449  360.8350 7.587605  12.28891       12.69220  
1 1 1 6  8  5  o 132.9559 5.586415  11.80498       0.9875190     10.42842       1.216341      14.46696       1.691453      124.8333 7.344708  147.0023 8.673551  -22.16896      11.36553  
1 1 1 6  8  6  o 394.5729 5.715114  103.7941       3.004870      106.0444       3.745576      99.73034       5.033328      398.7617 7.049067  386.4131 9.783163  12.34866       12.05818  
1 1 1 6  8  7  f 315.0877 5.995048  66.19724       2.517083      63.45255       3.083584      71.67810       4.357459      308.4193 7.503098  327.4970 9.996804  -19.07767      12.49930  
1 1 1 6  8  8  o 74.10751 9.941280  3.732666       0.9569589     2.150992       1.472195      4.889957       1.259297      56.77204 17.62247  84.78378 11.43808  -28.01175      21.00908  
1 1 1 6  8  9  o 269.6226 6.794151  48.52091       2.439039      49.82486       3.990657      47.74337       3.081596      272.8348 10.99923  267.3026 8.663091  5.532135       14.00115  
1 1 1 6  8  10 o 201.7644 0.9470799 27.12333       0.2546271     27.07718       0.2565036     30.24306       2.108887      201.5926 0.9548725 212.7655 7.449878  -11.17293      7.510823  
1 1 1 6  8  11 o 92.54254 2.295586  5.706763       0.2830795     5.694892       0.2850289     6.565710       2.424567      92.41711 2.316357  97.08443 19.42056  -4.667328      19.55821  
1 1 1 6  8  12 o 62.35014 10.86125  2.673677       0.8696066     2.540902       0.9257101     3.670533       2.536486      60.59449 11.88968  73.95999 23.15830  -13.36551      26.03212  
1 1 1 6  8  13 f 27.78166 8.680494  0.5101026      0.3565716     -0.3354290E-01 0.7997054     0.6450028      0.3983624     28.13187 12.02613  30.84594 9.082018  -2.714066      15.07020  
1 1 1 6  8  14 o 452.3130 6.906250  136.4884       4.162507      132.9118       5.841084      140.1790       5.933347      446.0453 9.827453  458.0905 9.720194  -12.04529      13.82248  
1 1 1 6  8  15 o 146.8883 5.889651  14.41164       1.150453      13.86410       1.664651      14.91228       1.591768      143.8446 8.725768  149.2637 8.032571  -5.419128      11.86007  
1 1 1 6  8  16 o 411.7033 9.645296  113.2013       5.291435      116.0855       6.300394      106.2964       9.748287      416.5692 11.36090  397.2693 18.46543  19.29990       21.68046  
1 1 1 6  8  17 o 337.6185 10.87034  76.25169       4.884009      74.96801       7.914193      77.04125       6.206891      333.6180 17.86779  338.9527 13.77104  -5.334717      22.55880  
1 1 1 6  8  18 o 174.8330 7.106034  20.42589       1.652031      17.78688       2.736467      21.93930       2.072281      162.5527 12.73506  181.0834 8.612774  -18.53065      15.37406  
1 1 1 6  8  19 o 416.4704 9.174859  115.8403       5.091632      110.6583       9.179432      118.1431       6.119274      405.5086 17.02588  420.2357 10.93711  -14.72714      20.23613  
1 1 1 6  8  20 o 268.7332 8.047330  48.26254       2.878439      49.99871       3.433806      44.15913       5.278993      273.3736 9.440563  255.9560 15.55129  17.41757       18.19249  
1 1 1 6  8  21 o 87.47742 12.68279  5.236317       1.435306      4.321881       1.489744      17.06694       5.358445      78.95500 14.70066  155.7735 26.78011  -76.81847      30.54969  
1 1 1 6  8  22 o 87.45168 9.964871  5.186614       1.140524      4.941981       1.230208      6.683275       3.042867      85.15073 11.10663  96.88960 23.75448  -11.73887      26.22275  
1 1 1 6  8  23 o 390.6659 12.26047  102.7730       6.374527      100.2707       6.981173      115.3230       15.63420      385.4000 13.61526  404.1188 29.23062  -18.71878      32.24600  
1 1 1 6  8  24 o 203.3030 8.751654  27.75686       2.365316      28.16049       2.610942      25.90936       5.585958      204.6149 9.602840  192.3262 22.20362  12.28865       24.19123  
1 1 1 6  8  25 o 94.45289 10.32959  6.074638       1.278912      6.448842       1.313484      -0.7543579     5.611113      97.36079 10.27935  69.54118 30.74927  27.81961       32.42195  
1 1 1 6  8  26 o 100.2239 8.041264  6.784928       1.064908      5.466590       1.429435      8.429169       1.596370      88.98610 12.39065  111.2016 10.91374  -22.21546      16.51175  
1 1 1 6  8  27 o 34.08944 12.46237  0.6464084      0.7376220     -0.6618975     0.8329705     5.399754       1.587723      24.00161 11.09278  87.85815 14.03380  -63.85654      17.88847  
1 1 1 6  8  28 o 86.98249 9.075130  5.162439       1.036406      4.610505       1.424445      5.783290       1.510759      80.92790 13.69725  91.13049 12.79287  -10.20259      18.74226  
1 1 1 6  8  29 o 130.9763 11.88665  11.85948       2.051989      1.486051       5.592011      13.47364       2.205869      72.07986 31.31168  139.6319 11.97094  -67.55209      33.52200  
1 1 1 6  8  30 o 57.91825 13.21375  2.429019       0.9971871     2.785946       1.038562      -1.784778      3.568448      62.18297 12.95498  49.29461 22.84436  12.88837       26.26206  
1 1 1 6  8  31 f 53.36054 13.61967  2.101238       0.9715452     1.967542       0.9973726     4.582873       4.297016      51.58900 14.10622  74.48965 29.38156  -22.90065      32.59235  
1 1 1 6  8  32 o 24.59477 11.29379  -0.5031349     0.8439347     -0.7501242     0.8942730     1.507326       2.551401      24.03050 11.23633  52.41617 21.89356  -28.38567      24.60860  
1 1 1 6  8  33 o 17.23833 8.390139  -1.022243      0.6168703     -0.8928429     0.6309147     -3.832060      2.939971      18.16248 8.754124  36.45945 17.86732  -18.29697      19.89662  
1 1 1 6  8  34 o 24.91323 11.05926  -0.1276053     0.7328488     -0.2426438E-01 0.7609380     -1.450343      2.722388      26.19859 11.46248  39.69654 18.87428  -13.49796      22.08227  
1 1 1 6  8  35 o 73.66167 7.122980  3.806247       0.6904476     3.956398       0.7107784     1.293636       2.907589      75.07528 7.192866  48.09035 21.63760  26.98493       22.80182  
1 1 1 6  8  36 o 47.16716 20.69195  1.657095       2.494479      1.061480       3.989433      2.039444       3.196381      48.63492 23.04383  49.97731 22.56858  -1.342388      32.25459  
1 1 1 6  9  0  o 598.7645 17.48928  240.1338       13.92714      240.1338       13.92714      240.1338       13.92714      598.7645 17.48928  598.7645 17.48928  0.000000       0.000000  
1 1 1 6  9  1  o 840.5520 30.62047  479.3488       34.23919      480.7062       47.56833      477.8893       49.32235      834.5668 42.91849  830.8895 44.71257  3.677246       61.97750  
1 1 1 6  9  2  o 164.1443 0.5624849 17.95139       0.1230298     17.95139       0.1230298     0.000000       0.000000      164.1443 0.5624849 ?        ?         0.000000       0.5624849 
1 1 1 6  9  3  o 619.8148 12.43867  256.7194       10.27329      254.9220       17.94951      257.5950       12.52819      615.3401 21.92595  620.4250 15.15394  -5.084900      26.65313  
1 1 1 6  9  4  o 241.1367 4.686080  38.75821       1.505728      37.25506       2.257143      39.96350       2.021184      236.2349 7.178698  244.7380 6.202706  -8.503082      9.487216  
1 1 1 6  9  5  o 442.9445 6.983214  130.8589       4.121717      126.9535       5.236089      137.2211       6.683181      436.1312 9.009825  453.2213 11.06622  -17.09015      14.27019  
1 1 1 6  9  6  o 263.3445 6.080539  46.24453       2.133732      46.78547       2.408562      44.27170       4.599684      264.7630 6.832665  256.8908 13.48433  7.872162       15.11663  
1 1 1 6  9  7  o 403.7572 5.424379  108.6909       2.918393      110.7925       4.100550      106.5338       4.154440      407.5059 7.551527  399.5785 7.802556  7.927368       10.85843  
1 1 1 6  9  8  o 224.3371 5.858030  33.58348       1.749663      32.46655       2.681371      34.41171       2.308974      220.3207 9.153245  226.9649 7.645522  -6.644272      11.92627  
1 1 1 6  9  9  o 397.9958 7.173193  105.6829       3.804211      107.5373       5.701476      104.1949       5.107356      400.9925 10.67983  394.9560 9.704515  6.036438       14.43040  
1 1 1 6  9  10 o 448.7690 7.241303  134.3763       4.330251      135.2479       5.285206      132.5964       7.552639      450.0643 8.812799  444.9259 12.75222  5.138397       15.50111  
1 1 1 6  9  11 o 441.8315 9.355365  130.3870       5.507962      129.4497       6.428537      132.9749       10.68157      440.0370 10.96350  444.3350 18.07835  -4.297974      21.14297  
1 1 1 6  9  12 o 54.29345 11.95853  2.048845       0.8417434     1.473720       0.9741019     3.744317       1.672510      46.84608 14.29782  73.20523 17.40246  -26.35915      22.52273  
1 1 1 6  9  13 o 62.82333 6.060976  2.656641       0.5010926     2.349285       0.7614341     2.891438       0.6655156     58.46591 10.14110  65.36223 7.794547  -6.896317      12.79050  
1 1 1 6  9  14 o 153.3127 2.389953  15.66265       0.4882486     18.48533       1.564758      15.35818       0.5139065     166.3083 7.077074  151.8138 2.540384  14.49451       7.519211  
1 1 1 6  9  15 o 538.3329 5.055805  193.2101       3.626726      200.3722       4.289565      175.2570       6.791463      548.1572 5.872656  512.2307 9.950026  35.92645       11.55383  
1 1 1 6  9  16 o 559.1439 10.94409  208.9308       8.154110      211.1689       9.720467      203.6158       14.97961      561.7853 12.98504  549.5439 20.49208  12.24146       24.25977  
1 1 1 6  9  17 o 331.9381 8.745009  73.60583       3.864671      72.36183       6.381979      74.32615       4.856336      328.3353 14.62364  333.3094 10.94908  -4.974121      18.26836  
1 1 1 6  9  18 o 448.3721 11.62786  134.5348       6.941372      145.1297       10.34405      125.8555       9.362362      464.6245 16.73497  432.7409 16.26513  31.88351       23.33696  
1 1 1 6  9  19 o 435.3553 8.914799  126.5965       5.171648      127.6939       6.129206      123.8839       9.635958      437.0226 10.52511  428.9524 16.89126  8.070190       19.90208  
1 1 1 6  9  20 o 64.66853 9.780362  2.858739       0.8164961     3.253904       0.9689695     1.891040       1.516322      68.89738 10.91800  54.28869 17.98944  14.60869       21.04335  
1 1 1 6  9  21 o 271.3261 8.473577  49.26009       3.059844      48.54309       3.824143      50.53596       5.101307      269.0004 10.68989  273.8080 14.02852  -4.807556      17.63727  
1 1 1 6  9  22 o 187.8345 7.294458  23.61577       1.822282      24.98398       2.107625      19.56408       3.626890      193.0905 8.210153  169.2993 16.27738  23.79120       18.23074  
1 1 1 6  9  23 o 78.20663 7.668967  4.131284       0.7889330     3.879668       0.7984774     14.46793       5.117795      75.71141 8.037218  141.1568 28.19604  -65.44537      29.31916  
1 1 1 6  9  24 o 94.80785 6.447262  6.038188       0.8096581     5.689426       0.8273122     13.94942       3.940277      91.97267 6.798581  140.3385 21.77588  -48.36580      22.81249  
1 1 1 6  9  25 o 130.7733 6.416440  11.47132       1.114702      11.47132       1.114702      0.000000       0.000000      130.7733 6.416440  ?        ?         0.000000       6.416440  
1 1 1 6  9  26 o 169.3397 8.429788  19.32102       1.896188      20.10990       2.030157      13.92863       5.307794      172.6724 8.852894  134.9208 30.26962  37.75163       31.53766  
1 1 1 6  9  27 o 187.5529 7.246659  23.65211       1.807662      22.86705       2.373148      24.73717       2.789977      183.7374 9.727566  190.6848 11.02726  -6.947403      14.70462  
1 1 1 6  9  28 o 72.05357 5.234647  3.494501       0.4991653     3.178756       0.5404691     5.326625       1.301907      68.59364 5.972567  87.68740 11.41269  -19.09377      12.88103  
1 1 1 6  9  29 o 86.90927 12.91895  5.331102       1.450684      4.229661       2.835314      5.721692       1.688423      74.47764 24.59617  89.41032 14.68071  -14.93269      28.64429  
1 1 1 6  9  30 o 15.92425 7.420459  -0.3490298     0.3846257     -0.3994503     0.3877141     2.778096       3.053380      15.59764 7.326833  64.14417 24.92336  -48.54654      25.97799  
1 1 1 6  9  31 o 132.3670 14.01141  12.72848       2.433879      12.55265       3.151736      12.98824       3.830841      127.0816 19.21106  124.6256 23.93801  2.456047       30.69353  
1 1 1 6  9  32 o 36.90697 17.20303  -1.101934      2.069587      1.399991       2.719106      -4.547283      3.190844      51.96731 22.19449  37.48703 18.42010  14.48029       28.84259  
1 1 1 6  9  33 o 39.66040 19.06247  -2.247494      2.942984      -2.820993      3.958400      -1.538687      4.400656      44.38647 21.52237  48.92129 23.46032  -4.534821      31.83707  
1 1 1 6  9  34 o 69.92039 20.63358  4.537377       2.054242      -0.1875329     3.327929      7.445929       2.611053      46.12059 21.60112  88.72482 22.15381  -42.60422      30.94188  
1 1 1 6  9  35 o 35.10744 16.20316  -0.3612899     1.768371      -0.6453278     2.396561      -0.2180271E-01 2.620065      38.58458 18.15328  41.85743 19.45840  -3.272854      26.61148  
1 1 1 6  10 0  o 44.57527 1.130003  1.326397       0.6702177E-01 1.326397       0.6702177E-01 1.326397       0.6702177E-01 44.57527 1.130003  44.57527 1.130003  -0.000000      0.000000  
1 1 1 6  10 1  o 511.8177 15.35937  175.6073       10.46334      170.4334       15.57297      179.8651       14.12725      502.2034 23.33497  516.7465 20.55768  -14.54309      31.09886  
1 1 1 6  10 2  o 164.4331 4.305526  18.03438       0.9425732     17.73420       1.376956      18.29907       1.293001      162.9510 6.353638  165.5585 5.870321  -2.607483      8.650398  
1 1 1 6  10 3  o 318.0686 6.008299  67.45997       2.546512      63.96882       2.871459      80.31908       5.510921      309.6851 6.958390  346.4320 11.95595  -36.74692      13.83344  
1 1 1 6  10 4  o 461.6571 4.064596  142.0537       2.500405      145.1527       2.892236      132.8844       4.975009      466.6373 4.651369  446.2262 8.366914  20.41110       9.572904  
1 1 1 6  10 5  o 424.3005 5.213586  120.0277       2.947702      121.6585       4.054297      118.1990       4.293326      427.0492 7.124660  420.8929 7.655062  6.156311       10.45757  
1 1 1 6  10 6  o 254.0945 6.787563  43.09832       2.296114      43.98079       2.511994      38.61606       5.661335      256.6425 7.352998  239.1058 17.89857  17.53668       19.35007  
1 1 1 6  10 7  o 441.5759 7.297397  130.0983       4.293849      126.6129       6.037659      133.6652       6.107789      435.3008 10.40892  447.2794 10.24782  -11.97864      14.60697  
1 1 1 6  10 8  o 209.5175 4.267123  29.26172       1.191321      29.44355       1.539501      28.99032       1.880877      210.0608 5.504727  208.3545 6.783648  1.706284       8.736127  
1 1 1 6  10 9  o 324.4653 8.134296  70.31667       3.514141      75.23851       6.241664      68.03247       4.252103      334.8332 14.02040  318.9427 10.01744  15.89056       17.23139  
1 1 1 6  10 10 o 397.2470 8.479725  105.3516       4.488652      102.6457       5.404325      111.3699       8.059790      391.7821 10.36107  407.3180 14.87464  -15.53592      18.12752  
1 1 1 6  10 11 o 38.62952 7.668531  1.030961       0.3808052     1.086029       0.3856547     -1.117487      2.408848      39.68461 7.569083  44.02372 19.76051  -4.339115      21.16055  
1 1 1 6  10 12 o 500.2755 7.234488  166.9838       4.822704      168.3561       5.413625      161.7071       10.61554      502.2385 8.089183  490.6458 16.25925  11.59262       18.16034  
1 1 1 6  10 13 o 160.5185 5.572807  17.20153       1.190182      17.21224       1.235462      17.06335       4.436894      160.5561 5.784145  157.6479 21.69589  2.908173       22.45368  
1 1 1 6  10 14 o 320.3683 7.058194  68.46866       3.013121      67.04295       3.303423      75.52747       7.350486      316.9696 7.821195  335.1340 16.51061  -18.16440      18.26941  
1 1 1 6  10 15 o 385.7775 5.843148  99.24017       3.003705      103.7054       4.607666      95.94031       3.961045      394.1501 8.772953  379.1802 7.839541  14.96997       11.76534  
1 1 1 6  10 16 o 272.4947 7.133183  49.56981       2.587863      48.80367       3.167803      51.10693       4.487042      270.2386 8.808823  276.1693 12.22330  -5.930664      15.06667  
1 1 1 6  10 17 o 377.6050 9.945785  95.31958       5.000023      92.58205       6.307858      99.94733       8.201379      371.7349 12.75319  385.6530 15.99412  -13.91812      20.45618  
1 1 1 6  10 18 o 211.4184 5.439515  29.82682       1.531142      31.95568       2.037005      27.06178       2.321506      218.7295 6.997945  201.1207 8.682878  17.60872       11.15184  
1 1 1 6  10 19 o 237.0879 5.773251  37.49572       1.823910      37.02460       2.620804      37.93819       2.539895      235.2911 8.372369  238.2172 8.012862  -2.926117      11.58890  
1 1 1 6  10 20 f 311.6884 7.422905  64.88261       3.082961      64.50470       4.394228      65.24895       4.326491      310.2063 10.64639  312.0325 10.42010  -1.826233      14.89712  
1 1 1 6  10 21 o 409.2001 9.620918  112.1245       5.245969      111.9061       7.154502      112.3784       7.715007      407.6967 13.18683  408.2177 14.20474  -0.5210876     19.38213  
1 1 1 6  10 22 o 86.05855 4.423285  4.953903       0.5055369     5.355467       0.5517682     2.854362       1.261657      89.47022 4.644016  63.71188 15.09417  25.75835       15.79243  
1 1 1 6  10 23 o 159.5618 6.522929  17.05030       1.383976      17.29270       1.466834      15.08480       4.176919      160.6494 6.868024  146.1150 22.14630  14.53438       23.18681  
1 1 1 6  10 24 o 176.5036 8.144114  20.93605       1.910288      20.64994       2.036749      23.02777       5.507102      175.1742 8.753304  179.7738 23.55525  -4.599670      25.12907  
1 1 1 6  10 25 f 174.7573 8.492339  20.56549       1.971669      20.51356       1.998757      22.44273       12.01679      174.5076 8.622219  157.7133 50.53425  16.79427       51.26454  
1 1 1 6  10 26 o 233.4073 8.780750  36.72604       2.726117      36.18298       3.197456      38.17155       5.216637      231.1271 10.40869  234.3814 16.81471  -3.254242      19.77562  
1 1 1 6  10 27 o 139.0284 5.951895  12.97620       1.100085      12.95684       1.309136      13.02273       2.029299      138.7018 7.106889  137.9906 11.13066  0.7111053      13.20604  
1 1 1 6  10 28 o 70.53769 5.611540  3.357510       0.5231000     3.252383       0.5497649     4.363042       1.700275      69.35270 6.008156  77.28214 16.97585  -7.929436      18.00771  
1 1 1 6  10 29 o 43.30677 14.58373  1.264041       0.9959193     -2.487006      3.003741      1.727331       1.055632      42.90722 20.22896  49.09304 14.86396  -6.185814      25.10275  
1 1 1 6  10 30 o 54.98819 18.36555  2.227207       1.579716      1.524773       2.425292      2.744823       2.081925      53.56628 21.74854  60.46117 21.06372  -6.894897      30.27671  
1 1 1 6  10 31 o 97.10921 16.25152  7.185176       2.028698      10.07185       2.754070      3.760719       2.999661      112.8918 18.98072  66.57786 24.98381  46.31394       31.37609  
1 1 1 6  10 32 o 75.68052 23.51695  5.342567       2.620982      3.775930       3.474300      7.411714       3.992812      64.07482 26.02481  81.79041 29.11285  -17.71559      39.04931  
1 1 1 6  10 33 o 35.70758 16.92999  -1.425274      2.160288      -1.441331      4.174936      -1.419402      2.524533      47.64466 22.84881  38.60617 18.30353  9.038498       29.27605  
1 1 1 6  10 34 o 69.68917 24.89075  5.427668       2.921115      3.929284       3.420834      9.462005       5.613148      59.96562 25.21871  73.94386 31.74090  -13.97824      40.53971  
1 1 1 6  10 35 o 32.57405 15.91939  -2.492046      2.286302      -3.750868      3.373357      -1.422524      3.109388      37.10256 18.36342  40.20321 19.39166  -3.100651      26.70678  
1 1 1 6  11 0  o 198.6981 10.87955  26.57935       2.860693      26.57935       2.860693      26.57935       2.860693      198.6981 10.87955  198.6981 10.87955  -0.000000      0.000000  
1 1 1 6  11 1  o 454.1982 9.799819  137.7830       5.931124      132.4623       10.06703      140.6118       7.340373      443.9255 17.05005  458.3980 12.02755  -14.47250      20.86543  
1 1 1 6  11 2  f 304.8488 5.513821  61.96604       2.239807      61.74812       5.925990      62.00236       2.419267      303.2344 14.70979  304.9183 5.954248  -1.683838      15.86918  
1 1 1 6  11 3  o 207.8572 5.046184  28.80476       1.397661      31.77422       2.396756      27.27463       1.720480      218.0301 8.264582  202.1193 6.396101  15.91075       10.45052  
1 1 1 6  11 4  o 320.2174 7.356042  68.41566       3.138793      72.81409       4.409732      63.89880       4.468703      329.9953 10.04006  309.0156 10.86937  20.97971       14.79682  
1 1 1 6  11 5  o 102.9229 5.976040  7.088261       0.8160695     7.246416       0.9767454     6.722625       1.485133      103.9787 7.092039  99.63480 11.39061  4.343887       13.41801  
1 1 1 6  11 6  f 499.0522 7.932178  166.2192       5.274873      165.4805       8.609583      166.6632       6.674222      497.0543 13.01003  499.4620 10.02824  -2.407745      16.42639  
1 1 1 6  11 7  o 396.8292 7.133992  105.0673       3.772331      97.50105       5.695341      110.9812       5.035204      381.7134 11.20932  407.6454 9.269601  -25.93195      14.54560  
1 1 1 6  11 8  o 747.1563 10.39659  373.0494       10.35084      374.1332       15.82612      372.2392       13.68319      746.7466 15.90478  745.5035 13.77413  1.243042       21.04017  
1 1 1 6  11 9  o 210.0917 5.142510  29.42913       1.439652      29.75894       1.663860      28.44675       2.871591      211.1581 5.919217  206.0541 10.49301  5.104019       12.04742  
1 1 1 6  11 10 o 333.5532 6.506111  74.21174       2.891745      71.69835       4.101284      76.69656       4.077907      327.5172 9.407246  338.7906 9.041091  -11.27344      13.04751  
1 1 1 6  11 11 o 56.14557 5.364788  2.120988       0.3964919     2.177209       0.3992932     -1.843619      3.353059      56.89517 5.328760  50.86205 23.02733  6.033119       23.63586  
1 1 1 6  11 12 o 302.4331 7.038873  61.01707       2.836651      65.33846       3.446704      51.94561       4.993793      312.7750 8.277140  278.2532 13.50879  34.52176       15.84293  
1 1 1 6  11 13 f 321.3993 7.941434  68.93127       3.401084      69.36687       3.875888      67.47292       7.091792      322.2128 9.036162  316.6699 16.86728  5.542908       19.13524  
1 1 1 6  11 14 o 198.3790 5.691590  26.26278       1.502982      26.39953       1.592004      25.14159       4.558463      198.8765 6.014320  192.6710 17.96227  6.205475       18.94242  
1 1 1 6  11 15 o 216.6648 7.273271  31.35361       2.096889      30.60555       2.462300      33.32794       4.000203      213.9512 8.654659  222.7357 13.54177  -8.784485      16.07118  
1 1 1 6  11 16 o 224.2461 6.629433  33.57259       1.978781      32.30318       2.482270      35.78553       3.277430      219.8155 8.490524  231.1588 10.66896  -11.34331      13.63509  
1 1 1 6  11 17 o 215.8441 1.432261  31.04208       0.4119420     27.02140       3.650495      31.09394       0.4145902     200.3557 13.75689  216.0243 1.440267  -15.66859      13.83208  
1 1 1 6  11 18 o 120.5339 1.634814  9.680600       0.2625736     7.423219       1.387527      9.764442       0.2674053     104.8941 10.04975  121.0546 1.657736  -16.16048      10.18556  
1 1 1 6  11 19 o 659.6473 14.25791  292.3932       12.53260      292.1644       13.51289      293.8006       33.51547      658.9279 15.38994  642.4921 39.33604  16.43579       42.23949  
1 1 1 6  11 20 o 401.8357 8.330318  107.9707       4.460501      105.0510       6.028811      111.5020       6.630189      395.5710 11.44962  407.3294 12.22922  -11.75839      16.75254  
1 1 1 6  11 21 o 177.7266 6.881686  21.14006       1.626669      21.29073       2.296729      20.98841       2.304204      177.9633 9.722061  176.6746 9.826244  1.288742       13.82294  
1 1 1 6  11 22 o 156.7178 8.234240  16.49435       1.713519      18.29034       2.318614      14.33301       2.543537      164.6339 10.62579  145.0958 13.30349  19.53809       17.02617  
1 1 1 6  11 23 o 136.8186 7.429525  12.57235       1.349421      15.06637       2.007130      10.51520       1.822885      149.3288 10.14719  124.4376 11.11020  24.89124       15.04666  
1 1 1 6  11 24 o 103.0037 10.22990  7.217757       1.385563      7.525936       1.447850      3.865414       4.775256      105.1493 10.47251  81.59155 31.31005  23.55775       33.01503  
1 1 1 6  11 25 o 290.2497 13.38963  57.51795       5.164666      59.90047       7.348341      55.19216       7.260334      292.7275 18.94043  280.5195 19.54543  12.20801       27.21697  
1 1 1 6  11 26 o 175.2912 6.900711  20.65037       1.608711      20.45977       1.752014      21.67459       4.061360      174.3286 7.560126  175.5582 17.59812  -1.229568      19.15331  
1 1 1 6  11 27 o 160.4244 9.144205  17.46965       1.946648      16.44306       2.096931      23.87137       5.236411      155.2760 10.19092  180.0876 22.29694  -24.81163      24.51547  
1 1 1 6  11 28 o 24.16576 10.54039  -0.1003160     0.6391236     -0.2193595     0.7345416     0.2706753      1.296718      25.00705 11.08802  37.10566 15.56086  -12.09861      19.10719  
1 1 1 6  11 29 o 97.85985 5.927375  6.474223       0.7693062     6.634402       0.9256995     6.116609       1.383168      98.76572 7.080787  93.32929 11.35544  5.436432       13.38221  
1 1 1 6  11 30 o 69.35460 6.982638  3.300215       0.6365356     4.045693       0.7443814     1.272018       1.227815      76.73756 7.370223  44.05700 16.08300  32.68056       17.69132  
1 1 1 6  11 31 o 17.51845 8.606647  -1.345358      0.6956787     -1.622907      0.7477502     0.4417898      1.897437      17.49077 8.654826  42.28534 18.30455  -24.79457      20.24753  
1 1 1 6  11 32 o 23.72810 10.65077  -0.2219805     0.6998302     -0.3089377E-01 0.7173293     -3.995795      3.187818      25.57569 11.16081  37.72558 18.51184  -12.14989      21.61602  
1 1 1 6  11 33 o 55.65083 23.95012  2.603528       3.211437      5.343188       4.670152      0.1459279      4.423217      65.79683 28.59816  51.17213 24.25137  14.62469       37.49645  
1 1 1 6  11 34 o 50.22216 22.21888  1.894800       2.933526      0.3748292      3.772737      4.218945       4.665203      47.73361 22.55484  58.85779 26.84798  -11.12418      35.06472  
1 1 1 6  12 0  o 124.5835 0.7980263 10.34241       0.1324681     10.34241       0.1324681     10.34241       0.1324681     124.5835 0.7980263 124.5835 0.7980263 0.000000       0.000000  
1 1 1 6  12 1  o 250.5706 2.043005  41.83628       0.6821396     37.20652       3.320307      42.04030       0.6970077     235.7185 10.59798  251.1803 2.082468  -15.46185      10.80064  
1 1 1 6  12 2  o 439.8956 2.416705  128.9472       1.416598      127.3341       12.58802      128.9679       1.425654      433.8252 21.84585  439.9304 2.431962  -6.105194      21.98080  
1 1 1 6  12 3  o 49.79076 15.10348  1.670192       1.089220      2.133986       1.922899      1.451070       1.321712      58.92994 20.25747  48.78123 16.79383  10.14871       26.31345  
1 1 1 6  12 4  o 68.12266 2.370058  3.096128       0.2148137     3.112032       0.2162399     1.902447       1.873424      68.29723 2.379706  56.70210 19.96441  11.59512       20.10574  
1 1 1 6  12 5  f 344.5479 5.580174  79.16146       2.561952      79.95683       2.854930      75.87202       5.805957      346.2405 6.187911  336.4344 12.97522  9.806091       14.37521  
1 1 1 6  12 6  o 230.8443 5.014884  35.52875       1.542601      38.64161       2.636091      33.90764       1.902332      240.4644 8.239067  225.3813 6.340549  15.08318       10.39638  
1 1 1 6  12 7  o 582.8497 8.311737  226.7617       6.455380      228.4640       7.969504      223.5138       11.00820      584.7521 10.22789  577.6021 14.30257  7.150024       17.58332  
1 1 1 6  12 8  o 579.8177 7.858864  224.3595       6.071902      222.4848       8.081057      226.7902       9.201585      577.0146 10.51012  582.3365 11.85810  -5.321899      15.84542  
1 1 1 6  12 9  o 353.4004 8.070415  83.35139       3.800462      81.10812       4.839702      86.95982       6.138129      348.2589 10.44079  360.2823 12.80592  -12.02338      16.52277  
1 1 1 6  12 10 o 442.5244 6.711509  130.6222       3.957590      139.5115       4.988341      115.5232       6.501257      457.2059 8.187867  415.5055 11.75395  41.70047       14.32468  
1 1 1 6  12 11 o 526.8513 7.811364  185.2162       5.483887      180.0366       7.235725      192.2067       8.405947      519.1199 10.46022  536.1859 11.76516  -17.06592      15.74278  
1 1 1 6  12 12 o 142.3057 11.54329  13.62440       2.170121      16.69096       2.767392      8.727304       3.497153      157.3808 13.32110  111.5577 24.22142  45.82304       27.64288  
1 1 1 6  12 13 o 583.4384 9.592326  227.3088       7.457486      232.6970       8.860492      214.2197       13.80980      590.0595 11.26908  564.3965 18.38694  25.66302       21.56553  
1 1 1 6  12 14 f 444.0103 6.598407  131.4949       3.903963      130.4294       4.025412      148.3580       16.01394      442.1902 6.831684  467.2719 25.81943  -25.08173      26.70795  
1 1 1 6  12 15 o 167.5977 9.450349  18.81877       2.101969      18.81601       2.486357      18.82568       3.935301      167.3968 11.21125  166.4193 18.03387  0.9775085      21.23471  
1 1 1 6  12 16 f 295.7029 6.479808  58.33157       2.553238      58.93061       3.854219      57.86311       3.408390      296.8210 9.757958  294.2361 8.702769  2.584900       13.07501  
1 1 1 6  12 17 o 170.8888 5.905819  19.50361       1.342808      22.73345       2.246788      17.70886       1.674843      184.2214 9.181620  162.6787 7.748542  21.54271       12.01424  
1 1 1 6  12 18 o 308.4429 6.287146  63.49020       2.584055      69.87618       4.370660      60.05838       3.204017      322.9973 10.16754  299.7292 8.029410  23.26816       12.95570  
1 1 1 6  12 19 o 409.3357 8.031937  112.0025       4.381002      117.9376       6.826173      107.8455       5.712787      418.9606 12.24043  401.0192 10.70034  17.94141       16.25809  
1 1 1 6  12 20 o 250.1498 7.161192  41.85803       2.384579      40.79161       3.229458      43.13649       3.535953      246.5002 9.851777  253.3694 10.49591  -6.869217      14.39520  
1 1 1 6  12 21 o 241.6019 6.790823  39.05548       2.184064      39.63556       3.853201      38.78089       2.651068      242.3211 11.97025  240.5026 8.284695  1.818481       14.55758  
1 1 1 6  12 22 o 367.8375 7.851701  90.64388       3.848515      92.85330       4.898375      87.08034       6.220893      371.5655 9.902170  358.5876 13.04091  12.97797       16.37432  
1 1 1 6  12 23 o 87.77497 9.704426  5.245157       1.116115      5.654586       1.444784      4.639194       1.757667      90.62499 12.27980  80.83447 16.86431  9.790520       20.86140  
1 1 1 6  12 24 o 160.3845 7.900594  17.30873       1.683282      18.45834       2.312786      16.01384       2.454578      165.0078 10.57424  153.2233 12.12071  11.78455       16.08497  
1 1 1 6  12 25 o 180.3902 7.879966  21.91158       1.889564      19.64314       2.824870      23.74841       2.541959      169.3735 12.60681  187.1480 10.23211  -17.77449      16.23662  
1 1 1 6  12 26 o 340.0602 9.657976  78.35333       4.371952      75.72209       5.150906      85.13337       8.268363      333.0541 11.62416  347.5303 17.91520  -14.47617      21.35592  
1 1 1 6  12 27 o 77.73769 11.08498  4.210517       1.115771      4.518520       1.150776      -0.6224914     4.558504      80.60483 11.00089  60.23180 27.09728  20.37303       29.24521  
1 1 1 6  12 28 o 177.5062 8.671146  21.48805       2.044784      18.95560       3.108936      23.41873       2.714544      163.3956 14.42706  183.9791 11.12472  -20.58348      18.21811  
1 1 1 6  12 29 o 71.52004 7.021530  3.501669       0.6605486     3.338492       0.8622674     3.733447       1.027661      69.01285 9.639032  72.55084 10.97239  -3.537994      14.60494  
1 1 1 6  12 30 f 17.22962 8.483584  -1.391742      0.6882731     0.3651158      1.150093      -2.372031      0.8590955     35.10191 14.68311  17.25796 8.653829  17.84395       17.04354  
1 1 1 6  12 31 o 37.92950 14.51832  0.8793584      1.024995      0.6397873      1.074910      3.280675       3.403140      36.11823 14.54534  61.66124 25.47922  -25.54300      29.33867  
1 1 1 6  12 32 o 84.77543 7.654018  5.020151       0.8553319     5.315207       0.8859057     0.9653689      3.284117      87.22354 7.701227  50.46255 22.82350  36.76099       24.08778  
1 1 1 6  12 33 o 51.54591 20.79146  2.258814       2.200144      3.380210       2.964341      0.8834135      3.282942      57.93613 23.84377  48.50080 22.27266  9.435329       32.62816  
1 1 1 6  12 34 o 34.11120 12.33662  0.8212823      0.7201234     0.7749847      0.7418018     1.578846       3.000668      33.66216 12.46474  48.60875 21.91629  -14.94658      25.21296  
1 1 1 6  13 0  o 424.0179 10.77322  120.2055       6.078123      120.2055       6.078123      120.2055       6.078123      424.0179 10.77322  424.0179 10.77322  -0.000000      0.000000  
1 1 1 6  13 1  o 525.1470 2.533671  183.7723       1.772983      0.000000       0.000000      183.7723       1.772983      ?        ?         525.1470 2.533671  0.000000       2.533671  
1 1 1 6  13 2  o 660.3148 17.40880  293.0638       15.30433      271.6563       41.69771      296.3966       16.45257      615.4522 51.31095  663.6431 18.62324  -48.19092      54.58607  
1 1 1 6  13 3  o 382.5971 6.993639  97.65524       3.565484      100.4419       4.826943      94.30903       5.289446      387.8187 9.340497  375.5208 10.58122  12.29788       14.11408  
1 1 1 6  13 4  o 606.4899 14.30171  246.4114       11.55806      222.5494       17.64659      264.3386       15.29550      573.4111 23.14272  626.8085 18.33252  -53.39740      29.52400  
1 1 1 6  13 5  o 132.7007 4.037329  11.74838       0.7130753     11.41503       1.179735      11.94027       0.8950889     130.6371 6.800524  133.7315 5.031926  -3.094406      8.459752  
1 1 1 6  13 6  o 687.3669 8.895792  315.4355       8.147921      309.9345       13.14443      318.8682       10.38349      680.1941 14.50225  690.6670 11.28239  -10.47290      18.37410  
1 1 1 6  13 7  o 249.7526 4.977355  41.58495       1.656465      42.26068       2.364691      40.93389       2.321106      251.5952 7.060383  247.6124 7.041909  3.982758       9.971834  
1 1 1 6  13 8  o 230.3556 7.209414  35.43466       2.210229      36.34575       2.625764      33.21983       4.093984      233.2020 8.463906  222.3314 13.88821  10.87062       16.26407  
1 1 1 6  13 9  o 256.6773 7.675740  43.99805       2.622364      44.84842       3.544319      42.96949       3.898029      258.9088 10.29388  253.2766 11.58049  5.632141       15.49425  
1 1 1 6  13 10 o 258.2497 6.238369  44.47667       2.146764      42.69630       2.663038      47.78091       3.627924      252.8324 7.914187  267.2667 10.20560  -14.43433      12.91467  
1 1 1 6  13 11 o 371.9696 6.522676  92.27963       3.233008      92.29714       3.678452      92.22018       6.777832      371.9485 7.421793  370.9438 13.73599  1.004669       15.61283  
1 1 1 6  13 12 o 259.5583 3.165544  44.89730       1.094855      44.60896       1.157443      47.34922       3.375198      258.7195 3.357352  266.1179 9.533534  -7.398407      10.10743  
1 1 1 6  13 13 o 143.2977 5.212104  13.70869       0.9935772     13.94373       1.095130      12.61477       2.362556      144.4944 5.698936  136.6781 13.13354  7.816315       14.31670  
1 1 1 6  13 14 o 247.8241 6.435293  40.99391       2.123331      43.97819       2.587375      34.83887       3.715820      256.6046 7.575253  227.8690 12.28299  28.73563       14.43109  
1 1 1 6  13 15 o 275.0319 6.565192  50.46463       2.406047      50.60837       2.679825      49.86702       5.464225      275.2828 7.312039  272.2102 15.12381  3.072601       16.79868  
1 1 1 6  13 16 o 507.4674 10.85696  172.2995       7.341588      178.4020       8.867130      158.9975       13.09142      515.9315 12.89786  484.5434 20.32103  31.38806       24.06863  
1 1 1 6  13 17 o 269.6441 5.900849  48.51354       2.120210      52.49434       3.719605      46.59763       2.580468      279.9305 9.987796  264.0587 7.340843  15.87177       12.39532  
1 1 1 6  13 18 o 279.7175 6.549282  52.24376       2.441107      53.75452       3.643494      51.01323       3.288265      283.2052 9.668982  275.9981 8.952866  7.207031       13.17737  
1 1 1 6  13 19 o 90.15603 2.665509  5.422534       0.3198684     4.032897       2.572442      5.444358       0.3223703     76.23800 23.22824  90.33673 2.681006  -14.09873      23.38245  
1 1 1 6  13 20 o 120.9614 1.893994  9.751072       0.3052805     8.220889       3.821210      9.760901       0.3062594     106.2726 26.94939  121.0223 1.899112  -14.74966      27.01622  
1 1 1 6  13 21 o 297.2495 9.310193  59.36963       3.683134      62.17252       6.194230      57.83665       4.580920      301.9880 15.44433  292.6447 11.77133  9.343323       19.41884  
1 1 1 6  13 22 o 262.1359 10.52669  46.37309       3.669508      52.29955       5.538748      41.73682       4.898895      276.5892 15.08516  247.0562 14.95086  29.53297       21.23889  
1 1 1 6  13 23 o 195.1017 5.874635  25.48634       1.525529      26.03817       4.079436      25.39663       1.644871      194.2407 15.90012  194.6773 6.349276  -0.4365997     17.12096  
1 1 1 6  13 24 o 108.1636 12.76433  8.069049       1.804330      4.619033       2.763169      10.63370       2.382382      79.48708 24.04429  123.7316 14.73905  -44.24456      28.20226  
1 1 1 6  13 25 o 65.62198 16.69348  3.110882       1.462966      -0.2743741     3.224855      3.988107       1.641609      53.42162 23.47844  74.27302 16.96054  -20.85139      28.96371  
1 1 1 6  13 26 o 64.64371 14.93847  3.018788       1.260960      3.233419       1.480780      2.452545       2.405166      66.53164 16.72380  61.48802 22.49983  5.043621       28.03440  
1 1 1 6  13 27 o 49.43777 14.22116  1.759504       0.9869626     1.414408       1.237025      2.363952       1.637150      46.39286 16.23151  57.27936 18.67782  -10.88650      24.74515  
1 1 1 6  13 28 o 65.15360 11.48515  3.029603       0.9607003     5.375876       1.463802      1.254288       1.273301      86.54619 13.10237  44.59904 16.36258  41.94715       20.96201  
1 1 1 6  13 29 o 36.59033 12.59170  0.8978922      0.7430050     1.318385       0.8397786     -0.6176351     1.594290      42.68621 13.31909  34.55392 15.73596  8.132290       20.61598  
1 1 1 6  13 30 o 32.08612 12.42112  0.5494533      0.7562538     0.7824144E-01  1.010195      1.150236       1.140659      30.97853 13.38296  41.60187 15.44703  -10.62333      20.43806  
1 1 1 6  13 31 o 11.58240 5.736094  -0.7519855     0.3310161     -0.7418169     0.3337997     -1.354069      2.568522      11.71519 5.794342  39.47287 18.63908  -27.75768      19.51895  
1 1 1 6  13 32 o 41.22886 18.42612  0.3113032      2.070114      -0.1932876     2.460824      1.532780       3.828719      41.70589 19.20006  52.98697 24.22790  -11.28109      30.91332  
1 1 1 6  13 33 o 49.42782 19.86576  2.070219       2.000818      1.236697       2.559086      3.381011       3.209172      46.56033 20.66757  56.72086 24.16475  -10.16053      31.79754  
1 1 1 6  14 0  o 258.5135 11.48040  44.86201       3.936899      44.86201       3.936899      44.86201       3.936899      258.5135 11.48040  258.5135 11.48040  -0.000000      0.000000  
1 1 1 6  14 1  o 467.0287 2.941199  145.3535       1.830381      0.000000       0.000000      145.3535       1.830381      ?        ?         467.0287 2.941199  0.000000       2.941199  
1 1 1 6  14 2  o 213.7140 6.629220  30.49328       1.885573      28.22715       4.911194      30.88507       2.042076      204.1882 18.24218  215.0489 7.136135  -10.86070      19.58830  
1 1 1 6  14 3  o 246.7091 7.456657  40.64538       2.448523      42.58922       3.584998      38.94581       3.352183      252.2456 10.68999  241.2200 10.45378  11.02560       14.95184  
1 1 1 6  14 4  o 362.9724 9.297898  88.02502       4.493391      90.45192       5.576601      83.53281       7.587049      367.6892 11.39567  352.5724 16.19244  15.11676       19.80041  
1 1 1 6  14 5  o 222.0047 6.470068  32.89894       1.911970      34.41354       2.605440      31.13152       2.814514      226.8994 8.633108  215.6844 9.818647  11.21506       13.07426  
1 1 1 6  14 6  o 343.8167 6.887805  78.84924       3.155595      79.43018       4.075575      77.97966       4.986279      344.8362 8.876949  341.4388 10.97374  3.397491       14.11465  
1 1 1 6  14 7  o 496.7487 6.810046  164.5891       4.507755      166.3834       6.022404      162.3031       6.797617      499.2358 9.052960  492.9275 10.34904  6.308319       13.74986  
1 1 1 6  14 8  o 750.7461 11.15065  376.6302       11.15493      380.8491       13.90148      369.0018       18.69279      754.3394 13.82996  740.8038 18.95196  13.53564       23.46156  
1 1 1 6  14 9  o 772.0917 9.905464  398.1093       10.19101      404.1217       13.98513      391.3017       14.88109      777.1168 13.50537  764.4078 14.60953  12.70898       19.89557  
1 1 1 6  14 10 o 466.8967 7.723633  145.4496       4.805250      150.4834       6.353743      138.7231       7.344777      474.6704 10.04532  455.3336 12.11606  19.33685       15.73873  
1 1 1 6  14 11 o 404.7240 7.068291  109.2709       3.811948      111.2220       4.879341      106.2148       6.106662      408.1656 8.971214  398.4484 11.51367  9.717194       14.59614  
1 1 1 6  14 12 o 293.2216 4.517505  57.31532       1.765095      56.27322       1.882120      64.92224       5.085064      290.5313 4.861618  311.2961 12.28295  -20.76486      13.21008  
1 1 1 6  14 13 o 346.3737 7.209366  80.05482       3.327480      83.03109       4.191159      74.98009       5.472727      352.4997 8.930004  334.5121 12.29868  17.98758       15.19877  
1 1 1 6  14 14 o 463.8895 6.437001  143.5670       3.978979      143.3238       4.404305      144.6470       9.280696      463.4257 7.132205  464.0118 15.02973  -0.5861206     16.63614  
1 1 1 6  14 15 o 123.9729 7.665868  10.30141       1.260178      9.912599       1.373515      12.36996       3.168085      121.5125 8.537124  134.2580 18.17488  -12.74551      20.08006  
1 1 1 6  14 16 o 383.5818 9.052392  98.38338       4.626951      98.87186       5.544905      97.26341       8.396118      384.0825 10.84504  379.4223 16.64717  4.660126       19.86815  
1 1 1 6  14 17 o 288.8418 8.813183  55.86406       3.388113      56.47322       3.950689      54.17035       6.587607      290.1629 10.23383  282.3294 17.59798  7.833435       20.35731  
1 1 1 6  14 18 o 202.5356 6.064026  27.41805       1.634732      29.95722       2.800504      26.10569       2.013342      211.1528 9.981525  197.4333 7.667432  13.71951       12.58652  
1 1 1 6  14 19 o 104.3040 5.714204  7.287601       0.7911667     9.660068       2.471557      7.016740       0.8351095     118.2619 16.10164  102.2965 6.154923  15.96537       17.23792  
1 1 1 6  14 20 o 81.66994 5.170881  4.471959       0.5598410     -1.338887      2.643366      4.744848       0.5728358     45.06222 20.41916  84.13813 5.133763  -39.07591      21.05464  
1 1 1 6  14 21 o 115.6445 2.234858  8.914824       0.3443882     9.172721       2.945942      8.911250       0.3467659     113.5073 20.21859  115.6209 2.250746  -2.113594      20.34348  
1 1 1 6  14 22 o 120.4999 12.05094  9.928535       1.909070      7.502695       3.016894      11.54864       2.465477      101.2911 22.89238  129.3340 14.55847  -28.04293      27.12951  
1 1 1 6  14 23 o 156.6772 7.577183  16.51688       1.577239      10.75515       3.404962      18.09092       1.779689      121.7698 21.78434  163.8603 8.176569  -42.09052      23.26830  
1 1 1 6  14 24 o 186.0964 6.420216  23.25047       1.589682      24.10905       4.484187      23.12706       1.700098      184.5598 18.48203  185.4944 6.890091  -0.9346771     19.72457  
1 1 1 6  14 25 o 66.95707 6.769912  3.043555       0.5957335     3.133216       3.639505      3.041086       0.6038782     70.88027 27.29944  66.91112 6.870439  3.969154       28.15071  
1 1 1 6  14 26 o 41.67147 16.59875  0.7517636      1.384085      -0.2170118     2.409413      1.228904       1.690918      45.83409 20.21317  47.99547 18.57507  -2.161381      27.45187  
1 1 1 6  14 27 o 37.32045 15.82001  0.2398406      1.363630      1.110115       2.712895      -0.5437226E-01 1.577379      53.60521 22.49562  37.89829 16.54399  15.70692       27.92413  
1 1 1 6  14 28 o 44.37925 18.53714  0.7292171      1.829147      -3.379732      3.270954      2.598790       2.206379      41.57435 20.01161  58.97759 21.55493  -17.40324      29.41223  
1 1 1 6  14 29 o 31.48027 12.90345  0.3556107      0.8636284     -0.7171229     1.084449      2.215560       1.427952      27.18179 12.59558  53.35679 17.44660  -26.17500      21.51819  
1 1 1 6  14 30 o 20.72682 9.657604  -0.5202043     0.6512923     -0.4747082     1.068782      -0.5470784     0.8214262     28.01879 12.80733  23.72572 10.98296  4.293066       16.87167  
1 1 1 6  14 31 o 39.13260 13.80305  1.102141       0.8958168     0.7754711      1.326041      1.376385       1.214984      38.85042 15.96377  43.35628 15.97047  -4.505859      22.58092  
1 1 1 6  14 32 o 22.40797 10.54332  -0.6846064     0.8086882     -0.5898093     0.8522624     -1.541190      2.561892      23.65985 11.03203  37.60205 17.99687  -13.94221      21.10908  
1 1 1 6  14 33 o 24.61586 11.25051  -0.3335297     0.8244122     -0.5500036     0.8564067     2.402352       3.044569      23.81167 11.08809  51.95125 22.82311  -28.13958      25.37401  
1 1 1 6  15 0  o 218.8385 11.56802  32.22411       3.351652      32.22411       3.351652      32.22411       3.351652      218.8385 11.56802  218.8385 11.56802  0.000000       0.000000  
1 1 1 6  15 1  o 288.5557 5.799836  55.51996       2.230072      56.12645       3.493457      55.10284       2.897173      289.8207 9.057032  287.2895 7.574608  2.531219       11.80697  
1 1 1 6  15 2  f 944.6635 12.69349  596.8329       15.97834      619.9980       32.45609      589.4224       18.35701      957.0048 25.47387  938.1773 14.68397  18.82745       29.40301  
1 1 1 6  15 3  o 137.5662 6.342038  12.64727       1.159428      11.57377       1.849242      13.34259       1.488279      131.1948 10.67005  141.1866 7.942771  -9.991852      13.30179  
1 1 1 6  15 4  o 310.6685 8.520801  64.46181       3.524040      69.01565       6.469352      62.54042       4.202228      320.6284 15.18522  305.8231 10.32664  14.80539       18.36384  
1 1 1 6  15 5  o 233.2455 7.956992  36.34295       2.469445      37.14793       4.325318      35.95366       3.007850      235.1925 13.86282  231.8365 9.758277  3.355972       16.95292  
1 1 1 6  15 6  o 386.8748 7.363332  99.84853       3.795932      98.57502       4.978096      101.6177       5.867367      384.0933 9.734265  389.7855 11.30846  -5.692200      14.92103  
1 1 1 6  15 7  o 235.9449 6.236787  37.15083       1.959134      36.71424       2.381143      38.06569       3.446910      234.4587 7.631759  238.4451 10.87711  -3.986404      13.28741  
1 1 1 6  15 8  o 765.8442 10.80498  391.8776       11.02650      393.4627       14.30751      389.5591       17.30400      766.6568 14.00521  761.9789 17.04237  4.677917       22.05874  
1 1 1 6  15 9  o 142.9112 5.779458  13.64101       1.098323      12.98076       1.294606      15.33673       2.074731      139.3215 6.995805  151.1658 10.36262  -11.84433      12.50301  
1 1 1 6  15 10 o 156.8501 4.919428  16.41785       1.026918      16.96656       1.377483      15.73134       1.540757      159.3580 6.500570  153.3589 7.562982  5.999008       9.972769  
1 1 1 6  15 11 o 300.4054 6.647430  60.20091       2.660939      58.94740       3.530511      61.84946       4.048775      296.9784 8.931679  304.0868 10.00562  -7.108429      13.41221  
1 1 1 6  15 12 o 372.2628 6.434711  92.44902       3.191921      94.77099       3.942577      88.03173       5.437886      376.7900 7.852489  362.6053 11.26808  14.18463       13.73430  
1 1 1 6  15 13 o 268.0781 3.078027  47.89730       1.099530      47.83383       1.154909      48.51188       3.593892      267.8957 3.235255  269.1752 10.03732  -1.279480      10.54584  
1 1 1 6  15 14 o 201.5223 4.683611  27.08167       1.257701      27.16618       1.353827      26.54919       3.398386      201.8225 5.034079  198.5389 12.91568  3.283646       13.86206  
1 1 1 6  15 15 o 252.6376 6.730080  42.64573       2.263626      40.99810       2.557529      48.60392       4.863488      247.5885 7.761639  268.5775 13.63414  -20.98901      15.68862  
1 1 1 6  15 16 o 41.35085 14.75993  0.9879242      1.027005      1.840289       1.219678      -1.088943      1.903868      52.15331 16.01440  38.08094 17.28484  14.07238       23.56325  
1 1 1 6  15 17 o 258.7411 9.119140  44.90094       3.139158      42.94614       3.910688      48.44252       5.263811      252.5079 11.65406  267.3369 14.83454  -14.82898      18.86480  
1 1 1 6  15 18 o 260.2464 9.196207  45.47015       3.184079      44.29060       3.942270      47.68344       5.400170      256.2753 11.57413  264.7334 15.37439  -8.458038      19.24402  
1 1 1 6  15 19 o 183.0135 6.991111  22.44406       1.701781      18.37357       3.291492      23.92915       1.988129      163.7260 15.26278  188.8297 7.918921  -25.10365      17.19482  
1 1 1 6  15 20 o 132.9400 5.976676  11.84115       1.056031      13.19312       2.835861      11.62349       1.137869      138.1877 15.67748  131.6414 6.506901  6.546265       16.97419  
1 1 1 6  15 21 o 221.2431 4.969933  32.70480       1.465190      38.33313       4.686923      32.09519       1.542498      236.4157 14.95441  219.1313 5.282588  17.28438       15.86001  
1 1 1 6  15 22 o 145.4953 2.326380  14.11398       0.4510276     13.20827       4.154521      14.12478       0.4537092     134.1577 24.12670  145.5504 2.339325  -11.39267      24.23985  
1 1 1 6  15 23 o 155.6929 1.653998  16.15717       0.3431447     15.81535       3.558114      16.16038       0.3447517     149.3320 18.26052  155.7081 1.661582  -6.376083      18.33596  
1 1 1 6  15 24 o 181.1159 7.715327  22.14187       1.857754      15.68368       3.965220      23.95814       2.102824      146.3431 20.92921  188.1852 8.407015  -41.84203      22.55460  
1 1 1 6  15 25 o 82.84629 5.341318  4.622775       0.5865088     9.403293       6.450690      4.582926       0.5889482     101.9026 36.91338  82.47914 5.388200  19.42351       37.30456  
1 1 1 6  15 26 o 78.05253 8.796361  4.202683       0.8989644     -1.838915      3.886227      4.544241       0.9240262     50.99748 23.70424  81.23560 8.670054  -30.23811      25.24007  
1 1 1 6  15 27 o 47.93764 18.21212  1.436038       1.605216      2.752466       2.867308      0.8351124      1.937252      62.07964 24.14337  46.03960 19.14164  16.04003       30.81079  
1 1 1 6  15 28 o 52.06601 19.11766  1.983319       1.738753      3.765335       3.234642      1.259157       2.061997      66.33432 25.68603  48.47670 19.91166  17.85762       32.49994  
1 1 1 6  15 29 o 27.04700 12.76691  -1.065956      1.203025      2.633020       4.046119      -1.424672      1.260008      60.18792 26.38001  26.36947 12.62093  33.81845       29.24368  
1 1 1 6  15 30 o 31.40328 12.88005  0.3965807      0.8611916     -1.078414      3.389055      0.4983981      0.8904192     45.10760 21.33293  32.69999 13.21364  12.40761       25.09371  
1 1 1 6  15 31 f 35.46035 13.16494  0.8445874      0.8284715     -3.863432      2.687242      1.339074       0.8708929     33.53185 16.55824  41.69844 13.62440  -8.166595      21.44293  
1 1 1 6  15 32 o 42.64811 19.86685  -0.3662416E-01 2.753397      -1.622410      4.115162      1.248704       3.704859      44.60748 21.70187  49.74817 23.13067  -5.140697      31.71749  
1 1 1 6  16 0  o 256.8682 10.24328  44.22371       3.493397      44.22371       3.493397      44.22371       3.493397      256.8682 10.24328  256.8682 10.24328  0.000000       0.000000  
1 1 1 6  16 1  o 373.9832 7.509380  93.30869       3.742224      89.27833       5.403774      97.02283       5.187458      365.3627 11.11232  381.0025 10.22695  -15.63980      15.10212  
1 1 1 6  16 2  o 92.16490 1.123051  5.659623       0.1379236     9.626551       1.326164      5.616246       0.1386756     119.8143 8.358870  91.81100 1.133527  28.00333       8.435376  
1 1 1 6  16 3  o 410.1806 8.473042  112.2878       4.631141      112.2843       5.895916      112.2935       7.483060      409.8148 10.80610  409.3977 13.73649  0.4171448      17.47750  
1 1 1 6  16 4  o 105.6764 8.929509  7.507559       1.245660      6.736025       1.880995      8.110217       1.662439      99.24361 14.66474  109.5524 11.56228  -10.30875      18.67461  
1 1 1 6  16 5  o 306.7815 6.619286  62.77180       2.705913      62.14615       3.623354      63.56070       4.068731      304.9863 8.925330  308.3410 9.915604  -3.354706      13.34094  
1 1 1 6  16 6  o 151.3822 7.063853  15.32058       1.420990      15.38529       1.529842      14.91380       3.835725      151.6622 7.594158  147.5727 20.02196  4.089478       21.41378  
1 1 1 6  16 7  o 534.3026 7.557071  190.4847       5.380397      186.3764       6.894200      196.8851       8.605179      528.2443 9.794348  542.6121 11.90137  -14.36780      15.41336  
1 1 1 6  16 8  o 387.0904 6.203735  99.93626       3.199921      98.76324       4.149461      101.6574       5.026305      384.6705 8.095232  390.1178 9.668954  -5.447357      12.61037  
1 1 1 6  16 9  o 174.0924 5.501897  20.23112       1.274736      21.11054       2.297524      19.83999       1.532202      177.4911 9.751736  172.3218 6.685393  5.169296       11.82332  
1 1 1 6  16 10 o 109.6286 10.11816  8.100844       1.461415      7.205563       1.645070      11.45232       3.182896      103.0424 12.21860  129.0284 19.08761  -25.98607      22.66343  
1 1 1 6  16 11 o 544.6168 10.55012  198.3900       7.656355      201.5962       10.31996      194.4648       11.41866      547.9713 14.14522  537.6263 15.95665  10.34503       21.32374  
1 1 1 6  16 12 o 311.8680 6.611509  64.91303       2.747545      65.74376       3.647559      63.82348       4.177331      313.5354 8.739086  308.7123 10.16868  4.823059       13.40797  
1 1 1 6  16 13 o 47.43188 6.404289  1.528804       0.3944434     0.9907373      0.4518940     3.250542       0.8083549     37.74105 9.093702  69.14959 8.985075  -31.40854      12.78386  
1 1 1 6  16 14 o 102.9958 4.499238  7.088661       0.6160033     7.378055       0.6856536     5.877403       1.402743      105.0522 4.911681  92.89723 11.58281  12.15495       12.58118  
1 1 1 6  16 15 o 231.5629 6.260715  35.83609       1.930047      35.44174       2.631263      36.29535       2.839627      229.9700 8.601729  232.6337 9.178426  -2.663773      12.57908  
1 1 1 6  16 16 o 270.1998 5.899168  48.75982       2.123975      49.33389       2.652904      47.73482       3.544868      271.5085 7.339442  266.5605 9.997726  4.948059       12.40250  
1 1 1 6  16 17 o 68.65944 13.80536  3.298217       1.219220      3.284028       2.042439      3.306072       1.519688      68.62624 20.65308  68.35342 16.80481  0.2728271      26.62614  
1 1 1 6  16 18 o 89.77315 12.50199  5.545558       1.455026      2.914549       1.973558      8.678648       2.153651      65.05761 20.43564  112.1166 14.77482  -47.05901      25.21727  
1 1 1 6  16 19 o 178.6183 9.087078  21.49232       2.155730      21.54536       2.803807      21.41562       3.371384      178.1518 11.87880  176.8380 14.43277  1.313828       18.69253  
1 1 1 6  16 20 f 90.39124 6.546278  5.498965       0.7831439     4.236995       2.423604      5.646095       0.8275381     76.63063 22.35734  91.55824 6.832182  -14.92760      23.37797  
1 1 1 6  16 21 o 73.34804 8.522565  3.665958       0.8174837     10.90448       2.478919      2.782706       0.8659237     125.2174 15.16544  63.33273 10.63746  61.88466       18.52420  
1 1 1 6  16 22 o 81.71070 6.513812  4.505524       0.7033638     7.283153       3.462470      4.385971       0.7183414     97.72432 26.09761  80.57397 6.752617  17.15035       26.95706  
1 1 1 6  16 23 o 188.2001 4.546045  23.69119       1.140059      26.49612       4.827734      23.52553       1.173241      192.1121 19.11207  187.4576 4.700603  4.654572       19.68163  
1 1 1 6  16 24 o 51.25341 12.91096  1.887561       0.8811957     -0.4080907     4.645948      1.973228       0.8974869     60.98474 27.40265  52.39248 12.93427  8.592262       30.30183  
1 1 1 6  16 25 o 46.75328 18.83648  0.9918471      1.803562      -0.8844637     4.474027      1.355919       1.970788      57.29947 26.19613  50.43271 19.89639  6.866756       32.89534  
1 1 1 6  16 26 o 51.72291 10.41643  1.914459       0.6930619     -4.494168      5.016123      2.039181       0.6997734     50.86036 24.55625  53.48986 10.18973  -2.629501      26.58646  
1 1 1 6  16 27 o 68.18470 13.30805  3.447067       1.165719      5.801512       5.153386      3.320097       1.196739      76.19361 31.40617  66.58063 13.93685  9.612984       34.35962  
1 1 1 6  16 28 o 92.06067 7.328910  5.854744       0.8916402     -2.581749      2.822314      6.790141       0.9397715     38.67060 18.60746  99.26225 7.152978  -60.59164      19.93496  
1 1 1 6  16 29 o 69.58408 13.57011  3.701968       1.213038      3.244927       4.204184      3.743472       1.266920      61.19011 26.85272  69.60960 14.14160  -8.419487      30.34886  
1 1 1 6  16 30 o 53.31588 17.50954  2.401751       1.437592      2.390220       4.277684      2.403219       1.526369      56.35235 25.70650  53.15991 18.05386  3.192440       31.41283  
1 1 1 6  16 31 o 59.05449 17.61901  3.076908       1.491279      6.162856       3.390173      2.336525       1.660565      70.49700 26.53777  51.47675 18.71699  19.02025       32.47428  
1 1 1 6  17 0  o 337.7063 10.08499  76.28605       4.529083      76.28605       4.529083      76.28605       4.529083      337.7063 10.08499  337.7063 10.08499  -0.000000      0.000000  
1 1 1 6  17 1  o 519.1565 8.434596  179.9022       5.834936      188.1460       8.703069      173.1710       7.864235      530.3686 12.31462  508.9367 11.59629  21.43188       16.91520  
1 1 1 6  17 2  o 204.1476 1.842327  27.76966       0.5011692     27.83219       2.330986      27.76662       0.5131705     204.0094 8.593890  204.1360 1.886551  -0.1265411     8.798524  
1 1 1 6  17 3  o 415.0459 6.828078  114.9145       3.776314      111.9917       4.459957      122.3169       7.097718      409.6239 8.170938  427.4061 12.47583  -17.78217      14.91344  
1 1 1 6  17 4  o 319.7529 4.916385  68.16451       2.094758      71.47157       3.337393      66.01473       2.690814      327.2643 7.653060  314.5974 6.418818  12.66696       9.988521  
1 1 1 6  17 5  o 744.1469 11.80162  370.3961       11.70237      366.9237       14.06549      378.2055       21.09340      739.9823 14.26462  748.4162 21.17222  -8.433899      25.52924  
1 1 1 6  17 6  o 363.5300 8.804955  88.25111       4.265214      87.81490       4.736171      90.12306       9.811223      362.3979 9.816764  365.0360 20.24972  -2.638092      22.50378  
1 1 1 6  17 7  o 212.1437 6.916484  30.06155       1.952577      33.11897       2.778468      27.07829       2.744566      222.4517 9.394531  201.0076 10.28094  21.44408       13.92677  
1 1 1 6  17 8  o 257.2850 6.896861  44.20580       2.362368      40.92582       3.618798      46.64160       3.118529      247.0950 11.01845  264.0862 8.874582  -16.99126      14.14795  
1 1 1 6  17 9  o 575.2823 6.664288  220.8593       5.108675      220.1176       6.138933      222.5299       9.212936      574.1045 8.024693  576.4002 11.99501  -2.295715      14.43177  
1 1 1 6  17 10 o 77.69608 6.543467  4.057396       0.6711648     4.167569       0.7589705     3.662182       1.437488      78.66595 7.324598  72.44878 15.36703  6.217171       17.02338  
1 1 1 6  17 11 o 142.0896 6.427210  13.50411       1.213759      12.59865       1.504901      15.18939       2.053101      137.0507 8.279102  150.2781 10.31533  -13.22734      13.22685  
1 1 1 6  17 12 o 190.0367 6.905952  24.15181       1.745869      23.17932       2.495806      25.08367       2.443102      185.7620 10.12102  193.3527 9.511583  -7.590729      13.88903  
1 1 1 6  17 13 o 224.6761 3.816270  33.66094       1.142535      34.43739       1.322383      31.37458       2.269196      227.2227 4.367492  216.4700 7.879996  10.75270       9.009402  
1 1 1 6  17 14 o 154.1986 4.621688  15.87846       0.9485587     15.67775       1.280244      16.12275       1.412401      153.0690 6.290113  155.1688 6.847796  -2.099884      9.298271  
1 1 1 6  17 15 o 117.9032 3.913272  9.282564       0.6139559     8.950419       0.6824217     10.69314       1.406330      115.7349 4.433213  126.0769 8.419264  -10.34196      9.515114  
1 1 1 6  17 16 o 209.5193 6.033887  29.36207       1.682838      32.82489       2.549918      26.69010       2.239892      221.0920 8.672069  199.3705 8.450430  21.72154       12.10845  
1 1 1 6  17 17 o 192.7672 7.742179  24.93904       1.984657      24.49021       2.946625      25.31172       2.685036      190.1400 11.68641  193.6314 10.44507  -3.491348      15.67391  
1 1 1 6  17 18 o 79.07771 12.31281  4.329009       1.255209      0.6401159      2.277199      5.938951       1.504382      50.42071 20.83918  92.85688 12.47343  -42.43617      24.28699  
1 1 1 6  17 19 o 192.4260 10.16752  25.04008       2.597816      27.93131       3.659431      22.10278       3.688475      202.0864 13.66993  178.9390 15.62581  23.14737       20.76133  
1 1 1 6  17 20 o 72.46246 18.92254  3.800942       1.846596      1.165454       5.317640      4.162332       1.969137      72.51944 31.00663  75.71230 19.42423  -3.192863      36.58841  
1 1 1 6  17 21 o 126.2926 7.964049  10.77570       1.333424      13.60018       3.263901      10.20984       1.460900      138.2911 18.14971  122.6820 8.999078  15.60909       20.25822  
1 1 1 6  17 22 o 173.0739 8.852717  20.31113       2.034870      11.82811       4.124996      23.03935       2.339313      123.7663 25.84728  184.0944 9.569019  -60.32814      27.56171  
1 1 1 6  17 23 o 102.9001 7.462531  7.184585       1.016282      8.966804       4.547232      7.090882       1.042655      102.8281 30.78703  102.1597 7.716323  0.6684189      31.73930  
1 1 1 6  17 24 o 146.0076 4.847614  14.31859       0.9418341     10.57955       5.137818      14.44860       0.9580691     107.0346 32.86866  146.6546 4.909536  -39.61998      33.23330  
1 1 1 6  17 25 o 24.47921 11.41752  -0.7666717     0.9139675     5.232147       4.417159      -1.034986      0.9341838     77.52377 30.01689  23.45994 11.12598  54.06383       32.01252  
1 1 1 6  17 26 o 141.8689 2.036000  13.43564       0.3848917     8.923850       6.000219      13.45428       0.3856860     87.23671 34.62143  141.9669 2.038794  -54.73018      34.68141  
1 1 1 6  17 27 o 28.46177 12.87170  -0.3644886     1.044267      -25.88367      12.25503      -0.1778396     1.048079      53.50224 27.39465  29.68829 13.19960  23.81395       30.40882  
1 1 1 6  17 28 o 79.26959 7.852704  4.389374       0.8185778     -18.70317      8.114916      4.626766       0.8227745     45.46581 23.19789  81.48838 7.667353  -36.02257      24.43216  
1 1 1 6  17 29 o 25.44017 12.02285  -0.9423028     1.072821      -2.135815      3.629281      -0.8280280     1.123006      43.30194 20.90214  26.68521 12.51429  16.61673       24.36200  
1 1 1 6  17 30 o 19.43865 9.600889  -1.778836      0.9050642     4.928195       3.578112      -2.237291      0.9354855     63.97646 26.24850  18.56417 9.266981  45.41230       27.83632  
1 1 1 6  18 0  o 303.9654 9.717710  61.84014       3.926940      61.84014       3.926940      61.84014       3.926940      303.9654 9.717710  303.9654 9.717710  -0.000000      0.000000  
1 1 1 6  18 1  o 189.9717 7.479813  24.12515       1.889746      23.61615       2.467543      24.84714       2.938815      187.7169 9.899788  192.3654 11.51768  -4.648529      15.18759  
1 1 1 6  18 2  o 643.2034 9.490615  276.4508       8.134226      283.9659       10.26725      263.7824       13.33050      651.3579 11.82934  626.4075 15.98346  24.95038       19.88478  
1 1 1 6  18 3  o 643.1796 9.492542  276.4476       8.135576      274.6328       10.66185      278.9771       12.58728      640.3617 12.49492  644.7803 14.65030  -4.418640      19.25498  
1 1 1 6  18 4  f 335.6744 5.966243  75.16483       2.668657      72.68157       3.336121      79.57729       4.447051      329.9577 7.587698  344.9053 9.685655  -14.94760      12.30386  
1 1 1 6  18 5  o 403.0733 7.063840  108.4418       3.794009      112.0215       5.110288      104.0455       5.663306      409.3914 9.367702  394.1978 10.79173  15.19360       14.29039  
1 1 1 6  18 6  o 142.0874 6.471438  13.50041       1.222048      13.89601       2.403288      13.36246       1.419223      143.4239 12.70641  141.2626 7.567246  2.161316       14.78905  
1 1 1 6  18 7  o 102.0743 5.400452  6.969553       0.7319343     9.545045       2.290136      6.676548       0.7724480     118.2562 14.86063  99.86571 5.830048  18.39050       15.96333  
1 1 1 6  18 8  o 41.89041 11.55826  1.211849       0.6661746     2.397114       2.299769      1.103285       0.6960152     62.95557 22.12356  40.33784 12.03728  22.61773       25.18627  
1 1 1 6  18 9  o 340.7314 6.336405  77.50295       2.876925      73.50743       4.384732      80.52324       3.812245      331.2113 9.946189  347.0721 8.243044  -15.86078      12.91799  
1 1 1 6  18 10 o 330.9029 6.964361  73.14517       3.070827      74.51130       4.585437      72.03425       4.135015      333.2957 10.33720  327.8800 9.474239  5.415710       14.02209  
1 1 1 6  18 11 o 284.1730 7.071614  53.96398       2.677780      52.67902       4.088748      54.92905       3.543427      279.9715 10.98111  286.2431 9.302337  -6.271667      14.39160  
1 1 1 6  18 12 o 144.2127 7.148310  13.93726       1.369383      13.39862       1.875707      14.55200       2.003835      140.9873 10.05006  146.9177 10.30090  -5.930420      14.39140  
1 1 1 6  18 13 o 155.3325 3.077955  16.08683       0.6370859     15.99773       0.6654758     17.06468       2.204698      154.8965 3.224165  159.0659 10.45960  -4.169403      10.94525  
1 1 1 6  18 14 f 71.37260 2.098557  3.398118       0.1993672     3.489654       0.2029793     0.8946328      1.061521      72.32791 2.108318  40.57657 14.93105  31.75134       15.07916  
1 1 1 6  18 15 o 83.39102 2.465783  4.639838       0.2736972     3.923359       0.6910878     4.773120       0.2980691     76.26753 6.873863  84.57219 2.648204  -8.304657      7.366341  
1 1 1 6  18 16 o 183.5161 7.000525  22.58225       1.708760      22.66546       2.274174      22.47436       2.589525      183.4016 9.336375  182.3025 10.70706  1.099136       14.20595  
1 1 1 6  18 17 o 192.1340 5.371527  24.69355       1.373881      23.13386       1.541095      30.73346       3.032670      185.8330 6.232294  213.1564 10.71143  -27.32347      12.39258  
1 1 1 6  18 18 o 129.2678 6.907935  11.23075       1.185584      11.14207       1.639429      11.32796       1.716566      128.2244 9.666258  129.2084 10.04898  -0.9839935     13.94341  
1 1 1 6  18 19 o 103.1171 9.946766  7.247850       1.349799      6.550597       1.759058      8.246307       2.104988      96.89117 14.03259  108.6226 14.93825  -11.73143      20.49549  
1 1 1 6  18 20 o 219.9404 7.789970  32.59769       2.279438      28.22995       4.909100      33.79822       2.573710      199.3472 18.69898  223.6655 8.651808  -24.31830      20.60354  
1 1 1 6  18 21 o 98.74940 15.93425  6.974605       2.025361      5.645498       2.776059      8.487226       2.961514      85.82186 23.56118  106.4149 21.62342  -20.59306      31.97970  
1 1 1 6  18 22 o 125.0890 9.714373  10.72840       1.606542      5.875684       3.711923      11.84694       1.782102      85.20493 28.14291  131.2701 10.26979  -46.06513      29.95817  
1 1 1 6  18 23 o 92.07857 10.88654  5.924783       1.309937      5.921723       4.502284      5.925066       1.369169      83.30128 30.73292  91.86655 11.43134  -8.565277      32.79005  
1 1 1 6  18 24 o 68.94140 10.21907  3.353552       0.9104024     -2.568767      4.559171      3.599509       0.9291148     52.08691 24.66614  71.54204 10.02060  -19.45512      26.62388  
1 1 1 6  18 25 o 111.1488 7.324126  8.471465       1.078716      3.914503       8.263211      8.550470       1.088027      73.40482 34.26810  111.6551 7.353799  -38.25033      35.04826  
1 1 1 6  18 26 o 29.37672 11.41523  0.4378152      0.6405628     2.647163       6.109700      0.4132597      0.6441128     64.79211 29.97920  29.12525 11.40949  35.66687       32.07692  
1 1 1 6  18 27 o 49.05230 14.77215  1.873522       1.044627      -13.69804      6.268285      2.318347       1.059443      42.52887 21.56894  54.51670 14.37963  -11.98783      25.92283  
1 1 1 6  18 28 o 98.20704 2.496325  6.459041       0.3264113     2.343708       5.645630      6.472844       0.3269582     58.94885 27.77385  98.31167 2.497845  -39.36282      27.88594  
1 1 1 6  18 29 o 49.55462 23.32768  0.4989651      3.967461      -1.356763      6.958690      1.392729       4.829274      53.02488 26.26723  53.56069 25.37062  -0.5358124     36.51897  
1 1 1 6  19 0  o 56.01329 20.98371  2.832148       1.461040      2.832148       1.461040      2.832148       1.461040      56.01329 20.98371  56.01329 20.98371  0.000000       0.000000  
1 1 1 6  19 1  o 251.7501 7.089429  42.35069       2.375865      43.65245       2.826679      39.21771       4.385221      255.4532 8.315163  241.2673 13.69641  14.18585       16.02291  
1 1 1 6  19 2  o 311.2943 7.307243  64.71390       3.031086      66.61858       4.089354      62.39161       4.515457      315.4087 9.741560  304.9904 11.12938  10.41821       14.79057  
1 1 1 6  19 3  o 81.27707 8.539057  4.463870       0.9110121     3.195731       1.187137      6.280527       1.420869      67.79052 13.61517  96.16490 11.30389  -28.37438      17.69606  
1 1 1 6  19 4  o 122.5314 7.240647  10.06239       1.176950      11.04265       1.286404      5.026216       2.915781      128.3492 7.555027  84.69962 24.46763  43.64954       25.60749  
1 1 1 6  19 5  o 50.22585 15.57526  1.693882       1.150328      1.184778       1.754664      2.077613       1.523365      49.86617 19.01807  56.05067 17.99586  -6.184502      26.18278  
1 1 1 6  19 6  o 414.1155 12.71554  115.3213       7.008339      115.3683       9.434009      115.2634       10.46920      412.6302 17.19549  411.6235 19.13950  1.006714       25.72947  
1 1 1 6  19 7  o 543.0958 5.884255  196.8913       4.258350      206.8248       9.797531      194.5778       4.728313      554.4717 13.26062  539.7676 6.573943  14.70410       14.80070  
1 1 1 6  19 8  o 87.18870 8.960248  5.141798       1.026207      4.754943       1.390386      5.604710       1.520937      83.10384 12.97988  90.37041 13.00415  -7.266563      18.37350  
1 1 1 6  19 9  o 262.7744 7.626140  46.21606       2.667483      49.03795       3.771324      43.39098       3.773458      270.1411 10.49680  253.9393 11.17897  16.20172       15.33467  
1 1 1 6  19 10 o 134.4018 6.040627  12.08984       1.079069      12.23835       1.411127      11.88072       1.674524      135.0142 7.877779  132.7840 9.527263  2.230194       12.36237  
1 1 1 6  19 11 o 151.4614 10.38411  15.47939       2.083097      11.57629       2.832447      20.07742       3.074277      129.4250 16.82125  171.8976 13.53046  -42.47261      21.58768  
1 1 1 6  19 12 o 112.8207 8.724455  8.583939       1.301414      9.736599       1.485837      4.786069       2.697060      120.0961 9.358555  81.83289 23.49908  38.26318       25.29406  
1 1 1 6  19 13 o 142.9011 2.329745  13.61224       0.4436266     13.66432       0.4466128     9.756927       3.842672      143.1739 2.340960  115.5726 25.62449  27.60132       25.73120  
1 1 1 6  19 14 o 62.70897 3.245883  2.629757       0.2703058     2.605834       0.2716469     5.034733       2.723666      62.42005 3.277415  83.41548 23.50345  -20.99543      23.73086  
1 1 1 6  19 15 o 73.26448 5.545019  3.608474       0.5373207     3.868087       0.5640499     1.062384       1.766410      75.85983 5.619885  48.53736 18.92906  27.32246       19.74570  
1 1 1 6  19 16 o 248.0984 6.815607  41.26706       2.251077      41.32317       3.344851      41.22061       3.043458      247.3265 10.17092  247.3119 9.251562  0.1458740E-01  13.74915  
1 1 1 6  19 17 o 249.9383 5.743696  41.80375       1.912924      43.30198       2.509320      39.72504       2.955732      253.8989 7.424862  242.6603 9.157412  11.23857       11.78926  
1 1 1 6  19 18 o 106.9248 8.008842  7.734002       1.132803      5.047410       1.758523      9.639611       1.481031      84.05767 16.28821  119.1216 9.406690  -35.06395      18.80935  
1 1 1 6  19 19 o 98.19550 9.701016  6.593871       1.252786      7.208652       3.223716      6.484509       1.359655      96.94678 24.84351  97.10641 10.68401  -0.1596375     27.04345  
1 1 1 6  19 20 o 197.4163 9.441776  26.52566       2.476563      22.82295       3.408832      30.66472       3.604100      180.6368 14.27808  210.4019 12.91731  -29.76505      19.25410  
1 1 1 6  19 21 o 79.84929 18.07452  4.765411       1.878184      4.419186       3.061014      4.974464       2.378559      75.41566 25.56709  80.12564 21.73253  -4.709976      33.55561  
1 1 1 6  19 22 o 178.0832 11.51025  22.10606       2.716744      22.61479       3.812475      21.58123       3.872336      176.2030 16.42680  171.4285 17.18324  4.774567       23.77190  
1 1 1 6  19 23 o 121.7189 10.15105  10.33274       1.631452      11.37278       3.546303      10.05353       1.837435      117.4240 23.48549  119.1792 11.72164  -1.755257      26.24814  
1 1 1 6  19 24 o 30.49398 13.14304  0.5765679E-01  0.9698799     -11.23079      6.271166      0.3342794      0.9816914     46.60965 23.37321  32.88677 13.64562  13.72288       27.06492  
1 1 1 6  19 25 o 90.51404 9.874362  5.813511       1.171672      0.4237251      5.374181      6.082484       1.200552      58.29650 27.35061  92.59921 9.882272  -34.30271      29.08118  
1 1 1 6  19 26 o 18.81721 9.304526  -1.795830      0.8586717     -6.324866      4.683590      -1.638305      0.8734770     42.88964 21.29881  19.60444 9.633966  23.28520       23.37633  
1 1 1 6  19 27 o 56.77848 11.85996  2.433003       0.8683210     11.16962       6.512765      2.274892       0.8761430     80.29227 34.32187  54.61586 12.33165  25.67642       36.47000  
1 1 1 6  19 28 o 52.90778 7.659072  1.988307       0.5242805     9.478427       6.289482      1.935897       0.5261116     72.15533 32.19162  52.12961 7.814422  20.02573       33.12651  
1 1 1 6  20 0  o 67.98752 24.03303  4.091106       1.978445      4.091106       1.978445      4.091106       1.978445      67.98752 24.03303  67.98752 24.03303  0.000000       0.000000  
1 1 1 6  20 1  o 329.7071 7.188602  72.64484       3.158248      68.30418       5.280800      75.06196       3.940671      318.5107 12.46642  334.7751 8.841455  -16.26437      15.28342  
1 1 1 6  20 2  o 329.3545 7.228106  72.49506       3.172208      76.06795       4.236411      67.93489       4.786068      336.8762 9.446768  317.9227 11.31559  18.95349       14.74055  
1 1 1 6  20 3  o 394.5945 6.437431  103.9991       3.384832      104.1899       4.301728      103.6889       5.484712      394.6540 8.179993  393.0607 10.48114  1.593292       13.29536  
1 1 1 6  20 4  o 140.0429 4.435081  13.09578       0.8265864     13.86090       1.454752      12.73100       1.004489      143.7763 7.620472  137.9955 5.473552  5.780823       9.382504  
1 1 1 6  20 5  o 209.8623 7.038511  29.47052       1.965503      30.31675       2.424480      27.84803       3.357111      212.6376 8.574259  203.0532 12.46756  9.584381       15.13135  
1 1 1 6  20 6  o 140.8260 14.56991  13.53934       2.694650      0.000000       0.000000      13.53934       2.694650      ?        ?         140.8260 14.56991  0.000000       14.56991  
1 1 1 6  20 7  o 243.7096 7.873330  39.78837       2.553490      40.54626       3.514703      38.94115       3.716066      245.4442 10.77262  240.3241 11.63874  5.120132       15.85905  
1 1 1 6  20 8  o 194.5496 6.396244  25.32306       1.655915      25.12922       2.187612      25.58315       2.534027      193.4934 8.505363  195.0068 9.783116  -1.513382      12.96343  
1 1 1 6  20 9  o 427.6731 6.955010  122.3410       3.963539      120.7968       5.665788      123.8209       5.546692      424.0708 10.02648  429.4603 9.692538  -5.389526      13.94545  
1 1 1 6  20 10 o 281.1400 7.458563  52.95382       2.791692      51.92012       3.390383      55.13051       4.919805      277.9883 9.165218  285.2816 12.97595  -7.293243      15.88636  
1 1 1 6  20 11 o 103.7840 14.89575  7.464340       2.001032      9.362000       3.241186      6.295553       2.543680      114.2333 22.09213  93.58591 20.92360  20.64742       30.42793  
1 1 1 6  20 12 o 147.9904 10.55309  14.82761       2.067414      13.90128       2.430815      17.24971       3.930660      142.6970 12.92390  156.9906 19.18794  -14.29362      23.13448  
1 1 1 6  20 13 o 175.1845 6.830631  20.58114       1.591464      20.98155       1.775152      18.94121       3.592488      176.7555 7.554259  165.4392 16.51660  11.31627       18.16218  
1 1 1 6  20 14 o 101.9422 1.789083  6.926523       0.2430290     6.944236       0.2440930     4.908081       2.605635      102.0724 1.794625  82.03685 22.94362  20.03553       23.01370  
1 1 1 6  20 15 o 41.19839 10.70386  1.190115       0.5928659     1.504236       0.6179487     -2.445316      2.102239      46.31165 10.28166  35.01017 16.62877  11.30148       19.55066  
1 1 1 6  20 16 o 212.9936 5.454502  30.37752       1.546813      32.60253       1.757978      22.74898       3.255127      220.5493 5.987372  181.8905 13.52710  38.65875       14.79294  
1 1 1 6  20 17 o 165.7147 6.786892  18.46998       1.495497      18.31404       1.955475      18.68969       2.321125      164.4411 8.958007  165.5995 10.57404  -1.158340      13.85843  
1 1 1 6  20 18 o 31.50030 9.279270  0.6837792      0.4157683     0.4783241E-01  1.010201      0.8134703      0.4561972     31.78951 13.55100  34.15654 9.617257  -2.367029      16.61690  
1 1 1 6  20 19 o 135.0808 6.931778  12.32719       1.243532      10.05244       1.893312      14.05298       1.649109      120.2671 11.97301  143.7118 8.651657  -23.44469      14.77174  
1 1 1 6  20 20 o 158.0274 9.418264  17.11521       1.974250      13.88261       3.020797      19.52544       2.608403      138.1594 16.75014  167.5503 11.75768  -29.39082      20.46485  
1 1 1 6  20 21 o 104.7252 17.57679  8.229509       2.365998      0.1167526      4.271678      11.81981       2.841711      58.16251 26.19306  125.9947 17.38916  -67.83223      31.43977  
1 1 1 6  20 22 o 108.3353 15.22043  8.688917       2.136693      10.36544       5.010616      8.316289       2.362241      100.2249 32.67550  104.2492 17.63314  -4.024269      37.12972  
1 1 1 6  20 23 f 47.67672 18.60425  1.444329       1.707110      2.206491       2.458776      0.7350155      2.371997      55.87882 22.16708  47.47210 20.50776  8.406727       30.19847  
1 1 1 6  20 24 o 27.52903 12.95274  -1.026665      1.220482      0.9972610      3.338526      -1.338878      1.311244      52.68810 23.48354  27.46227 13.06915  25.22582       26.87525  
1 1 1 6  20 25 o 37.99920 15.00121  0.8209813      1.120998      -3.740937      5.113122      1.051326       1.148951      48.40754 23.68915  40.32061 15.38649  8.086926       28.24747  
1 1 1 6  20 26 o 63.57652 11.28504  3.005665       0.9210191     -8.415292      4.857017      3.431660       0.9380386     40.29026 20.25422  68.39867 10.63763  -28.10841      22.87778  
1 1 1 6  20 27 o 29.58586 12.04701  0.3826336      0.7466957     -4.362413      5.911784      0.4595599      0.7527241     47.63236 23.69982  30.46020 12.20461  17.17216       26.65772  
1 1 1 6  21 0  o 234.7923 9.730500  37.04766       3.032421      37.04766       3.032421      37.04766       3.032421      234.7923 9.730500  234.7923 9.730500  0.000000       0.000000  
1 1 1 6  21 1  o 171.5182 6.880994  19.70160       1.569468      26.91776       3.384792      17.72518       1.771406      199.3757 12.80824  162.4912 8.207737  36.88457       15.21243  
1 1 1 6  21 2  o 194.8921 6.332491  25.41030       1.642349      22.66264       2.472178      27.58092       2.197309      183.4381 10.15346  202.7886 8.148156  -19.35051      13.01865  
1 1 1 6  21 3  o 268.2016 8.521631  48.24440       3.041629      49.74066       3.716571      45.20967       5.292974      271.9278 10.27537  257.6555 15.48804  14.27225       18.58662  
1 1 1 6  21 4  o 138.9494 0.6323965 12.86385       0.1170900     9.608769       1.556157      12.88239       0.1174229     119.2278 9.883684  139.0495 0.6337380 -19.82166      9.903981  
1 1 1 6  21 5  o 294.4814 7.318509  58.03312       2.871799      58.10836       3.410689      57.84983       5.323288      294.2770 8.707435  292.0988 13.71485  2.178131       16.24551  
1 1 1 6  21 6  o 287.2520 7.210474  55.25618       2.757763      60.37186       3.772141      49.38250       4.041957      299.7215 9.456716  270.5545 11.23595  29.16702       14.68591  
1 1 1 6  21 7  o 319.6068 7.708832  68.42236       3.283054      68.00549       4.736663      68.80779       4.554569      317.4974 11.21350  319.5399 10.71181  -2.042542      15.50760  
1 1 1 6  21 8  o 198.8630 8.596061  26.58097       2.272480      30.31816       3.346344      23.38244       3.095803      211.5792 11.91745  185.5405 12.59632  26.03874       17.34050  
1 1 1 6  21 9  o 25.12581 11.90927  -1.268536      1.067422      -1.097983      1.361150      -1.540952      1.720259      30.55035 14.14072  33.62812 15.67783  -3.077774      21.11289  
1 1 1 6  21 10 o 162.5415 5.724177  17.68464       1.237863      17.03331       1.520717      18.96371       2.131064      159.3022 7.182435  167.6380 9.579932  -8.335846      11.97341  
1 1 1 6  21 11 o 112.1223 12.54874  8.623233       1.842725      8.532392       3.117032      8.672039       2.284729      108.4396 22.31603  111.5279 15.81681  -3.088310      27.35282  
1 1 1 6  21 12 f 335.7983 10.36907  76.17287       4.634160      78.07439       7.423917      74.95894       5.931736      336.3887 16.61361  331.5603 13.45392  4.828430       21.37802  
1 1 1 6  21 13 o 106.3751 8.349694  7.654240       1.174063      7.644712       1.345107      7.684718       2.405833      106.0484 9.623408  103.8705 18.03593  2.177872       20.44272  
1 1 1 6  21 14 o 159.9282 3.207582  17.06690       0.6835596     16.99942       0.6909205     20.18329       4.695388      159.6086 3.248615  167.3054 21.56228  -7.696793      21.80563  
1 1 1 6  21 15 o 51.41390 2.306534  1.766298       0.1576183     1.750089       0.1579098     6.145628       2.595628      51.17600 2.321677  90.83921 21.73487  -39.66321      21.85852  
1 1 1 6  21 16 o 214.6416 4.983356  30.84308       1.425310      31.17262       1.471244      25.81134       5.748919      215.7571 5.117362  185.9256 23.74579  29.83142       24.29094  
1 1 1 6  21 17 o 93.82599 8.610150  6.011205       1.064492      5.860679       1.338687      6.270057       1.755491      91.88459 11.16228  93.85904 14.50321  -1.974449      18.30136  
1 1 1 6  21 18 o 90.35312 13.83364  5.825955       1.612603      5.094586       1.950028      7.408088       2.868099      82.49229 18.22639  97.45050 22.53642  -14.95821      28.98433  
1 1 1 6  21 19 o 107.1906 5.114172  7.735754       0.7283681     7.669137       2.275709      7.743358       0.7688102     101.4497 17.46414  107.1793 5.400529  -5.729652      18.28009  
1 1 1 6  21 20 o 93.78619 6.814264  5.992599       0.8457824     7.606247       3.146961      5.866966       0.8780903     94.75298 24.68220  92.68513 7.165371  2.067841       25.70123  
1 1 1 6  21 21 o 91.03128 12.43987  5.988584       1.469532      2.515345       3.770769      6.610562       1.595697      62.31816 26.35675  95.45239 12.87344  -33.13424      29.33264  
1 1 1 6  21 22 o 48.20729 14.99640  1.758482       1.065477      4.152447       3.380930      1.494508       1.122684      67.77283 26.25569  45.28308 15.48147  22.48976       30.48011  
1 1 1 6  21 23 o 21.26379 9.445266  -0.1423276     0.5354094     -4.914318      5.322999      -0.9355508E-01 0.5381385     48.36494 23.77040  21.77659 9.580090  26.58835       25.62831  
1 1 1 6  21 24 o 25.50083 10.86112  0.8809458E-01  0.6479923     -2.783977      2.350141      0.3244071      0.6741236     33.90114 16.47190  28.34839 11.48208  5.552755       20.07889  
1 1 1 6  21 25 o 22.10726 8.076960  0.2873228      0.3097620     -0.7652209     3.172080      0.2974565      0.3112496     44.21072 20.82646  22.32777 8.105507  21.88295       22.34817  
1 1 1 6  21 26 f 40.90044 12.35451  1.283103       0.7298830     2.283916       5.249912      1.263377       0.7370408     56.40173 26.63733  40.60793 12.44522  15.79380       29.40121  
1 1 1 6  22 0  o 157.4947 8.741989  16.73715       1.821619      16.73715       1.821619      16.73715       1.821619      157.4947 8.741989  157.4947 8.741989  0.000000       0.000000  
1 1 1 6  22 1  o 65.04013 14.64953  2.985371       1.239032      4.515953       1.869315      1.785993       1.654750      79.61428 18.03950  53.64779 18.77285  25.96649       26.03542  
1 1 1 6  22 2  o 190.2120 7.728628  24.28231       1.954828      21.78235       3.333800      25.59225       2.413231      178.5965 14.12344  194.9668 9.315858  -16.37030      16.91912  
1 1 1 6  22 3  f 205.9378 8.334306  28.49149       2.282343      29.57414       3.726465      27.84157       2.887232      208.4480 13.48851  203.0257 10.71016  5.422256       17.22346  
1 1 1 6  22 4  o 223.0936 5.293202  33.25182       1.573545      38.51373       2.792685      30.80421       1.904676      239.3660 8.770427  214.4497 6.673460  24.91638       11.02068  
1 1 1 6  22 5  o 204.8674 7.051799  28.13653       1.922199      26.84383       2.565717      29.79036       2.902048      199.5550 9.677639  210.0609 10.40012  -10.50587      14.20631  
1 1 1 6  22 6  o 329.2831 6.933755  72.60353       3.042366      70.78214       4.661517      73.95509       4.015506      323.7944 10.81919  331.6160 9.095815  -7.821625      14.13466  
1 1 1 6  22 7  o 292.6468 6.952132  57.35908       2.711036      59.51936       3.382679      53.47973       4.532999      297.5929 8.539137  280.8304 12.14214  16.76248       14.84414  
1 1 1 6  22 8  o 237.9271 6.706912  37.93930       2.124255      39.28026       3.399170      37.08001       2.721038      241.0453 10.60879  234.7407 8.714193  6.304520       13.72893  
1 1 1 6  22 9  o 84.04339 10.47428  4.838653       1.147620      5.568282       1.310115      2.432502       2.379140      90.09232 11.15092  62.49810 22.44670  27.59423       25.06386  
1 1 1 6  22 10 o 60.00919 11.12529  2.512286       0.8568662     3.109343       1.006026      0.9346674      1.635319      66.79113 11.73145  46.23237 18.15917  20.55876       21.61903  
1 1 1 6  22 11 f 168.3410 9.725341  19.19367       2.172279      21.06988       2.965487      17.02122       3.191029      175.3920 12.77619  156.5191 15.50343  18.87289       20.08949  
1 1 1 6  22 12 o 185.7312 9.865883  23.39459       2.432952      27.40643       3.642841      20.16415       3.268883      199.4466 13.79186  170.6326 14.51448  28.81404       20.02213  
1 1 1 6  22 13 o 87.87389 8.904346  5.266966       1.028266      6.625583       1.155019      0.7608800E-01  2.257673      98.66182 8.880430  46.53273 20.05410  52.12909       21.93237  
1 1 1 6  22 14 o 104.0763 4.984817  7.268780       0.6893029     7.346214       0.6982120     4.292418       4.328754      104.6247 5.022846  78.87704 29.92093  25.74769       30.33960  
1 1 1 6  22 15 o 221.8884 1.472330  32.81910       0.4353246     32.81701       0.4361832     33.34631       6.941402      221.8812 1.475282  207.9211 25.59331  13.96005       25.63579  
1 1 1 6  22 16 o 73.84747 9.133936  3.765347       0.8796676     3.498474       0.9104398     7.514249       3.412332      70.92596 9.902838  96.15929 26.00867  -25.23334      27.83015  
1 1 1 6  22 17 o 69.26665 1.303897  3.198287       0.1203486     3.198293       0.1205916     3.196782       1.896616      69.26663 1.306530  64.77518 19.98437  4.491447       20.02703  
1 1 1 6  22 18 o 61.73719 11.75058  2.741103       0.9313703     3.069175       1.183267      2.206839       1.509997      64.50040 14.15649  54.65451 17.94484  9.845882       22.85659  
1 1 1 6  22 19 o 93.93611 10.70679  6.229815       1.316290      7.782462       1.591893      2.873445       2.340520      104.6116 11.61542  61.02498 22.21624  43.58662       25.06948  
1 1 1 6  22 20 o 54.58814 4.133339  2.013070       0.2984238     2.735210       3.574651      2.008002       0.2994692     61.90427 25.88977  54.51528 4.153770  7.388988       26.22087  
1 1 1 6  22 21 o 26.72931 11.72947  -0.8328392E-01 0.8020943     -1.284252      4.669629      -0.4677289E-01 0.8141955     52.48705 24.88718  27.21204 11.88240  25.27502       27.57831  
1 1 1 6  22 22 o 47.04370 11.31378  1.645069       0.7004993     -0.9659903     3.140667      1.781763       0.7186016     44.90611 21.01687  49.01183 11.24260  -4.105721      23.83495  
1 1 1 6  22 23 o 29.90534 11.98824  0.4084757      0.7266449     -0.8785657     3.272147      0.4752385      0.7452533     45.11520 21.22144  30.85603 12.21562  14.25918       24.48614  
1 1 1 6  22 24 o 35.36370 15.63140  0.1097318      1.448794      -0.1516313     3.881915      0.1520288      1.561631      48.72610 22.97977  36.62599 16.20715  12.10011       28.12013  
1 1 1 6  22 25 o 78.16886 16.57269  5.077041       1.672598      7.850132       2.802262      3.542358       2.084663      88.94635 23.35089  60.95182 21.08633  27.99453       31.46263  
1 1 1 6  23 0  o 55.22264 20.83758  2.788811       1.435782      2.788811       1.435782      2.788811       1.435782      55.22264 20.83758  55.22264 20.83758  0.000000       0.000000  
1 1 1 6  23 1  o 110.6664 8.947033  8.286932       1.308135      7.607391       1.571145      9.822486       2.361788      105.4949 11.35525  118.9497 15.25105  -13.45490      19.01411  
1 1 1 6  23 2  o 42.06572 16.61701  0.7168421      1.376275      1.454107       2.902990      0.5030918      1.563102      59.71610 23.95375  42.46572 17.37749  17.25038       29.59323  
1 1 1 6  23 3  o 165.7916 9.995207  18.59422       2.197891      18.62143       3.891338      18.58147       2.663410      163.1239 18.21264  165.1313 12.19011  -2.007401      21.91573  
1 1 1 6  23 4  o 159.4008 1.873894  16.93596       0.3980239     14.85252       1.834705      17.03886       0.4077343     148.2403 9.335495  159.8829 1.913823  -11.64255      9.529648  
1 1 1 6  23 5  o 140.0979 9.671268  13.29092       1.794383      13.82198       2.477013      12.70448       2.602950      141.9023 13.25311  135.5545 14.64258  6.347809       19.74968  
1 1 1 6  23 6  o 149.3999 9.170551  15.08972       1.816861      15.49151       2.404338      14.55488       2.773982      150.5929 12.08299  145.1398 14.53863  5.453064       18.90425  
1 1 1 6  23 7  o 254.3043 7.057741  43.41664       2.389312      44.05002       3.439890      42.82621       3.321227      255.1309 10.13850  251.6380 9.924334  3.492920       14.18737  
1 1 1 6  23 8  o 139.1907 6.938611  13.03142       1.282877      11.58429       1.970898      14.09530       1.689874      130.1234 11.48448  144.3622 8.826902  -14.23882      14.48473  
1 1 1 6  23 9  o 39.80146 15.88953  0.6071121      1.271164      0.1972666      1.499381      1.654510       2.396943      39.41310 16.64224  56.80175 22.07901  -17.38865      27.64863  
1 1 1 6  23 10 o 51.55347 13.10860  1.892296       0.9023863     2.177667       1.008202      0.7428853      2.023396      55.21228 13.75487  48.08573 19.73482  7.126545       24.05535  
1 1 1 6  23 11 o 45.82035 16.51551  1.279422       1.289281      0.8878143      1.928321      1.596004       1.733791      48.00756 19.42871  51.65836 19.06926  -3.650806      27.22336  
1 1 1 6  23 12 o 167.6716 12.40913  19.44096       2.752870      19.20435       4.147532      19.62728       3.680473      162.3969 19.55968  165.9663 16.87666  -3.569397      25.83414  
1 1 1 6  23 13 o 110.0266 9.120192  8.278647       1.325132      9.417968       1.500374      4.238205       2.825471      117.2109 9.692920  74.52294 24.55088  42.68797       26.39505  
1 1 1 6  23 14 o 116.3574 5.404727  9.111359       0.8357053     9.565387       0.8768437     4.610458       2.760772      119.1984 5.535614  76.50819 24.18857  42.69022       24.81391  
1 1 1 6  23 15 o 72.22429 7.102976  3.562175       0.6747575     3.645109       0.6905755     1.813785       3.170756      73.04678 7.187745  59.68581 24.62166  13.36098       25.64936  
1 1 1 6  23 16 o 90.62700 6.361808  5.577276       0.7633858     5.425524       0.7851319     8.203451       3.266158      89.30296 6.645499  98.90108 24.82471  -9.598122      25.69881  
1 1 1 6  23 17 o 108.8851 10.99643  8.363712       1.573649      9.366076       1.811113      5.275443       3.179001      114.6714 12.03166  77.36008 26.05567  37.31128       28.69945  
1 1 1 6  23 18 o 18.71696 7.837738  0.5228866E-01  0.3282355     0.4740018E-01  0.3306592     0.3820809      2.715899      18.70855 7.852546  48.36725 21.38947  -29.65870      22.78534  
1 1 1 6  23 19 o 51.99179 1.816748  1.806314       0.1256710     1.808474       0.1257078     -1.881019      5.193594      52.02295 1.816187  53.79488 25.71371  -1.771931      25.77777  
1 1 1 6  23 20 o 30.16346 14.77119  -3.086919      1.998288      -4.954242      2.739642      -0.9640576     2.921090      33.10485 16.41376  43.83184 20.43318  -10.72699      26.20928  
1 1 1 6  23 21 o 14.61490 7.105465  -0.7330441     0.4391261     1.247662       3.861383      -0.7589958     0.4419935     54.43890 24.67249  14.54403 7.083989  39.89488       25.66933  
1 1 1 6  23 22 o 56.69480 7.927254  2.273556       0.5825318     0.1036205      3.433597      2.337865       0.5911009     48.25761 22.37929  57.50476 7.924553  -9.247150      23.74092  
1 1 1 6  23 23 o 17.45872 7.868373  -0.1624506     0.3863108     -0.3881961     2.916834      -0.1584201     0.3897441     43.63232 20.36606  17.58746 7.916847  26.04486       21.85069  
1 1 1 6  24 0  o 21.32230 14.55697  -0.7560341     1.289303      -0.7560341     1.289303      -0.7560341     1.289303      21.32230 14.55697  21.32230 14.55697  0.000000       0.000000  
1 1 1 6  24 1  o 47.52358 16.36945  1.449418       1.255812      1.143538       1.842257      1.714930       1.716390      49.37688 19.30953  52.88476 19.05655  -3.507881      27.12950  
1 1 1 6  24 2  o 97.62167 10.67333  6.533620       1.365817      8.001882       2.066370      5.394481       1.820098      106.8487 14.91949  86.95107 16.30784  19.89766       22.10287  
1 1 1 6  24 3  o 100.3849 12.70603  6.985474       1.661607      5.515984       3.175967      7.539291       1.949736      85.59842 25.75273  103.7674 14.49573  -18.16900      29.55214  
1 1 1 6  24 4  o 104.5944 9.415712  7.451463       1.298274      6.798208       1.491593      9.492997       2.636862      99.33128 11.48018  115.3139 17.72729  -15.98261      21.11992  
1 1 1 6  24 5  o 227.9220 6.496716  34.88758       1.971107      33.12611       2.506588      37.74186       3.190757      221.4596 8.509887  235.7266 10.18209  -14.26695      13.27001  
1 1 1 6  24 6  f 91.80753 14.24962  5.940108       1.686747      6.781586       2.478163      5.213781       2.302367      95.98473 20.02431  83.73813 20.74224  12.24660       28.83077  
1 1 1 6  24 7  o 144.2204 8.573357  14.09904       1.640162      14.62090       1.935733      12.77081       3.088223      146.4354 9.979966  133.5262 17.79972  12.90918       20.40661  
1 1 1 6  24 8  o 151.8903 7.668947  15.59378       1.547148      13.98423       2.103574      17.49040       2.283475      142.6727 11.15338  159.7972 10.78713  -17.12456      15.51644  
1 1 1 6  24 9  o 104.3015 6.590669  7.345954       0.9113120     6.447397       1.048101      10.13017       1.844939      97.33284 8.156023  121.0228 11.58153  -23.68999      14.16519  
1 1 1 6  24 10 f 112.9389 7.714962  8.658560       1.154077      7.591286       1.287240      13.03116       2.605501      105.2743 9.270827  135.7260 14.63758  -30.45173      17.32648  
1 1 1 6  24 11 o 39.24202 16.10917  0.4971299      1.348636      0.4093489      2.093871      0.5593630      1.763034      45.93060 19.54179  43.81544 18.24236  2.115150       26.73322  
1 1 1 6  24 12 o 214.3596 8.769039  31.36135       2.499485      29.02683       4.046075      32.80206       3.178509      201.4972 15.18089  217.7713 10.98892  -16.27414      18.74075  
1 1 1 6  24 13 o 133.5462 10.02466  12.33968       1.770896      14.26398       2.632316      10.74866       2.393531      141.1150 14.19129  121.8029 15.06816  19.31213       20.69884  
1 1 1 6  24 14 o 161.3083 6.534776  17.64104       1.401719      17.28719       1.456230      22.10365       5.171532      159.5367 6.866161  164.1418 24.38408  -4.605194      25.33235  
1 1 1 6  24 15 o 45.95183 17.48025  1.317926       1.479972      0.8218421      1.645962      3.412046       3.381760      43.40225 17.80450  66.13982 26.07233  -22.73756      31.57162  
1 1 1 6  24 16 o 87.05248 7.258466  5.207707       0.8343206     5.930663       0.8828468     -0.8316206     2.551666      92.96300 7.182582  42.52430 19.56753  50.43870       20.84413  
1 1 1 6  24 17 o 62.64194 9.392177  2.784928       0.7598427     2.706258       0.7736886     4.924085       4.034431      61.59249 9.751160  71.53893 28.38992  -9.946445      30.01787  
1 1 1 6  24 18 o 46.49205 19.13593  1.179841       1.909573      2.179440       2.082047      -4.114687      4.791717      53.82949 20.66978  47.54692 23.19542  6.282566       31.06875  
1 1 1 6  24 19 o 29.96969 10.11025  0.6081069      0.4786380     0.5844203      0.4808823     3.128008       4.959983      29.58966 10.13174  62.90150 28.28464  -33.31184      30.04451  
1 1 1 6  24 20 o 52.42371 21.49056  2.044579       2.395948      2.963264       2.732901      -1.007056      4.980889      58.14198 23.26898  51.87383 24.89798  6.268150       34.07866  
1 1 1 6  24 21 o 56.29427 5.192001  2.170547       0.3850833     2.178155       0.3877139     1.615637       3.311377      56.38554 5.219473  52.29191 23.34203  4.093628       23.91847  
1 1 1 6  25 0  o 32.97350 20.20565  0.7017876      1.700988      0.7017876      1.700988      0.7017876      1.700988      32.97350 20.20565  32.97350 20.20565  0.000000       0.000000  
1 1 1 6  25 1  f 78.41064 14.40402  4.395568       1.449542      3.648364       2.577975      4.741020       1.752883      70.44105 23.45990  80.61980 16.85997  -10.17875      28.88988  
1 1 1 6  25 2  o 86.04054 13.03121  5.214959       1.447317      4.965271       2.866951      5.300356       1.676649      80.27103 24.53462  85.97008 15.19142  -5.699043      28.85701  
1 1 1 6  25 3  o 79.89369 14.66682  4.575991       1.503905      6.060261       1.951285      2.404263       2.360298      91.42552 16.62935  60.70116 22.27642  30.72436       27.79882  
1 1 1 6  25 4  o 102.6090 8.953134  7.194737       1.211901      8.365203       1.434463      4.276018       2.265198      110.4187 9.852689  75.03296 21.53231  35.38579       23.67944  
1 1 1 6  25 5  o 95.05959 10.17757  6.234661       1.269138      5.606788       1.583503      7.362395       2.122202      88.81397 13.83041  100.8966 16.34330  -12.08266      21.40989  
1 1 1 6  25 6  o 93.92452 10.23075  6.098170       1.259772      4.723015       1.743558      7.600200       1.822216      80.07419 16.87383  103.6895 13.50929  -23.61529      21.61544  
1 1 1 6  25 7  o 33.97991 15.36041  -0.6180755     1.485162      -4.652550      3.030119      0.6575809      1.703856      37.96783 18.50531  43.89292 18.07198  -5.925087      25.86587  
1 1 1 6  25 8  o 96.31299 10.36918  6.436862       1.309828      5.567574       1.917415      7.197453       1.793536      86.57603 17.22672  100.4686 13.75795  -13.89261      22.04634  
1 1 1 6  25 9  o 127.2951 8.962346  11.11538       1.510505      12.64583       1.895036      8.448859       2.501386      135.0548 10.61540  106.1280 18.35173  28.92683       21.20078  
1 1 1 6  25 10 o 93.39912 6.390288  5.918697       0.7905192     5.366082       0.8820677     8.174014       1.781945      88.59278 7.543564  107.2428 12.71684  -18.64998      14.78592  
1 1 1 6  25 11 o 42.28544 17.47679  0.6617551      1.601629      3.396320       2.437559      -1.415778      2.124638      65.69007 22.79739  37.35142 17.41689  28.33865       28.68918  
1 1 1 6  25 12 o 46.86227 17.28744  1.449312       1.424518      0.7257776      1.769689      2.780985       2.400856      43.87352 18.27246  60.69141 22.43334  -16.81788      28.93333  
1 1 1 6  25 13 o 45.56428 16.64897  1.398790       1.316211      0.4658554      1.471560      5.130746       2.943206      39.30785 16.53626  76.08109 25.05683  -36.77324      30.02154  
1 1 1 6  25 14 o 98.38683 7.206396  6.645466       0.9382221     7.432948       0.9961869     0.4633259      2.791194      104.0707 7.228466  48.96598 21.66766  55.10476       22.84159  
1 1 1 6  25 15 o 46.93140 10.00516  1.595950       0.6065650     1.824795       0.6221870     -2.790302      2.723940      50.39476 9.616090  37.77456 18.20261  12.62021       20.58650  
1 1 1 6  25 16 o 35.27547 14.22291  0.5767863      1.029121      0.2975097      1.055102      6.038946       4.666156      33.21234 13.98881  74.50603 30.19730  -41.29369      33.28008  
1 1 1 6  25 17 o 27.76919 12.07918  -0.1091056E-02 0.8345292     -0.1476370     0.8458071     5.384450       5.127422      26.82165 11.89511  70.04839 30.20551  -43.22673      32.46331  
1 1 1 6  25 18 o 19.59461 9.834794  -3.016823      1.122479      -2.863894      1.140824      -7.657568      6.284461      20.20722 10.10927  47.44683 23.73527  -27.23961      25.79846  
1 1 1 6  25 19 o 51.28210 21.70901  1.835246       2.562029      -0.5076168     3.640507      4.134220       3.606247      47.34653 22.30601  63.14996 26.17384  -15.80342      34.38935  
1 1 1 6  25 20 o 37.88148 18.28260  -2.237309      2.773798      0.8010070      3.330285      -9.119186      5.012084      49.35557 22.57821  40.00932 20.17227  9.346252       30.27699  
1 1 1 6  26 0  o 63.54342 27.28602  4.150896       2.365519      4.150896       2.365519      4.150896       2.365519      63.54342 27.28602  63.54342 27.28602  0.000000       0.000000  
1 1 1 6  26 1  o 115.1767 10.86600  9.228403       1.647952      8.982323       2.283781      9.495730       2.380329      111.0564 15.88441  114.1028 16.10264  -3.046394      22.61879  
1 1 1 6  26 2  o 35.60845 15.36263  0.4089655E-01  1.327685      1.146094       2.166651      -0.6236438     1.680079      50.30718 20.50740  36.13630 16.33606  14.17088       26.21870  
1 1 1 6  26 3  f 83.32841 14.50862  5.047476       1.552491      5.565864       2.606750      4.762538       1.932626      83.22038 22.82517  78.92751 18.67000  4.292862       29.48825  
1 1 1 6  26 4  o 200.9189 7.092282  27.37055       1.895826      30.49910       2.790096      24.68720       2.583960      210.3393 9.983123  188.9898 10.29955  21.34952       14.34376  
1 1 1 6  26 5  o 97.79198 6.501565  6.490559       0.8424059     7.183323       0.9847722     4.600653       1.626534      102.6787 7.244003  78.55084 16.08145  24.12782       17.63770  
1 1 1 6  26 6  o 72.52279 16.07679  3.950424       1.512820      6.417397       2.265178      1.964090       2.032573      91.00161 19.28036  54.40016 20.53300  36.60145       28.16622  
1 1 1 6  26 7  o 28.75582 13.08153  -0.5290182     1.098099      -0.2915346     1.348021      -0.9974372     1.893203      33.54528 14.93868  36.49617 16.81579  -2.950886      22.49300  
1 1 1 6  26 8  o 118.1006 9.145448  9.656273       1.428024      6.953559       2.353247      11.23166       1.796640      94.09476 19.41289  126.5344 10.75751  -32.43967      22.19424  
1 1 1 6  26 9  o 72.57596 11.72670  3.792106       1.095422      4.092304       1.230461      2.645205       2.405064      74.95879 12.77664  59.48938 22.36104  15.46941       25.75381  
1 1 1 6  26 10 o 101.2858 7.063402  7.022252       0.9473404     6.879466       1.033843      7.769980       2.365831      99.94519 7.825159  99.49950 18.52540  0.4456863      20.11029  
1 1 1 6  26 11 o 121.7767 10.07706  10.42566       1.620577      10.90111       1.911433      9.210186       3.056175      123.3930 11.76739  104.1646 22.66411  19.22834       25.53690  
1 1 1 6  26 12 o 50.27438 17.02196  1.909218       1.356790      2.610232       1.475106      -1.942286      3.457603      57.40829 17.60861  45.25454 21.44532  12.15375       27.74824  
1 1 1 6  26 13 o 58.62363 18.46687  2.780439       1.610508      3.867809       2.267147      1.672775       2.288205      66.75498 21.99183  51.55968 21.05331  15.19530       30.44475  
1 1 1 6  26 14 o 87.30463 9.632239  5.402252       1.101963      5.425549       1.197135      5.272959       2.820171      86.99356 10.54203  74.74408 24.52296  12.24948       26.69289  
1 1 1 6  26 15 o 80.57383 6.192321  4.452720       0.6597500     4.521419       0.6705339     2.368272       3.693528      81.17599 6.246986  57.99782 25.31707  23.17818       26.07641  
1 1 1 6  26 16 o 61.72517 4.570353  2.587520       0.3732447     2.626796       0.3739969     -7.146558      5.887779      62.20111 4.543624  46.50965 23.22187  15.69146       23.66220  
1 1 1 6  26 17 o 67.92157 12.87058  3.513149       1.122248      3.604123       1.136940      0.6114561E-01  7.003486      68.81471 12.87195  57.46901 28.03725  11.34570       30.85085  
1 1 1 6  27 0  o 36.34273 21.95390  1.135227       1.946849      1.135227       1.946849      1.135227       1.946849      36.34273 21.95390  36.34273 21.95390  -0.000000      0.000000  
1 1 1 6  27 1  o 35.01152 15.47022  -0.1503939     1.417859      0.6251826      1.718251      -1.805442      2.510034      42.70012 17.91006  39.34677 18.53237  3.353355       25.77244  
1 1 1 6  27 2  o 78.37804 15.03752  4.600810       1.513415      4.174498       2.306304      4.923213       2.005638      70.86662 22.06631  78.54327 19.30292  -7.676659      29.31765  
1 1 1 6  27 3  o 71.33474 18.46788  4.030776       1.769067      1.336906       3.113746      5.314810       2.149726      55.09124 23.64429  81.10072 20.01580  -26.00948      30.97878  
1 1 1 6  27 4  o 47.49324 17.01881  1.576479       1.366792      1.841725       2.438987      1.455046       1.650263      54.33455 21.89989  47.86721 18.39651  6.467342       28.60134  
1 1 1 6  27 5  o 47.19047 8.405453  1.573224       0.5091727     1.609036       0.6611584     1.521025       0.7982057     47.04160 10.77905  45.39842 12.69953  1.643185       16.65731  
1 1 1 6  27 6  o 44.60800 19.40097  0.4114355      2.152191      3.095840       2.545165      -6.324418      4.031700      62.07044 23.06899  40.84562 20.19044  21.22482       30.65668  
1 1 1 6  27 7  o 42.14378 17.10761  0.8666869      1.500327      0.5986657E-01  1.638507      5.053983       3.732731      38.25461 16.77643  73.29179 27.78881  -35.03719      32.46024  
1 1 1 6  27 8  o 35.83798 13.61286  0.7461538      0.8967351     1.418662       0.9577045     -4.036856      2.554074      44.02233 14.28058  33.62859 16.51529  10.39373       21.83323  
1 1 1 6  27 9  f 118.0767 8.818968  9.713107       1.377549      10.03545       1.618909      8.867337       2.622364      119.0992 10.30214  104.5389 19.54364  14.56030       22.09271  
1 1 1 6  27 10 o 76.96248 14.65422  4.508852       1.447975      3.563249       1.649721      7.681250       3.021689      66.14014 18.16507  91.74898 24.32444  -25.60884      30.35866  
1 1 1 6  27 11 o 94.55505 11.38284  6.469964       1.405385      7.073323       1.723183      5.271379       2.428723      97.30054 13.66676  76.76552 22.37647  20.53502       26.21997  
1 1 1 6  27 12 o 69.74610 15.46978  3.820856       1.400068      4.789811       1.725519      1.953680       2.395302      76.96594 17.25230  52.70825 21.53350  24.25769       27.59227  
1 1 1 6  27 13 o 83.97504 21.03115  6.232238       2.347984      1.677595       3.162316      11.82811       3.505194      53.39353 23.36390  112.9248 24.03277  -59.53126      33.51784  
1 1 1 6  27 14 o 37.25827 12.54797  1.000487       0.7372814     1.023498       0.7662723     0.7135366      2.705992      37.68867 12.79190  47.24197 21.09341  -9.553299      24.66911  
1 1 1 6  27 15 o 31.40822 12.85414  0.4124678      0.8553878     0.4453248      0.8743678     -0.3198064     4.127781      31.93604 13.02416  49.83141 23.55994  -17.89537      26.92024  
1 1 1 6  28 0  o 75.04374 29.79660  5.980577       2.874902      5.980577       2.874902      5.980577       2.874902      75.04374 29.79660  75.04374 29.79660  0.000000       0.000000  
1 1 1 6  28 1  o 57.76342 19.69865  2.679255       1.817415      2.560491       2.495699      2.813343       2.651824      57.84946 22.51715  59.70373 23.21870  -1.854275      32.34393  
1 1 1 6  28 2  o 34.24972 15.60698  -0.5490212     1.571304      -2.724200      3.291193      0.9315756E-01  1.788273      42.15593 20.23504  39.62836 17.44757  2.527569       26.71843  
1 1 1 6  28 3  o 50.35586 17.21695  1.924551       1.388506      1.412378       2.346673      2.200455       1.722360      50.49023 21.03585  53.48195 19.11164  -2.991722      28.42115  
1 1 1 6  28 4  f 51.14372 18.25134  1.975330       1.570253      2.412197       2.269250      1.573966       2.175089      56.13831 21.57320  50.50246 20.56217  5.635849       29.80278  
1 1 1 6  28 5  o 53.79017 14.72746  2.231441       1.086333      1.420846       1.253655      4.674663       2.176494      44.88093 16.27092  73.67529 21.09505  -28.79436      26.64102  
1 1 1 6  28 6  o 50.82316 16.10675  2.005952       1.223470      2.054855       1.301185      1.632854       3.594020      51.34702 16.64475  56.05022 24.70407  -4.703194      29.78823  
1 1 1 6  28 7  o 78.84821 16.11548  4.882778       1.635973      3.497454       2.177987      6.676342       2.478209      63.34914 21.56513  87.66656 21.40363  -24.31742      30.38372  
1 1 1 6  28 8  o 115.6347 9.272653  9.426122       1.416816      10.21965       1.657993      7.278128       2.727837      119.5102 10.51850  89.73605 22.77722  29.77413       25.08866  
1 1 1 6  28 9  o 31.67095 14.54754  -0.5915065     1.401716      1.023669       1.592711      -6.140356      2.952084      42.97001 17.55757  32.56007 16.28511  10.40993       23.94730  
1 1 1 6  28 10 o 40.60615 16.47263  0.9057379      1.389961      0.9006856      1.539584      0.9280068      3.232266      41.60722 17.15966  50.71552 22.81667  -9.108299      28.54915  
1 1 1 6  28 11 f 61.24933 15.74122  3.021521       1.291649      2.495919       1.464174      4.865860       2.742739      54.86183 17.64552  70.03733 24.18866  -15.17550      29.94087  
1 1 1 6  28 12 o 30.10172 14.41063  -1.623167      1.644788      -3.789326      2.226803      0.9775125      2.439945      30.34421 15.00053  46.94227 20.53222  -16.59806      25.42809  
1 1 1 6  29 0  o 40.95050 23.82248  1.881026       2.140243      1.881026       2.140243      1.881026       2.140243      40.95050 23.82248  40.95050 23.82248  0.000000       0.000000  
1 1 1 6  29 1  o 34.85671 15.67174  -0.2206511     1.522119      -0.1433258     1.895374      -0.3610959     2.554387      38.72815 17.44367  42.82698 19.65948  -4.098831      26.28263  
1 1 1 6  29 2  o 69.76438 19.86276  4.215117       1.934984      3.230573       2.652459      5.335102       2.829028      60.34978 23.28912  73.83953 24.57526  -13.48975      33.85744  
1 1 1 6  29 3  o 58.65472 18.44258  2.882022       1.606985      3.831508       2.150540      1.681508       2.418170      65.31094 21.41380  50.94738 21.29965  14.36356       30.20308  
1 1 1 6  29 4  o 77.78971 15.64946  4.775533       1.565913      4.696372       2.402643      4.833990       2.064658      71.00127 22.57959  74.28618 20.28902  -3.284912      30.35592  
1 1 1 6  29 5  o 29.53784 13.28701  -0.2639631     1.095672      -1.087960      1.190696      4.289110       2.798920      26.63944 12.61239  66.42933 24.27753  -39.78989      27.35820  
1 1 1 6  29 6  o 58.55901 16.75779  2.810941       1.373865      2.963804       1.767721      2.577755       2.183308      58.72581 19.42220  55.46235 21.19909  3.263470       28.75106  
1 1 1 6  29 7  o 68.80564 15.01885  3.733429       1.338261      2.495079       1.689893      5.816284       2.191629      54.59531 18.97981  81.44193 20.27446  -26.84663      27.77205  
1 1 1 7  0  1  o 833.8815 21.66601  465.3808       24.03775      465.3808       24.03775      465.3808       24.03775      833.8815 21.66601  833.8815 21.66601  -0.000000      0.000000  
1 1 1 7  0  2  o 437.1904 2.607944  127.3641       1.519174      127.3641       1.519174      127.3641       1.519174      437.1904 2.607944  437.1904 2.607944  0.000000       0.000000  
1 1 1 7  0  3  f 327.0056 15.40197  71.80994       6.677231      71.80994       6.677231      71.80994       6.677231      327.0056 15.40197  327.0056 15.40197  -0.000000      0.000000  
1 1 1 7  0  4  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 7  0  5  o 301.9721 14.35609  61.23815       5.746780      61.23815       5.746780      61.23815       5.746780      301.9721 14.35609  301.9721 14.35609  -0.000000      0.000000  
1 1 1 7  0  6  o 607.8771 16.02473  247.0947       12.95977      247.0947       12.95977      247.0947       12.95977      607.8771 16.02473  607.8771 16.02473  -0.000000      0.000000  
1 1 1 7  0  7  o 481.7928 14.31147  155.2721       9.169582      155.2721       9.169582      155.2721       9.169582      481.7928 14.31147  481.7928 14.31147  -0.000000      0.000000  
1 1 1 7  0  8  o 972.5417 20.04294  632.7886       25.94937      632.7886       25.94937      632.7886       25.94937      972.5417 20.04294  972.5417 20.04294  -0.000000      0.000000  
1 1 1 7  0  9  o 905.1452 21.51159  548.7919       25.91253      548.7919       25.91253      548.7919       25.91253      905.1452 21.51159  905.1452 21.51159  0.000000       0.000000  
1 1 1 7  0  10 o 309.8787 6.916129  64.10057       2.852592      64.10057       2.852592      64.10057       2.852592      309.8787 6.916129  309.8787 6.916129  -0.000000      0.000000  
1 1 1 7  0  11 o 356.6110 7.559106  84.89419       3.588377      84.89419       3.588377      84.89419       3.588377      356.6110 7.559106  356.6110 7.559106  0.000000       0.000000  
1 1 1 7  0  12 o 126.5378 13.11921  11.02869       2.152786      11.02869       2.152786      11.02869       2.152786      126.5378 13.11921  126.5378 13.11921  -0.000000      0.000000  
1 1 1 7  0  13 o 122.4093 8.768171  10.14611       1.413009      10.14611       1.413009      10.14611       1.413009      122.4093 8.768171  122.4093 8.768171  0.000000       0.000000  
1 1 1 7  0  14 o 488.9794 12.27208  159.9422       7.984795      159.9422       7.984795      159.9422       7.984795      488.9794 12.27208  488.9794 12.27208  -0.000000      0.000000  
1 1 1 7  0  15 o 1255.112 4.303868  1049.883       7.197859      1049.883       7.197859      1049.883       7.197859      1255.112 4.303868  1255.112 4.303868  -0.000000      0.000000  
1 1 1 7  0  16 o 554.8236 8.320090  205.4367       6.148036      205.4367       6.148036      205.4367       6.148036      554.8236 8.320090  554.8236 8.320090  -0.000000      0.000000  
1 1 1 7  0  17 o 28.36635 17.78545  0.2832764      1.394353      0.2832764      1.394353      0.2832764      1.394353      28.36635 17.78545  28.36635 17.78545  -0.000000      0.000000  
1 1 1 7  0  18 o 269.1594 12.11587  48.65413       4.325375      48.65413       4.325375      48.65413       4.325375      269.1594 12.11587  269.1594 12.11587  -0.000000      0.000000  
1 1 1 7  0  19 o 131.2275 18.33078  12.17134       3.026393      12.17134       3.026393      12.17134       3.026393      131.2275 18.33078  131.2275 18.33078  0.000000       0.000000  
1 1 1 7  0  20 o 68.69643 25.07765  4.211146       2.114738      4.211146       2.114738      4.211146       2.114738      68.69643 25.07765  68.69643 25.07765  -0.000000      0.000000  
1 1 1 7  0  21 o 473.1114 18.15573  150.5135       11.40758      150.5135       11.40758      150.5135       11.40758      473.1114 18.15573  473.1114 18.15573  -0.000000      0.000000  
1 1 1 7  0  22 o 620.6541 24.96031  260.6808       20.56700      260.6808       20.56700      260.6808       20.56700      620.6541 24.96031  620.6541 24.96031  -0.000000      0.000000  
1 1 1 7  0  23 o 204.8680 29.67703  30.14875       7.607019      30.14875       7.607019      30.14875       7.607019      204.8680 29.67703  204.8680 29.67703  -0.000000      0.000000  
1 1 1 7  0  24 o 473.1045 14.12541  150.3671       8.886974      150.3671       8.886974      150.3671       8.886974      473.1045 14.12541  473.1045 14.12541  -0.000000      0.000000  
1 1 1 7  0  25 o 401.6355 12.58390  108.4042       6.719759      108.4042       6.719759      108.4042       6.719759      401.6355 12.58390  401.6355 12.58390  -0.000000      0.000000  
1 1 1 7  0  26 o 69.00838 15.29967  3.627863       1.229909      3.627863       1.229909      3.627863       1.229909      69.00838 15.29967  69.00838 15.29967  -0.000000      0.000000  
1 1 1 7  0  27 f 18.20536 11.13745  0.1879432      0.5148704     0.1879432      0.5148704     0.1879432      0.5148704     18.20536 11.13745  18.20536 11.13745  -0.000000      0.000000  
1 1 1 7  0  28 o 280.3466 15.93523  53.71910       5.908538      53.71910       5.908538      53.71910       5.908538      280.3466 15.93523  280.3466 15.93523  -0.000000      0.000000  
1 1 1 7  0  29 o 138.1198 61.41921  22.52118       11.95603      22.52118       11.95603      22.52118       11.95603      138.1198 61.41921  138.1198 61.41921  -0.000000      0.000000  
1 1 1 7  0  30 o 93.95474 14.42502  6.388041       1.679597      6.388041       1.679597      6.388041       1.679597      93.95474 14.42502  93.95474 14.42502  -0.000000      0.000000  
1 1 1 7  0  31 o 17.69054 12.36628  -1.030250      1.076682      -1.030250      1.076682      -1.030250      1.076682      17.69054 12.36628  17.69054 12.36628  0.000000       0.000000  
1 1 1 7  0  32 o 56.34048 27.48866  3.505678       2.432375      3.505678       2.432375      3.505678       2.432375      56.34048 27.48866  56.34048 27.48866  0.000000       0.000000  
1 1 1 7  0  33 o 39.37677 25.21407  0.9160640      2.977235      0.9160640      2.977235      0.9160640      2.977235      39.37677 25.21407  39.37677 25.21407  -0.000000      0.000000  
1 1 1 7  0  34 o 61.95758 30.69958  4.850477       3.052711      4.850477       3.052711      4.850477       3.052711      61.95758 30.69958  61.95758 30.69958  0.000000       0.000000  
1 1 1 7  0  35 o 43.67861 27.49588  2.137766       3.368766      2.137766       3.368766      2.137766       3.368766      43.67861 27.49588  43.67861 27.49588  0.000000       0.000000  
1 1 1 7  0  36 o 48.60184 30.07854  3.563293       3.858009      3.563293       3.858009      3.563293       3.858009      48.60184 30.07854  48.60184 30.07854  0.000000       0.000000  
1 1 1 7  0  37 o 47.09607 31.34279  3.662902       5.290816      3.662902       5.290816      3.662902       5.290816      47.09607 31.34279  47.09607 31.34279  0.000000       0.000000  
1 1 1 7  1  0  o 543.9045 32.84431  200.3638       23.60355      200.3638       23.60355      200.3638       23.60355      543.9045 32.84431  543.9045 32.84431  0.000000       0.000000  
1 1 1 7  1  1  o 1116.798 23.05091  835.7120       34.30333      809.2923       51.81660      856.3243       45.76882      1094.177 35.58653  1127.702 30.48601  -33.52417      46.85934  
1 1 1 7  1  2  o 436.1032 9.053309  126.8258       5.261023      117.7928       8.371751      132.7214       6.763374      419.6960 14.99361  445.8641 11.39314  -26.16812      18.83115  
1 1 1 7  1  3  o 735.5797 14.94256  361.3884       14.64631      362.1173       17.96141      359.9419       25.30230      735.8656 18.31760  731.8330 25.98749  4.032593       31.79440  
1 1 1 7  1  4  o 590.2377 19.04320  233.3097       14.95794      224.4051       19.27496      246.7910       23.71652      577.7545 25.09654  604.9247 29.51133  -27.17017      38.73957  
1 1 1 7  1  5  o 201.3733 3.047473  27.02060       0.8177401     27.43821       4.260313      27.00463       0.8332332     202.0071 15.95659  201.3133 3.106137  0.6938171      16.25611  
1 1 1 7  1  6  o 445.6085 13.03167  132.6891       7.729660      136.2087       8.571176      117.3592       17.88811      451.3531 14.26909  415.7473 32.54881  35.60587       35.53917  
1 1 1 7  1  7  o 575.6327 12.26483  221.2086       9.407635      220.5137       11.62490      222.5273       16.01457      574.2209 15.20614  575.8801 20.90407  -1.659119      25.84970  
1 1 1 7  1  8  o 530.0468 9.022055  187.4060       6.372256      178.2062       10.05757      193.5756       8.236310      516.1721 14.63739  538.5050 11.47808  -22.33289      18.60106  
1 1 1 7  1  9  o 287.6115 3.534206  55.12437       1.354477      58.79975       2.518204      53.62819       1.606687      296.9780 6.363456  283.6688 4.250559  13.30920       7.652505  
1 1 1 7  1  10 o 214.4258 5.348992  30.64953       1.528349      32.38700       2.918727      29.99316       1.793957      220.0526 9.979878  211.9995 6.357625  8.053146       11.83289  
1 1 1 7  1  11 o 308.9699 6.094210  63.65310       2.509038      64.67997       3.677275      62.75862       3.432036      311.1883 8.877145  306.5671 8.409365  4.621185       12.22788  
1 1 1 7  1  12 o 108.9264 6.696342  7.943504       0.9672531     7.437560       1.476480      8.323884       1.280222      104.9710 10.70533  111.3351 8.698378  -6.364120      13.79369  
1 1 1 7  1  13 o 30.00107 11.73842  0.3537191      0.6811017     0.1147901      1.047468      0.5287402      0.8965025     33.41760 13.99799  35.05260 13.53618  -1.635002      19.47234  
1 1 1 7  1  14 o 513.5938 8.228708  176.0821       5.631511      176.7479       7.560143      175.2520       8.440743      514.1714 11.03440  511.7639 12.37763  2.407562       16.58203  
1 1 1 7  1  15 o 376.4780 9.340830  94.67332       4.685959      109.6133       10.79765      91.20664       5.201288      402.7354 20.18472  369.2380 10.58228  33.49744       22.79051  
1 1 1 7  1  16 o 383.5041 10.19938  98.35268       5.207529      96.72147       7.346071      100.0004       7.383185      379.5841 14.55052  386.0072 14.37919  -6.423157      20.45676  
1 1 1 7  1  17 o 515.8785 12.35450  178.0553       8.492708      176.3216       14.76526      178.9125       10.38196      510.6851 21.74752  516.3697 15.10470  -5.684570      26.47842  
1 1 1 7  1  18 o 83.06844 17.36196  4.804802       1.859812      5.617895       2.393502      3.565833       2.954570      89.57628 20.49727  74.80285 25.11861  14.77343       32.42040  
1 1 1 7  1  19 o 671.4712 16.26163  302.4694       14.55007      290.4806       18.42627      322.3256       23.71364      656.1689 21.10150  689.1005 25.87104  -32.93158      33.38539  
1 1 1 7  1  20 o 528.9457 10.89838  187.0051       7.681508      189.5921       12.27790      185.3412       9.846643      531.0104 17.37531  525.8444 14.06525  5.166016       22.35471  
1 1 1 7  1  21 o 215.6725 10.26886  31.15810       2.942667      30.74704       3.448160      32.25993       5.645373      214.0126 12.14115  217.9390 19.65029  -3.926422      23.09852  
1 1 1 7  1  22 o 434.7722 15.53886  127.1737       8.987841      126.2990       11.15009      128.7964       15.18705      432.1011 19.41468  433.6148 26.40950  -1.513702      32.77790  
1 1 1 7  1  23 o 403.9554 10.66600  109.3456       5.736255      107.3501       9.668602      110.4295       7.125862      398.0530 18.27721  405.3370 13.21077  -7.283936      22.55173  
1 1 1 7  1  24 o 100.2312 6.783964  6.741506       0.9007278     7.431411       1.216398      5.903984       1.340229      105.0206 8.772211  93.17978 11.00620  11.84087       14.07438  
1 1 1 7  1  25 o 294.7498 7.662809  58.16958       3.007092      58.69079       4.111221      57.56992       4.409801      295.4424 10.45948  292.3699 11.34063  3.072540       15.42759  
1 1 1 7  1  26 o 75.81288 5.894693  3.864369       0.5908181     7.566970       2.070737      3.536243       0.6164417     104.4322 15.33713  72.43355 6.454266  31.99863       16.63987  
1 1 1 7  1  27 o 142.4207 8.024025  13.65238       1.516627      18.74241       3.301043      12.29048       1.707511      164.9927 15.18477  134.8115 9.567405  30.18123       17.94749  
1 1 1 7  1  28 f 227.3169 10.12162  34.95276       3.058192      39.39021       6.955182      33.88923       3.405010      234.6643 22.51877  223.3450 11.47964  11.31929       25.27602  
1 1 1 7  1  29 o 91.60673 32.68264  6.240285       5.034850      3.504845       8.237211      7.871802       6.361541      90.06523 38.55169  100.7477 36.63405  -10.68242      53.18164  
1 1 1 7  1  30 o 75.38656 7.883434  3.873827       0.7802287     4.649533       0.9236572     1.941570       1.457789      82.51794 8.522677  53.17448 17.63945  29.34346       19.59046  
1 1 1 7  1  31 o 40.91225 12.83026  1.161646       0.7782517     1.225621       0.7913550     -0.7223477     4.294434      41.85751 12.90794  57.36510 26.00686  -15.50760      29.03397  
1 1 1 7  1  32 o 113.3085 11.98143  9.076305       1.781656      9.977500       1.936813      4.117998       4.543024      118.5909 12.44141  73.19062 29.74764  45.40028       32.24455  
1 1 1 7  1  33 o 64.51183 18.00411  3.316823       1.606299      3.339847       1.782389      3.217269       3.706341      64.19036 19.28800  64.47486 26.61089  -0.2845001     32.86589  
1 1 1 7  1  34 o 28.09372 14.02383  -4.684218      2.142078      -3.205989      2.873269      -6.533829      3.213999      37.28462 18.13804  33.96077 16.98665  3.323845       24.85025  
1 1 1 7  1  35 o 54.96523 21.78123  2.614458       2.371527      3.183734       3.942200      2.291602       2.968800      58.98904 25.94085  54.16658 23.16394  4.822456       34.77781  
1 1 1 7  1  36 o 43.97556 19.60256  0.8328060      2.326936      0.2342522      3.515356      1.299593       3.104396      46.69862 21.97550  48.58171 22.05923  -1.883099      31.13731  
1 1 1 7  1  37 o 39.09534 18.73548  -1.055194      2.795980      -1.453638      4.117864      -0.7143763     3.808462      43.70395 21.35999  44.07626 21.30917  -0.3723145     30.17167  
1 1 1 7  2  0  o 225.3578 13.48334  34.23162       4.015448      34.23162       4.015448      34.23162       4.015448      225.3578 13.48334  225.3578 13.48334  -0.000000      0.000000  
1 1 1 7  2  1  o 499.9729 10.64480  166.7525       7.091816      164.2055       10.21823      169.1196       9.850556      495.5580 15.49321  503.0132 14.71210  -7.455231      21.36552  
1 1 1 7  2  2  o 1019.124 16.75457  694.1303       22.75274      724.7457       42.16662      681.5549       27.02460      1037.208 30.54238  1009.167 20.09661  28.04065       36.56105  
1 1 1 7  2  3  o 92.50587 9.729324  5.770371       1.181361      6.620167       2.126341      5.390942       1.420826      98.15027 16.86567  89.03825 12.30392  9.112015       20.87671  
1 1 1 7  2  4  o 590.9241 14.28413  233.2027       11.24758      248.3378       17.31639      222.1573       14.79296      608.5376 21.38810  575.8796 19.30475  32.65796       28.81187  
1 1 1 7  2  5  o 678.2897 27.15858  309.7407       24.49722      304.0311       29.85583      321.5051       42.85563      670.1787 33.53880  683.9778 47.31261  -13.79913      57.99426  
1 1 1 7  2  6  o 538.5095 11.72192  193.5477       8.411349      199.1944       10.21824      181.6794       14.81408      545.9203 14.05836  520.2461 21.41518  25.67426       25.61732  
1 1 1 7  2  7  o 462.4240 9.741717  142.6545       6.002739      161.5065       19.75633      140.7371       6.300610      488.3458 30.51271  459.2712 10.29532  29.07455       32.20279  
1 1 1 7  2  8  o 308.0560 6.770399  63.27015       2.779185      65.33695       3.877143      61.08585       3.985832      312.8141 9.311847  302.4129 9.904473  10.40121       13.59445  
1 1 1 7  2  9  o 1005.785 11.88471  675.5698       15.92821      670.7920       20.93105      682.1433       24.55141      1001.353 15.68665  1009.062 18.25933  -7.709106      24.07227  
1 1 1 7  2  10 o 346.6714 4.806805  80.10667       2.220486      76.55779       3.401755      82.74136       2.931041      338.7978 7.535098  352.2735 6.244079  -13.47571      9.786021  
1 1 1 7  2  11 o 504.0451 8.074809  169.5144       5.423444      162.3511       6.696527      183.1697       9.245827      493.0703 10.19218  523.1484 13.27389  -30.07803      16.73549  
1 1 1 7  2  12 o 456.2624 7.587991  138.8951       4.613335      150.1319       6.937461      129.9866       6.177031      473.9931 10.98386  441.1020 10.50914  32.89108       15.20156  
1 1 1 7  2  13 o 303.5414 6.230723  61.45279       2.520170      59.48126       4.137017      62.61613       3.177878      298.1663 10.42856  306.2103 7.794659  -8.044006      13.01966  
1 1 1 7  2  14 o 143.0031 8.741666  13.70528       1.657804      13.43249       2.264160      14.02053       2.434023      141.1770 12.15385  144.1683 12.80315  -2.991364      17.65323  
1 1 1 7  2  15 o 153.3834 14.66727  15.91376       2.961319      0.000000       0.000000      15.91376       2.961319      ?        ?         153.3834 14.66727  0.000000       14.66727  
1 1 1 7  2  16 o 369.4293 9.382625  91.21784       4.615063      92.56976       6.184832      89.51941       6.932309      371.7052 12.50473  365.2131 14.27233  6.492096       18.97545  
1 1 1 7  2  17 o 463.4347 11.36036  143.5957       7.015430      144.7034       8.689203      141.5215       11.88973      464.5800 14.05224  458.1124 19.52196  6.467560       24.05353  
1 1 1 7  2  18 o 446.6968 4.198126  133.0059       2.498860      133.3960       3.623063      132.6520       3.451052      447.2376 6.079447  446.0076 5.806785  1.229980       8.407046  
1 1 1 7  2  19 o 206.4771 8.432937  28.50423       2.315312      35.68573       3.967253      24.79484       2.851239      230.5702 12.96481  192.2784 11.17650  38.29187       17.11725  
1 1 1 7  2  20 o 369.5487 10.49947  91.33357       5.165022      84.55942       9.772625      93.95925       6.084219      353.5864 20.83393  374.5803 12.20581  -20.99387      24.14610  
1 1 1 7  2  21 o 536.6420 9.715665  192.4219       6.947534      204.6483       10.96607      184.2239       8.979588      552.1624 14.91793  524.5258 12.84742  27.63660       19.68759  
1 1 1 7  2  22 o 172.1066 8.884242  19.84368       2.030575      19.82088       2.855635      19.86700       2.887970      171.5368 12.58065  171.7178 12.71142  -0.1809845     17.88444  
1 1 1 7  2  23 o 12.95553 6.454322  -1.150850      0.4442378     1.239492       1.180344      -1.545316      0.4794940     45.42359 15.85784  12.39212 6.246888  33.03147       17.04390  
1 1 1 7  2  24 o 216.0063 8.405344  31.26189       2.414714      31.61102       3.502380      30.94557       3.333703      216.5474 12.18689  214.3437 11.71648  2.203690       16.90551  
1 1 1 7  2  25 o 187.2531 6.884931  23.47532       1.714992      23.62471       3.079941      23.40818       2.064691      186.8317 12.44229  186.7773 8.316640  0.5436707E-01  14.96586  
1 1 1 7  2  26 o 299.8095 7.893514  60.27161       3.150731      63.39960       4.818220      57.93480       4.164529      306.2910 11.82758  293.1590 10.67863  13.13196       15.93501  
1 1 1 7  2  27 o 144.4226 9.661897  14.10264       1.848696      15.84353       3.146322      13.18469       2.284680      151.3421 15.83577  138.9395 12.47290  12.40256       20.15800  
1 1 1 7  2  28 o 64.01319 19.37366  2.902171       1.793607      3.663253       3.476094      2.626019       2.093870      74.87373 27.10081  62.51309 21.14611  12.36063       34.37458  
1 1 1 7  2  29 o 79.27571 30.20605  4.038729       4.423752      7.831128       7.379982      1.911874       5.526718      101.5949 38.93943  75.15186 31.85233  26.44303       50.30755  
1 1 1 7  2  30 o 34.16115 7.515021  0.8166662      0.3327751     0.7985557      0.3357923     1.810901       2.487997      33.76203 7.642573  57.70190 22.47595  -23.93987      23.73978  
1 1 1 7  2  31 o 64.07058 10.12587  2.873622       0.8358074     3.227852       0.8608780     -2.943833      3.488713      68.08905 9.767687  45.66341 21.61024  22.42564       23.71519  
1 1 1 7  2  32 o 26.31245 12.62567  -1.650977      1.278782      -1.530084      1.298916      -5.460069      7.291061      27.05941 12.91370  59.81310 29.05070  -32.75369      31.79161  
1 1 1 7  2  33 f 19.47115 9.360774  -0.9778810     0.7105876     -1.048054      0.7292889     0.3379796      3.158044      19.50159 9.402648  50.57243 22.66864  -31.07085      24.54133  
1 1 1 7  2  34 o ?        ?         -2.758689      0.6495782     -2.805963      0.6606899     -1.388622      3.556786      ?        ?         45.79404 21.71554  0.000000       21.71554  
1 1 1 7  2  35 o 30.06368 14.07359  -0.8828031     1.409658      -0.8513920     1.582359      -1.003599      3.103059      32.10777 14.99129  43.11900 20.39857  -11.01122      25.31483  
1 1 1 7  2  36 o 36.68100 16.65252  -0.3296042E-01 1.768134      -1.175201      2.191206      2.098863       2.993505      35.68714 16.95797  51.17593 22.55122  -15.48879      28.21578  
1 1 1 7  2  37 o 39.57320 18.80398  -0.6675340     2.693810      -3.456689      3.680386      2.550948       3.953507      38.69444 19.15661  52.03688 24.09082  -13.34245      30.77894  
1 1 1 7  3  0  o 287.0574 10.98517  55.17876       4.187935      55.17876       4.187935      55.17876       4.187935      287.0574 10.98517  287.0574 10.98517  0.000000       0.000000  
1 1 1 7  3  1  o 663.6653 14.19724  294.1200       12.55528      311.4644       21.15119      284.6835       15.60122      681.2531 23.33428  652.2443 17.96755  29.00879       29.45032  
1 1 1 7  3  2  o 235.5268 4.928444  36.96955       1.546762      36.25947       1.869021      38.51287       2.755437      233.1604 6.020732  240.1698 8.623907  -7.009415      10.51765  
1 1 1 7  3  3  o 36.91069 3.585491  0.9164091      0.1741303     4.999283       2.439655      0.8955029      0.1745755     84.77499 21.55269  36.47774 3.640101  48.29726       21.85793  
1 1 1 7  3  4  o 556.7460 12.13474  206.8824       9.002455      225.3513       15.11493      196.7290       11.20710      579.9200 19.58792  542.3881 15.52232  37.53198       24.99258  
1 1 1 7  3  5  f 801.2950 18.44212  429.6057       19.69141      430.4482       23.09536      427.3630       37.68382      801.1519 21.65383  793.8312 35.71634  7.320740       41.76776  
1 1 1 7  3  6  f 211.3598 2.058149  29.76545       0.5796590     0.000000       0.000000      29.76545       0.5796590     ?        ?         211.3598 2.058149  0.000000       2.058149  
1 1 1 7  3  7  o 485.2014 13.29442  157.3629       8.587276      164.6710       13.65507      152.5819       11.04459      495.2091 20.73931  477.2126 17.39769  17.99649       27.07025  
1 1 1 7  3  8  o 795.7307 15.44017  423.4360       16.37162      480.5697       23.74871      371.6961       22.59992      846.3688 21.05751  743.5565 22.83677  102.8124       31.06343  
1 1 1 7  3  9  o 634.0856 9.462454  268.2974       7.995124      269.7658       9.745915      265.2754       13.98109      635.5815 11.50742  629.2531 16.68883  6.328369       20.27160  
1 1 1 7  3  10 o 455.2217 6.447908  138.1814       3.911248      132.5241       5.867961      142.7042       5.246711      445.5565 9.883504  462.4691 8.513946  -16.91263      13.04496  
1 1 1 7  3  11 f 67.56921 2.741793  3.047408       0.2463509     2.450424       1.194497      3.073929       0.2517633     59.35470 15.07613  67.86089 2.790144  -8.506184      15.33214  
1 1 1 7  3  12 o 196.8526 4.518273  25.83156       1.185188      25.64825       2.350576      25.89405       1.372412      195.7940 9.033863  197.0038 5.232642  -1.209854      10.43989  
1 1 1 7  3  13 o 54.82959 9.662913  2.067235       0.6802015     0.5133282      1.062384      3.146767       0.8854962     37.07018 14.61325  67.89647 10.09398  -30.82629      17.76051  
1 1 1 7  3  14 o 362.7704 7.019124  87.80637       3.393034      91.86512       4.615521      83.03360       5.005065      370.7386 9.350312  352.2842 10.67442  18.45444       14.19055  
1 1 1 7  3  15 o 139.0316 10.54544  12.99345       1.939101      15.00436       3.199919      11.82648       2.437659      148.6064 16.43375  132.1222 14.06176  16.48422       21.62871  
1 1 1 7  3  16 o 397.6454 11.26658  105.8122       5.963807      116.0076       8.238791      94.58938       8.643985      415.7097 14.89712  374.8059 17.35460  40.90387       22.87152  
1 1 1 7  3  17 o 204.9337 9.134097  28.09968       2.488054      27.87317       2.839303      28.84905       5.164260      203.9681 10.48178  206.2370 19.00540  -2.268921      21.70422  
1 1 1 7  3  18 o 247.8404 8.096084  41.03836       2.670161      41.40859       3.717880      40.64396       3.837306      248.6386 11.25071  246.2708 11.72707  2.367813       16.25124  
1 1 1 7  3  19 o 181.2044 7.887170  21.95342       1.899862      21.40300       3.715338      22.14831       2.210765      177.9628 15.83246  181.8990 9.150306  -3.936264      18.28646  
1 1 1 7  3  20 f 405.2780 9.348583  109.6949       5.048615      114.1026       11.09483      108.5438       5.669608      411.0350 20.31967  402.8752 10.57023  8.159790       22.90456  
1 1 1 7  3  21 o 335.3427 8.450167  75.13744       3.772954      73.80338       6.648077      75.77126       4.582410      331.3185 15.09801  336.5330 10.23051  -5.214569      18.23769  
1 1 1 7  3  22 o 406.6529 11.77531  110.8449       6.374002      115.5422       9.663724      107.2277       8.480194      413.6728 17.57132  398.9431 15.98459  14.72971       23.75412  
1 1 1 7  3  23 o 170.9160 7.176811  19.54454       1.630873      22.58408       2.692933      17.78405       2.049453      183.2502 11.08004  162.7583 9.490953  20.49190       14.58923  
1 1 1 7  3  24 o 284.7600 9.989172  54.42062       3.784503      51.38110       4.971198      58.61041       5.836531      275.8341 13.56669  294.2351 14.93515  -18.40100      20.17706  
1 1 1 7  3  25 o 69.40529 12.28087  3.339983       1.094232      3.124686       2.090553      3.421225       1.284195      67.40136 21.01220  69.88691 14.27299  -2.485550      25.40139  
1 1 1 7  3  26 o 142.8269 8.416168  13.72907       1.594662      14.83457       2.842229      13.22120       1.926444      147.0297 14.70415  139.7753 10.41807  7.254364       18.02077  
1 1 1 7  3  27 o 127.8333 8.269058  11.01751       1.400997      7.296472       2.645300      12.46814       1.651658      100.6529 20.42205  135.8432 9.178377  -35.19029      22.38980  
1 1 1 7  3  28 f 63.56692 24.03816  2.301133       2.788779      -0.2880045     4.292612      4.192017       3.668399      61.61273 27.08280  78.51286 27.90936  -16.90012      38.88972  
1 1 1 7  3  29 o 67.46205 23.93052  3.053134       2.695727      4.324296       3.262076      0.3154555      4.787238      77.46811 26.39158  65.90378 28.79435  11.56433       39.05931  
1 1 1 7  3  30 o 87.56506 16.29845  5.541678       1.831772      4.693548       2.231056      7.295941       3.208681      78.91241 20.89205  96.74837 24.78175  -17.83596      32.41316  
1 1 1 7  3  31 o 134.4908 18.29168  13.35406       3.193198      12.75538       4.156087      14.21670       4.988842      125.7650 25.66970  129.2531 29.60382  -3.488113      39.18316  
1 1 1 7  3  32 o 89.77959 6.839949  5.495025       0.8121246     5.518003       0.8154737     2.714766       8.970024      89.96394 6.854084  76.64018 35.75371  13.32375       36.40475  
1 1 1 7  3  33 o 65.43658 12.33806  3.151365       1.036380      3.167606       1.039610      0.5501569      13.15682      65.60564 12.34495  71.88911 35.69947  -6.283463      37.77367  
1 1 1 7  3  34 o 58.84774 14.15554  2.692564       1.096415      3.375399       1.233750      0.1275181      2.391206      65.88161 14.45196  43.48062 19.58781  22.40099       24.34217  
1 1 1 7  3  35 o 20.43192 9.538804  -0.5109084     0.6403754     -0.5819121     0.6523485     1.370317       3.357836      20.22333 9.501015  51.26233 23.14181  -31.03900      25.01625  
1 1 1 7  3  36 o 54.52330 16.51443  2.570094       1.302905      3.653551       1.405702      -4.035456      3.470898      65.55802 16.18897  37.52529 18.58237  28.03273       24.64522  
1 1 1 7  4  0  o 336.3430 36.03015  78.47177       15.68105      78.47177       15.68105      78.47177       15.68105      336.3430 36.03015  336.3430 36.03015  0.000000       0.000000  
1 1 1 7  4  1  o 256.4272 10.22077  43.93299       3.485380      43.59000       3.738961      46.20740       9.628178      255.3647 11.01384  260.6657 28.16637  -5.301071      30.24317  
1 1 1 7  4  2  o 417.0695 8.728918  115.9990       4.851124      123.0537       11.82092      114.5702       5.319725      428.1641 20.78100  414.4521 9.632552  13.71204       22.90494  
1 1 1 7  4  3  o 555.4515 7.484327  205.6989       5.539525      186.4728       9.718415      214.9519       6.742012      528.2437 13.81850  567.7261 8.912039  -39.48248      16.44309  
1 1 1 7  4  4  o 202.9641 4.156111  27.45215       1.124035      29.10401       1.919326      26.58986       1.386720      208.8273 6.906943  199.6705 5.216432  9.156830       8.655462  
1 1 1 7  4  5  o 260.2504 0.8235169 45.12637       0.2855864     45.19608       0.2891743     42.36930       1.818579      260.4514 0.8332198 252.1273 5.413009  8.324020       5.476762  
1 1 1 7  4  6  o 497.4466 12.39366  165.2236       8.215229      171.2889       11.99580      159.8664       11.27394      505.6030 17.83310  488.5081 17.34685  17.09491       24.87835  
1 1 1 7  4  7  o 904.8760 33.27948  555.4181       40.05887      599.0488       55.01178      506.1668       58.44783      933.4160 44.35589  853.1245 51.65617  80.29144       68.08675  
1 1 1 7  4  8  o 229.2382 4.558478  35.02423       1.392453      34.03055       1.454539      45.92411       4.817402      225.9581 4.830856  261.7581 13.86085  -35.80005      14.67857  
1 1 1 7  4  9  o 334.0614 7.193282  74.42488       3.202041      74.26128       3.707726      74.90498       6.351301      333.6383 8.339849  334.3578 14.28829  -0.7195435     16.54413  
1 1 1 7  4  10 o 186.8025 3.500570  23.25541       0.8713546     22.50977       1.040596      25.00498       1.593988      183.7718 4.249423  193.5487 6.188418  -9.776886      7.506938  
1 1 1 7  4  11 o 274.4459 3.991548  50.20230       1.459727      55.12793       2.546979      47.79303       1.781304      287.4968 6.648427  267.7504 4.992686  19.74634       8.314355  
1 1 1 7  4  12 o 585.8412 10.19921  229.2993       7.961963      228.2420       12.47829      230.0254       10.34045      583.0801 16.07562  586.2148 13.23760  -3.134705      20.82450  
1 1 1 7  4  13 o 331.9843 6.079150  73.50678       2.689266      70.77464       4.036840      75.68678       3.605929      325.3969 9.319708  336.7411 8.036140  -11.34424      12.30595  
1 1 1 7  4  14 o 170.6417 7.406430  19.46780       1.680088      19.31912       2.544539      19.58272       2.237056      169.5948 11.32449  170.9181 9.864255  -1.323303      15.01824  
1 1 1 7  4  15 o 558.2050 10.40600  208.2463       7.740182      199.4313       14.62845      211.6738       9.121679      543.5665 20.23161  562.4597 12.17054  -18.89319      23.61017  
1 1 1 7  4  16 o 355.7908 8.481017  84.50756       4.020834      81.05461       7.504863      85.89775       4.761945      347.1522 16.26893  358.4309 9.979950  -11.27872      19.08606  
1 1 1 7  4  17 o 262.6955 8.271825  46.10677       2.891917      45.88934       3.603868      46.49997       4.846343      261.8679 10.34830  263.1521 13.86979  -1.284210      17.30487  
1 1 1 7  4  18 o 556.7795 4.107841  206.6326       3.047687      220.0087       4.818826      197.7153       3.934542      574.3495 6.296389  544.5450 5.422341  29.80444       8.309410  
1 1 1 7  4  19 f 549.4022 11.54548  201.8064       8.452316      181.4742       17.55422      207.9429       9.643837      516.9020 25.56522  557.4368 12.98317  -40.53479      28.67304  
1 1 1 7  4  20 o 463.3196 10.86356  143.4977       6.706972      151.7123       12.44589      140.1359       7.961971      474.1970 19.73988  457.3363 13.07849  16.86069       23.67931  
1 1 1 7  4  21 o 725.0287 16.87955  353.4880       16.30758      333.3217       19.93078      394.3336       28.36504      701.8044 21.33730  759.1313 28.08941  -57.32697      35.27457  
1 1 1 7  4  22 o 338.2365 10.75020  76.64851       4.839035      94.58182       7.067630      60.82304       6.639295      375.0224 14.16853  300.0446 16.67145  74.97778       21.87886  
1 1 1 7  4  23 o 384.7599 11.20172  99.33672       5.737006      99.80685       8.699583      98.97493       7.631618      383.8900 17.04916  382.9910 14.98281  0.8989868      22.69710  
1 1 1 7  4  24 o 169.8295 12.14276  19.49430       2.729787      16.55984       3.689797      23.04247       4.057326      155.0177 18.20955  183.5961 16.76948  -28.57831      24.75486  
1 1 1 7  4  25 o 138.8708 13.88761  13.17110       2.535439      13.61932       3.490035      12.67016       3.689585      139.7185 19.25735  133.9878 21.38351  5.730667       28.77673  
1 1 1 7  4  26 o 119.5908 9.828379  9.682142       1.552412      8.484921       2.376394      10.57341       2.050390      110.2113 16.70446  124.4173 12.53835  -14.20603      20.88658  
1 1 1 7  4  27 o 76.04876 13.72996  4.052051       1.340157      1.027323       2.330167      5.547095       1.638215      52.98732 21.38842  89.14630 14.27223  -36.15898      25.71305  
1 1 1 7  4  28 o 122.7768 16.90202  10.61127       2.691915      10.54284       2.898200      11.04131       7.265154      121.7769 18.43653  116.1229 39.38844  5.653999       43.48972  
1 1 1 7  4  29 o 58.08027 15.29482  2.421186       1.199839      1.719830       3.886329      2.495080       1.261463      65.91799 27.23212  58.92071 15.76013  6.997280       31.46379  
1 1 1 7  4  30 o 61.58447 22.16578  2.553826       2.321379      4.746587       3.000228      -0.7170714     3.664309      78.55274 25.25834  54.13069 24.32841  24.42205       35.06929  
1 1 1 7  4  31 o 78.92017 20.86491  4.847965       2.227247      5.329719       2.777345      3.979900       3.728153      81.36528 23.98683  72.90360 27.74127  8.461678       36.67351  
1 1 1 7  4  32 o 47.26770 18.83675  1.208110       1.783307      1.752233       1.833439      -8.335583      7.678492      51.51783 19.48867  56.82620 28.04778  -5.308372      34.15387  
1 1 1 7  4  33 o 111.7135 6.277737  8.513258       0.9307465     8.532031       0.9326891     4.020734       14.42823      111.8343 6.284037  73.93398 36.82514  37.90035       37.35746  
1 1 1 7  4  34 o 55.12827 10.95974  2.247184       0.7767366     2.142236       0.8005638     3.931931       3.207572      53.51835 11.56399  63.63126 25.29388  -10.11291      27.81198  
1 1 1 7  4  35 o 31.61056 14.40023  -0.3533232     1.336493      -0.1927209     1.479581      -1.065251      3.115165      33.94240 15.33863  42.73792 20.28274  -8.795525      25.42957  
1 1 1 7  4  36 o 31.80842 12.79599  0.5384086      0.8309420     0.4525135      0.8506683     2.326288       3.881013      31.17328 12.79512  52.68229 24.20161  -21.50900      27.37577  
1 1 1 7  5  0  o 456.7678 24.63160  140.7329       14.89181      140.7329       14.89181      140.7329       14.89181      456.7678 24.63160  456.7678 24.63160  -0.000000      0.000000  
1 1 1 7  5  1  o 910.5023 28.99397  558.6898       35.13244      536.6151       40.26926      629.0352       71.88594      890.4152 34.00215  951.0481 56.98550  -60.63293      66.35883  
1 1 1 7  5  2  o 179.1098 1.695835  21.37461       0.4047404     23.80952       2.471865      21.30753       0.4102776     188.6666 9.866614  178.8285 1.721740  9.838135       10.01571  
1 1 1 7  5  3  o 257.3727 3.463028  44.14043       1.187660      44.26965       1.336139      43.65405       2.592294      257.7439 3.890358  255.7611 7.614829  1.982788       8.551053  
1 1 1 7  5  4  o 450.0866 6.698035  135.0515       4.017140      136.3625       4.915290      132.4146       6.971187      452.1995 8.157285  445.2349 11.76046  6.964569       14.31258  
1 1 1 7  5  5  o 813.5081 15.07321  442.3573       16.33959      440.4140       21.84705      444.8242       24.61517      810.6716 20.22434  813.7922 22.72172  -3.120605      30.41875  
1 1 1 7  5  6  o 255.7305 11.20923  43.73893       3.810444      46.90473       5.030660      39.47812       5.836185      264.5324 14.32504  242.1335 18.22212  22.39891       23.17871  
1 1 1 7  5  7  o 667.7106 16.15420  298.3311       14.37299      283.8837       20.48847      312.3304       20.16826      649.3043 23.72020  681.5292 22.23782  -32.22498      32.51413  
1 1 1 7  5  8  o 324.9713 6.063104  70.40874       2.625510      74.42841       3.241869      62.74679       4.475793      334.0691 7.282586  306.3495 10.98203  27.71964       13.17729  
1 1 1 7  5  9  o 754.5983 11.18949  380.3701       11.25122      395.1983       15.51210      363.9094       16.34371      768.3337 15.15120  736.9285 16.64377  31.40515       22.50720  
1 1 1 7  5  10 o 546.8469 8.601767  199.5834       6.267970      195.0301       8.307399      205.6013       9.550540      540.2006 11.54082  554.4288 12.92732  -14.22821      17.32934  
1 1 1 7  5  11 o 302.4186 6.102748  60.99203       2.459277      63.10372       4.353712      60.00251       2.980290      307.1278 10.65431  299.8851 7.458132  7.242676       13.00531  
1 1 1 7  5  12 o 93.36842 1.447596  5.808560       0.1801030     6.137571       0.4305836     5.738791       0.1982814     95.90477 3.374591  92.80537 1.603376  3.099403       3.736131  
1 1 1 7  5  13 o 259.5836 6.386276  44.94743       2.209014      49.53147       3.095547      40.19078       3.153290      272.2409 8.543747  245.0900 9.674281  27.15089       12.90687  
1 1 1 7  5  14 o 482.1769 9.756647  155.3261       6.268744      157.4078       11.83161      154.5137       7.391482      483.3718 18.40276  480.6523 11.54056  2.719513       21.72202  
1 1 1 7  5  15 o 442.4340 12.96268  131.1499       7.633929      136.8611       11.00003      125.8436       10.60293      450.7227 18.35356  432.1432 18.45551  18.57950       26.02804  
1 1 1 7  5  16 o 295.5133 7.962864  58.32449       3.132737      54.81217       4.828721      60.87736       4.116696      285.9263 12.70546  301.6785 10.25564  -15.75220      16.32810  
1 1 1 7  5  17 o 130.2779 5.159492  11.33354       0.8939055     10.68206       2.332616      11.44568       0.9677894     125.5049 14.19688  130.8982 5.561148  -5.393242      15.24722  
1 1 1 7  5  18 o 166.4132 6.757147  18.50299       1.495273      18.07008       3.678397      18.58869       1.636592      163.1884 17.17303  166.7534 7.383641  -3.564987      18.69308  
1 1 1 7  5  19 o 373.8230 9.495771  93.38851       4.726265      101.2401       7.431434      88.05582       6.124460      388.4830 14.38061  362.5486 12.69694  25.93442       19.18370  
1 1 1 7  5  20 o 372.6800 8.795912  92.74573       4.368078      93.93961       6.251507      91.60682       6.105858      374.4282 12.54748  369.7677 12.40966  4.660522       17.64764  
1 1 1 7  5  21 o 79.29465 10.18789  4.272482       1.051626      6.136011       1.240814      -0.4794144     1.981401      95.29717 9.916172  42.02298 18.43820  53.27419       20.93556  
1 1 1 7  5  22 o 203.7953 10.11381  27.85985       2.737937      30.00539       3.453359      24.22873       4.492553      211.1790 12.32564  188.5515 18.10307  22.62744       21.90075  
1 1 1 7  5  23 o 320.0352 11.43024  68.80882       4.866632      69.35799       6.786674      68.22749       6.982413      320.0618 15.96330  317.2390 16.57504  2.822815       23.01214  
1 1 1 7  5  24 o 48.99345 21.94214  -1.150017      2.952019      -4.049529      3.641875      4.404707       5.040734      46.61160 22.06506  86.85338 32.42887  -40.24178      39.22370  
1 1 1 7  5  25 o 46.75246 18.56488  0.8404580      1.726200      0.8404580      1.726200      0.000000       0.000000      46.75246 18.56488  ?        ?         0.000000       18.56488  
1 1 1 7  5  26 o 62.95658 16.40193  2.813769       1.389543      1.671568       1.669877      5.385179       2.505526      52.66321 18.81830  86.17722 21.80511  -33.51402      28.80263  
1 1 1 7  5  27 o 109.6291 9.473856  8.153749       1.370402      7.947329       2.112587      8.303711       1.800654      106.7121 15.29348  109.9203 12.51629  -3.208199      19.76229  
1 1 1 7  5  28 o 83.54968 14.54786  4.919081       1.560822      7.576411       2.626837      3.468915       1.940525      102.1923 20.00680  69.25769 19.94655  32.93462       28.25132  
1 1 1 7  5  29 o 81.29825 25.44897  4.992294       3.063307      3.906512       3.359068      10.35625       7.466042      74.64948 26.68822  109.6081 39.71130  -34.95865      47.84609  
1 1 1 7  5  30 f 86.39784 13.10101  5.276496       1.461027      3.917350       2.776662      5.796874       1.718102      72.23961 24.35114  89.95068 14.85199  -17.71107      28.52297  
1 1 1 7  5  31 o 91.78176 20.53320  6.545750       2.448314      7.255129       3.019385      5.183936       4.183486      94.46120 23.95645  79.11761 29.54248  15.34359       38.03511  
1 1 1 7  5  32 o 70.22466 21.36593  4.043097       2.177517      3.514365       2.264617      10.52271       7.927772      65.78054 21.98969  91.37016 38.40652  -25.58961      44.25615  
1 1 1 7  5  33 o 41.56430 20.00377  -2.764063      3.265525      -3.055688      3.349208      2.853939       14.70010      41.47928 20.03638  71.67627 35.92074  -30.19699      41.13096  
1 1 1 7  5  34 o 48.22144 22.89464  -0.9425082     3.977237      -0.1829008     4.697556      -2.865457      7.474141      52.53618 24.92534  55.44894 27.42387  -2.912762      37.05862  
1 1 1 7  5  35 o 34.79387 13.31958  0.7633261      0.8627849     1.207750       0.9088749     -3.288172      2.744183      40.12931 13.92098  35.06278 17.19915  5.066532       22.12701  
1 1 1 7  5  36 o 42.15325 13.81928  1.418753       0.8956463     1.528108       0.9392357     0.3219614      2.974521      43.48499 14.14490  44.25859 20.62781  -0.7735977     25.01169  
1 1 1 7  6  0  o 306.7758 10.58499  62.97384       4.315290      62.97384       4.315290      62.97384       4.315290      306.7758 10.58499  306.7758 10.58499  -0.000000      0.000000  
1 1 1 7  6  1  f 1203.542 31.49469  978.8187       50.46601      955.0836       59.03175      1043.268       97.27458      1185.435 37.41782  1220.397 60.00096  -34.96143      70.71216  
1 1 1 7  6  2  o 498.1939 3.794745  165.3969       2.519153      147.7713       14.26023      165.9647       2.559406      468.6942 22.90236  499.0468 3.848791  -30.35269      23.22351  
1 1 1 7  6  3  o 444.0653 7.653386  131.4927       4.528704      122.6397       9.085134      134.4198       5.223994      427.9611 15.95934  448.9238 8.732861  -20.96268      18.19240  
1 1 1 7  6  4  o 265.3513 2.214019  46.91568       0.7828455     46.73207       0.8162601     49.02152       2.764380      264.8307 2.313059  271.0242 7.662178  -6.193451      8.003700  
1 1 1 7  6  5  o 589.2068 9.053396  231.6027       7.108089      230.1908       8.899698      234.0899       11.81247      587.1876 11.37430  591.5044 14.99891  -4.316772      18.82398  
1 1 1 7  6  6  o 187.6072 2.013550  23.45160       0.5033678     23.45646       0.5133662     23.33033       2.562962      187.6264 2.053335  186.6734 10.34398  0.9530334      10.54581  
1 1 1 7  6  7  o 488.6659 12.54035  159.6690       8.158982      151.2692       11.15833      169.3199       11.96047      474.7888 17.66784  502.3090 17.89776  -27.52017      25.14920  
1 1 1 7  6  8  f 745.8541 12.40206  371.8264       12.32597      380.4473       15.37178      356.3009       20.62869      753.8223 15.30318  727.5527 21.30107  26.26965       26.22829  
1 1 1 7  6  9  o 417.1938 7.071539  116.0969       3.931202      115.7349       4.876236      116.7692       6.644487      416.4120 8.787958  417.7841 11.94765  -1.372101      14.83154  
1 1 1 7  6  10 o 91.26814 2.468525  5.554761       0.2999379     5.632176       0.3067328     3.865300       1.432923      91.90112 2.507101  74.65457 14.92636  17.24655       15.13545  
1 1 1 7  6  11 o 214.9965 4.046469  30.81054       1.159261      31.81309       1.547254      29.52752       1.750351      218.4311 5.315862  210.3149 6.252650  8.116196       8.206949  
1 1 1 7  6  12 o 493.0935 10.00134  162.4500       6.571445      164.7798       9.444959      160.2640       9.148963      495.6869 14.31444  488.8988 14.05823  6.788086       20.06332  
1 1 1 7  6  13 o 582.5706 11.56493  226.9888       8.977696      224.9947       12.56054      229.0715       12.83673      578.6902 16.30503  583.8502 16.51643  -5.159973      23.20876  
1 1 1 7  6  14 o 428.3811 8.632671  122.5236       4.927754      115.8451       8.020572      126.5732       6.245545      415.4964 14.50880  435.1478 10.77110  -19.65137      18.06992  
1 1 1 7  6  15 o 447.6461 8.877832  133.7975       5.295601      137.0207       7.100292      129.7569       7.949708      452.4837 11.78609  439.9965 13.57526  12.48721       17.97775  
1 1 1 7  6  16 o 534.7147 7.467899  190.7764       5.321011      205.0854       8.812318      182.5660       6.675257      553.7736 11.94220  522.8345 9.581428  30.93903       15.31078  
1 1 1 7  6  17 o 239.8903 7.242842  38.42778       2.312584      35.08781       3.719105      40.53328       2.952863      228.7236 12.24730  246.2318 9.014869  -17.50821      15.20738  
1 1 1 7  6  18 o 393.3682 7.455611  103.2438       3.908013      106.1015       5.444489      100.2066       5.612886      398.3887 10.26452  387.0729 10.89311  11.31580       14.96730  
1 1 1 7  6  19 o 331.9140 9.465013  73.63927       4.181928      77.09843       5.581312      69.21142       6.314623      339.2412 12.36749  321.0079 14.80229  18.23331       19.28893  
1 1 1 7  6  20 o 40.05983 12.07629  1.081657       0.6978813     0.8308082      0.7522522     2.631192       1.869639      36.91578 12.67104  62.92285 19.90707  -26.00707      23.59760  
1 1 1 7  6  21 o 264.1368 9.687423  46.70859       3.403881      47.18958       5.640611      46.43312       4.268759      264.3858 16.08699  262.9827 12.21487  1.403137       20.19887  
1 1 1 7  6  22 o 175.7852 9.893312  20.74539       2.308028      19.50992       2.853847      23.08133       3.924136      170.0281 12.68757  184.3407 16.13790  -14.31255      20.52819  
1 1 1 7  6  23 f 225.1830 15.79586  34.44366       4.709655      34.44366       4.709655      0.000000       0.000000      225.1830 15.79586  ?        ?         0.000000       15.79586  
1 1 1 7  6  24 o 70.31700 17.72954  3.499806       1.660595      1.311246       2.162853      6.642510       2.591788      53.94200 20.97156  96.58357 20.75671  -42.64157      29.50674  
1 1 1 7  6  25 o 228.4012 11.35723  35.24714       3.445718      35.51437       4.192213      34.69067       6.049534      228.5046 13.83291  223.0995 20.58116  5.405075       24.79786  
1 1 1 7  6  26 o 122.4450 14.20059  10.33647       2.274059      7.126016       3.435643      12.83973       3.033736      98.08713 25.90559  135.6761 17.16379  -37.58897      31.07564  
1 1 1 7  6  27 o 133.3595 10.66172  12.09519       1.878864      12.02996       4.247336      12.11105       2.094991      127.1139 25.95431  133.1074 11.93819  -5.993492      28.56828  
1 1 1 7  6  28 o 166.0730 12.16698  18.88755       2.673813      20.28313       4.259073      17.97972       3.435095      168.8125 19.27902  160.3003 16.30849  8.512177       25.25168  
1 1 1 7  6  29 f 111.8759 18.21647  9.058153       2.622305      8.139401       2.826989      14.72238       7.019326      104.6201 21.00890  128.4446 38.20179  -23.82450      43.59760  
1 1 1 7  6  30 o 38.35389 14.60423  0.7758164      1.033668      1.945634       1.718951      0.1131980      1.293708      53.87193 19.10939  35.89701 15.31948  17.97491       24.49195  
1 1 1 7  6  31 o 79.95442 22.00145  5.137801       2.417486      4.843706       3.216433      5.519646       3.665001      76.30173 26.20062  80.19016 27.94663  -3.888420      38.30779  
1 1 1 7  6  32 o 81.60919 25.74248  6.033020       3.128514      5.705493       3.314483      8.708465       9.473057      78.78247 26.60516  83.42842 38.13284  -4.645950      46.49675  
1 1 1 7  6  33 o 46.58767 22.24726  -1.966125      3.867844      -1.966125      3.867844      0.000000       0.000000      46.58767 22.24726  ?        ?         0.000000       22.24726  
1 1 1 7  6  34 o 39.87703 18.64826  -0.8674599     2.464455      -2.404905      3.520928      0.6092361      3.450665      42.50412 20.53441  49.86992 22.87664  -7.365791      30.74090  
1 1 1 7  6  35 o 43.96730 20.29390  0.1470974      2.774797      0.9832259      3.255232      -2.075095      5.306843      48.62209 22.27257  48.49732 23.81516  0.1247749      32.60719  
1 1 1 7  6  36 f 23.18729 10.37683  -0.1428600     0.6588864     -0.3084406     0.6818468     2.192254       2.560566      22.34787 10.22062  49.97005 21.44378  -27.62218      23.75493  
1 1 1 7  7  0  o 262.7153 12.31408  46.34009       4.289176      46.34009       4.289176      46.34009       4.289176      262.7153 12.31408  262.7153 12.31408  -0.000000      0.000000  
1 1 1 7  7  1  o 608.1406 17.70137  247.8039       14.32921      247.8039       14.32921      0.000000       0.000000      608.1406 17.70137  ?        ?         0.000000       17.70137  
1 1 1 7  7  2  o 263.1814 6.601256  46.20877       2.313196      40.29140       4.429969      48.42705       2.712339      245.1827 13.61274  269.3742 7.563881  -24.19145      15.57302  
1 1 1 7  7  3  o 961.5079 15.33091  618.3099       19.64240      617.8035       27.36487      618.8481       28.21156      959.3813 21.40565  959.9737 22.05435  -0.5923462     30.73429  
1 1 1 7  7  4  o 458.9983 7.774751  140.5115       4.755225      139.9162       8.055691      140.8298       5.891096      457.3905 13.23119  459.3925 9.623624  -2.002014      16.36088  
1 1 1 7  7  5  o 363.4059 6.842604  88.06328       3.313499      90.28461       4.255848      84.64412       5.280049      367.8658 8.682070  355.8589 11.14866  12.00684       14.13050  
1 1 1 7  7  6  o 218.7044 7.071716  31.93277       2.058186      33.00506       2.494787      29.64770       3.641900      222.2563 8.439088  210.1939 13.06735  12.06242       15.55551  
1 1 1 7  7  7  o 223.6224 9.010238  33.42999       2.679383      33.62820       2.932499      32.42824       6.592630      224.2131 9.839255  218.2030 23.02034  6.010040       25.03492  
1 1 1 7  7  8  o 349.3066 9.102525  81.50553       4.233231      82.58571       4.780659      77.58270       9.110456      351.4970 10.21772  339.0373 20.25836  12.45972       22.68926  
1 1 1 7  7  9  o 163.5451 5.302980  17.85169       1.154135      16.98824       1.363582      20.03275       2.167189      159.4691 6.430176  172.9514 9.439494  -13.48236      11.42152  
1 1 1 7  7  10 o 136.6030 1.265486  12.43320       0.2303516     12.40869       0.2323440     13.84381       1.762732      136.4682 1.277692  143.6855 9.255852  -7.217209      9.343623  
1 1 1 7  7  11 o 422.4689 7.048358  119.0781       3.967859      120.5892       5.297471      117.1470       5.988689      424.9179 9.355996  418.5107 10.74759  6.407135       14.24940  
1 1 1 7  7  12 o 151.4679 5.757032  15.32215       1.159849      13.97707       2.349254      15.75568       1.333732      144.0035 12.36239  153.5472 6.533518  -9.543640      13.98268  
1 1 1 7  7  13 o 213.4334 5.048815  30.37246       1.435904      28.33814       1.643016      36.95005       2.954372      206.0448 5.990567  235.0130 9.453377  -28.96820      11.19166  
1 1 1 7  7  14 o 328.3377 6.488504  71.90999       2.838827      70.82941       5.140376      72.38418       3.405210      325.2035 11.88220  329.3363 7.759447  -4.132874      14.19140  
1 1 1 7  7  15 o 421.8372 9.580121  118.8464       5.385046      127.6688       8.218830      112.2100       7.128280      436.3643 14.15344  409.2552 13.08808  27.10916       19.27739  
1 1 1 7  7  16 o 521.4075 11.22377  181.7176       7.798114      176.6124       8.899868      198.5925       16.18076      513.5841 13.01513  542.0242 22.45163  -28.44012      25.95129  
1 1 1 7  7  17 o 299.4440 6.950081  59.81473       2.773186      59.37647       3.634144      60.42572       4.290931      298.0703 9.160637  300.5244 10.73238  -2.454010      14.11033  
1 1 1 7  7  18 f 180.7000 9.559385  21.86808       2.293580      24.00583       3.034880      19.02106       3.502331      189.0689 12.10981  167.6747 15.86395  21.39412       19.95776  
1 1 1 7  7  19 o 238.2612 6.990508  37.90811       2.217000      36.05494       3.792772      38.86993       2.732417      231.7985 12.32356  241.1370 8.517108  -9.338440      14.98036  
1 1 1 7  7  20 o 259.8815 6.652204  45.09411       2.301746      41.27863       3.695934      47.51157       2.941909      248.1387 11.20672  266.6066 8.291116  -18.46790      13.94034  
1 1 1 7  7  21 o 125.3164 17.34033  10.78504       2.818094      11.53839       4.808147      10.39083       3.478128      127.0202 29.04147  121.8577 22.23918  5.162529       36.57852  
1 1 1 7  7  22 o 360.3448 11.30904  87.16920       5.423499      99.46934       9.189892      80.59576       6.718179      382.7621 18.06907  345.5981 14.62140  37.16403       23.24385  
1 1 1 7  7  23 o 103.6202 15.47631  7.416482       2.071513      8.122899       2.518425      5.938711       3.642522      107.8866 18.16263  91.51190 27.59008  16.37473       33.03171  
1 1 1 7  7  24 o 154.1912 10.89450  16.06828       2.224002      14.75375       3.061700      17.53671       3.235958      146.5144 15.93886  160.0370 15.36277  -13.52264      22.13734  
1 1 1 7  7  25 o 177.4812 10.15053  21.26468       2.390560      21.54895       2.962191      20.73375       4.048239      178.0542 12.56567  172.9214 17.82393  5.132874       21.80799  
1 1 1 7  7  26 o 280.5711 13.02243  53.59202       4.855371      52.54947       5.466919      57.48547       10.56481      276.9287 14.86951  279.5115 28.77607  -2.582733      32.39080  
1 1 1 7  7  27 o 49.22638 20.73253  0.4140974      2.317366      -0.3085687     3.412381      1.032642       3.156998      55.18752 24.20618  59.01067 24.47654  -3.823143      34.42441  
1 1 1 7  7  28 o 37.24988 15.24715  0.3935433      1.203744      4.386236       3.065255      -0.3344746     1.308895      77.48782 25.57340  33.60195 14.85488  43.88588       29.57476  
1 1 1 7  7  29 o 64.75398 18.79423  3.083037       1.716647      2.980227       3.181979      3.125244       2.038793      67.85610 25.67313  65.42974 20.79881  2.426361       33.04089  
1 1 1 7  7  30 o 110.3961 17.31875  8.957305       2.463926      9.602837       3.278753      8.119790       3.734618      110.6881 22.98241  98.49355 27.43945  12.19454       35.79266  
1 1 1 7  7  31 o 39.23419 15.45820  0.7619983      1.188237      1.614764       2.799802      0.5746590      1.312281      55.84066 23.09577  38.91633 15.92338  16.92432       28.05296  
1 1 1 7  7  32 o 43.27147 20.21945  -1.319617      2.887682      -2.507708      3.114361      5.962171       7.710157      41.68048 19.92007  75.82407 34.55937  -34.14359      39.88934  
1 1 1 7  7  33 o 47.37047 22.25375  -0.8287848     3.578086      -0.7492473     3.889177      -1.267139      9.130282      49.05172 23.09263  61.34057 30.33274  -12.28885      38.12276  
1 1 1 7  7  34 o 40.57073 16.65519  0.9114966      1.441673      1.735397       1.562579      -3.802874      3.737805      47.50620 17.98697  40.75419 20.00756  6.752007       26.90415  
1 1 1 7  7  35 o 73.91773 18.49825  4.874933       1.817481      5.289555       1.899978      0.4090604      6.235560      76.88802 18.72198  53.11791 26.02891  23.77011       32.06270  
1 1 1 7  7  36 o 17.08259 8.702411  -4.073449      1.106443      -5.677955      1.211484      3.994063       2.716545      ?        ?         59.07275 23.34248  0.000000       23.34248  
1 1 1 7  8  0  o 479.7884 12.46962  153.8934       7.959999      153.8934       7.959999      153.8934       7.959999      479.7884 12.46962  479.7884 12.46962  -0.000000      0.000000  
1 1 1 7  8  1  o 364.1337 13.27898  88.73795       6.432373      94.13551       8.112668      79.60022       10.55564      374.6444 16.28959  343.2305 23.21604  31.41385       28.36080  
1 1 1 7  8  2  o 255.3432 4.402051  43.45569       1.497797      44.34387       1.819147      41.58635       2.639139      257.9190 5.293110  249.5645 7.946206  8.354477       9.547733  
1 1 1 7  8  3  o 359.5034 9.545694  86.31883       4.568773      97.40817       8.330311      81.54815       5.463848      381.0354 16.44547  349.1976 11.75909  31.83777       20.21706  
1 1 1 7  8  4  o 356.4226 5.003579  84.68217       2.376400      94.76521       3.264471      73.31540       3.466053      376.9804 6.498610  331.5185 7.846101  45.46191       10.18790  
1 1 1 7  8  5  o 228.6915 6.308511  34.90153       1.920593      36.00069       3.130430      34.23805       2.432127      231.9749 10.15179  226.3882 8.075234  5.586624       12.97182  
1 1 1 7  8  6  o 446.2321 9.264739  132.9272       5.508934      137.0320       6.614735      123.6351       9.952322      452.8929 10.96083  428.9406 17.44863  23.95230       20.60569  
1 1 1 7  8  7  o 169.4436 4.176925  19.13707       0.9430945     17.19672       1.276467      21.46942       1.399479      160.4776 5.979733  179.3403 5.864074  -18.86270      8.375235  
1 1 1 7  8  8  o 160.7784 5.664611  17.25810       1.211692      16.45206       1.904351      17.80640       1.570644      156.7065 9.159757  163.2113 7.239962  -6.504730      11.67554  
1 1 1 7  8  9  o 578.0994 9.725100  223.2303       7.491523      231.4978       12.47136      218.5628       9.370543      587.2359 15.95255  571.5882 12.30291  15.64771       20.14561  
1 1 1 7  8  10 f 230.6322 3.674228  35.45242       1.129171      37.37982       1.299406      29.50827       2.281938      236.8071 4.117906  210.0987 8.166480  26.70845       9.145958  
1 1 1 7  8  11 o 14.74662 7.208913  -0.9014856     0.4698071     -0.7272301     0.5367351     -1.472419      0.9715376     17.37923 8.295969  22.69083 10.91806  -5.311600      13.71230  
1 1 1 7  8  12 o 519.9960 11.36029  180.8032       7.871602      180.1456       11.37758      181.4071       10.90190      517.7592 16.51218  519.7682 15.75872  -2.009033      22.82519  
1 1 1 7  8  13 o 238.7172 8.181199  38.08156       2.598555      37.73059       2.905871      39.48257       5.805769      237.5190 9.198695  241.6796 18.16079  -4.160583      20.35756  
1 1 1 7  8  14 o 439.0680 10.27100  128.7990       6.009220      123.9273       7.551214      137.2122       9.923314      430.0981 13.19136  451.8964 16.50725  -21.79828      21.13058  
1 1 1 7  8  15 o 385.9633 8.594821  99.43864       4.420348      101.8489       6.963905      97.81226       5.720530      389.8564 13.42527  382.3748 11.23945  7.481659       17.50895  
1 1 1 7  8  16 o 327.4392 5.087522  71.48043       2.219783      71.18768       4.283097      71.58794       2.595571      326.3280 9.861172  327.6465 5.945028  -1.318420      11.51460  
1 1 1 7  8  17 o 146.6204 5.663398  14.35604       1.104403      14.79677       1.700056      14.03425       1.452677      148.6360 8.620521  144.8334 7.553190  3.802582       11.46142  
1 1 1 7  8  18 o 425.1101 9.463112  120.7030       5.360545      124.7798       7.368164      116.1186       7.813317      431.5972 12.82594  416.0971 14.11225  15.50006       19.06988  
1 1 1 7  8  19 o 148.4866 8.590979  14.77269       1.692565      14.50105       2.172728      15.19197       2.699386      146.8212 11.18991  149.9564 13.65885  -3.135178      17.65725  
1 1 1 7  8  20 o 276.6760 8.530959  51.18885       3.141403      45.75873       4.839500      55.14291       4.129684      260.7516 13.97946  286.8600 10.82313  -26.10834      17.67952  
1 1 1 7  8  21 f 151.0573 8.021642  15.29065       1.608861      7.426054       7.320648      15.68978       1.649181      108.8238 39.33711  153.0111 8.117620  -44.18730      40.16595  
1 1 1 7  8  22 o 258.6019 9.620582  44.85791       3.309397      45.72947       6.124874      44.49855       3.932926      259.0031 17.85602  257.1909 11.50502  1.812195       21.24154  
1 1 1 7  8  23 o 121.7854 12.08842  10.08098       1.935861      14.71320       2.679018      5.019271       2.800459      146.9655 13.84307  83.93102 23.89524  63.03445       27.61545  
1 1 1 7  8  24 o 388.9602 11.60658  102.0798       6.008925      100.6979       6.345197      114.0910       18.70642      385.9950 12.35234  390.6224 36.35589  -4.627350      38.39702  
1 1 1 7  8  25 o 286.6394 10.14009  55.40410       3.866933      52.85172       4.848156      59.86723       6.410963      278.8418 13.08453  295.1885 16.36262  -16.34677      20.95090  
1 1 1 7  8  26 o 215.5727 11.04486  31.50770       3.162114      29.43126       3.704916      37.07780       6.068070      207.4504 13.47557  229.5277 20.04081  -22.07727      24.15005  
1 1 1 7  8  27 o 97.96635 16.16126  6.791675       2.036223      6.661177       2.457880      7.077204       3.635671      95.68920 19.92470  96.37537 27.15474  -0.6861725     33.68046  
1 1 1 7  8  28 o 152.2957 12.63656  16.00266       2.541357      14.68684       5.795982      16.31584       2.827669      133.6775 32.79084  153.1968 14.00658  -19.51929      35.65702  
1 1 1 7  8  29 o 66.52679 16.15906  3.246007       1.418067      2.914713       2.557339      3.393102       1.704044      64.75850 23.27048  67.52892 18.42760  -2.770424      29.68318  
1 1 1 7  8  30 o 81.92454 15.29017  4.920046       1.607791      4.816235       1.735961      5.546203       4.263435      80.35014 16.75694  81.12218 29.91053  -0.7720490     34.28461  
1 1 1 7  8  31 f 75.31099 11.61117  4.064320       1.127816      8.074996       1.706541      0.9542663      1.502767      106.2665 12.27716  43.28400 17.27762  62.98251       21.19539  
1 1 1 7  8  32 o 88.98707 15.71697  6.090362       1.795542      6.299138       1.913878      4.556993       5.186775      89.86330 16.59416  69.44246 30.16098  20.42085       34.42457  
1 1 1 7  8  33 o 36.13575 14.83370  0.5937631      1.143497      0.4484206      1.173660      3.312954       5.076518      35.28456 14.80108  62.14254 28.21360  -26.85798      31.86031  
1 1 1 7  8  34 o 59.56406 15.06415  2.871762       1.196237      3.050132       1.237110      0.3054286      4.692490      61.32663 15.21252  51.98110 24.73351  9.345531       29.03735  
1 1 1 7  8  35 o 74.76774 13.90832  4.460691       1.334694      4.555914       1.366640      2.495028       6.209240      75.38830 14.12316  55.23056 26.82129  20.15774       30.31246  
1 1 1 7  9  0  o 529.3207 22.78243  188.7534       16.00123      188.7534       16.00123      188.7534       16.00123      529.3207 22.78243  529.3207 22.78243  -0.000000      0.000000  
1 1 1 7  9  1  o 153.7353 0.7257974 15.74693       0.1486834     15.74693       0.1486834     0.000000       0.000000      153.7353 0.7257974 ?        ?         0.000000       0.7257974 
1 1 1 7  9  2  o 616.7331 4.537889  253.5341       3.729277      234.5459       33.33619      253.7748       3.752833      579.8761 43.45884  617.0241 4.564399  -37.14801      43.69787  
1 1 1 7  9  3  o 65.74194 0.6038370 2.879599       0.5289757E-01 3.637320       0.1170710     2.685217       0.5929569E-01 73.88598 1.189087  63.48418 0.7009453 10.40180       1.380309  
1 1 1 7  9  4  o 112.0036 2.284711  8.359116       0.3409862     8.468994       0.3660753     7.638934       0.9372067     112.7364 2.436872  106.8181 6.616899  5.918312       7.051362  
1 1 1 7  9  5  o 453.0585 8.439934  136.9932       5.095266      136.6918       8.463007      137.1646       6.381459      451.6523 14.07919  453.1207 10.56897  -1.468353      17.60473  
1 1 1 7  9  6  o 645.6577 13.65113  279.0568       11.74477      283.1814       16.00012      274.2379       17.29452      648.8742 18.52397  637.9090 20.37199  10.96521       27.53462  
1 1 1 7  9  7  o 348.3852 5.858446  80.93919       2.719666      82.04548       3.163723      77.80709       5.323305      350.7044 6.769922  340.9107 11.73587  9.793732       13.54852  
1 1 1 7  9  8  o 237.8740 6.361691  37.76786       2.014666      37.57040       2.394247      38.24676       3.728668      237.1605 7.585989  238.8622 11.75081  -1.701736      13.98674  
1 1 1 7  9  9  f 156.5718 7.688167  16.39938       1.599115      15.00432       2.365878      17.57278       2.169804      149.2925 11.99354  161.8608 10.11066  -12.56828      15.68663  
1 1 1 7  9  10 o 142.5853 5.673373  13.57904       1.075776      12.73253       1.209485      16.78514       2.353817      137.9995 6.596427  158.0479 11.25017  -20.04836      13.04144  
1 1 1 7  9  11 o 228.8856 1.158295  34.90573       0.3532737     34.82751       0.3551818     42.12645       3.412691      228.6290 1.165859  250.8815 10.22979  -22.25252      10.29601  
1 1 1 7  9  12 o 371.9302 14.51118  92.83088       7.178002      99.09160       7.830186      59.87501       17.96497      384.1284 15.32834  287.4671 48.63161  96.66138       50.99011  
1 1 1 7  9  13 o 294.9997 8.942312  58.15527       3.511101      57.55117       3.968911      60.33003       7.530446      293.3331 10.16937  298.9227 19.00390  -5.589661      21.55375  
1 1 1 7  9  14 o 138.9101 6.057669  12.89253       1.118581      12.29962       1.209722      16.38851       2.937481      135.6270 6.714576  155.7867 14.31022  -20.15979      15.80721  
1 1 1 7  9  15 o 475.8660 10.29383  151.2725       6.527327      150.6385       8.234672      152.3443       10.70652      474.3127 13.04128  476.1924 16.89980  -1.879700      21.34662  
1 1 1 7  9  16 o 192.4852 5.396129  24.72283       1.382688      26.81786       2.028486      22.90465       1.889714      200.3366 7.612528  185.1165 7.677524  15.22011       10.81180  
1 1 1 7  9  17 o 563.0707 4.271683  211.3401       3.205055      197.5123       13.24698      212.1999       3.303195      541.7203 18.37797  564.2070 4.393617  -22.48663      18.89586  
1 1 1 7  9  18 o 558.3770 12.08491  208.6353       8.991756      212.0477       11.01377      201.8148       15.57088      562.1478 14.71586  546.2341 21.43407  15.91364       25.99954  
1 1 1 7  9  19 o 253.5871 7.141471  42.95511       2.410769      39.39611       4.123790      44.80293       2.971411      242.1370 12.82667  258.8376 8.627186  -16.70053      15.45806  
1 1 1 7  9  20 o 198.7906 10.87937  26.53988       2.870875      25.58372       4.245764      27.34528       3.896716      194.1422 16.57028  201.1561 14.63775  -7.013870      22.10968  
1 1 1 7  9  21 o 83.59500 13.61058  4.819412       1.463999      14.06884       5.071774      3.978676       1.529088      140.1308 28.13977  75.41753 15.72559  64.71326       32.23571  
1 1 1 7  9  22 o 63.13095 15.36124  2.802864       1.279774      2.867015       2.148009      2.767561       1.593470      65.58957 21.39484  63.00599 18.05294  2.583580       27.99371  
1 1 1 7  9  23 o 69.32296 13.85485  3.362412       1.235046      3.635823       1.582848      2.936888       1.974667      71.66292 16.85932  65.39117 20.42701  6.271744       26.48583  
1 1 1 7  9  24 o 135.1988 10.09316  12.36463       1.805212      11.54784       1.945863      17.40978       4.836069      130.3760 11.31244  155.8347 24.06333  -25.45877      26.58976  
1 1 1 7  9  25 o 18.20314 8.795491  -1.030009      0.6465444     -1.305000      0.6784621     1.688090       2.133042      17.63867 8.631262  55.82207 21.04211  -38.18340      22.74355  
1 1 1 7  9  26 o 163.8914 9.573442  18.17352       2.081626      19.36399       2.356371      13.94286       4.442093      168.9282 10.52032  137.2950 25.20932  31.63324       27.31642  
1 1 1 7  9  27 o 61.94660 11.08838  2.681603       0.8816811     3.131561       0.9338775     -1.009394      2.674704      67.13158 10.80649  45.86842 20.68524  21.26316       23.33794  
1 1 1 7  9  28 o 22.21076 9.646606  -0.7313325E-01 0.5305624     -0.7313325E-01 0.5305624     0.000000       0.000000      22.21076 9.646606  ?        ?         0.000000       9.646606  
1 1 1 7  9  29 o 68.93082 17.96165  3.561479       1.666181      0.2010955      10.08828      3.655714       1.689381      80.90096 37.79920  69.81026 18.03391  11.09071       41.88080  
1 1 1 7  9  30 o 54.58032 13.04080  2.180297       0.9354492     2.236611       0.9484718     0.1716704      5.664552      55.27634 13.08179  64.21632 29.40271  -8.939976      32.18155  
1 1 1 7  9  31 o 29.01114 11.73379  0.3147251      0.7028679     1.418829       0.9547374     -0.9917490     1.038555      44.18294 14.25233  25.23050 11.89503  18.95244       18.56396  
1 1 1 7  9  32 o 24.98935 11.34890  -0.3575773     0.8221547     1.215235       1.060517      -2.726616      1.301563      41.66684 14.98386  22.86115 11.33107  18.80569       18.78587  
1 1 1 7  9  33 o 28.33378 12.36054  0.1266297E-01  0.8792454     -0.1193383     0.9083855     1.971636       3.499415      27.77957 12.32322  54.70331 24.23116  -26.92374      27.18475  
1 1 1 7  9  34 o 23.96063 11.21343  -0.6613222     0.8938618     -0.6945623     0.9503391     -0.4063344     2.632131      24.66368 11.54886  41.49426 19.36098  -16.83059      22.54382  
1 1 1 7  9  35 o 24.97533 11.21097  -0.1640358     0.7754526     -0.2443465     0.7961231     1.322577       3.425250      24.73191 11.20649  48.62603 22.48076  -23.89412      25.11912  
1 1 1 7  10 0  o 763.6330 28.85352  394.1221       29.26476      394.1221       29.26476      394.1221       29.26476      763.6330 28.85352  763.6330 28.85352  0.000000       0.000000  
1 1 1 7  10 1  o 137.8996 0.7911037 12.66998       0.1453683     12.66998       0.1453683     0.000000       0.000000      137.8996 0.7911037 ?        ?         0.000000       0.7911037 
1 1 1 7  10 2  o 368.4175 5.868214  90.51009       2.880844      101.8750       4.630430      83.33289       3.679735      390.6463 8.895371  353.3913 7.814248  37.25504       11.84019  
1 1 1 7  10 3  o 227.0639 6.418402  34.41449       1.940048      32.74861       3.509561      35.14755       2.328093      220.9816 11.96315  229.3850 7.627216  -8.403458      14.18772  
1 1 1 7  10 4  o 453.4867 8.443489  137.2727       5.102230      140.6183       8.623313      135.4705       6.328944      457.9930 14.14695  450.2644 10.54848  7.728577       17.64672  
1 1 1 7  10 5  o 265.0228 5.680349  46.83624       2.006004      44.98306       3.269233      47.95530       2.540480      259.3572 9.475555  268.0105 7.119921  -8.653320      11.85240  
1 1 1 7  10 6  o 197.6601 6.672582  26.09122       1.754945      26.08055       2.193434      26.11022       2.925493      197.4891 8.353911  197.3186 11.17212  0.1705627      13.95006  
1 1 1 7  10 7  f 249.6248 6.762691  41.59917       2.247401      41.47255       2.426444      42.36343       5.961213      249.2021 7.315016  250.4147 17.98470  -1.212570      19.41543  
1 1 1 7  10 8  o 237.3808 5.470093  37.57473       1.730270      40.87034       2.261500      32.92192       2.687115      247.4181 6.866124  221.8490 9.109197  25.56909       11.40706  
1 1 1 7  10 9  o 329.9555 6.640010  72.62435       2.919427      72.34683       4.496137      72.82664       3.838745      328.8874 10.27192  330.1537 8.733355  -1.266296      13.48272  
1 1 1 7  10 10 o 262.4038 6.702024  45.96208       2.341500      48.37310       3.372273      43.71767       3.253671      268.9605 9.423934  255.6595 9.567647  13.30107       13.42946  
1 1 1 7  10 11 o 423.8232 7.916299  119.8765       4.470750      118.2986       5.390774      123.3526       8.001289      420.8590 9.612602  428.9398 14.01760  -8.080750      16.99692  
1 1 1 7  10 12 o 270.0083 11.64363  48.83268       4.179429      50.61009       5.353557      46.05886       6.687861      274.4620 14.69170  260.9706 19.37000  13.49139       24.31138  
1 1 1 7  10 13 o 366.2874 8.639004  89.55732       4.216568      90.95306       5.459395      87.49375       6.638214      368.7376 11.12373  361.2567 13.81538  7.480896       17.73703  
1 1 1 7  10 14 o 479.3202 8.582817  153.3504       5.481874      152.1582       6.386582      156.6872       10.68431      477.2933 10.04176  483.0206 16.62474  -5.727264      19.42213  
1 1 1 7  10 15 o 326.8525 7.490535  71.27833       3.262408      73.98971       4.173316      67.01775       5.231433      332.7428 9.421857  316.3022 12.43633  16.44052       15.60236  
1 1 1 7  10 16 o 75.41163 4.740660  3.806155       0.4739665     4.678538       1.110607      3.611889       0.5240886     83.05895 10.25196  73.40267 5.395915  9.656281       11.58527  
1 1 1 7  10 17 o 377.7691 6.485846  95.19814       3.264875      105.3219       5.659770      90.14922       3.996931      396.7857 10.71438  367.4837 8.162346  29.30197       13.46929  
1 1 1 7  10 18 o 434.0089 7.229276  125.7192       4.180872      121.9123       7.002304      127.8281       5.211833      426.4993 12.33405  437.4313 8.941433  -10.93207      15.23410  
1 1 1 7  10 19 o 47.71726 8.449118  1.566505       0.5175716     2.313475       0.8643832     1.149004       0.6462240     57.74805 11.63557  40.85021 11.42653  16.89784       16.30804  
1 1 1 7  10 20 o 163.9844 5.280683  17.95975       1.152390      16.69026       1.847434      18.76832       1.474397      157.7242 8.825363  167.5256 6.617823  -9.801346      11.03098  
1 1 1 7  10 21 o 335.1901 8.293859  75.17358       3.704430      76.56133       5.690485      74.15294       4.880099      337.0845 12.69151  332.1867 11.04019  4.897827       16.82142  
1 1 1 7  10 22 o 243.1635 7.379668  39.59237       2.388393      38.60799       3.024071      41.22446       3.893872      239.7281 9.485442  247.1657 11.85737  -7.437561      15.18456  
1 1 1 7  10 23 o 200.1698 7.163311  26.85330       1.907591      24.42951       2.810527      28.92363       2.597527      190.1059 11.14364  207.3150 9.427438  -17.20911      14.59649  
1 1 1 7  10 24 o 234.9953 7.454211  37.04881       2.331228      37.76037       3.225331      36.27042       3.373355      236.5175 10.25821  231.5820 10.96272  4.935577       15.01373  
1 1 1 7  10 25 o 184.1793 6.072901  22.72855       1.488389      23.36077       1.660566      20.14536       3.356614      186.6151 6.688655  170.9619 14.88243  15.65323       16.31640  
1 1 1 7  10 26 o 212.3785 6.807636  30.28573       1.924062      30.56119       2.149670      29.17617       4.314364      213.1458 7.580778  204.9438 15.92308  8.201920       17.63555  
1 1 1 7  10 27 f 98.27057 7.629525  6.539936       0.9912453     5.983804       1.036306      12.52092       3.398485      93.81397 8.377928  131.1972 20.07719  -37.38319      21.75507  
1 1 1 7  10 28 o 154.6461 8.763209  16.26856       1.798435      16.07809       1.827954      22.02369       10.04785      153.6615 8.966392  142.9982 46.24530  10.66330       47.10652  
1 1 1 7  10 29 o 110.2606 11.64247  8.515238       1.684765      2.614302       5.267864      9.187582       1.778156      71.21283 30.66118  114.4843 11.82605  -43.27146      32.86279  
1 1 1 7  10 30 f 43.67131 10.29544  1.374234       0.5892822     2.127048       0.6395917     -2.854171      1.515819      54.95934 9.048083  25.71412 12.64723  29.24521       15.55057  
1 1 1 7  10 31 f 32.79950 10.25521  0.7573897      0.4975891     0.8017968      0.5019198     -1.782725      3.796073      33.59556 10.26512  47.51596 22.50327  -13.92041      24.73398  
1 1 1 7  10 32 o 15.60106 7.897746  -2.718797      0.8157738     1.221349       4.450998      -2.855751      0.8298303     55.93279 25.77583  15.53526 7.875525  40.39753       26.95213  
1 1 1 7  10 33 o 36.58303 17.57336  -1.977904      2.493025      4.426559       4.588338      -4.660593      2.969608      63.20628 27.88328  34.46133 17.08675  28.74495       32.70220  
1 1 1 7  10 34 o 65.34934 24.61550  4.877041       2.917841      10.72742       5.717096      2.816385       3.393020      75.75833 32.26353  54.61982 24.04115  21.13851       40.23571  
1 1 1 7  11 0  o 21.94527 15.21341  -1.312041      1.540740      -1.312041      1.540740      -1.312041      1.540740      21.94527 15.21341  21.94527 15.21341  -0.000000      0.000000  
1 1 1 7  11 1  o 140.0329 0.8029383 13.06505       0.1498255     13.05468       0.1502697     14.81102       1.950103      139.9773 0.8056384 148.5765 9.906545  -8.599167      9.939250  
1 1 1 7  11 2  o 335.1572 13.06722  75.29527       5.824681      75.29527       5.824681      0.000000       0.000000      335.1572 13.06722  ?        ?         0.000000       13.06722  
1 1 1 7  11 3  o 941.3015 18.40273  595.7317       23.08259      584.6517       27.73893      620.6785       41.62247      930.4960 22.37184  950.8854 32.89886  -20.38934      39.78485  
1 1 1 7  11 4  o 440.7144 12.42652  130.0561       7.290318      123.4776       16.57246      131.6347       8.117996      424.5280 29.47902  443.1327 13.76475  -18.60471      32.53431  
1 1 1 7  11 5  o 150.6998 5.307446  15.16156       1.064127      15.57628       1.986005      14.99455       1.260311      152.3830 9.833200  149.8025 6.327969  2.580521       11.69337  
1 1 1 7  11 6  o 526.6033 8.741378  185.1488       6.133904      177.3629       8.363031      194.2139       9.023915      514.9031 12.18890  538.7388 12.57023  -23.83563      17.50943  
1 1 1 7  11 7  o 352.1100 8.163516  82.75402       3.830268      81.17793       4.375398      87.92326       7.923915      348.5086 9.430393  361.5647 16.49017  -13.05609      18.99626  
1 1 1 7  11 8  o 502.9657 8.172134  168.8521       5.477058      167.7047       7.683110      170.0376       7.809906      500.8083 11.51309  504.2621 11.62294  -3.453827      16.35983  
1 1 1 7  11 9  o 370.8850 5.893928  91.73241       2.912846      89.34681       3.872114      94.84231       4.421017      365.8929 7.941831  376.9055 8.802704  -11.01263      11.85581  
1 1 1 7  11 10 o 139.4970 6.237661  13.00381       1.156539      12.88835       1.345341      13.33076       2.263891      138.7981 7.299698  140.6609 12.19886  -1.862854      14.21611  
1 1 1 7  11 11 o 559.8973 9.471441  209.3344       7.066396      207.2082       7.923666      217.5961       15.61937      556.8765 10.67809  568.0714 20.66863  -11.19489      23.26401  
1 1 1 7  11 12 o 172.2738 8.351645  19.85373       1.911476      19.47374       2.098567      21.70431       4.631166      170.5324 9.269973  178.5676 19.79531  -8.035217      21.85833  
1 1 1 7  11 13 o 379.3442 8.974911  96.06590       4.536669      97.70148       4.957760      87.64610       11.24864      382.3698 9.738272  359.5005 23.61228  22.86932       25.54161  
1 1 1 7  11 14 o 253.9848 6.401994  43.05037       2.164962      42.18162       2.590318      45.06348       3.943114      251.3106 7.744390  259.3989 11.43580  -8.088226      13.81134  
1 1 1 7  11 15 o 404.3780 7.436130  109.1064       4.006896      112.0798       4.374876      93.62821       9.981447      409.8033 8.011553  372.3490 20.19287  37.45435       21.72411  
1 1 1 7  11 16 o 382.1784 9.426262  97.56443       4.800419      102.1856       5.807105      87.59195       8.530701      390.7654 11.16389  360.5056 17.81338  30.25977       21.02258  
1 1 1 7  11 17 o 102.3017 3.627280  6.984618       0.4936847     4.989605       0.6655119     9.425777       0.7361748     86.29517 5.821633  118.8088 4.659097  -32.51359      7.456447  
1 1 1 7  11 18 o 104.8803 2.360859  7.330387       0.3299419     9.223237       0.7096924     6.808456       0.3726647     117.5224 4.540396  101.0355 2.770646  16.48695       5.318992  
1 1 1 7  11 19 o 115.5241 1.756873  8.893092       0.2704497     13.09569       1.060516      8.600772       0.2796975     139.9740 5.697773  113.6087 1.847582  26.36531       5.989840  
1 1 1 7  11 20 f 81.26086 2.807426  4.406830       0.3035362     4.531415       0.3291518     3.698573       0.7848008     82.39321 3.003021  73.92638 8.099272  8.466827       8.638075  
1 1 1 7  11 21 o 78.39641 2.912035  4.102964       0.3036763     4.119092       0.3047808     1.889831       3.570300      78.55029 2.916899  67.25980 26.70210  11.29049       26.86094  
1 1 1 7  11 22 o 50.78235 10.03207  1.792428       0.6547666     0.6377750      1.479456      2.073679       0.7301692     42.73647 17.11474  54.65145 10.40644  -11.91498      20.03019  
1 1 1 7  11 23 o 38.91986 14.25680  0.8375032      0.9660686     0.9409332      1.195511      0.6428699      1.639981      42.26794 15.79067  44.36100 17.93016  -2.093060      23.89217  
1 1 1 7  11 24 o 136.1806 7.846101  12.48549       1.417752      14.67944       1.841606      9.293363       2.221380      147.3751 9.427192  115.7820 14.73130  31.59308       17.48952  
1 1 1 7  11 25 o 181.6185 8.174316  22.22062       1.973197      26.50522       2.471753      14.69276       3.276313      198.0516 9.392745  144.6624 17.34158  53.38911       19.72192  
1 1 1 7  11 26 o 88.47677 10.53987  5.381555       1.218218      6.084091       1.572909      4.328409       1.925809      93.45464 12.98071  76.91042 18.92280  16.54422       22.94714  
1 1 1 7  11 27 o 137.6019 14.87038  13.32863       2.683327      14.59282       3.379937      11.17353       4.413002      142.2025 18.25802  117.9450 28.41705  24.25749       33.77698  
1 1 1 7  11 28 o 112.7516 16.89183  9.273723       2.459852      8.685132       2.781246      11.38804       5.271307      107.1223 20.22554  112.4748 33.01596  -5.352501      38.71855  
1 1 1 7  11 29 o 131.2221 13.15392  12.26898       2.269063      11.40492       2.602049      15.01173       4.635913      124.5638 16.04909  132.7267 27.12903  -8.162888      31.52075  
1 1 1 7  11 30 o 31.39614 14.09517  -0.3418405     1.226257      -2.644840      2.376027      0.4942776      1.431655      35.49517 17.07785  39.05354 16.36228  -3.558369      23.65115  
1 1 1 7  11 31 o 41.53952 18.45004  0.1360834      2.042479      0.4472934      2.510296      -0.4734776     3.513231      46.14532 20.47724  48.58681 22.56812  -2.441483      30.47355  
1 1 1 7  11 32 o 55.91983 15.86627  2.528399       1.236790      3.152197       3.151243      2.414814       1.344684      59.31688 24.51504  54.28308 16.84075  5.033798       29.74219  
1 1 1 7  11 33 o 39.19338 18.87387  -1.933032      2.917156      -11.49570      7.295749      -0.1132697     3.182641      45.36056 23.03266  45.39997 21.21828  -0.3940582E-01 31.31643  
1 1 1 7  11 34 o 41.15084 19.45997  -0.5748132     2.818940      1.482124       5.008541      -1.528500      3.410386      52.20780 25.03424  41.68063 20.15433  10.52717       32.13892  
1 1 1 7  12 0  o 482.6543 23.09740  157.3841       14.77715      157.3841       14.77715      157.3841       14.77715      482.6543 23.09740  482.6543 23.09740  -0.000000      0.000000  
1 1 1 7  12 1  o 91.43112 2.531669  5.574934       0.3081458     5.466647       0.3143956     8.217655       1.553153      90.53543 2.608780  110.3757 10.69390  -19.84029      11.00751  
1 1 1 7  12 2  o 411.3951 6.344520  112.8851       3.478014      120.8776       8.481542      111.2694       3.813384      424.3826 15.02205  408.3914 7.007457  15.99121       16.57608  
1 1 1 7  12 3  o 75.55360 11.20281  3.898183       1.093747      3.117076       1.382069      5.207207       1.789156      66.84798 15.77210  86.74709 16.06982  -19.89911      22.51662  
1 1 1 7  12 4  o 364.4354 6.808913  88.59827       3.306526      94.11767       4.742320      83.37661       4.612644      375.2765 9.491057  353.1617 9.811239  22.11481       13.65066  
1 1 1 7  12 5  o 612.5737 4.282155  250.1346       3.495379      247.7092       3.654575      276.1681       11.97328      609.5811 4.499165  642.1369 13.99304  -32.55585      14.69856  
1 1 1 7  12 6  o 421.5432 5.683939  118.4952       3.192751      125.5402       4.120880      107.9156       5.049917      433.7866 7.129192  401.9826 9.427649  31.80392       11.81973  
1 1 1 7  12 7  o 379.3343 8.079763  96.03375       4.084080      99.03714       4.883564      89.04640       7.448816      385.0940 9.516924  364.1460 15.38572  20.94797       18.09122  
1 1 1 7  12 8  o 461.0824 9.182487  141.9477       5.641731      153.0583       7.508062      127.5380       8.550400      478.4585 11.77633  436.0762 14.73584  42.38229       18.86338  
1 1 1 7  12 9  o 206.6910 5.854698  28.51054       1.610875      27.12973       2.079334      30.58323       2.547561      201.4906 7.759050  213.8488 8.959992  -12.35822      11.85261  
1 1 1 7  12 10 o 367.6826 6.204291  90.15714       3.039756      93.37134       3.949682      85.48730       4.760765      374.0678 7.923887  357.6251 10.00004  16.44275       12.75887  
1 1 1 7  12 11 o 348.9952 6.226887  81.22494       2.895769      83.06902       3.517603      77.34746       5.100706      352.8613 7.481164  340.0156 11.27350  12.84573       13.52995  
1 1 1 7  12 12 o 672.2411 10.35896  301.8761       9.279288      297.0066       11.56519      310.6758       15.54688      666.2918 13.02611  680.2084 17.16623  -13.91663      21.54899  
1 1 1 7  12 13 o 305.6671 7.691168  62.38157       3.130181      62.18401       3.314200      64.01383       9.526329      305.1421 8.158172  307.0023 23.46463  -1.860229      24.84240  
1 1 1 7  12 14 o 18.31103 7.652161  0.3693542E-01  0.3119192     0.7718277E-02  0.3139169     2.310634       2.769250      17.94192 7.597295  65.47980 24.11243  -47.53789      25.28099  
1 1 1 7  12 15 o 500.4685 8.680753  167.2444       5.789054      165.1070       6.685486      173.6499       11.57363      497.0682 10.09354  508.0729 17.11949  -11.00476      19.87351  
1 1 1 7  12 16 o 99.77995 5.109969  6.656414       0.6771522     6.848649       0.6939018     2.818060       3.100659      101.2107 5.162203  70.49146 25.58408  30.71921       26.09968  
1 1 1 7  12 17 o ?        ?         -1.523156      0.3775640     -1.358527      1.892209      -1.529983      0.3853124     36.87757 16.92550  ?        ?         0.000000       16.92550  
1 1 1 7  12 18 o 556.3398 10.19002  207.2309       7.554201      196.0582       10.93735      217.4225       10.44608      539.2992 15.23506  568.7021 13.78463  -29.40289      20.54563  
1 1 1 7  12 19 o 118.9642 2.255460  9.431995       0.3575401     10.23976       0.8753268     9.270237       0.3917072     123.7568 5.320386  117.9358 2.492541  5.821037       5.875310  
1 1 1 7  12 20 o 75.76718 2.687510  3.831500       0.2709046     2.499701       0.4610713     4.533667       0.3347872     60.91367 5.748391  82.40716 3.054095  -21.49348      6.509339  
1 1 1 7  12 21 o 119.1690 4.604065  9.492272       0.7297269     8.625116       0.8728788     11.50504       1.329849      113.4757 5.791839  130.8721 7.659213  -17.39642      9.602549  
1 1 1 7  12 22 o 69.32785 4.288332  3.220226       0.3942199     4.364540       0.5009412     1.358694       0.6389241     80.71632 4.677526  44.04406 10.93669  36.67227       11.89498  
1 1 1 7  12 23 o 159.4837 5.323406  17.01929       1.129719      16.38076       1.739755      17.48484       1.485524      155.9587 8.402559  161.4158 6.922623  -5.457123      10.88695  
1 1 1 7  12 24 o 111.8099 3.618296  8.352021       0.5383758     6.956352       0.7492024     9.842257       0.7741680     101.8294 5.542332  121.2668 4.800415  -19.43735      7.332218  
1 1 1 7  12 25 o 193.6444 8.984440  25.34744       2.311981      27.80675       2.817941      20.28272       4.043921      202.3217 10.48820  169.3730 18.20317  32.94873       21.00852  
1 1 1 7  12 26 o 119.9929 6.163377  9.688023       0.9821776     9.275495       1.095631      11.37617       2.216373      117.2258 7.046563  127.9370 13.18972  -10.71120      14.95402  
1 1 1 7  12 27 o 172.5835 12.39150  20.68740       2.830717      19.24615       3.201016      25.85793       6.062988      165.0737 14.70627  181.8042 25.74651  -16.73041      29.65059  
1 1 1 7  12 28 o 39.65847 17.55209  -0.2353695     1.832342      -3.354011      3.081232      1.470935       2.279135      40.91008 19.62176  52.89027 21.22142  -11.98019      28.90263  
1 1 1 7  12 29 o 54.18878 21.41185  1.859998       2.285690      -0.2688133E-01 3.253854      3.698043       3.211471      50.89076 22.89436  67.65092 25.74615  -16.76015      34.45310  
1 1 1 7  12 30 o 46.63017 16.86282  1.552305       1.345437      -0.6140171     3.434073      1.945134       1.462345      48.47062 22.44424  50.68109 17.65355  -2.210472      28.55507  
1 1 1 7  12 31 o 46.34861 17.74207  1.519551       1.530793      -0.8358427     4.152452      1.889996       1.646777      49.83511 23.58212  49.74992 18.54333  0.8518600E-01  29.99952  
1 1 1 7  12 32 o 36.75946 17.22122  -0.9471036     2.117522      2.472409       4.687766      -1.823699      2.373468      57.73555 26.55059  36.11132 17.29385  21.62422       31.68613  
1 1 1 7  12 33 o 74.89819 13.50687  4.404731       1.298446      3.619946       7.351637      4.430000       1.319185      58.42223 28.55061  74.94482 13.71488  -16.52259      31.67388  
1 1 1 7  13 0  o 96.76485 21.84127  7.141047       2.456784      7.141047       2.456784      7.141047       2.456784      96.76485 21.84127  96.76485 21.84127  -0.000000      0.000000  
1 1 1 7  13 1  o 426.8471 7.401591  121.5648       4.209892      124.7225       10.24901      120.9238       4.617411      430.5067 17.90513  425.6568 8.140769  4.849915       19.66890  
1 1 1 7  13 2  o 132.6769 6.094801  11.76427       1.074649      9.001102       1.699954      13.60354       1.386940      115.5101 11.18420  142.6045 7.323316  -27.09436      13.36852  
1 1 1 7  13 3  o 566.2797 11.46976  214.3725       8.654833      212.5322       16.00288      215.1333       10.28951      561.0991 21.44297  566.8924 13.62136  -5.793274      25.40359  
1 1 1 7  13 4  o 389.7471 9.152456  101.4219       4.753287      100.7253       5.975582      102.6220       7.843490      387.9897 11.57103  391.0502 15.08058  -3.060547      19.00823  
1 1 1 7  13 5  o 250.6515 4.208248  41.87711       1.405546      41.07778       1.520594      46.56789       3.683598      248.2372 4.596982  263.8046 10.49989  -15.56743      11.46211  
1 1 1 7  13 6  o 414.0311 7.041302  114.3522       3.884718      114.1675       4.720013      114.7400       6.839336      413.5745 8.564775  414.0119 12.41133  -0.4374390     15.07967  
1 1 1 7  13 7  o 317.5508 6.320068  67.25027       2.674290      66.09152       3.974693      68.20872       3.614894      314.4680 9.496237  319.5676 8.496593  -5.099609      12.74247  
1 1 1 7  13 8  o 511.4846 7.991160  174.5732       5.446481      178.4297       7.136203      169.1925       8.429249      516.8324 10.36201  502.8116 12.59076  14.02078       16.30639  
1 1 1 7  13 9  o 533.6302 8.996305  190.0918       6.397026      185.1055       8.635964      196.1542       9.522374      526.1410 12.31786  541.4711 13.19765  -15.33008      18.05291  
1 1 1 7  13 10 o 331.8523 7.378735  73.46867       3.262873      74.44216       4.144836      71.88234       5.291034      333.7836 9.328138  327.6620 12.13927  6.121582       15.30934  
1 1 1 7  13 11 o 234.3909 4.863352  36.62482       1.518973      36.57576       1.651640      36.89396       3.868233      234.2214 5.291943  234.5527 12.42080  -0.3312225     13.50115  
1 1 1 7  13 12 o 264.7245 5.115469  46.72182       1.804484      47.54588       1.905747      39.57990       5.610380      267.0403 5.355683  242.1782 17.50346  24.86208       18.30449  
1 1 1 7  13 13 o 359.7050 5.060509  86.26590       2.425572      87.21952       2.927850      84.17934       4.330871      361.6321 6.075867  354.9290 9.164815  6.703125       10.99591  
1 1 1 7  13 14 o 256.4569 6.393836  43.87436       2.184990      44.93591       2.309768      34.83792       6.739014      259.4401 6.686823  225.8259 22.70260  33.61420       23.66689  
1 1 1 7  13 15 o 242.9994 6.583427  39.42936       2.129759      39.05960       2.606058      40.17291       3.695531      241.7179 8.102444  244.7482 11.36241  -3.030289      13.95543  
1 1 1 7  13 16 o 55.22040 10.03459  2.102646       0.7111786     2.048905       0.7357933     2.865790       2.772728      54.42025 10.52734  68.89758 24.28550  -14.47733      26.46904  
1 1 1 7  13 17 f 218.1976 8.894631  31.89385       2.580715      32.02541       2.856476      31.30951       6.020286      218.5162 9.835308  213.4222 21.46017  5.093979       23.60661  
1 1 1 7  13 18 o 52.71968 8.761993  1.909224       0.5939326     2.700508       0.8301328     1.079380       0.8501189     62.66773 10.29842  40.92918 13.46589  21.73855       16.95251  
1 1 1 7  13 19 o 318.6365 6.547075  67.84507       2.779818      70.09882       4.413512      66.36311       3.578906      323.0316 10.26639  314.6971 8.542518  8.334442       13.35565  
1 1 1 7  13 20 o 93.66879 3.458315  5.859271       0.4309101     4.851998       1.175674      6.015585       0.4631402     84.29028 10.70873  94.89803 3.669450  -10.60776      11.31997  
1 1 1 7  13 21 o 354.1989 6.530697  83.92702       3.082337      86.05824       4.735170      82.35994       4.060385      357.5783 9.947481  350.3274 8.698002  7.250854       13.21392  
1 1 1 7  13 22 o 102.2661 1.865919  6.970652       0.2542717     5.472576       0.8662192     7.111908       0.2659896     90.07963 7.278450  103.2956 1.932454  -13.21601      7.530618  
1 1 1 7  13 23 o 179.0877 6.271058  21.49971       1.494202      21.47202       1.848500      21.55191       2.538026      178.6786 7.782445  178.2636 10.73437  0.4150543      13.25870  
1 1 1 7  13 24 o 38.55977 11.09127  1.031891       0.6003539     0.1775330      0.7002257     3.402581       1.166421      28.13984 11.58558  69.53561 13.06817  -41.39577      17.46433  
1 1 1 7  13 25 o 74.67634 8.895893  3.819230       0.8678267     0.6070830      2.572756      4.231634       0.9218546     51.87962 21.84727  78.64217 8.956402  -26.76255      23.61187  
1 1 1 7  13 26 o 93.45216 7.219543  5.921784       0.8920606     5.231849       0.9597336     10.30295       2.418472      87.54645 8.327102  120.2958 15.44330  -32.74935      17.54526  
1 1 1 7  13 27 o 129.8183 7.040632  11.42331       1.213369      11.90390       1.389723      9.882027       2.488763      132.2313 7.923500  116.3543 16.51537  15.87695       18.31773  
1 1 1 7  13 28 o 78.89991 6.701998  4.246678       0.6979575     4.220663       0.7182177     4.688379       2.959412      78.59353 6.928850  74.59197 25.13972  4.001556       26.07709  
1 1 1 7  13 29 o 106.9949 5.338458  7.751532       0.7587143     8.231111       0.8049487     3.932895       2.271394      110.2095 5.498568  68.08033 21.98508  42.12913       22.66226  
1 1 1 7  13 30 o 35.01337 9.525738  0.8900890      0.4561507     1.078825       0.5034918     0.2566802E-01  1.077525      38.42740 9.802750  31.34744 13.67920  7.079956       16.82898  
1 1 1 7  13 31 o 47.82014 6.842982  1.601146       0.4236284     1.449379       0.4463063     2.981710       1.346086      45.17379 7.689577  60.40444 16.33429  -15.23064      18.05377  
1 1 1 7  13 32 o 59.20127 21.99134  3.407760       2.312371      11.29009       7.714664      2.629690       2.423814      72.20542 33.50574  54.14606 21.82893  18.05936       39.98921  
1 1 1 7  13 33 o 32.18210 14.45566  -0.6441239E-01 1.291676      -10.12349      5.779687      0.4644083      1.325194      40.50385 20.55972  35.70851 15.37652  4.795338       25.67371  
1 1 1 7  14 0  o 272.1572 16.43162  50.04621       5.908754      50.04621       5.908754      50.04621       5.908754      272.1572 16.43162  272.1572 16.43162  -0.000000      0.000000  
1 1 1 7  14 1  o 179.9768 2.194135  21.58377       0.5262031     21.95074       0.5691352     19.42302       1.381031      181.4987 2.353252  170.5556 6.086404  10.94315       6.525497  
1 1 1 7  14 2  o 952.3343 6.950539  604.9625       8.820260      645.1578       36.44711      602.4620       9.090466      974.4132 28.09960  950.3272 7.178596  24.08600       29.00207  
1 1 1 7  14 3  o 261.7303 8.439883  45.76603       2.939651      49.58383       4.192119      42.07251       4.123324      272.1194 11.58766  250.5267 12.38994  21.59270       16.96422  
1 1 1 7  14 4  o 82.80439 17.79954  4.777539       1.905505      4.075717       2.709740      5.464086       2.680088      77.66383 23.87404  88.35399 22.65771  -10.69016      32.91415  
1 1 1 7  14 5  o 115.0241 12.60527  8.953042       1.900425      5.906247       2.335737      14.92024       3.268794      92.01265 19.64798  148.2131 16.84989  -56.20047      25.88362  
1 1 1 7  14 6  o 480.5603 5.880757  153.9902       3.765777      151.8293       4.479149      159.2002       6.955028      477.0920 7.045630  488.1638 10.69202  -11.07184      12.80469  
1 1 1 7  14 7  o 388.8429 6.662268  100.8435       3.451992      99.33727       5.438280      101.8600       4.467378      385.4741 10.59754  390.6624 8.581783  -5.188385      13.63653  
1 1 1 7  14 8  o 658.2139 9.358526  289.2565       8.208202      280.8400       9.989342      306.7516       14.40223      648.2115 11.56503  676.4797 15.97722  -28.26819      19.72363  
1 1 1 7  14 9  o 512.5494 8.953926  175.3705       6.115371      172.4878       8.412624      178.6008       8.905268      507.8636 12.43114  516.5428 12.94820  -8.679260      17.94963  
1 1 1 7  14 10 o 80.30080 10.49094  4.380610       1.095738      4.940527       1.191158      1.299893       2.794046      85.32739 10.71174  59.59327 23.63347  25.73413       25.94768  
1 1 1 7  14 11 o 186.4322 5.477435  23.19553       1.359254      22.31599       1.582749      25.66693       2.653124      182.7969 6.508234  195.7414 10.20714  -12.94453      12.10549  
1 1 1 7  14 12 o 354.5346 6.483088  83.84675       3.062768      81.33411       3.699229      89.32333       5.461371      349.0755 7.952768  365.3174 11.23244  -16.24191      13.76278  
1 1 1 7  14 13 o 375.1098 5.697065  93.84465       2.847627      94.77637       3.566127      92.20514       4.730536      376.8594 7.101398  371.3473 9.567942  5.512177       11.91534  
1 1 1 7  14 14 o 131.2135 5.839041  11.50791       1.018367      11.48854       1.084453      11.65247       2.962516      131.0740 6.226793  130.3991 17.49018  0.6748352      18.56554  
1 1 1 7  14 15 o 360.5303 7.550790  86.81125       3.627502      86.78587       4.031189      86.91925       8.316519      360.3750 8.394695  358.4709 17.46316  1.904083       19.37609  
1 1 1 7  14 16 o 425.1579 7.764242  120.7985       4.398685      123.2474       5.018866      112.6858       9.134821      429.2657 8.774167  408.0197 16.83757  21.24603       18.98657  
1 1 1 7  14 17 f 431.0858 9.000231  124.4117       5.170004      124.2280       5.927742      124.9955       10.56825      430.4385 10.33486  428.3889 18.55764  2.049561       21.24136  
1 1 1 7  14 18 o 130.0021 10.44211  11.41751       1.793688      10.83306       2.026038      13.53621       3.857515      126.2880 12.19095  138.8203 21.55219  -12.53226      24.76119  
1 1 1 7  14 19 f 59.77171 9.810726  2.460248       0.7543085     3.099107       1.162983      1.996335       0.9910363     66.53691 13.57730  53.33770 13.82967  13.19921       19.38047  
1 1 1 7  14 20 o 56.27388 7.127413  2.153411       0.5224864     0.7928390      0.9200302     2.801100       0.6347815     37.96983 13.91228  64.23006 7.561437  -26.26023      15.83435  
1 1 1 7  14 21 o 127.5151 3.646712  10.85797       0.6189997     13.63286       1.740415      10.45612       0.6623048     142.0937 9.242023  125.1041 3.978002  16.98959       10.06178  
1 1 1 7  14 22 o 116.7558 2.464912  9.089177       0.3834893     11.99637       1.739865      8.940728       0.3931584     133.0343 9.885379  115.7954 2.548019  17.23885       10.20848  
1 1 1 7  14 23 o 56.85384 7.183814  2.203186       0.5321092     3.443581       1.085628      1.810974       0.6104662     70.23922 12.03177  51.05016 9.317311  19.18906       15.21761  
1 1 1 7  14 24 o 42.71394 11.50890  1.285774       0.6697034     1.842906       0.9284247     0.6814361      0.9669574     50.88617 13.47955  37.00168 14.11649  13.88449       19.51854  
1 1 1 7  14 25 o 90.81541 6.649940  5.576648       0.7991523     3.109417       4.788050      5.647348       0.8105216     74.40099 30.42615  91.38161 6.702924  -16.98062      31.15573  
1 1 1 7  14 26 o 107.7836 6.982739  7.875644       0.9974896     6.355148       1.740607      8.619170       1.217184      94.15446 14.32449  112.4255 8.180874  -18.27106      16.49599  
1 1 1 7  14 27 o 155.2621 5.433375  16.24829       1.122377      15.78178       2.014525      16.45829       1.351582      150.9153 10.07537  155.8694 6.521816  -4.954178      12.00196  
1 1 1 7  14 28 o 85.43111 9.401022  5.110181       1.052532      5.205040       1.116083      4.347685       3.164294      85.99767 9.921148  70.53656 25.80800  15.46111       27.64927  
1 1 1 7  14 29 o 23.56391 11.11963  -0.8732261     0.9114152     -0.8490618     1.049569      -0.9473179     1.837846      25.89137 12.12795  35.15073 16.32571  -9.259359      20.33755  
1 1 1 7  14 30 o 23.46402 11.21573  -1.130840      0.9880990     -1.119868      1.092713      -1.180055      2.314170      25.10953 11.94410  38.08508 17.89327  -12.97555      21.51350  
1 1 1 7  14 31 o 27.25231 11.70013  0.1020623      0.7629244     -1.045966      0.9295525     2.471497       1.335427      22.74530 10.87387  54.37601 16.76793  -31.63071      19.98511  
1 1 1 7  14 32 o 35.53096 10.72166  0.9460213      0.5499001     1.384966       0.6784306     0.1052924      0.9389197     42.37200 11.65351  29.40925 12.80225  12.96275       17.31190  
1 1 1 7  15 0  o 670.1520 15.22948  300.4905       13.58392      300.4905       13.58392      300.4905       13.58392      670.1520 15.22948  670.1520 15.22948  0.000000       0.000000  
1 1 1 7  15 1  o 360.6778 7.255728  86.77916       3.487176      0.000000       0.000000      86.77916       3.487176      ?        ?         360.6778 7.255728  0.000000       7.255728  
1 1 1 7  15 2  o 319.6978 9.149555  68.28463       3.893733      68.34796       11.23295      68.27599       4.151101      316.5509 26.88442  319.6169 9.758183  -3.066040      28.60060  
1 1 1 7  15 3  o 375.7621 8.300465  94.22570       4.156128      88.79567       6.968204      97.22402       5.177968      363.9059 14.39847  381.4023 10.19747  -17.49640      17.64382  
1 1 1 7  15 4  o 490.0781 10.50562  160.4346       6.860571      156.6324       9.586199      164.4268       9.822751      483.3786 14.90062  495.2706 14.90086  -11.89197      21.07283  
1 1 1 7  15 5  o 390.2792 9.708559  101.7087       5.048980      104.3957       6.305213      96.90643       8.429273      394.9906 11.99342  379.7713 16.69773  15.21930       20.55860  
1 1 1 7  15 6  o 193.1035 5.239487  24.87864       1.346948      22.55783       1.640915      29.67248       2.358345      183.7830 6.711772  210.6902 8.417137  -26.90718      10.76550  
1 1 1 7  15 7  o 527.8895 4.394696  185.7525       3.091330      184.4669       3.359302      192.8597       7.898577      526.0361 4.792476  537.2219 11.03371  -11.18585      12.02957  
1 1 1 7  15 8  o 88.50004 6.806574  5.255226       0.7965237     2.967084       1.663418      5.935978       0.9073078     65.53468 18.33308  94.04462 7.297202  -28.50994      19.73198  
1 1 1 7  15 9  o 413.8986 9.516618  114.4147       5.248680      117.1332       6.627200      109.8401       8.596876      418.3350 11.90074  404.3417 15.98731  13.99332       19.93042  
1 1 1 7  15 10 o 112.9002 11.91326  8.620511       1.765259      9.402925       2.212184      7.248948       2.928941      117.5850 14.42026  101.6672 22.24017  15.91779       26.50602  
1 1 1 7  15 11 o 173.9449 8.878922  20.26078       2.051193      21.43253       2.725271      18.72957       3.115355      178.6203 11.51129  166.5529 14.17171  12.06740       18.25780  
1 1 1 7  15 12 o 339.9149 6.175577  77.08409       2.797185      78.13181       3.521318      75.29244       4.604795      342.0881 7.724916  335.3837 10.31600  6.704437       12.88776  
1 1 1 7  15 13 o 332.8101 5.431528  73.88341       2.408751      73.87173       2.714999      73.92659       5.220730      332.7308 6.123549  331.9727 11.82086  0.7580566      13.31280  
1 1 1 7  15 14 o 37.21106 12.68356  0.8552660      0.7534502     1.082271       0.8060322     -0.7162806     2.120792      40.69340 13.09260  42.40264 18.81874  -1.709240      22.92512  
1 1 1 7  15 15 o 18.27321 8.795774  -0.9614354     0.6319389     -1.152219      0.6535392     1.782453       2.478475      17.82170 8.665403  59.68110 22.64020  -41.85940      24.24186  
1 1 1 7  15 16 o 353.5746 8.263594  83.64920       3.893350      87.30367       4.777050      76.41936       6.719104      360.7359 9.947446  335.9730 15.04655  24.76297       18.03747  
1 1 1 7  15 17 o 357.5473 8.181396  85.58757       3.897933      86.17538       4.440357      83.61291       8.138502      358.4009 9.305566  349.9827 17.50675  8.418213       19.82624  
1 1 1 7  15 18 o 218.7047 8.737336  32.12155       2.541181      28.17136       3.050860      41.07151       4.592237      204.2511 11.25294  245.8761 14.07514  -41.62500      18.02049  
1 1 1 7  15 19 o 318.9250 12.34048  68.85884       5.234482      72.64085       6.400239      61.21862       9.096784      326.4793 14.74993  294.7046 23.35560  31.77478       27.62326  
1 1 1 7  15 20 o 187.8767 8.412599  23.74497       2.100747      21.81538       2.817769      26.15958       3.152069      179.2068 11.86671  196.2319 12.11364  -17.02516      16.95757  
1 1 1 7  15 21 o 26.90839 11.27811  0.8588073E-01  0.6805742     -0.4566920     1.782152      0.1785163      0.7363844     39.19756 17.33088  28.81086 11.87336  10.38670       21.00800  
1 1 1 7  15 22 o 99.27711 5.485085  6.614586       0.7227945     8.849386       1.257280      5.511395       0.8833606     114.3959 8.304543  90.30334 7.406107  24.09251       11.12726  
1 1 1 7  15 23 o 97.77220 3.969531  6.396697       0.5160884     12.02724       2.372684      6.117077       0.5287480     131.6021 13.73199  95.58703 4.161194  36.01507       14.34863  
1 1 1 7  15 24 o 26.45538 11.36116  -0.2076081E-01 0.7197354     -0.8180214     1.060222      0.6606932      0.9802004     26.97132 12.48269  36.80236 14.16922  -9.831041      18.88344  
1 1 1 7  15 25 o 159.6347 1.722356  16.99188       0.3663734     10.43306       2.547414      17.13041       0.3702223     120.0792 16.34442  160.2833 1.733408  -40.20414      16.43608  
1 1 1 7  15 26 o 110.7050 7.656036  8.364477       1.122436      7.764860       1.885969      8.693354       1.396735      103.8334 13.98623  112.1926 9.429975  -8.359253      16.86828  
1 1 1 7  15 27 o 102.3747 6.323187  7.128592       0.8583758     4.408803       1.831676      7.893982       0.9716781     74.70557 18.49859  107.5760 6.813508  -32.87040      19.71349  
1 1 1 7  15 28 o 57.31746 13.52541  2.485640       1.016253      2.443470       1.116291      2.689785       2.456113      56.33400 14.71311  58.31791 22.43532  -1.983917      26.82945  
1 1 1 7  15 29 o 23.86832 9.948202  0.1351322      0.5251328     -1.857518      0.7239187     2.348246       0.7629150     16.22641 8.107972  56.70461 10.48285  -40.47820      13.25252  
1 1 1 7  15 30 o 41.88137 12.89071  1.334191       0.7896983     1.716646       0.8483012     -1.150485      2.162195      47.10596 13.06044  36.53456 17.20553  10.57141       21.60105  
1 1 1 7  15 31 o 21.90168 10.53127  -1.104451      0.9003988     -1.752385      1.324219      -0.5473117     1.227938      25.51630 12.39016  29.16134 13.47421  -3.645041      18.30493  
1 1 1 7  16 0  o 48.61290 23.32152  2.326421       1.741196      2.326421       1.741196      2.326421       1.741196      48.61290 23.32152  48.61290 23.32152  -0.000000      0.000000  
1 1 1 7  16 1  o 314.6435 7.713189  66.05473       3.233897      59.46671       4.924385      71.05045       4.288178      297.9438 12.43080  326.0265 9.882074  -28.08264      15.88019  
1 1 1 7  16 2  o 351.3896 11.04989  82.59076       5.167498      93.73910       12.90712      80.46271       5.639171      371.1159 26.27013  346.6750 12.22643  24.44089       28.97595  
1 1 1 7  16 3  o 55.72593 10.21463  2.139358       0.7305533     1.428021       0.8630676     3.937116       1.372059      45.77432 13.33798  75.47482 14.16266  -29.70049      19.45463  
1 1 1 7  16 4  o 264.9585 9.715550  46.94689       3.424386      51.34073       5.250361      43.69408       4.517478      276.5205 14.29769  255.1756 13.33191  21.34488       19.54900  
1 1 1 7  16 5  o 388.8330 8.929482  100.9393       4.626610      104.0657       6.612209      97.94041       6.475949      394.2095 12.60389  382.4007 12.72672  11.80881       17.91166  
1 1 1 7  16 6  o 246.5351 5.033151  40.52245       1.653455      41.88240       2.382581      39.25903       2.296472      250.4501 7.146562  242.4754 7.115245  7.974716       10.08464  
1 1 1 7  16 7  o 601.4161 8.032701  241.4241       6.437395      239.6062       9.455539      242.9946       8.788695      598.5093 11.85610  602.9028 10.93965  -4.393555      16.13205  
1 1 1 7  16 8  o 347.2834 6.663286  80.46149       3.083514      81.76202       4.156140      78.86910       4.598892      349.7817 8.924304  343.3924 10.06138  6.389343       13.44896  
1 1 1 7  16 9  o 540.7156 8.277703  195.2282       5.964201      195.4178       8.082500      195.0016       8.837253      540.4777 11.22263  539.6839 12.28865  0.7937622      16.64207  
1 1 1 7  16 10 o 340.1368 8.315762  77.27104       3.769027      74.99967       4.660546      81.56451       6.407636      334.7000 10.46264  348.4373 13.82811  -13.73740      17.34023  
1 1 1 7  16 11 o 326.2886 6.906940  71.06714       3.003040      70.84328       3.528349      71.65554       5.720346      325.6557 8.130914  326.5642 13.17263  -0.9085083     15.47998  
1 1 1 7  16 12 o 101.0884 8.192885  6.873274       1.094149      6.359919       1.196518      9.494122       2.703530      97.06606 9.366999  117.2609 17.86603  -20.19487      20.17265  
1 1 1 7  16 13 o 98.31467 2.896122  6.448262       0.3789964     6.493689       0.3903142     5.698859       1.585321      98.65728 2.972400  91.11257 13.46254  7.544708       13.78678  
1 1 1 7  16 14 o 185.4906 1.313985  22.92615       0.3247773     22.91375       0.3278881     23.57048       2.363360      185.4402 1.326931  187.3565 9.497439  -1.916336      9.589687  
1 1 1 7  16 15 o 281.1206 7.671232  52.90162       2.870947      50.95110       3.643770      56.09482       4.662173      275.4448 9.943886  288.4784 12.15559  -13.03357      15.70475  
1 1 1 7  16 16 o 229.5448 6.827115  35.26175       2.085909      33.22927       2.479352      40.18518       3.858867      222.5744 8.374616  243.9903 11.90493  -21.41589      14.55546  
1 1 1 7  16 17 o 48.39054 16.64053  1.467501       1.297576      1.283328       1.408957      2.496146       3.329802      47.44804 17.24245  68.65359 26.19490  -21.20555      31.36041  
1 1 1 7  16 18 o 25.23292 12.12983  -1.742547      1.192654      -2.563858      1.397042      0.4646043      2.290190      25.58224 12.48979  49.64828 20.74039  -24.06604      24.21071  
1 1 1 7  16 19 o 112.3068 9.837337  8.555931       1.457317      9.009180       1.655668      6.996974       3.070589      115.0301 10.93288  97.63490 23.81712  17.39523       26.20654  
1 1 1 7  16 20 o 163.7424 9.793030  18.13854       2.126978      20.55095       2.608837      13.35594       3.673269      173.8974 11.32002  136.6470 20.83121  37.25044       23.70827  
1 1 1 7  16 21 o 64.83814 12.26202  2.950161       1.020616      1.512041       2.089365      3.400859       1.169661      53.94244 20.70788  69.52564 13.10585  -15.58320      24.50673  
1 1 1 7  16 22 o 84.86794 8.602016  4.907631       0.9593654     3.585239       2.105411      5.254151       1.077757      70.03217 20.94455  87.66654 9.371180  -17.63437      22.94544  
1 1 1 7  16 23 o 136.0981 6.503083  12.47920       1.175943      9.307836       2.599479      13.29519       1.318578      113.3639 17.79363  140.3465 7.073478  -26.98264      19.14804  
1 1 1 7  16 24 o 129.6131 4.665069  11.27133       0.8043988     12.36650       2.794001      11.17235       0.8399630     130.8998 16.37549  128.9965 4.895505  1.903320       17.09159  
1 1 1 7  16 25 o 113.0033 3.340631  8.546808       0.5024769     2.308823       3.485415      8.679209       0.5077814     63.00935 25.88494  113.8745 3.350033  -50.86517      26.10082  
1 1 1 7  16 26 o 75.87463 7.591225  3.964055       0.7572117     2.290188       2.740894      4.102364       0.7878745     58.49894 23.33946  77.14032 7.770600  -18.64138      24.59904  
1 1 1 7  16 27 o 88.79279 7.985061  5.465831       0.9346968     9.529147       1.500395      2.888787       1.194885      116.3955 9.763676  61.36648 14.78778  55.02900       17.72027  
1 1 1 7  16 28 o 89.88052 7.272162  5.588268       0.8635370     5.166595       0.9650317     7.282536       1.934395      85.79958 8.554678  97.00555 15.48531  -11.20597      17.69117  
1 1 1 7  16 29 o 41.23492 12.51465  1.282373       0.7476900     0.4321847      0.9861124     2.432144       1.146766      33.11133 13.70188  55.15907 15.14334  -22.04774      20.42210  
1 1 1 7  16 30 o 17.29674 8.499764  -1.275301      0.6798138     -2.959086      0.9380519     0.5872314      0.9865871     16.90610 8.548122  34.10850 13.86284  -17.20240      16.28646  
1 1 1 7  16 31 o 40.53724 12.81262  1.277122       0.7746628     2.142918       0.9407414     -0.5466100     1.365347      51.69601 13.50919  30.59213 14.16091  21.10388       19.57114  
1 1 1 7  17 0  o 324.7868 12.29036  70.73121       5.301760      70.73121       5.301760      70.73121       5.301760      324.7868 12.29036  324.7868 12.29036  -0.000000      0.000000  
1 1 1 7  17 1  o 587.8366 11.12202  231.0338       8.711917      234.4872       13.91141      228.8057       11.17445      590.3773 17.70349  584.3170 14.35173  6.060242       22.79003  
1 1 1 7  17 2  f 299.9423 6.008457  60.00227       2.401453      56.55846       3.729616      62.44120       3.138662      290.8131 9.637780  305.7788 7.709213  -14.96573      12.34175  
1 1 1 7  17 3  o 219.2043 7.510013  32.10425       2.190389      31.98120       3.131144      32.22218       3.065264      218.4570 10.78970  219.3118 10.51963  -0.8547211     15.06918  
1 1 1 7  17 4  o 817.8137 14.26595  448.3296       15.54635      440.1708       23.25698      454.9202       20.90270      806.8746 21.65042  821.8337 19.08732  -14.95905      28.86289  
1 1 1 7  17 5  o 215.8366 9.892306  31.19768       2.837526      30.46607       7.273597      31.32901       3.081699      209.9739 26.59166  216.1939 10.73081  -6.219971      28.67519  
1 1 1 7  17 6  o 390.2338 7.106218  101.6297       3.695191      100.2719       4.254848      105.7967       7.453758      387.5065 8.240083  396.9306 14.11494  -9.424164      16.34413  
1 1 1 7  17 7  f 197.3020 5.973559  25.99261       1.568692      24.85181       2.266317      27.04191       2.173522      192.6653 8.851269  201.0659 8.129211  -8.400681      12.01786  
1 1 1 7  17 8  o 33.47525 1.390912  0.7479495      0.6190842E-01 3.957638       1.312155      0.7407888      0.6197745E-01 75.69370 13.50468  33.31398 1.399271  42.37971       13.57697  
1 1 1 7  17 9  o 78.95868 7.935894  4.206357       0.8236561     5.151411       1.471606      3.775261       0.9939182     86.65991 13.15675  74.41458 10.29930  12.24533       16.70855  
1 1 1 7  17 10 f 313.0060 8.704000  65.55517       3.626798      64.83873       6.634276      65.86054       4.331309      309.6858 16.13239  313.4523 10.38423  -3.766479      19.18557  
1 1 1 7  17 11 o 502.6823 8.464922  168.9823       5.670092      171.1959       7.360604      165.7516       8.892229      505.3403 10.93090  496.2755 13.45908  9.064758       17.33873  
1 1 1 7  17 12 o 201.9270 6.734414  27.26791       1.809504      26.83668       1.989506      29.33272       4.353425      200.2361 7.469500  207.7390 15.84635  -7.502975      17.51857  
1 1 1 7  17 13 o 194.2612 5.383071  25.20978       1.392101      25.30016       1.575055      24.88713       2.975948      194.5380 6.083478  192.0696 11.68294  2.468384       13.17193  
1 1 1 7  17 14 o 78.64792 4.708265  4.142540       0.4911667     4.251619       0.5017868     1.647152       2.400042      79.67688 4.747743  57.96581 22.20886  21.71107       22.71067  
1 1 1 7  17 15 o 277.8803 6.744368  51.63942       2.497310      50.12522       2.886513      56.14616       4.979807      273.4681 7.929619  288.0144 13.00910  -14.54636      15.23534  
1 1 1 7  17 16 o 166.4915 4.006674  18.49576       0.8888930     18.43563       0.9350669     19.05991       2.864086      166.1532 4.226814  167.3686 12.94267  -1.215317      13.61538  
1 1 1 7  17 17 o 314.9542 5.552961  66.30035       2.330481      66.29008       2.674356      66.33274       4.750829      314.7711 6.376038  313.2416 11.40096  1.529572       13.06277  
1 1 1 7  17 18 o 111.3229 8.065305  8.360552       1.188294      7.961601       1.339461      9.834816       2.574884      108.3826 9.366467  118.5583 16.76598  -10.17575      19.20491  
1 1 1 7  17 19 o 48.73811 18.01542  1.338410       1.548357      -2.622743      2.610312      3.488730       1.923239      40.04148 18.87169  69.64645 19.79351  -29.60498      27.34820  
1 1 1 7  17 20 o 51.57833 18.70970  1.599741       1.657944      3.294071       2.051279      -1.592474      2.815605      67.78358 20.75977  45.21155 20.71170  22.57203       29.32478  
1 1 1 7  17 21 o 69.18781 20.15796  3.505891       1.971426      4.734332       2.534852      1.625450       3.136212      79.49891 22.76652  61.02463 24.74809  18.47428       33.62711  
1 1 1 7  17 22 o 51.71638 19.92852  1.454012       1.940171      -1.106863      2.608582      4.624546       2.902529      44.33479 20.16619  77.80944 24.82583  -33.47466      31.98433  
1 1 1 7  17 23 o 165.8611 7.780325  18.66347       1.714762      19.60110       3.198561      18.28530       2.031343      166.3422 14.57761  163.5145 9.362084  2.827682       17.32500  
1 1 1 7  17 24 o 70.38605 10.54630  3.488728       0.9587232     -1.098388      2.317176      4.436167       1.053088      40.66114 18.68701  79.67361 10.14927  -39.01247      21.26528  
1 1 1 7  17 25 o 151.9558 5.299885  15.58191       1.071499      16.47808       2.996052      15.45047       1.147387      149.6696 15.23463  151.1603 5.706622  -1.490707      16.26836  
1 1 1 7  17 26 o 16.46603 8.331178  -2.985121      0.9002323     -4.983240      3.533724      -2.846443      0.9309483     39.39584 19.36332  17.25579 8.699383  22.14005       21.22775  
1 1 1 7  17 27 o 62.75575 12.62655  2.951387       1.019266      9.311451       4.055820      2.522629       1.053062      92.70284 29.31919  57.28218 13.93203  35.42066       32.46100  
1 1 1 7  17 28 o 60.34046 22.43210  3.309086       2.406879      4.440106       3.591568      2.387074       3.242776      65.56731 26.52246  56.14397 24.11319  9.423340       35.84531  
1 1 1 7  17 29 o 24.62416 11.91564  -1.560879      1.197627      -3.277358      3.693840      -1.359246      1.266016      41.00698 20.08163  26.27408 12.59544  14.73289       23.70479  
1 1 1 7  17 30 o 34.03966 12.72266  0.7712377      0.7762663     0.9328485      1.716628      0.7296951      0.8703372     41.53881 17.68437  34.28518 13.31061  7.253632       22.13389  
1 1 1 7  18 0  o 260.4833 9.844839  45.47882       3.406035      45.47882       3.406035      45.47882       3.406035      260.4833 9.844839  260.4833 9.844839  -0.000000      0.000000  
1 1 1 7  18 1  o 446.0941 7.734780  132.8742       4.597777      125.8859       9.067220      135.2930       5.334462      432.4484 15.76135  449.9783 8.896630  -17.52994      18.09890  
1 1 1 7  18 2  o 798.8442 11.38483  427.2118       12.11887      411.8569       18.05043      439.8138       16.35244      781.9083 17.32440  809.0472 15.16824  -27.13892      23.02629  
1 1 1 7  18 3  o 411.4119 8.886656  113.1073       4.871792      108.1190       7.442292      116.8476       6.444445      401.1299 13.94470  417.5652 11.59333  -16.43533      18.13450  
1 1 1 7  18 4  o 640.1335 11.57875  274.4469       9.876562      288.8227       16.98729      267.1057       12.13916      653.2644 19.53663  630.5983 14.44649  22.66614       24.29776  
1 1 1 7  18 5  o 288.3055 7.575833  55.54811       2.907906      56.60605       4.832763      54.94770       3.640721      290.2822 12.52346  286.4857 9.550330  3.796539       15.74947  
1 1 1 7  18 6  o 104.4380 7.645941  7.324382       1.056679      7.263887       1.213916      7.513580       2.146770      103.8641 8.855387  104.4665 15.92463  -0.6024017     18.22119  
1 1 1 7  18 7  f 256.3068 7.305451  43.91371       2.492513      42.76793       3.016931      46.37742       4.423952      252.7251 8.972908  262.5460 12.68288  -9.820953      15.53604  
1 1 1 7  18 8  o 224.1518 6.628963  33.57923       1.977807      32.98015       2.587961      34.42044       3.066655      221.8837 8.770316  226.4729 10.18799  -4.589203      13.44298  
1 1 1 7  18 9  o 449.4828 7.420442  135.0172       4.444433      136.8543       6.331440      133.2326       6.240304      451.8399 10.51585  445.8240 10.50434  6.015900       14.86352  
1 1 1 7  18 10 o 185.9066 6.464709  23.11279       1.599028      22.72816       3.226542      23.23801       1.841012      183.2501 13.30416  186.2991 7.430951  -3.049026      15.23876  
1 1 1 7  18 11 o 297.3854 7.222066  59.12733       2.861901      55.88347       3.569959      64.96131       4.787572      288.6386 9.293981  310.6573 11.58569  -22.01868      14.85282  
1 1 1 7  18 12 o 224.6685 6.566882  33.76464       1.963852      30.73989       2.488425      38.75946       3.197710      214.0246 8.743852  240.1109 10.01632  -26.08635      13.29593  
1 1 1 7  18 13 o 84.75172 6.466535  4.829466       0.7247732     4.279925       0.8013027     7.301181       1.699401      79.59917 7.648684  103.2856 12.60866  -23.68642      14.74723  
1 1 1 7  18 14 o 27.10358 10.26887  0.3527138      0.5094971     0.4360120      0.5320773     -0.5666797     1.767696      28.66107 10.56670  38.66114 17.16829  -10.00007      20.15950  
1 1 1 7  18 15 o 198.6699 5.874451  26.40958       1.553444      27.89319       1.764499      21.29691       3.275558      204.0829 6.496729  176.5518 14.03874  27.53107       15.46912  
1 1 1 7  18 16 o 113.9738 4.876590  8.692717       0.7389068     8.724172       0.7912596     8.478332       2.065710      114.1443 5.216035  110.7262 14.33679  3.418106       15.25616  
1 1 1 7  18 17 o 164.2951 7.050600  18.12379       1.539970      18.71521       2.023734      17.31024       2.373547      166.5243 9.155384  159.6110 11.23164  6.913315       14.49037  
1 1 1 7  18 18 o 185.4503 5.761548  23.03861       1.422045      25.58648       1.764887      18.32303       2.401024      195.2429 6.794077  164.1353 11.04220  31.10765       12.96494  
1 1 1 7  18 19 o 90.23740 14.74066  5.739512       1.711326      5.595670       2.670769      5.839708       2.229043      86.58299 22.82804  89.52308 19.25764  -2.940086      29.86597  
1 1 1 7  18 20 o 127.2492 13.60289  11.27379       2.270797      14.78455       2.986874      6.465343       3.495576      144.9234 15.71834  91.11709 26.92290  53.80630       31.17546  
1 1 1 7  18 21 o 85.84009 8.754715  5.043341       0.9873925     4.779042       1.027465      8.234728       3.570336      83.36404 9.413911  101.6892 26.19005  -18.32520      27.83056  
1 1 1 7  18 22 o 32.47584 15.33783  -1.713235      1.740695      -2.200737      2.637676      -1.337116      2.316842      40.41965 19.02533  40.18496 18.54655  0.2346916      26.56949  
1 1 1 7  18 23 o 59.73166 22.45832  2.480361       2.426402      5.327352       3.091293      -2.088445      3.916054      79.66516 25.64093  49.97966 23.41617  29.68550       34.72427  
1 1 1 7  18 24 o 125.9906 7.434929  10.85734       1.242664      8.098829       2.947560      11.45361       1.370404      98.48274 22.89633  129.1530 8.002191  -30.67029      24.25442  
1 1 1 7  18 25 o 97.38705 9.399594  6.656608       1.204647      7.844514       4.767393      6.575588       1.245050      84.13689 31.51242  96.57217 9.811279  -12.43528      33.00446  
1 1 1 7  18 26 o 54.13493 10.68828  2.143943       0.7436334     -1.436430      3.028575      2.373650       0.7671174     42.99714 20.28389  57.12800 10.46263  -14.13086      22.82330  
1 1 1 7  18 27 o 37.15210 13.08332  0.9628447      0.8045877     1.909130       3.872831      0.9201600      0.8225341     55.98631 25.09871  36.73053 13.19757  19.25578       28.35703  
1 1 1 7  18 28 o 43.73589 17.99344  1.193385       1.687373      6.036974       3.700636      -0.7795250E-01 1.895934      70.85610 27.46387  38.19272 17.30104  32.66338       32.45906  
1 1 1 7  18 29 f 56.21564 15.60087  2.636479       1.209780      -4.191619      3.874496      3.374100       1.273450      39.79494 19.69315  64.16257 15.14040  -24.36763      24.84052  
1 1 1 7  19 0  f 17.62935 11.28479  0.2912229E-01  0.5957485     0.2912229E-01  0.5957485     0.2912229E-01  0.5957485     17.62935 11.28479  17.62935 11.28479  0.000000       0.000000  
1 1 1 7  19 1  o 263.6903 7.057199  46.47226       2.477476      44.87966       3.258614      48.65389       3.813910      258.8036 9.465012  269.2813 10.64996  -10.47766      14.24809  
1 1 1 7  19 2  o 260.3526 3.419506  45.18759       1.186312      47.70998       3.000446      44.72021       1.291549      266.9943 8.444166  258.9879 3.742467  8.006378       9.236341  
1 1 1 7  19 3  o 82.04528 5.839187  4.515310       0.6342080     5.437930       1.092495      4.046355       0.7788855     89.67422 9.276573  77.44218 7.647558  12.23204       12.02248  
1 1 1 7  19 4  o 356.6880 7.883896  85.04538       3.747166      87.57253       5.874950      83.31221       4.865281      360.9123 12.23368  352.4621 10.37038  8.450134       16.03770  
1 1 1 7  19 5  o 431.7780 8.237835  124.6781       4.739659      133.3434       7.635814      119.2469       6.045200      445.1478 12.88650  421.5759 10.77003  23.57184       16.79451  
1 1 1 7  19 6  f 269.9998 6.939940  48.73821       2.494782      49.58767       3.011088      46.87837       4.455428      272.1411 8.313145  263.7203 12.71610  8.420746       15.19236  
1 1 1 7  19 7  o 216.0826 7.185651  31.24237       2.066117      28.70907       2.638046      35.26188       3.322960      206.7729 9.600688  228.9557 10.92332  -22.18280      14.54277  
1 1 1 7  19 8  o 382.0725 6.936572  97.56939       3.531540      101.9189       4.498375      90.58219       5.701488      390.1521 8.652630  366.8927 11.67694  23.25940       14.53337  
1 1 1 7  19 9  o 439.9969 7.652789  129.5211       4.486863      129.4356       5.679530      129.6632       7.318334      439.3007 9.702351  438.5429 12.53639  0.7578125      15.85234  
1 1 1 7  19 10 o 353.0917 8.207287  83.49269       3.861541      87.45615       7.131425      81.84851       4.593179      358.9600 14.94195  349.0588 9.885049  9.901245       17.91581  
1 1 1 7  19 11 o 205.4550 5.639973  28.21917       1.542611      27.99274       1.968148      28.57984       2.483962      204.4056 7.237310  206.2182 9.061622  -1.812637      11.59705  
1 1 1 7  19 12 o 203.6466 5.470074  27.72577       1.483032      26.95268       1.985131      28.70220       2.230977      200.4926 7.443408  206.7846 8.112352  -6.292007      11.00975  
1 1 1 7  19 13 o 318.0335 6.886579  67.70286       2.918435      69.82059       3.959148      65.18282       4.318851      322.2466 9.229700  310.9558 10.43787  11.29077       13.93329  
1 1 1 7  19 14 o 24.33181 9.336296  0.2674230      0.4245729     0.7620875      0.6557996     -0.8952416E-01 0.5570802     34.84711 11.83385  22.73588 9.879619  12.11123       15.41580  
1 1 1 7  19 15 o 228.0357 1.386950  34.65339       0.4214415     34.75721       0.4246759     27.91529       3.421226      228.3767 1.395508  202.4201 12.74870  25.95657       12.82485  
1 1 1 7  19 16 o 89.80093 6.829875  5.435675       0.8111432     5.185296       0.9034123     6.476998       1.842381      87.53472 7.827717  96.22035 14.84651  -8.685631      16.78368  
1 1 1 7  19 17 o 201.6513 7.980894  27.38576       2.140265      31.06396       2.852590      22.64834       3.237376      214.1367 10.02494  181.5197 13.48053  32.61705       16.79953  
1 1 1 7  19 18 o 78.97295 13.82728  4.403086       1.402097      6.888305       1.962325      1.811020       2.004064      98.66486 15.43090  55.23238 20.48116  43.43248       25.64353  
1 1 1 7  19 19 o 277.3402 8.407180  52.02482       3.103380      52.67564       4.253345      51.28391       4.538173      277.2521 11.53805  272.8942 12.51326  4.357849       17.02082  
1 1 1 7  19 20 o 133.8257 9.279010  12.23585       1.644435      12.83471       2.115510      11.32155       2.613944      136.0636 11.78414  125.7156 15.96337  10.34805       19.84175  
1 1 1 7  19 21 o 212.9095 8.664746  30.91593       2.453104      29.95376       3.166168      32.36096       3.880127      207.7641 11.48106  214.2213 13.66405  -6.457275      17.84715  
1 1 1 7  19 22 o 69.42160 18.03754  3.710081       1.683508      3.119581       2.976044      3.987965       2.041556      65.05729 24.77843  71.00482 20.46212  -5.947533      32.13517  
1 1 1 7  19 23 o 35.89873 15.91578  -0.1754500     1.513070      -1.095411      2.970393      0.1468928      1.758281      45.13960 20.89211  40.17649 17.50390  4.963112       27.25558  
1 1 1 7  19 24 o 43.67590 17.86105  0.9577530      1.649966      -0.3946488     3.154363      1.467155       1.935928      47.65278 21.86433  48.82931 19.56994  -1.176525      29.34334  
1 1 1 7  19 25 o 38.96386 14.81905  0.9492714      1.063519      2.619123       2.413815      0.5470245      1.184709      57.03801 22.16057  36.45304 15.04515  20.58498       26.78521  
1 1 1 7  19 26 o 26.33746 11.55653  -0.5746872E-01 0.7784640     0.7548231      3.856701      -0.9196894E-01 0.7948238     52.42508 24.09894  26.32670 11.60992  26.09837       26.74975  
1 1 1 7  19 27 o 85.61823 9.179444  5.244947       1.030933      -1.152842      3.128967      6.024051       1.091903      42.71282 20.28723  91.90654 9.032438  -49.19372      22.20713  
1 1 1 7  19 28 o 44.95718 19.59928  1.074604       2.207451      4.762621       5.462510      0.3547853      2.413278      61.24304 28.34052  42.83903 19.45077  18.40401       34.37321  
1 1 1 7  20 0  o 615.0634 12.62827  253.6595       10.34009      253.6595       10.34009      253.6595       10.34009      615.0634 12.62827  615.0634 12.62827  0.000000       0.000000  
1 1 1 7  20 1  o 248.3426 7.622794  41.28384       2.519559      39.46492       4.519153      42.10425       3.035037      241.4331 14.10858  250.5518 9.105751  -9.118713      16.79186  
1 1 1 7  20 2  o 390.8832 5.362803  101.9894       2.793267      102.1080       5.953949      101.9560       3.162949      389.6354 11.48014  390.7151 6.075171  -1.079681      12.98851  
1 1 1 7  20 3  o 180.1590 5.347997  21.68524       1.282447      20.74347       2.259361      22.13289       1.557703      175.6367 9.691334  181.8981 6.436771  -6.261337      11.63417  
1 1 1 7  20 4  o 117.3209 5.868076  9.215053       0.9144579     9.315701       0.9969282     8.681116       2.296173      117.9111 6.368697  112.1471 15.80298  5.763962       17.03803  
1 1 1 7  20 5  o 301.0691 7.188649  60.61432       2.883945      54.24294       6.151976      62.40884       3.264918      282.1741 16.43263  305.2495 8.033809  -23.07538      18.29135  
1 1 1 7  20 6  o 287.8625 6.297477  55.37270       2.415602      61.05288       3.291469      48.74197       3.556226      301.8500 8.190807  269.3106 9.926728  32.53937       12.86970  
1 1 1 7  20 7  o 312.1359 6.919022  65.15761       2.877809      62.36664       4.174244      67.68581       3.972889      304.5130 10.30206  317.4938 9.401048  -12.98077      13.94676  
1 1 1 7  20 8  o 183.0616 8.438416  22.50617       2.052872      23.02780       2.445937      21.26304       3.775950      184.8882 9.964837  176.0169 16.28352  8.871277       19.09060  
1 1 1 7  20 9  o 92.17718 8.020553  5.735509       0.9753489     3.746663       2.018718      6.341158       1.114002      72.57285 20.15739  96.84715 8.725755  -24.27431      21.96496  
1 1 1 7  20 10 f 367.8525 6.958322  90.56693       3.410765      93.14633       4.436784      86.84013       5.333045      372.5041 8.938481  358.7539 11.16952  13.75015       14.30576  
1 1 1 7  20 11 o 331.3428 7.678974  73.58138       3.390425      69.99478       4.938806      76.77814       4.662673      321.7776 11.53708  337.4873 10.38056  -15.70966      15.51967  
1 1 1 7  20 12 o 86.75046 9.076241  5.111967       1.033674      4.561346       1.396812      5.778550       1.536876      80.95056 13.41894  91.44884 12.97599  -10.49828      18.66666  
1 1 1 7  20 13 o 35.74535 12.19454  0.8003864      0.6964968     0.6847341E-01  0.8284926     2.564273       1.286158      29.33106 12.37723  60.08914 15.84095  -30.75808      20.10303  
1 1 1 7  20 14 o 66.51316 2.992178  2.956843       0.2645179     5.395135       0.6352288     2.445349       0.2909427     89.66702 5.340672  60.42361 3.630234  29.24341       6.457661  
1 1 1 7  20 15 o 108.9087 2.235772  7.908201       0.3244618     8.113799       0.3387836     5.629572       1.127846      110.3128 2.304745  90.87398 9.451955  19.43885       9.728889  
1 1 1 7  20 16 o 170.1808 6.596305  19.46120       1.493006      19.81600       2.127337      19.11682       2.095874      170.9938 9.372300  167.9318 9.403662  3.062012       13.27663  
1 1 1 7  20 17 o 105.0830 4.012570  7.390269       0.5608284     7.528226       0.5857531     5.871929       1.943245      106.0439 4.153327  90.25725 16.77472  15.78661       17.28125  
1 1 1 7  20 18 o 60.07632 16.46079  2.634408       1.356511      4.157837       2.116714      1.572697       1.767071      74.27188 20.64519  51.38993 19.19792  22.88195       28.19192  
1 1 1 7  20 19 o 95.07899 12.00931  6.339811       1.487635      6.424406       2.382937      6.285787       1.904305      91.98666 20.01134  92.98461 15.94276  -0.9979553     25.58565  
1 1 1 7  20 20 f 47.51311 13.57115  1.636218       0.9018685     1.636956       1.013049      1.633399       1.980085      47.67557 14.58664  52.20029 20.12786  -4.524727      24.85761  
1 1 1 7  20 21 o 83.01369 15.15165  5.110641       1.614297      8.215792       3.837443      4.442994       1.779401      95.09010 28.23720  75.84151 17.89770  19.24859       33.43153  
1 1 1 7  20 22 o 40.48530 17.14741  0.4734867      1.599850      0.8279940      2.781443      0.2982143      1.955755      50.80325 22.07589  42.57420 18.50564  8.229053       28.80631  
1 1 1 7  20 23 o 35.93000 15.96703  -0.1207707     1.531769      1.632496       3.444489      -0.5529667     1.710177      56.04068 24.45597  35.65469 16.26061  20.38599       29.36839  
1 1 1 7  20 24 o 38.79650 18.52217  -2.042713      2.677565      -2.815327      2.887881      2.689559       7.147148      38.46044 18.58480  65.03568 30.82320  -26.57524      35.99256  
1 1 1 7  20 25 o 59.68051 22.41038  3.203451       2.414385      2.003918       2.859867      6.179465       4.504609      53.58692 22.82008  71.74522 29.44536  -18.15830      37.25299  
1 1 1 7  20 26 o 46.23593 12.94309  1.661160       0.8288001     0.9309674      3.036897      1.719921       0.8615031     48.57510 21.96087  46.93490 13.21642  1.640202       25.63111  
1 1 1 7  20 27 o 26.65727 12.20860  -0.4044937     0.9774269     -6.938334      4.942025      -0.1385091     0.9971234     41.22985 20.68576  28.57330 12.77786  12.65656       24.31408  
1 1 1 7  21 0  o 664.1487 12.71895  296.1537       11.24685      296.1537       11.24685      296.1537       11.24685      664.1487 12.71895  664.1487 12.71895  -0.000000      0.000000  
1 1 1 7  21 1  f 204.4416 10.33505  28.16206       2.806366      21.16093       3.851390      36.08713       4.097647      175.4823 16.67063  230.6615 13.38926  -55.17923      21.38182  
1 1 1 7  21 2  o 316.5574 6.949607  67.03423       2.931475      59.06212       6.020459      69.51173       3.356214      294.4579 15.39730  322.1824 7.817616  -27.72449      17.26823  
1 1 1 7  21 3  o 176.4254 8.163781  20.89926       1.914022      20.69617       2.343768      21.30589       3.316374      175.2097 10.08139  176.7766 14.19809  -1.566864      17.41322  
1 1 1 7  21 4  o 175.8975 6.077796  20.70486       1.422415      21.32995       1.571266      17.86671       3.348089      178.4639 6.618794  161.2971 15.77908  17.16678       17.11104  
1 1 1 7  21 5  o 147.7256 8.454610  14.67998       1.657317      14.06180       1.954202      16.26359       3.127776      144.2480 10.23328  153.8694 15.46439  -9.621368      18.54366  
1 1 1 7  21 6  o 421.5301 8.592892  119.1989       4.826602      113.7817       6.703154      125.0317       6.955530      410.2109 12.27686  430.0941 12.14866  -19.88321      17.27169  
1 1 1 7  21 7  o 69.63632 20.62141  3.425220       2.048894      4.510874       2.518046      1.298106       3.524628      79.25747 22.68887  63.54621 26.05951  15.71126       34.55261  
1 1 1 7  21 8  o 132.1473 6.381691  11.70952       1.120423      11.99061       1.593706      11.43482       1.575485      133.3081 9.024974  130.1461 9.142848  3.161987       12.84686  
1 1 1 7  21 9  o 28.57190 13.30589  -1.103873      1.233686      -0.4397686     1.846080      -1.639791      1.658369      40.14271 17.69858  32.39474 15.19680  7.747971       23.32771  
1 1 1 7  21 10 o 112.2833 9.129340  8.532825       1.354153      6.634480       2.277564      9.570839       1.684165      96.52586 18.37842  118.6139 10.77293  -22.08804      21.30310  
1 1 1 7  21 11 o 138.5912 7.099584  12.90816       1.306749      13.03398       1.537684      12.58110       2.479231      139.0415 8.337748  135.1666 13.96582  3.874878       16.26537  
1 1 1 7  21 12 o 172.0944 8.678910  19.97708       1.983815      18.69663       2.286185      23.88009       3.991438      166.0308 10.38555  185.4538 16.31800  -19.42302      19.34262  
1 1 1 7  21 13 o 232.1336 9.972490  36.48687       3.077521      33.47805       3.754912      42.64408       5.371473      221.1910 12.79429  247.7226 16.36416  -26.53162      20.77209  
1 1 1 7  21 14 o 157.3574 6.678460  16.64751       1.397167      17.13791       1.560798      14.66969       3.134481      159.5086 7.363125  144.3388 16.59887  15.16986       18.15869  
1 1 1 7  21 15 o 149.9560 1.888432  14.99208       0.3773451     15.21574       0.3960100     12.78574       1.243777      151.0662 1.967277  137.7702 6.796044  13.29594       7.075055  
1 1 1 7  21 16 o 60.46567 8.501801  2.519976       0.6661114     2.859044       0.9782271     2.226837       0.9095637     63.56671 11.98829  55.82824 12.53443  7.738468       17.34448  
1 1 1 7  21 17 o 243.2220 7.478818  40.00732       2.420990      39.72618       2.612557      41.71619       6.441124      242.0491 8.111527  237.2346 20.57895  4.814575       22.11990  
1 1 1 7  21 18 o 68.73605 13.87098  3.429782       1.226618      4.189091       1.790851      2.758760       1.683520      74.35325 18.22017  60.74802 18.84295  13.60522       26.21129  
1 1 1 7  21 19 o 153.0048 7.264080  15.92122       1.476784      15.37102       1.971348      16.62485       2.229344      148.9931 9.987094  154.4229 10.90419  -5.429749      14.78660  
1 1 1 7  21 20 o 58.42714 16.39086  2.613974       1.327657      2.562865       1.632816      2.713695       2.280761      57.66341 18.64182  59.80670 21.90609  -2.143284      28.76446  
1 1 1 7  21 21 o 93.39929 11.81573  6.285316       1.437688      6.537015       1.985075      6.007638       2.085000      91.96009 16.81920  86.75262 18.59523  5.207466       25.07325  
1 1 1 7  21 22 o 44.21207 17.41675  1.190138       1.508199      3.548279       2.578823      -0.3572917E-01 1.859338      63.76649 23.30359  39.42094 17.55059  24.34555       29.17328  
1 1 1 7  21 23 o 74.52817 19.97248  4.768533       2.023549      5.515939       3.634173      4.432681       2.436135      72.53260 27.43805  69.44559 22.79260  3.087006       35.67001  
1 1 1 7  21 24 o 31.93945 15.25222  -1.631288      1.817950      3.670894       3.535740      -3.536727      2.119584      61.75918 25.78286  29.91071 14.75802  31.84847       29.70783  
1 1 1 7  21 25 o 64.27554 21.36313  3.923343       2.137978      4.109612       3.722912      3.831684       2.611552      61.82425 26.17034  61.93612 23.29681  -0.1118736     35.03752  
1 1 1 7  22 0  o 263.3683 12.66477  46.90115       4.421090      46.90115       4.421090      46.90115       4.421090      263.3683 12.66477  263.3683 12.66477  -0.000000      0.000000  
1 1 1 7  22 1  o 234.6891 8.555960  37.01508       2.671208      39.98014       4.665829      35.56941       3.257962      241.9956 14.53632  229.5019 10.68266  12.49377       18.03951  
1 1 1 7  22 2  o 170.8038 7.569534  19.58809       1.718542      18.06837       3.002682      20.32840       2.095733      162.5041 14.00310  173.7170 9.085152  -11.21291      16.69212  
1 1 1 7  22 3  o 124.5622 4.855080  10.37823       0.8043104     7.408260       2.160382      10.85612       0.8666088     102.8957 16.29902  127.3750 5.116230  -24.47930      17.08315  
1 1 1 7  22 4  o 248.9392 9.540645  41.74276       3.158930      41.14965       3.750144      43.19170       5.861454      246.5741 11.44493  249.9598 17.71266  -3.385696      21.08850  
1 1 1 7  22 5  o 112.4862 11.78191  8.645504       1.739821      9.562100       2.084533      6.540883       3.158687      117.9193 13.50995  94.28008 24.81083  23.63927       28.25059  
1 1 1 7  22 6  o 230.3041 6.944404  35.56092       2.128696      35.67391       2.252794      34.61930       6.503436      230.5853 7.341250  220.8876 22.40479  9.697739       23.57687  
1 1 1 7  22 7  o 257.2418 8.873589  44.54635       3.037131      44.53350       3.658691      44.57481       5.446855      256.5996 10.72395  254.3337 16.15545  2.265915       19.39076  
1 1 1 7  22 8  o 94.60241 9.742434  6.093956       1.210587      6.309428       1.744057      5.893617       1.681702      95.17912 14.18386  91.92740 14.18459  3.251717       20.05952  
1 1 1 7  22 9  o 220.8947 7.890843  32.81781       2.318911      28.99732       3.082272      37.80055       3.520023      206.6143 11.23763  235.9823 11.22638  -29.36795      15.88446  
1 1 1 7  22 10 o 107.6842 11.57042  7.958287       1.634241      6.047861       2.196247      10.32839       2.446243      91.55706 18.63624  121.5816 15.44763  -30.02453      24.20617  
1 1 1 7  22 11 f 86.53102 9.814932  5.125394       1.111737      4.974085       1.199631      6.045933       2.958936      84.97997 10.84041  89.64177 24.20785  -4.661797      26.52423  
1 1 1 7  22 12 o 137.1563 12.25846  12.95440       2.216804      11.58453       3.091365      14.40451       3.180608      126.8826 18.85660  142.6100 17.07646  -15.72738      25.43967  
1 1 1 7  22 13 o 65.49354 25.28963  2.536660       3.129110      3.733973       4.361537      1.266763       4.491796      76.39944 29.75873  66.71983 28.51140  9.679619       41.21264  
1 1 1 7  22 14 o 146.5981 7.693359  14.54489       1.497597      15.14769       1.604637      10.47352       4.170254      149.4926 8.085426  114.1103 27.70701  35.38223       28.86265  
1 1 1 7  22 15 o 108.2433 3.589364  7.840375       0.5170008     8.210849       0.5341306     2.340797       2.057945      110.7694 3.623591  58.54858 20.89421  52.22078       21.20609  
1 1 1 7  22 16 o 66.63076 1.503635  2.959923       0.1335029     4.337406       3.163032      2.957465       0.1336220     74.23215 25.95619  66.60303 1.505603  7.629120       25.99982  
1 1 1 7  22 17 o 49.80547 10.02009  1.764862       0.6419417     1.845705       0.6515304     -0.9211982     3.755534      50.97945 9.948306  52.19192 23.91349  -1.212467      25.90027  
1 1 1 7  22 18 o 50.33311 7.804399  1.766258       0.5065030     1.106956       1.054440      1.964015       0.5774907     41.35287 14.93180  52.93984 8.471859  -11.58697      17.16773  
1 1 1 7  22 19 o 81.79502 7.652024  4.614299       0.8243397     6.192755       1.771437      4.178001       0.9313244     90.85936 15.16547  77.20124 9.236299  13.65812       17.75671  
1 1 1 7  22 20 o 49.16601 10.96609  1.770692       0.7001453     1.999219       1.659512      1.721207       0.7722392     51.69589 18.72330  48.13240 12.06501  3.563488       22.27390  
1 1 1 7  22 21 o ?        ?         -0.8711871     0.1722725     -1.329082      2.587329      -0.8691481     0.1726557     40.33791 18.94166  ?        ?         0.000000       18.94166  
1 1 1 7  22 22 o 33.39691 11.92660  0.7366086      0.6706414     4.316301       2.680577      0.4975846      0.6926697     67.36156 23.86626  30.58477 11.87440  36.77679       26.65707  
1 1 1 7  22 23 o 66.77193 12.42998  3.371368       1.065268      4.915046       2.649204      3.073626       1.163475      70.19167 23.78527  62.53482 14.27740  7.656857       27.74137  
1 1 1 7  22 24 o 29.08862 11.86977  0.3520530      0.7267466     1.103992       3.532128      0.3188129      0.7426360     50.63137 23.19580  28.95539 11.92734  21.67598       26.08268  
1 1 1 7  23 0  o 81.70795 23.24507  5.512357       2.192373      5.512357       2.192373      5.512357       2.192373      81.70795 23.24507  81.70795 23.24507  -0.000000      0.000000  
1 1 1 7  23 1  o 32.86530 14.46898  -0.2956222     1.229625      -0.1043775     1.998362      -0.4121487     1.559883      43.44308 18.79539  36.67769 16.21556  6.765392       24.82360  
1 1 1 7  23 2  o 124.6303 8.538284  10.49196       1.409407      10.90269       2.063541      10.13283       1.929598      126.1149 12.44115  121.6428 12.06312  4.472145       17.32920  
1 1 1 7  23 3  o 63.49627 1.621206  2.688873       0.1370580     2.378766       2.413998      2.689876       0.1372795     62.16425 22.57237  63.50803 1.623528  -1.343777      22.63068  
1 1 1 7  23 4  o 237.5581 9.910008  38.15334       3.130131      40.27271       4.683413      36.44241       4.208002      242.0586 14.58776  230.6148 13.75603  11.44380       20.05071  
1 1 1 7  23 5  o 127.2280 11.83244  11.08188       1.983005      10.11382       2.282510      14.06161       4.004508      120.6854 14.48227  139.1693 22.35042  -18.48394      26.63227  
1 1 1 7  23 6  f 214.1768 6.650394  30.78757       1.895687      28.57012       2.275807      35.81301       3.426069      205.8860 8.312448  229.4928 11.23766  -23.60677      13.97791  
1 1 1 7  23 7  o 246.4637 6.559207  40.76651       2.152244      40.33471       2.537893      41.87234       4.061403      244.7907 7.790371  247.5294 12.35237  -2.738693      14.60380  
1 1 1 7  23 8  o 25.56908 12.28398  -1.727314      1.218912      -4.529383      2.277973      -0.6031719     1.442845      31.43343 15.46882  33.93311 15.25719  -2.499674      21.72709  
1 1 1 7  23 9  o 68.57631 17.80282  3.429546       1.640907      1.961058       2.059141      5.984662       2.716166      56.59135 20.80033  89.10783 22.78797  -32.51647      30.85361  
1 1 1 7  23 10 o 74.18990 17.62524  4.030215       1.716477      6.189050       2.363254      1.619703       2.497212      91.38462 19.96676  56.75098 22.39425  34.63364       30.00290  
1 1 1 7  23 11 o 135.8836 7.187717  12.47189       1.296833      11.67357       1.439058      15.92231       2.991754      131.1575 8.276213  150.2897 15.14541  -19.13216      17.25918  
1 1 1 7  23 12 o 137.6861 11.64666  13.12100       2.116782      11.68187       2.961996      14.62319       3.026200      126.6236 18.06652  143.0383 16.15973  -16.41473      24.23915  
1 1 1 7  23 13 o 57.06457 19.72092  2.284500       1.823234      3.842147       3.227859      1.554693       2.209450      71.82967 26.09868  53.58937 21.08973  18.24029       33.55470  
1 1 1 7  23 14 o 39.14840 12.33385  1.064195       0.7183866     1.178135       0.7484936     -0.2672640     2.558675      40.91376 12.54202  46.34164 20.61266  -5.427879      24.12849  
1 1 1 7  23 15 o 75.22567 7.055937  3.866936       0.6990287     3.993573       0.7218072     1.954972       2.804670      76.42656 7.171451  58.06329 23.45532  18.36327       24.52716  
1 1 1 7  23 16 o 102.0083 2.182802  6.946018       0.2967039     6.973288       0.2994871     5.499228       2.181414      102.2069 2.198997  83.12370 19.94880  19.08316       20.06963  
1 1 1 7  23 17 o 95.81719 3.590040  6.160997       0.4575594     6.101565       0.4659063     7.775233       2.428142      95.33707 3.674320  99.16959 19.06719  -3.832520      19.41799  
1 1 1 7  23 18 o 84.98071 1.229489  4.815228       0.1392254     4.908266       0.1431950     3.206606       0.5954237     85.79653 1.252520  68.32111 6.623289  17.47542       6.740679  
1 1 1 7  23 19 o 34.62891 11.39057  0.8380495      0.6082885     1.130819       1.962865      0.8069457      0.6397853     46.57772 19.30807  34.35320 11.68815  12.22452       22.57021  
1 1 1 7  23 20 o 69.53565 12.69789  3.613429       1.133216      2.641875       2.614480      3.838177       1.257475      57.33822 22.82174  71.06490 13.77658  -13.72668      26.65757  
1 1 1 7  23 21 o 37.62154 16.00102  0.4812139      1.402993      -1.682785      3.198216      0.9968902      1.561234      42.63186 20.32264  42.33584 17.35061  0.2960167      26.72178  
1 1 1 7  23 22 o 39.04830 18.06058  -0.5132031     2.214223      0.7970551      3.089194      -1.897566      3.175351      48.62701 22.05022  41.35810 19.85825  7.268909       29.67428  
1 1 1 7  23 23 o 48.32548 20.33053  1.610143       2.224454      -0.2173572     3.704597      2.640566       2.781762      47.51860 22.42204  54.88196 22.88725  -7.363361      32.04020  
1 1 1 7  24 0  o 74.35677 17.98290  4.345003       1.544426      4.345003       1.544426      4.345003       1.544426      74.35677 17.98290  74.35677 17.98290  -0.000000      0.000000  
1 1 1 7  24 1  o 85.20982 14.21176  5.123071       1.556856      8.189844       2.133635      1.630991       2.276782      107.8136 15.27912  55.71445 21.55636  52.09915       26.42211  
1 1 1 7  24 2  o 81.24691 16.67471  4.757212       1.744707      10.14028       3.407023      2.843802       2.031255      116.7142 22.72439  63.56568 20.80971  53.14854       30.81301  
1 1 1 7  24 3  o 39.06875 13.62178  0.9514782      0.8707830     2.355259       2.467436      0.7517709      0.9306646     61.54776 22.74364  37.34121 13.93580  24.20654       26.67357  
1 1 1 7  24 4  o 83.94221 3.785586  4.716411       0.4223456     4.631225       4.052674      4.717346       0.4246579     80.48685 29.24376  83.94843 3.806136  -3.461586      29.49041  
1 1 1 7  24 5  o 48.04885 19.19785  0.9833900      1.857138      2.768517       2.734519      -0.5448788     2.530150      65.25233 23.97229  46.08501 20.49804  19.16732       31.54109  
1 1 1 7  24 6  o 82.72704 14.19286  4.860063       1.508247      3.154910       1.800195      8.875915       2.762656      65.61199 19.30334  109.9840 19.56778  -44.37201      27.48667  
1 1 1 7  24 7  o 27.34529 13.12890  -1.897402      1.387300      -2.309116      2.060488      -1.556004      1.876299      34.53333 16.41962  34.98380 16.33092  -0.4504662     23.15821  
1 1 1 7  24 8  o 61.02456 11.06295  2.622333       0.8664825     3.451767       1.071482      1.054851       1.472975      69.97507 11.91803  45.04750 17.36270  24.92757       21.05950  
1 1 1 7  24 9  o 50.20210 17.39027  1.690610       1.418101      3.179693       2.188322      0.6125537      1.861968      65.64183 21.60524  45.20192 18.77738  20.43991       28.62475  
1 1 1 7  24 10 o 64.68319 16.14354  3.092560       1.386944      2.383308       1.654377      4.769977       2.544221      57.43357 18.77891  77.99636 22.94866  -20.56279      29.65279  
1 1 1 7  24 11 f 141.8801 7.399180  13.66527       1.394040      14.07903       1.486677      10.65213       4.011900      143.8765 7.783472  113.0228 27.00797  30.85364       28.10717  
1 1 1 7  24 12 o 67.95193 18.71232  3.548516       1.747984      5.470779       3.464725      2.892190       2.024520      80.40188 27.20130  61.92606 20.79262  18.47582       34.23804  
1 1 1 7  24 13 o 198.4357 9.010910  27.07131       2.376442      26.98007       3.012406      27.22167       3.867020      196.1494 11.57680  193.7039 15.10106  2.445557       19.02799  
1 1 1 7  24 14 o 23.53664 10.18442  -0.3310794E-01 0.5869017     0.2331113      0.6027296     -4.903141      2.577916      26.64190 10.83273  32.57235 16.10890  -5.930445      19.41249  
1 1 1 7  24 15 o 40.63018 13.25106  1.173493       0.8240017     0.9020531      0.8515978     5.159267       3.263275      37.36642 13.42838  75.27225 26.36110  -37.90584      29.58427  
1 1 1 7  24 16 o 59.63239 8.533000  2.499536       0.6587392     2.518912       0.6761525     2.137830       2.921426      59.79125 8.745196  56.95382 23.57747  2.837429       25.14707  
1 1 1 7  24 17 o 52.63058 9.570373  1.988302       0.6464657     1.875551       0.6687291     3.597575       2.526415      50.84462 10.22509  64.30888 23.12680  -13.46426      25.28639  
1 1 1 7  24 18 o 64.94975 17.28661  3.421032       1.522363      3.791908       1.887527      2.730734       2.575120      66.74615 19.79958  58.01146 22.78687  8.734684       30.18716  
1 1 1 7  24 19 o 73.18465 1.318986  3.572515       0.1286275     3.567707       0.1315693     3.676446       0.6116899     73.13341 1.350098  73.08131 6.344118  0.5210114E-01  6.486185  
1 1 1 7  24 20 o 15.80515 7.159925  -0.1632652     0.3247515     -0.2432532     1.341830      -0.1582884     0.3347018     32.48222 14.64957  16.14227 7.294976  16.33994       16.36540  
1 1 1 7  24 21 o 52.42897 13.29480  2.148985       0.9299909     2.470758       2.225073      2.080876       1.023694      53.70478 21.15528  51.06305 14.41668  2.641731       25.60052  
1 1 1 7  25 0  o 27.88678 18.50717  -0.3659792     1.823300      -0.3659792     1.823300      -0.3659792     1.823300      27.88678 18.50717  27.88678 18.50717  0.000000       0.000000  
1 1 1 7  25 1  o 45.17234 16.56151  1.230878       1.304098      0.8050734      1.598250      2.079101       2.255768      44.13937 17.74995  57.69751 21.66258  -13.55814      28.00585  
1 1 1 7  25 2  o 40.03324 18.00010  -0.6497675     2.008301      -1.122444      2.633754      0.6855439E-02  3.104213      44.25424 20.18124  52.42498 23.03793  -8.170746      30.62725  
1 1 1 7  25 3  o 117.4577 2.881536  9.210965       0.4510026     8.982151       3.324101      9.215256       0.4552119     107.1119 23.89726  117.4828 2.907808  -10.37091      24.07352  
1 1 1 7  25 4  o 38.87651 1.684997  1.009598       0.8708181E-01 0.9017813E-01  4.232208      1.009987       0.8710025E-01 59.71938 26.53964  38.88402 1.685027  20.83536       26.59308  
1 1 1 7  25 5  o 53.68239 20.78042  1.653152       2.116603      2.622879       3.306733      0.9800711      2.754915      65.20766 25.75770  53.92236 22.65148  11.28530       34.30086  
1 1 1 7  25 6  o 85.79522 11.67883  5.173538       1.300538      5.259609       1.495724      4.906807       2.633058      85.78684 13.53257  78.69668 23.39522  7.090164       27.02715  
1 1 1 7  25 7  o 40.42006 15.57596  0.8588170      1.185244      1.638349       1.552143      -0.2315340     1.835684      50.02301 18.10887  39.83741 17.60264  10.18560       25.25438  
1 1 1 7  25 8  o 68.40170 17.42550  3.541936       1.592492      1.723922       2.002862      6.666826       2.625849      52.95038 20.28792  91.77688 21.79732  -38.82650      29.77789  
1 1 1 7  25 9  o 45.84026 13.53502  1.520886       0.8837322     2.431366       1.070923      -0.4224860     1.564593      57.39437 14.10495  35.60675 15.95843  21.78761       21.29838  
1 1 1 7  25 10 o 52.76892 11.77042  2.020765       0.8065757     1.523785       0.8518823     6.323681       2.506638      45.73271 13.22954  88.57012 21.46569  -42.83741      25.21500  
1 1 1 7  25 11 o 56.62344 8.185393  2.235810       0.5997022     2.468315       0.6249990     -0.4632274     2.129449      59.57745 8.080831  40.87379 18.44262  18.70366       20.13529  
1 1 1 7  25 12 o 75.23103 14.88809  4.250658       1.439628      1.481589       1.891992      8.058603       2.218696      49.39680 19.49245  102.8827 16.76027  -53.48592      25.70724  
1 1 1 7  25 13 o 110.6045 18.18528  9.577292       2.587129      15.73307       4.730701      6.950664       3.090177      129.9049 28.14418  87.57565 25.15508  42.32923       37.74749  
1 1 1 7  25 14 o 27.08179 11.72957  -0.3849379E-02 0.7799871     0.1082957E-01  0.8100757     -0.1905104     2.888716      27.68271 11.97176  46.79448 21.26008  -19.11178      24.39906  
1 1 1 7  25 15 o 35.58171 11.83552  0.8838771      0.6561893     0.8546831      0.6708052     1.532000       3.160665      35.24476 11.96848  54.38212 23.58253  -19.13736      26.44580  
1 1 1 7  25 16 o 29.12010 13.24761  -0.4378171     1.126254      -0.1647570     1.166389      -4.202041      4.330638      31.26342 13.91082  44.72847 21.87016  -13.46505      25.91938  
1 1 1 7  25 17 o 37.00880 13.63822  0.9024188      0.8861948     0.8626632      0.9015412     2.040429       4.823471      36.67479 13.71021  58.87708 27.02276  -22.20229      30.30181  
1 1 1 7  25 18 o 87.16290 6.878807  5.258120       0.7924758     6.044396       0.8490014     -0.6378201E-01 2.208789      93.49434 6.862556  41.04860 18.62622  52.44574       19.85021  
1 1 1 7  25 19 o 74.86253 16.66034  4.610523       1.619153      3.986956       1.774541      7.710575       3.956661      67.44798 18.95971  79.18147 28.87644  -11.73349      34.54445  
1 1 1 7  26 0  o 56.49652 28.86899  3.591576       2.743085      3.591576       2.743085      3.591576       2.743085      56.49652 28.86899  56.49652 28.86899  0.000000       0.000000  
1 1 1 7  26 1  o 118.5285 10.76111  9.798312       1.681121      11.56323       2.429514      8.176938       2.328623      126.5256 14.68242  104.6039 17.31117  21.92165       22.69912  
1 1 1 7  26 2  o 157.0127 9.936516  17.04476       2.068278      16.56581       2.832017      17.59220       3.027759      152.0057 14.14407  156.2270 14.71767  -4.221313      20.41236  
1 1 1 7  26 3  o 47.72526 19.31540  1.093390       1.905998      5.002825       3.365681      -0.7522683     2.312552      76.93687 26.78311  41.79164 19.00084  35.14523       32.83849  
1 1 1 7  26 4  o 83.57110 18.52874  5.387999       2.009203      9.480807       3.345492      3.078945       2.512849      107.1509 24.02547  63.67208 23.04258  43.47883       33.28939  
1 1 1 7  26 5  f 116.4670 19.56055  10.50154       2.928184      9.290103       5.798419      10.91624       3.392553      94.04739 34.84478  116.0317 22.75550  -21.98429      41.61696  
1 1 1 7  26 6  o 69.99461 15.09317  3.667099       1.366266      4.600387       1.552309      0.4585994      2.878201      78.44988 15.39954  50.65582 22.22435  27.79406       27.03826  
1 1 1 7  26 7  o 131.5324 10.25245  12.09180       1.782758      8.095403       2.216652      19.41117       2.999852      103.5925 16.62003  163.8250 13.87216  -60.23253      21.64861  
1 1 1 7  26 8  o 41.81875 15.77009  1.071680       1.198368      0.2595755      1.395307      3.354892       2.339575      37.22628 15.89885  64.29556 22.33331  -27.06928      27.41442  
1 1 1 7  26 9  o 22.97548 11.37688  -2.760894      1.300518      -1.186807      1.620911      -5.605242      2.178895      32.29398 15.10912  27.36582 13.73067  4.928164       20.41609  
1 1 1 7  26 10 o 70.49634 11.64636  3.602353       1.055863      3.070148       1.374804      4.367703       1.648660      62.79848 16.29177  74.75294 16.94386  -11.95445      23.50567  
1 1 1 7  26 11 o 58.50949 20.82300  2.742242       2.042589      4.326619       3.774286      2.086008       2.429041      69.02052 27.43707  54.92411 21.95208  14.09641       35.13810  
1 1 1 7  26 12 o 55.57542 20.42938  2.411456       1.986449      3.782047       3.031899      1.380600       2.629420      65.45735 24.99074  51.60464 21.92519  13.85271       33.24532  
1 1 1 7  26 13 o 85.75854 15.99992  5.720101       1.761153      6.497336       2.554446      5.015941       2.431400      85.94265 22.16234  74.83435 22.53681  11.10830       31.60818  
1 1 1 7  26 14 o 44.79133 14.45824  1.515524       0.9824189     1.443071       1.061639      1.947359       2.591845      44.09833 15.05522  53.35191 22.15776  -9.253582      26.78854  
1 1 1 7  26 15 o 104.8018 6.918500  7.577349       0.9607673     7.648981       0.9831797     6.059688       4.525487      105.2281 7.052492  71.68810 29.47758  33.53997       30.30950  
1 1 1 7  26 16 o 70.58367 5.931635  3.422930       0.5527380     3.567643       0.5593246     -2.613203      3.612346      72.09064 5.873376  42.65588 20.65394  29.43476       21.47281  
1 1 1 7  26 17 o 66.67061 14.39706  3.497680       1.241553      4.877757       1.310370      -8.615689      3.882174      80.37092 12.65339  35.05049 17.68217  45.32043       21.74322  
1 1 1 7  27 0  o 41.61186 25.37979  1.592647       2.655704      1.592647       2.655704      1.592647       2.655704      41.61186 25.37979  41.61186 25.37979  0.000000       0.000000  
1 1 1 7  27 1  o 37.57948 15.16999  0.6307858      1.172280      2.067261       1.765874      -0.5010840     1.567505      53.16016 19.30541  34.73104 15.73228  18.42913       24.90388  
1 1 1 7  27 2  o 41.15260 17.36476  0.5363204      1.630570      0.1041231      2.563180      0.8301250      2.113330      46.31446 20.61385  46.62159 19.72543  -0.3071251     28.53110  
1 1 1 7  27 3  o 92.41470 12.72838  6.204964       1.525843      6.032597       2.509658      6.306044       1.921847      84.48502 22.05863  90.76311 16.49797  -6.278091      27.54571  
1 1 1 7  27 4  o 52.96039 1.340346  1.871515       0.9451322E-01 5.985563       3.465805      1.868453       0.9454838E-01 79.54259 27.20085  52.91693 1.341950  26.62566       27.23393  
1 1 1 7  27 5  o 40.22172 17.19301  0.4038248      1.634244      -0.2525662     2.900401      0.7091519      1.978151      46.98041 21.32819  44.78997 19.02295  2.190437       28.57909  
1 1 1 7  27 6  o 39.37893 14.60300  0.9829936      1.018814      0.7078177      1.110307      2.449250       2.562966      37.48599 14.88785  57.67904 22.70972  -20.19304      27.15473  
1 1 1 7  27 7  o 55.85218 18.66450  2.459681       1.631528      1.280858       1.894389      5.845302       3.210438      47.47973 19.24179  78.57675 26.18023  -31.09702      32.49078  
1 1 1 7  27 8  o 72.30318 14.53729  3.971006       1.351992      3.604022       1.561619      5.069289       2.701526      67.17902 17.33060  74.73639 23.96189  -7.557365      29.57231  
1 1 1 7  27 9  o 53.27500 15.35914  2.203300       1.150030      1.759697       1.450295      2.954718       1.887553      48.79062 17.52527  59.76563 20.07703  -10.97501      26.65000  
1 1 1 7  27 10 o 81.63492 12.44471  4.914716       1.310990      5.014145       1.597922      4.709977       2.292978      80.46811 15.46421  72.89935 21.87054  7.568756       26.78548  
1 1 1 7  27 11 o 69.08032 13.67520  3.630404       1.214250      4.015118       1.415128      2.556497       2.364342      71.68477 15.28198  56.28075 21.91373  15.40402       26.71611  
1 1 1 7  27 12 o 33.31082 14.83024  -0.1102498     1.327595      -1.765945      1.788596      1.921100       1.981137      31.37216 15.02113  50.84558 19.98236  -19.47341      24.99858  
1 1 1 7  27 13 o 54.36424 21.91954  2.362798       2.444302      3.972648       3.285466      0.3671810      3.657994      63.49533 25.47837  50.35583 23.26332  13.13950       34.50115  
1 1 1 7  27 14 o 61.64404 15.78987  3.077462       1.302628      2.643817       1.365341      7.475287       4.348033      56.52101 16.85756  76.95070 29.78487  -20.42969      34.22449  
1 1 1 7  28 0  f 47.12787 25.46571  2.600393       2.228732      2.600393       2.228732      2.600393       2.228732      47.12787 25.46571  47.12787 25.46571  -0.000000      0.000000  
1 1 1 7  28 1  o 105.0150 11.45726  7.945564       1.577291      7.298800       2.034741      8.919376       2.496742      97.06603 16.30922  105.5551 18.42061  -8.489098      24.60304  
1 1 1 7  28 2  o 79.61752 14.48399  4.808455       1.480044      6.030740       2.445418      4.101916       1.859236      83.30890 21.78572  70.22101 19.28338  13.08789       29.09410  
1 1 1 7  28 3  o 33.59266 15.44705  -0.6945317     1.586370      -2.802501      2.202583      1.577547       2.286714      32.95300 15.99620  50.80069 20.92814  -17.84770      26.34132  
1 1 1 7  28 4  o 50.40442 1.701516  1.697413       0.1141182     3.395560       1.799251      1.690554       0.1143485     63.67173 19.43155  50.30179 1.708457  13.36995       19.50652  
1 1 1 7  28 5  o 72.92184 19.23842  4.457320       1.896097      5.043772       3.209066      4.142770       2.350214      71.69067 26.02631  67.99831 22.39060  3.692352       34.33231  
1 1 1 7  28 6  o 30.99930 12.85092  0.3183186      0.8695842     0.2364378      1.081802      0.4678321      1.461830      32.91989 14.02762  38.41647 16.33589  -5.496582      21.53219  
1 1 1 7  28 7  o 62.33340 18.28049  3.238475       1.616658      4.031362       2.054934      1.950682       2.618877      67.70149 20.78642  53.32920 22.22083  14.37229       30.42763  
1 1 1 7  28 8  o 92.70670 15.70046  6.726641       1.870379      4.814374       2.785339      8.297071       2.524138      70.32036 24.37138  99.00363 19.82518  -28.68327      31.41659  
1 1 1 7  28 9  o 78.69461 11.23840  4.534964       1.145048      3.742122       1.434239      5.928602       1.901530      68.27894 16.03838  85.36215 17.31022  -17.08321      23.59816  
1 1 1 7  28 10 o 25.36953 11.17446  -0.8482795E-01 0.7342578     -0.2390692     0.7834707     1.028503       2.104915      25.01640 11.24586  45.66473 19.51584  -20.64833      22.52415  
1 1 1 7  28 11 o 31.63700 14.84403  -1.022701      1.583505      -1.924530      2.026302      0.3920300      2.537927      33.05893 15.87078  45.01839 20.23876  -11.95946      25.71943  
1 1 1 7  29 0  o 36.34231 24.98641  -0.9548181     3.951364      -0.9548181     3.951364      -0.9548181     3.951364      36.34231 24.98641  36.34231 24.98641  0.000000       0.000000  
1 1 1 7  29 1  o 41.15449 17.03210  0.8455950      1.523941      1.222350       1.913980      0.1930806      2.518855      45.98094 19.06389  44.49016 20.06773  1.490784       27.67933  
1 1 1 7  29 2  f 27.62558 13.43945  -2.210870      1.577691      -2.558170      1.891545      -1.416933      2.859943      30.10563 14.66163  41.34858 19.56762  -11.24294      24.45108  
1 1 1 7  29 3  o 45.73458 18.07475  1.405147       1.629031      0.1492839      3.122115      1.874953       1.909576      47.56069 21.79610  50.17314 19.64793  -2.612450      29.34470  
1 1 1 7  29 4  o 27.37088 12.00995  -0.4828367E-01 0.8407433     -2.177883      2.541303      0.2134461      0.8909106     36.91357 17.73488  30.18897 12.79167  6.724602       21.86671  
1 1 1 7  29 5  o 54.41339 18.17722  2.455249       1.547471      4.295304       2.391097      1.129114       2.029905      67.58492 22.59546  45.88773 19.36941  21.69719       29.76120  
1 1 1 8  0  0  o 21.68623 11.73042  0.4427902      0.4733775     0.4427902      0.4733775     0.4427902      0.4733775     21.68623 11.73042  21.68623 11.73042  0.000000       0.000000  
1 1 1 8  0  1  o 17.52989 10.92947  0.1220853      0.5188820     0.1220853      0.5188820     0.1220853      0.5188820     17.52989 10.92947  17.52989 10.92947  0.000000       0.000000  
1 1 1 8  0  2  o 718.3262 22.99457  345.9346       21.95890      345.9346       21.95890      345.9346       21.95890      718.3262 22.99457  718.3262 22.99457  -0.000000      0.000000  
1 1 1 8  0  3  o 389.0349 12.31958  101.2345       6.371910      101.2345       6.371910      101.2345       6.371910      389.0349 12.31958  389.0349 12.31958  -0.000000      0.000000  
1 1 1 8  0  4  f 517.3176 35.10731  182.1327       23.94077      182.1327       23.94077      182.1327       23.94077      517.3176 35.10731  517.3176 35.10731  -0.000000      0.000000  
1 1 1 8  0  5  o 402.8260 30.71083  110.6542       16.25886      110.6542       16.25886      110.6542       16.25886      402.8260 30.71083  402.8260 30.71083  -0.000000      0.000000  
1 1 1 8  0  6  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 8  0  7  o 306.8436 6.378065  62.83139       2.605289      62.83139       2.605289      62.83139       2.605289      306.8436 6.378065  306.8436 6.378065  -0.000000      0.000000  
1 1 1 8  0  8  o 419.0639 11.74959  117.4185       6.549436      117.4185       6.549436      117.4185       6.549436      419.0639 11.74959  419.0639 11.74959  -0.000000      0.000000  
1 1 1 8  0  9  o 7.149833 5.163492  -0.4786539     0.2530690     -0.4786539     0.2530690     -0.4786539     0.2530690     7.149833 5.163492  7.149833 5.163492  -0.000000      0.000000  
1 1 1 8  0  10 o 78.71397 1.631442  4.133512       0.1709526     4.133512       0.1709526     4.133512       0.1709526     78.71397 1.631442  78.71397 1.631442  -0.000000      0.000000  
1 1 1 8  0  11 o 252.2849 7.426131  42.54440       2.491578      42.54440       2.491578      42.54440       2.491578      252.2849 7.426131  252.2849 7.426131  -0.000000      0.000000  
1 1 1 8  0  12 o 211.2850 7.538350  29.87886       2.116222      29.87886       2.116222      29.87886       2.116222      211.2850 7.538350  211.2850 7.538350  0.000000       0.000000  
1 1 1 8  0  13 o 371.4241 12.50394  92.42720       6.172659      92.42720       6.172659      92.42720       6.172659      371.4241 12.50394  371.4241 12.50394  -0.000000      0.000000  
1 1 1 8  0  14 o 234.2453 13.81827  37.03761       4.278511      37.03761       4.278511      37.03761       4.278511      234.2453 13.81827  234.2453 13.81827  -0.000000      0.000000  
1 1 1 8  0  15 o 118.8816 10.82190  9.663161       1.679976      9.663161       1.679976      9.663161       1.679976      118.8816 10.82190  118.8816 10.82190  -0.000000      0.000000  
1 1 1 8  0  16 o 338.2685 11.85666  76.66328       5.329473      76.66328       5.329473      76.66328       5.329473      338.2685 11.85666  338.2685 11.85666  -0.000000      0.000000  
1 1 1 8  0  17 o 153.1292 16.98657  16.24673       3.357162      16.24673       3.357162      16.24673       3.357162      153.1292 16.98657  153.1292 16.98657  -0.000000      0.000000  
1 1 1 8  0  18 o 200.8317 17.69764  27.59723       4.647716      27.59723       4.647716      27.59723       4.647716      200.8317 17.69764  200.8317 17.69764  0.000000       0.000000  
1 1 1 8  0  19 o 386.8927 11.17587  100.1412       5.750746      100.1412       5.750746      100.1412       5.750746      386.8927 11.17587  386.8927 11.17587  -0.000000      0.000000  
1 1 1 8  0  20 o 44.93711 29.51091  -0.6858921     4.447303      -0.6858921     4.447303      -0.6858921     4.447303      44.93711 29.51091  44.93711 29.51091  0.000000       0.000000  
1 1 1 8  0  21 o 275.9660 18.37913  51.68843       6.688735      51.68843       6.688735      51.68843       6.688735      275.9660 18.37913  275.9660 18.37913  -0.000000      0.000000  
1 1 1 8  0  22 o 207.5560 12.94053  29.13077       3.546739      29.13077       3.546739      29.13077       3.546739      207.5560 12.94053  207.5560 12.94053  -0.000000      0.000000  
1 1 1 8  0  23 o 81.02716 29.47498  5.901106       2.927014      5.901106       2.927014      5.901106       2.927014      81.02716 29.47498  81.02716 29.47498  -0.000000      0.000000  
1 1 1 8  0  24 o 211.8867 13.72766  30.46826       3.838093      30.46826       3.838093      30.46826       3.838093      211.8867 13.72766  211.8867 13.72766  -0.000000      0.000000  
1 1 1 8  0  25 o 126.6971 18.35745  11.47701       2.909935      11.47701       2.909935      11.47701       2.909935      126.6971 18.35745  126.6971 18.35745  -0.000000      0.000000  
1 1 1 8  0  26 o 227.5047 12.59101  35.06849       3.790099      35.06849       3.790099      35.06849       3.790099      227.5047 12.59101  227.5047 12.59101  0.000000       0.000000  
1 1 1 8  0  27 o 264.3067 11.48535  47.16989       4.027644      47.16989       4.027644      47.16989       4.027644      264.3067 11.48535  264.3067 11.48535  -0.000000      0.000000  
1 1 1 8  0  28 o 83.52210 15.42588  5.159028       1.544416      5.159028       1.544416      5.159028       1.544416      83.52210 15.42588  83.52210 15.42588  0.000000       0.000000  
1 1 1 8  0  29 o 36.11551 18.79796  1.308557       1.177212      1.308557       1.177212      1.308557       1.177212      36.11551 18.79796  36.11551 18.79796  -0.000000      0.000000  
1 1 1 8  0  30 o 235.6966 11.81203  37.86887       3.688446      37.86887       3.688446      37.86887       3.688446      235.6966 11.81203  235.6966 11.81203  0.000000       0.000000  
1 1 1 8  0  31 o 70.28986 12.72211  3.662763       1.075843      3.662763       1.075843      3.662763       1.075843      70.28986 12.72211  70.28986 12.72211  0.000000       0.000000  
1 1 1 8  0  32 o 6.876348 5.033230  -0.7370988     0.2913609     -0.7370988     0.2913609     -0.7370988     0.2913609     6.876348 5.033230  6.876348 5.033230  -0.000000      0.000000  
1 1 1 8  0  33 o 97.28190 13.55550  6.939741       1.659679      6.939741       1.659679      6.939741       1.659679      97.28190 13.55550  97.28190 13.55550  -0.000000      0.000000  
1 1 1 8  0  34 o 9.243464 6.851955  -2.531424      0.7085550     -2.531424      0.7085550     -2.531424      0.7085550     9.243464 6.851955  9.243464 6.851955  0.000000       0.000000  
1 1 1 8  0  35 o 47.62138 28.59609  3.069564       3.263556      3.069564       3.263556      3.069564       3.263556      47.62138 28.59609  47.62138 28.59609  -0.000000      0.000000  
1 1 1 8  0  36 o 35.26889 24.63035  -1.048271      4.242234      -1.048271      4.242234      -1.048271      4.242234      35.26889 24.63035  35.26889 24.63035  -0.000000      0.000000  
1 1 1 8  1  0  o 722.5226 22.36040  349.8471       21.48133      349.8471       21.48133      349.8471       21.48133      722.5226 22.36040  722.5226 22.36040  -0.000000      0.000000  
1 1 1 8  1  1  o 547.0426 12.41400  199.7510       9.049121      190.7183       15.86104      204.1100       11.01831      532.9630 22.38355  552.5453 14.97871  -19.58240      26.93297  
1 1 1 8  1  2  o 621.7053 11.77509  257.9558       9.754889      279.8633       17.69206      248.3866       11.69286      646.1282 20.57502  609.8114 14.38970  36.31683       25.10767  
1 1 1 8  1  3  o 422.7122 8.768968  119.1651       4.939315      112.3171       7.191595      125.2799       6.795697      409.9289 13.18282  433.0953 11.78640  -23.16641      17.68349  
1 1 1 8  1  4  o 448.9930 19.81999  135.2547       11.82892      121.8320       15.50348      153.9549       18.29922      424.6781 27.54515  477.2846 28.90830  -52.60648      39.93025  
1 1 1 8  1  5  o 729.1044 24.19839  357.3782       23.47727      365.4756       32.45987      348.4958       33.99722      734.4270 33.25468  716.2018 35.73621  18.22516       48.81547  
1 1 1 8  1  6  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 8  1  7  o 497.7184 11.01671  165.3630       7.306498      168.1790       7.726060      141.5276       22.47773      501.8908 11.55248  454.4752 37.44865  47.41562       39.19006  
1 1 1 8  1  8  o 247.0199 4.516825  40.66876       1.486753      39.99720       1.606769      44.66697       3.920536      244.9639 4.922413  258.3820 11.41518  -13.41814      12.43127  
1 1 1 8  1  9  o 326.7520 7.414939  71.21074       3.228490      72.80311       4.112270      68.65240       5.212408      330.1486 9.357005  320.3021 12.23501  9.846497       15.40289  
1 1 1 8  1  10 o 293.8811 3.431193  57.55756       1.343663      54.84417       2.147577      59.30299       1.722441      286.8063 5.619357  298.2802 4.333576  -11.47397      7.096270  
1 1 1 8  1  11 o 452.2285 6.455663  136.3966       3.890203      136.8003       4.805879      135.6294       6.625406      452.7764 7.965547  450.5122 11.03653  2.264191       13.61084  
1 1 1 8  1  12 o 383.0835 5.682559  97.86131       2.900754      98.64346       4.061099      97.04662       4.144753      384.4520 7.927347  381.3085 8.157342  3.143555       11.37475  
1 1 1 8  1  13 o 286.5488 8.075186  54.85037       3.080288      55.08960       4.512206      54.64159       4.215304      286.7439 11.83466  285.6706 11.09472  1.073303       16.22196  
1 1 1 8  1  14 o 261.2346 6.613711  45.55433       2.300383      51.83628       5.005540      43.87233       2.590105      277.8688 13.55973  256.2851 7.592756  21.58368       15.54079  
1 1 1 8  1  15 o 627.4195 8.686399  262.8392       7.262252      255.3881       10.28669      270.2431       10.25414      617.7557 12.49641  635.5541 12.10802  -17.79834      17.40013  
1 1 1 8  1  16 o 392.2601 9.609247  102.7738       5.022697      102.6658       6.902552      102.8953       7.322357      391.3903 13.25419  391.6856 14.05219  -0.2952881     19.31677  
1 1 1 8  1  17 o 590.2303 8.762231  232.5737       6.891436      216.1430       10.54781      244.8113       9.102962      568.1271 13.93296  605.1584 11.28860  -37.03131      17.93209  
1 1 1 8  1  18 f 477.9061 12.18684  152.8475       7.754483      164.8848       14.18209      147.7139       9.261558      494.0721 21.59368  469.3053 14.82861  24.76678       26.19493  
1 1 1 8  1  19 o 345.1171 8.585842  79.50848       3.948416      78.54166       5.435165      80.58890       5.745560      342.5008 11.92727  346.8654 12.45097  -4.364594      17.24199  
1 1 1 8  1  20 o 338.0927 13.50856  76.67296       6.073559      72.38257       12.12199      78.11101       7.017998      324.7882 28.29120  340.8954 15.49012  -16.10718      32.25424  
1 1 1 8  1  21 o 80.34206 16.98275  4.502882       1.761161      4.461553       2.221692      4.572767       2.889057      79.79288 20.71542  81.61551 24.56365  -1.822624      32.13257  
1 1 1 8  1  22 o 318.4164 9.820735  67.88018       4.161917      68.12699       8.468539      67.80158       4.778856      316.5466 20.18204  317.9834 11.29631  -1.436798      23.12837  
1 1 1 8  1  23 o 221.3248 10.59891  32.89985       3.116741      29.53933       3.684231      41.35804       5.844979      209.1990 13.28504  246.4931 17.91761  -37.29410      22.30545  
1 1 1 8  1  24 o 228.3535 10.62823  35.07445       3.225144      24.52390       6.436382      38.61161       3.726763      185.9089 26.75085  239.3756 11.71927  -53.46664      29.20530  
1 1 1 8  1  25 o 225.2492 8.433847  34.04760       2.526939      26.64231       5.169350      36.37275       2.896609      195.8383 20.09378  232.6330 9.363395  -36.79465      22.16829  
1 1 1 8  1  26 o 62.42469 14.12833  2.749811       1.147725      4.001652       1.491806      0.9341338      1.796623      75.31489 15.38525  47.95528 18.97251  27.35961       24.42667  
1 1 1 8  1  27 o 152.1605 7.860430  15.58032       1.588353      16.37498       2.186757      14.69287       2.310925      155.3771 10.62581  146.8011 11.91598  8.575928       15.96554  
1 1 1 8  1  28 o 13.53853 6.662860  -0.8913963     0.4228156     0.5197806      0.9413775     -1.248017      0.4732347     35.17543 13.78921  13.25347 6.612072  21.92196       15.29254  
1 1 1 8  1  29 o 148.7746 8.439743  14.97641       1.666275      16.98367       2.475161      13.31277       2.253361      157.3107 11.89604  139.0347 12.28922  18.27597       17.10382  
1 1 1 8  1  30 o 30.70076 11.12091  0.5437158      0.5854868     0.3308616      2.539567      0.5556644      0.6016956     49.68365 21.33883  31.06750 11.27096  18.61616       24.13256  
1 1 1 8  1  31 o 80.13557 4.853183  4.324407       0.5158042     3.917794       0.5406234     8.450351       1.722131      76.16936 5.360725  109.7034 11.97497  -33.53401      13.12011  
1 1 1 8  1  32 o 188.9981 8.844418  24.60279       2.221232      26.38719       2.863253      21.90578       3.520105      193.9239 11.12710  172.6444 15.46498  21.27948       19.05198  
1 1 1 8  1  33 o 56.72453 15.79069  2.514997       1.237316      1.592944       1.362710      6.844721       2.952947      47.02398 16.97537  86.27644 24.52863  -39.25247      29.82980  
1 1 1 8  1  34 o 32.56034 13.19650  0.4789192      0.8911135     0.2695149      0.9060613     6.668852       4.926151      30.84801 12.97636  72.72387 30.40199  -41.87585      33.05551  
1 1 1 8  1  35 o 33.07297 14.33065  0.2146865      1.165295      0.6622159      1.288807      -1.790211      2.727866      37.40030 15.58632  38.47688 18.45673  -1.076576      24.15749  
1 1 1 8  1  36 o 20.74031 10.17423  -1.622934      0.9607304     -1.456118      0.9897694     -4.341328      3.995509      21.77396 10.60443  39.43505 19.59827  -17.66109      22.28331  
1 1 1 8  2  0  o 208.3720 7.725952  29.05787       2.138483      29.05787       2.138483      29.05787       2.138483      208.3720 7.725952  208.3720 7.725952  0.000000       0.000000  
1 1 1 8  2  1  o 88.10287 5.785700  5.195986       0.6754752     6.525033       1.354614      4.756155       0.7792704     98.33931 10.49973  84.17387 7.011249  14.16544       12.62545  
1 1 1 8  2  2  o 653.2210 10.98513  284.7181       9.561786      281.1107       13.70982      288.1347       13.34248      648.5424 15.86426  656.6728 15.24804  -8.130432      22.00403  
1 1 1 8  2  3  o 474.0649 10.46061  149.9425       6.607977      163.9854       9.776646      138.1317       8.966063      495.1988 14.83292  454.4523 14.82592  40.74655       20.97196  
1 1 1 8  2  4  o 351.5855 11.76339  82.60062       5.503325      78.81441       7.127725      88.18947       8.659840      343.0313 15.63460  362.6052 17.97872  -19.57382      23.82594  
1 1 1 8  2  5  o 395.4873 9.083442  104.3296       4.786923      106.5405       8.956812      103.4456       5.663635      398.7397 16.89569  393.5665 10.80973  5.173157       20.05778  
1 1 1 8  2  6  o 256.7015 13.51965  44.14402       4.608223      44.14402       4.608223      0.000000       0.000000      256.7015 13.51965  ?        ?         0.000000       13.51965  
1 1 1 8  2  7  o 87.62167 1.061498  5.115339       0.1239379     5.102664       0.1243827     6.878131       1.466855      87.51304 1.066630  100.9002 11.09266  -13.38717      11.14382  
1 1 1 8  2  8  o 485.9003 6.938809  157.4384       4.492681      154.2411       5.627417      163.0583       7.460620      480.8167 8.783266  494.1432 11.33049  -13.32648      14.33617  
1 1 1 8  2  9  o 433.4410 9.859591  125.4167       5.694590      133.0428       7.443714      114.6553       8.842441      445.9806 12.53809  413.4490 16.08072  32.53165       20.39101  
1 1 1 8  2  10 o 273.0482 4.558179  49.69691       1.658457      48.91625       2.943073      50.06015       2.007555      270.6295 8.170526  274.0145 5.498198  -3.384979      9.848231  
1 1 1 8  2  11 o 295.3817 3.556850  58.14977       1.399983      64.10623       2.242445      54.34532       1.792147      310.0762 5.427249  285.5215 4.710439  24.55472       7.186325  
1 1 1 8  2  12 o 227.6321 5.736235  34.57602       1.738553      33.79457       2.350040      35.52077       2.583941      224.8918 7.854080  230.5215 8.426146  -5.629715      11.51896  
1 1 1 8  2  13 o 253.6729 7.199955  42.97116       2.431297      40.19784       3.979021      44.62351       3.071338      244.8086 12.23644  258.3521 8.935034  -13.54353      15.15141  
1 1 1 8  2  14 o 171.9019 7.510407  19.75745       1.716201      21.31540       4.803721      19.52950       1.837468      176.5970 20.81294  170.8568 8.093764  5.740189       22.33131  
1 1 1 8  2  15 o 356.1186 6.667775  84.60188       3.164092      79.00552       5.242401      87.80872       3.968414      343.5262 11.46848  362.6873 8.211285  -19.16101      14.10501  
1 1 1 8  2  16 o 473.9255 10.32125  150.0758       6.518026      149.9088       8.656371      150.2946       9.905064      472.9401 13.75047  473.1180 15.73326  -0.1778870     20.89524  
1 1 1 8  2  17 o 225.0294 9.294581  33.87144       2.781036      32.95744       3.890041      34.82693       3.977371      221.5148 13.23927  227.7426 13.16232  -6.227798      18.66882  
1 1 1 8  2  18 o 348.5826 11.38478  81.31211       5.281058      97.76385       12.81674      77.94772       5.795947      379.0898 25.52114  341.0926 12.77458  37.99722       28.53977  
1 1 1 8  2  19 o 214.6951 10.17618  30.86261       2.902971      32.14777       3.925454      29.31141       4.312650      218.7235 13.53486  208.5051 15.63612  10.21844       20.68044  
1 1 1 8  2  20 o 500.8766 13.11600  168.0907       8.746449      167.2676       11.40319      169.2669       13.63170      498.6486 17.18731  500.6221 20.47783  -1.973511      26.73472  
1 1 1 8  2  21 o 174.7975 12.08859  20.55326       2.798343      21.10094       3.231172      18.90991       5.597081      176.8668 13.81973  164.6367 26.40532  12.23010       29.80312  
1 1 1 8  2  22 o 198.3597 9.921254  26.38757       2.614043      18.24991       4.978384      29.48523       3.071537      162.0163 23.76606  209.5504 11.03897  -47.53409      26.20466  
1 1 1 8  2  23 o 341.1504 8.868708  77.91742       4.028203      77.40474       5.369114      78.57760       6.092730      339.3737 11.89111  341.5382 13.41357  -2.164459      17.92547  
1 1 1 8  2  24 o 108.4359 8.497394  7.919797       1.218013      11.40798       1.696695      4.210767       1.749583      130.0603 9.863608  77.23460 17.41682  52.82568       20.01591  
1 1 1 8  2  25 o 238.8621 8.990781  38.32310       2.856553      43.66822       5.952580      36.72389       3.255956      252.1061 17.83449  233.4753 10.49241  18.63086       20.69202  
1 1 1 8  2  26 o 105.4653 4.926728  7.445218       0.6904624     5.378642       1.676328      7.867452       0.7577226     87.73379 14.86947  108.3866 5.262121  -20.65280      15.77311  
1 1 1 8  2  27 o 206.2500 8.122931  28.61209       2.228076      26.98687       3.446984      29.77845       2.920107      198.8006 13.08486  209.7673 10.48009  -10.96661      16.76443  
1 1 1 8  2  28 o 70.45605 11.32711  3.447814       1.027397      5.890627       2.793250      3.065627       1.104848      89.00212 23.28805  65.95065 13.03444  23.05148       26.68763  
1 1 1 8  2  29 o 80.59824 19.06160  4.775091       2.014854      4.775091       2.014854      0.000000       0.000000      80.59824 19.06160  ?        ?         0.000000       19.06160  
1 1 1 8  2  30 o 43.40993 12.90693  1.326070       0.8013583     2.356964       1.934922      1.112637       0.8804140     58.46172 20.31010  40.93621 13.71131  17.52550       24.50511  
1 1 1 8  2  31 o 42.16904 19.76640  -2.007212      2.796187      -3.073926      4.015285      -1.002825      3.896215      48.70115 23.08786  53.33110 24.40609  -4.629948      33.59623  
1 1 1 8  2  32 o 65.07039 25.32583  3.254069       3.156940      -0.1832625     4.758059      5.957278       4.219479      58.08361 26.72460  79.72790 29.68921  -21.64429      39.94563  
1 1 1 8  2  33 o 111.1649 6.326345  8.439744       0.9332486     8.538648       0.9707670     7.233896       3.389652      111.7187 6.549750  85.83829 26.75521  25.88045       27.54524  
1 1 1 8  2  34 o 22.43262 10.97858  -1.842789      1.098752      -1.807344      1.165759      -2.124793      3.288207      23.52403 11.46828  42.06988 20.20212  -18.54585      23.23030  
1 1 1 8  2  35 o 26.02465 11.74058  -0.2467723     0.8625621     -0.3262037     0.8650907     13.28102       11.28961      25.53988 11.61559  69.32849 34.17894  -43.78861      36.09877  
1 1 1 8  2  36 o 34.27643 14.27559  0.5635285      1.080180      0.3065813      1.172539      2.004472       2.776699      33.21130 14.38290  49.79858 21.83917  -16.58728      26.14990  
1 1 1 8  3  0  o 264.4451 13.38234  47.00154       4.687949      47.00154       4.687949      47.00154       4.687949      264.4451 13.38234  264.4451 13.38234  0.000000       0.000000  
1 1 1 8  3  1  f 751.3881 15.72371  377.3429       15.74320      328.4379       32.44555      392.4026       18.00472      695.8316 35.10612  765.9245 17.64115  -70.09290      39.28931  
1 1 1 8  3  2  o 100.3294 3.236668  6.714445       0.4321466     6.803895       0.6831321     6.654768       0.5579814     100.9094 5.096926  99.84143 4.203472  1.067924       6.606650  
1 1 1 8  3  3  o 616.3010 14.54669  253.7748       11.94622      287.1996       28.54993      246.6805       13.15304      651.0555 33.01670  607.1964 16.27103  43.85907       36.80827  
1 1 1 8  3  4  o 267.5526 7.308398  47.76455       2.603143      42.19362       5.530633      49.34994       2.950387      250.6264 16.65504  271.9116 8.152081  -21.28520      18.54310  
1 1 1 8  3  5  o 424.9862 9.504052  120.4938       5.382167      116.5426       9.120969      122.6047       6.666547      417.0937 16.44317  428.3897 11.68946  -11.29602      20.17477  
1 1 1 8  3  6  o 407.3384 16.39939  111.1910       8.883170      111.1910       8.883170      0.000000       0.000000      407.3384 16.39939  ?        ?         0.000000       16.39939  
1 1 1 8  3  7  o 224.0073 3.860743  33.44089       1.152409      28.26335       3.857576      33.94824       1.207552      205.1264 14.20066  225.6978 4.015179  -20.57140      14.75738  
1 1 1 8  3  8  o 292.3760 4.988417  56.98110       1.943471      57.63963       2.202755      54.66740       4.128855      294.0421 5.621902  285.9235 10.85665  8.118530       12.22590  
1 1 1 8  3  9  o 529.1820 8.726640  186.8796       6.153549      188.0278       7.260962      183.9528       11.59251      530.6389 10.26884  523.6402 16.63498  6.998718       19.54921  
1 1 1 8  3  10 f 162.8589 2.261146  17.67335       0.4906971     17.21576       0.5204310     21.33808       1.472811      160.7352 2.429846  178.7720 6.191987  -18.03687      6.651680  
1 1 1 8  3  11 o 237.2637 4.405921  37.52528       1.392969      43.77602       2.664354      35.17403       1.634087      256.0072 7.819439  229.6833 5.339152  26.32390       9.468377  
1 1 1 8  3  12 o 252.0510 1.018833  42.32848       0.3421881     36.21869       2.650901      42.43201       0.3450752     232.7642 8.561392  252.3590 1.026175  -19.59480      8.622671  
1 1 1 8  3  13 o 333.7134 9.357966  74.44174       4.157188      78.58272       7.393547      72.52733       5.027121      341.7597 16.28205  329.1173 11.48049  12.64240       19.92253  
1 1 1 8  3  14 f 610.4089 10.68057  249.0547       8.687378      237.2338       13.95869      256.5280       11.09884      593.8260 17.66017  618.9105 13.45787  -25.08447      22.20351  
1 1 1 8  3  15 o 425.9678 9.218224  121.1791       5.232359      117.9836       8.780973      122.9384       6.515386      419.0718 15.75268  428.6273 11.41757  -9.555542      19.45528  
1 1 1 8  3  16 o 143.0659 8.373026  13.70892       1.589240      9.996240       4.069183      14.37716       1.726347      119.1375 26.33356  146.4756 8.886634  -27.33812      27.79260  
1 1 1 8  3  17 o 221.3129 6.388154  32.69449       1.881919      27.49754       3.867761      34.30648       2.154102      202.1015 14.45755  226.6555 7.141161  -24.55397      16.12504  
1 1 1 8  3  18 o 144.1403 14.89599  14.06688       2.819896      10.67363       4.166312      16.93542       3.830667      123.2414 26.17900  157.6744 18.58910  -34.43298      32.10755  
1 1 1 8  3  19 o 150.9365 13.66340  15.37706       2.718328      16.02260       3.438917      14.30195       4.437991      153.5527 17.09662  143.5562 24.05006  9.996536       29.50762  
1 1 1 8  3  20 f 766.1517 5.653867  391.4566       5.772100      392.2560       5.839939      357.6505       37.97955      766.9258 5.714542  714.9601 40.02504  51.96570       40.43093  
1 1 1 8  3  21 o 726.0616 15.63876  354.2169       15.13036      345.7936       18.09097      373.8225       27.60021      715.7065 18.98616  738.4879 28.09884  -22.78143      33.91193  
1 1 1 8  3  22 o 447.5623 13.15316  134.5716       7.835840      151.5722       14.38307      127.3961       9.344306      471.0940 22.98174  434.5370 16.16607  36.55692       28.09808  
1 1 1 8  3  23 o 516.5213 10.26400  178.7873       7.064448      187.7838       11.69979      173.6253       8.862371      526.6082 16.69421  507.9223 13.10515  18.68588       21.22361  
1 1 1 8  3  24 o 90.78945 4.715762  5.515089       0.5685514     5.429589       3.191669      5.517891       0.5777926     87.36858 25.70251  90.80632 4.792063  -3.437737      26.14542  
1 1 1 8  3  25 o 169.0198 6.049955  19.11765       1.360386      19.67265       2.027992      18.66359       1.834309      171.0203 8.930017  166.6757 8.284956  4.344635       12.18137  
1 1 1 8  3  26 o 123.0701 8.400781  10.21222       1.369412      11.77281       2.161504      9.165834       1.769940      131.2913 12.50599  115.9183 11.61493  15.37299       17.06771  
1 1 1 8  3  27 o 167.7599 8.493409  18.96501       1.892467      19.94883       2.493622      17.62869       2.906209      171.4296 10.97382  160.2567 13.74186  11.17288       17.58589  
1 1 1 8  3  28 o 122.6907 8.692367  10.18954       1.411894      13.04856       3.821338      9.737549       1.519407      133.7736 22.21633  119.7155 9.605216  14.05816       24.20383  
1 1 1 8  3  29 o 125.4475 11.28784  10.81146       1.866733      13.60263       3.791724      9.918514       2.144645      135.8669 21.67103  119.2447 13.74858  16.62221       25.66431  
1 1 1 8  3  30 o 136.2016 10.43475  12.75182       1.879395      10.43611       3.360518      13.80573       2.267079      116.9140 22.38577  140.9778 12.18778  -24.06382      25.48852  
1 1 1 8  3  31 o 81.73570 18.55823  5.100313       1.974937      12.59430       9.428045      4.756389       2.019747      102.8114 42.43875  78.45535 19.42389  24.35609       46.67264  
1 1 1 8  3  32 o 46.13679 18.83885  1.028860       1.832141      1.037836       1.864463      0.7767081      9.882277      46.42050 18.98537  72.58537 34.89884  -26.16488      39.72875  
1 1 1 8  3  33 o 40.02902 18.50372  -0.8058876     2.319395      3.266818       3.337368      -4.610654      3.225720      62.32507 25.43465  37.49234 18.44206  24.83273       31.41705  
1 1 1 8  3  34 o 22.86296 9.564590  0.1141571      0.4880897     0.8682496E-01  0.4929686     1.474535       3.477859      22.63853 9.549991  53.08320 23.79183  -30.44467      25.63696  
1 1 1 8  3  35 o 21.04771 10.40076  -2.077842      1.066794      -1.958397      1.078958      -7.285859      7.124528      21.58687 10.62763  48.03353 24.19674  -26.44666      26.42781  
1 1 1 8  3  36 f 20.16555 10.17026  -3.585652      1.279316      -5.027940      1.382792      4.983556       3.370555      19.02061 9.693269  62.60846 25.55683  -43.58785      27.33333  
1 1 1 8  4  0  o 384.4181 19.56104  99.47042       9.960523      99.47042       9.960523      99.47042       9.960523      384.4181 19.56104  384.4181 19.56104  0.000000       0.000000  
1 1 1 8  4  1  o 475.3583 12.74495  150.9893       8.065677      154.4717       10.13946      144.9884       13.30997      480.4337 15.86001  464.5479 21.56051  15.88580       26.76557  
1 1 1 8  4  2  o 836.5140 2.671131  466.2646       2.977433      588.2419       44.03977      465.7045       2.984261      930.9413 35.56713  836.0111 2.678867  94.93018       35.66787  
1 1 1 8  4  3  o 276.7854 7.929147  51.12938       2.921429      50.25164       4.197827      51.95378       4.068267      274.1362 11.51737  278.7942 10.97239  -4.658020      15.90733  
1 1 1 8  4  4  o 279.7788 2.704061  52.15788       1.008103      44.29028       3.827319      52.74441       1.045004      257.3505 11.18755  281.3466 2.787423  -23.99603      11.52957  
1 1 1 8  4  5  o 113.6268 1.117539  8.602284       0.1692066     7.696208       0.5672541     8.690779       0.1772771     107.3907 3.970872  114.2097 1.164866  -6.818970      4.138205  
1 1 1 8  4  6  o 1033.926 28.74234  722.6232       39.56066      722.6232       39.56066      0.000000       0.000000      1033.926 28.74234  ?        ?         0.000000       28.74234  
1 1 1 8  4  7  f 93.74219 2.043450  5.855269       0.2552541     5.878665       0.2628070     5.465693       1.072413      93.92908 2.099730  90.05341 9.059921  3.875679       9.300056  
1 1 1 8  4  8  o 680.4184 15.06364  309.8888       13.65776      324.3430       16.71489      280.8513       23.69109      695.1750 18.05942  643.6649 27.68652  51.51013       33.05580  
1 1 1 8  4  9  o 435.6156 7.650754  126.5993       4.441004      127.7411       4.930948      121.6952       10.21935      437.5105 8.458014  425.4203 18.06847  12.09018       19.95013  
1 1 1 8  4  10 o 281.7820 5.383458  52.93961       2.021380      52.98672       2.478328      52.84601       3.493668      281.8567 6.598678  281.1769 9.337515  0.6797791      11.43380  
1 1 1 8  4  11 o 509.7832 7.924703  173.4405       5.383219      173.6595       7.729210      173.2342       7.501918      509.6466 11.38132  509.0717 11.05910  0.5749207      15.86941  
1 1 1 8  4  12 o 418.2004 5.915929  116.6369       3.296711      114.2194       4.381579      119.7912       5.004848      413.6813 7.948612  423.5600 8.867524  -9.878723      11.90854  
1 1 1 8  4  13 o 325.0742 8.230432  70.58728       3.562290      75.85300       6.480665      68.30740       4.264298      336.0973 14.50456  319.5778 10.02617  16.51956       17.63254  
1 1 1 8  4  14 o 69.92908 4.404706  3.272758       0.4083536     3.577658       1.499633      3.248340       0.4243905     71.61832 16.10584  69.65250 4.598241  1.965820       16.74939  
1 1 1 8  4  15 o 486.9151 10.23684  158.4133       6.641904      136.5532       10.84972      171.5157       8.399777      450.3503 18.11681  506.3054 12.45035  -55.95502      21.98249  
1 1 1 8  4  16 o 110.3481 11.06165  8.219758       1.604607      8.142546       2.515434      8.272736       2.083594      108.6846 17.99824  110.1878 14.54569  -1.503227      23.14116  
1 1 1 8  4  17 o 558.0559 10.56999  208.0820       7.860059      185.7341       10.50044      236.5618       11.85380      526.2728 14.98876  593.9838 14.98844  -67.71094      21.19708  
1 1 1 8  4  18 o 391.8714 8.528676  102.5043       4.453472      96.47809       7.385760      105.9472       5.582500      379.2112 14.64393  398.0648 10.53376  -18.85355      18.03897  
1 1 1 8  4  19 o 564.6011 10.97014  213.0799       8.253295      203.8442       11.20913      224.0156       12.19722      551.1807 15.27648  577.6713 15.86053  -26.49066      22.02106  
1 1 1 8  4  20 o 595.4326 6.136733  236.4880       4.869040      234.1340       4.999096      279.9724       21.48577      592.4395 6.332482  641.5770 25.18100  -49.13745      25.96504  
1 1 1 8  4  21 o 686.3156 14.21044  316.1591       12.99586      317.3142       16.45759      314.2457       21.18149      685.8028 18.02479  679.5676 23.42611  6.235168       29.55800  
1 1 1 8  4  22 o 339.1115 9.583100  77.00005       4.325999      87.46677       9.596489      74.33063       4.846350      358.4701 20.17166  332.9253 10.93917  25.54474       22.94692  
1 1 1 8  4  23 o 188.0787 6.183463  23.64586       1.547584      24.85347       2.601642      22.98456       1.925245      192.2940 10.18970  185.2434 7.817124  7.050568       12.84279  
1 1 1 8  4  24 o 114.3989 8.953127  8.823205       1.353940      10.59145       3.042282      8.386488       1.511920      123.0985 19.17105  111.2960 10.31199  11.80254       21.76847  
1 1 1 8  4  25 o 79.08421 9.196004  4.253766       0.9510332     2.580654       1.318637      6.067500       1.372934      60.47449 16.08518  94.27320 11.14440  -33.79871      19.56861  
1 1 1 8  4  26 o 136.8633 8.571788  12.62778       1.555413      11.71597       2.170526      13.59029       2.230056      130.9099 12.59821  141.2452 11.96099  -10.33528      17.37182  
1 1 1 8  4  27 o 167.4466 11.62458  19.08831       2.577640      17.84775       4.674331      19.63040       3.089914      157.1508 23.00291  169.0784 13.83554  -11.92760      26.84317  
1 1 1 8  4  28 o 153.7350 13.51037  16.29775       2.739543      18.97753       4.049603      14.03650       3.719954      163.4517 18.94334  139.4892 20.63535  23.96255       28.01192  
1 1 1 8  4  29 o 86.35812 15.10392  5.317332       1.674807      5.823561       3.823041      5.197105       1.863102      86.69425 28.55776  84.64009 17.10821  2.054161       33.29018  
1 1 1 8  4  30 o 66.17554 12.61783  3.124983       1.072045      5.517749       2.431793      2.547786       1.194369      84.61697 21.52085  59.04905 15.11652  25.56793       26.29936  
1 1 1 8  4  31 o 56.53445 16.02345  2.384356       1.262099      0.8109772      2.711861      2.819366       1.425938      51.88396 22.16206  61.11578 16.92848  -9.231823      27.88782  
1 1 1 8  4  32 o 60.06226 23.05857  2.712379       2.590750      1.432819       2.721709      15.05707       8.453793      53.44521 22.48661  101.4299 40.81067  -47.98471      46.59569  
1 1 1 8  4  33 o 50.61789 21.60310  1.360190       2.572922      3.978711       3.154570      -3.843179      4.446870      65.50859 25.36616  45.97265 22.40926  19.53594       33.84697  
1 1 1 8  4  34 o 53.17352 21.49472  2.238644       2.357189      0.3951262      2.924726      5.655690       3.981869      46.95527 21.35624  69.88399 28.04653  -22.92872      35.25190  
1 1 1 8  4  35 o 40.64294 19.83213  -2.726821      3.508909      -5.183734      4.067006      4.427841       6.940239      39.50061 19.65438  60.62569 29.17364  -21.12508      35.17664  
1 1 1 8  4  36 o 47.41162 12.89542  1.800346       0.8360823     1.707293       0.8398281     12.16202       8.862161      46.09385 13.07310  64.81746 31.60397  -18.72361      34.20113  
1 1 1 8  5  0  o 860.9472 30.78091  499.1224       35.21023      499.1224       35.21023      499.1224       35.21023      860.9472 30.78091  860.9472 30.78091  0.000000       0.000000  
1 1 1 8  5  1  o 228.3502 9.342089  34.84362       2.836619      36.66430       4.123988      33.20875       3.907898      233.9091 13.28575  222.5817 13.23567  11.32744       18.75351  
1 1 1 8  5  2  f 525.9589 8.377929  184.5020       5.871675      190.4737       10.52952      181.8069       7.073599      533.6058 14.82297  521.9743 10.16993  11.63153       17.97631  
1 1 1 8  5  3  o 673.3660 12.41831  302.8127       11.14261      275.4896       20.48056      314.3008       13.28007      639.7469 24.06773  685.7203 14.53383  -45.97345      28.11562  
1 1 1 8  5  4  o 259.7935 5.282906  44.98784       1.828835      44.68804       2.771251      45.21914       2.434144      258.7249 8.048084  260.3211 7.023610  -1.596191      10.68189  
1 1 1 8  5  5  o 518.1750 8.849125  179.1332       6.110129      182.5637       7.436344      172.0044       10.71988      522.9548 10.67141  506.7621 15.89459  16.19269       19.14464  
1 1 1 8  5  6  o 1038.520 27.96395  729.4269       38.66264      735.0923       43.86783      709.7134       81.82990      1040.361 31.68072  995.9592 61.96602  44.40149       69.59494  
1 1 1 8  5  7  o 470.7105 13.39575  148.2774       8.393682      143.6303       9.497420      164.8574       17.93934      462.9360 15.41762  492.9624 27.41785  -30.02640      31.45539  
1 1 1 8  5  8  o 221.0154 8.002134  32.63481       2.352797      30.91240       3.120633      34.90351       3.581485      214.8341 10.93698  228.2209 11.81723  -13.38681      16.10169  
1 1 1 8  5  9  o 232.6167 4.704273  36.07090       1.458166      35.59236       1.512375      42.38969       5.495598      231.0630 4.911968  250.8786 16.53121  -19.81566      17.24553  
1 1 1 8  5  10 o 387.9691 6.502990  100.3966       3.361892      97.94196       3.754535      110.3253       7.551092      383.1378 7.354068  405.6495 13.99058  -22.51172      15.80565  
1 1 1 8  5  11 o 230.7243 4.817683  35.48998       1.481171      35.69957       1.672415      34.72760       3.189720      231.3849 5.424197  227.7180 10.54051  3.666992       11.85429  
1 1 1 8  5  12 o 393.6994 6.579103  103.3969       3.451476      105.7661       4.358156      99.41093       5.652823      398.0474 8.216644  385.4532 11.01707  12.59415       13.74369  
1 1 1 8  5  13 o 280.1946 6.804647  52.37587       2.540616      50.33184       3.225326      55.71774       4.124050      274.4089 8.832181  288.5158 10.74584  -14.10696      13.90973  
1 1 1 8  5  14 o 301.2590 4.853494  60.50748       1.948355      57.17435       4.070370      61.49816       2.219093      292.3080 10.46698  303.6877 5.483714  -11.37970      11.81646  
1 1 1 8  5  15 o 174.7402 6.542294  20.39522       1.520648      22.30600       6.642561      20.28955       1.562132      178.8992 28.84546  174.2727 6.739602  4.626511       29.62233  
1 1 1 8  5  16 o 605.9698 9.504031  245.2203       7.674186      238.7903       12.39012      249.2223       9.774890      596.5990 15.59884  610.4699 12.01639  -13.87091      19.69054  
1 1 1 8  5  17 o 149.8111 11.65529  15.09420       2.308406      16.14794       3.821591      14.48885       2.896544      153.8379 19.04929  146.2866 15.07504  7.551331       24.29263  
1 1 1 8  5  18 f 356.7062 7.659636  84.90359       3.640763      80.19841       6.262590      87.30559       4.474589      345.8499 13.61577  361.4680 9.297591  -15.61810      16.48740  
1 1 1 8  5  19 o 410.1479 8.137744  112.2872       4.447521      120.6478       8.027049      108.5837       5.342545      424.1016 14.22419  403.1429 9.945248  20.95874       17.35614  
1 1 1 8  5  20 o 400.3430 6.640738  106.9368       3.542600      109.3170       5.819498      105.5354       4.465287      404.1557 10.81568  397.5382 8.429406  6.617493       13.71254  
1 1 1 8  5  21 o 287.3176 9.972435  55.28115       3.812221      57.09578       5.044780      52.86541       5.820670      291.4847 13.02119  279.9134 15.66797  11.57138       20.37244  
1 1 1 8  5  22 o 350.1341 10.72179  82.21702       4.996469      85.40612       7.374650      79.51094       6.793250      355.5791 15.60236  343.2761 14.88655  12.30298       21.56485  
1 1 1 8  5  23 o 117.5455 7.917504  9.283091       1.232897      5.902256       1.807062      12.22733       1.686350      92.29329 15.22398  134.7693 9.450278  -42.47606      17.91863  
1 1 1 8  5  24 o 332.5952 9.201111  74.24134       4.073917      73.42194       7.119525      74.64026       4.967575      328.2023 16.33060  332.9021 11.21437  -4.699829      19.81037  
1 1 1 8  5  25 o 82.78436 10.36938  4.682043       1.118840      5.567396       1.289912      1.992473       2.248243      90.26495 10.94777  58.99339 21.72571  31.27156       24.32817  
1 1 1 8  5  26 o 68.05463 19.36084  3.304249       1.839142      4.863490       2.806890      2.131246       2.434548      81.84449 24.11038  60.81638 22.56982  21.02811       33.02586  
1 1 1 8  5  27 o 117.2071 11.76286  9.407958       1.812325      14.53196       3.095677      6.735993       2.235458      144.3221 16.38693  97.14038 17.93042  47.18167       24.29056  
1 1 1 8  5  28 o 199.4197 14.42225  27.50813       3.806540      29.58711       6.515974      26.43105       4.690052      199.8519 25.01430  193.2366 18.43765  6.615311       31.07511  
1 1 1 8  5  29 o 129.0854 11.47854  11.48388       1.953841      13.36475       3.974700      10.88457       2.243632      133.0919 23.25808  124.7651 13.72163  8.326881       27.00410  
1 1 1 8  5  30 o 35.36534 15.47740  -0.1441181     1.388196      1.037923       2.659198      -0.5869232     1.627574      53.53677 22.35568  35.88940 16.16480  17.64737       27.58763  
1 1 1 8  5  31 o 82.84291 14.10791  5.003881       1.501609      2.382118       2.879721      5.982956       1.759794      60.51395 23.99484  90.17393 15.18454  -29.65998      28.39582  
1 1 1 8  5  32 o 59.34753 15.91158  2.722027       1.283967      0.1857232      2.210754      4.013000       1.577242      43.92870 19.36786  71.74005 16.79698  -27.81135      25.63694  
1 1 1 8  5  33 o 41.36954 18.54957  0.1955217E-01  2.116514      0.4153907      2.554366      -0.8474803     3.780434      45.99498 20.51814  48.53097 22.82256  -2.535992      30.68979  
1 1 1 8  5  34 o 51.08673 21.43101  1.859349       2.460825      1.415374       2.885475      3.043580       4.712549      50.42521 22.18345  59.65651 27.12355  -9.231297      35.03988  
1 1 1 8  5  35 o 41.49672 20.14247  -2.105458      3.491180      -3.610816      4.103633      1.839059       6.642717      41.68361 20.56072  55.92212 27.28761  -14.23851      34.16660  
1 1 1 8  5  36 o 72.07573 33.29040  14.48985       7.485202      8.923252       13.78688      16.81650       8.913256      58.20877 29.74484  70.24400 33.60600  -12.03524      44.87894  
1 1 1 8  6  0  o 938.0638 29.29264  592.0519       36.53455      592.0519       36.53455      592.0519       36.53455      938.0638 29.29264  938.0638 29.29264  -0.000000      0.000000  
1 1 1 8  6  1  o 372.6740 13.12117  92.90759       6.505743      86.29816       7.374524      116.1056       13.81583      358.8708 15.45759  414.5861 25.12652  -55.71527      29.50049  
1 1 1 8  6  2  o 1029.964 3.996017  706.9730       5.484322      658.2965       91.11390      707.1500       5.494284      951.4012 72.41394  1030.093 4.002777  -78.69128      72.52449  
1 1 1 8  6  3  o 554.3426 12.12935  205.2555       8.959615      228.0871       16.85322      196.2604       10.57832      582.3419 21.75683  541.5478 14.67259  40.79407       26.24204  
1 1 1 8  6  4  o 603.3698 11.79714  243.1628       9.484920      255.3795       14.45512      233.9260       12.56915      617.1510 17.59545  590.9708 15.97589  26.18024       23.76613  
1 1 1 8  6  5  o 548.7552 10.18531  201.0321       7.447774      193.9614       8.402429      226.9520       16.08758      538.8469 11.70216  580.8638 20.81833  -42.01685      23.88186  
1 1 1 8  6  6  o 478.6525 9.198388  152.9154       5.866858      150.3582       7.279393      157.6552       9.910608      474.3962 11.51544  485.0113 15.35403  -10.61514      19.19249  
1 1 1 8  6  7  o 194.5238 7.260166  25.27608       1.878582      27.28977       2.882970      23.79013       2.476539      201.8362 10.75820  188.4962 9.894470  13.33995       14.61641  
1 1 1 8  6  8  o 162.1792 2.455482  17.52656       0.5306466     17.53566       0.5339319     16.79421       4.790929      162.2211 2.470045  156.0017 23.79951  6.219437       23.92735  
1 1 1 8  6  9  o 575.4399 11.02434  221.3140       8.453296      234.7363       11.85810      207.4449       12.05383      591.6428 15.05342  555.8525 16.29149  35.79028       22.18148  
1 1 1 8  6  10 o 460.5247 7.556589  141.5212       4.637162      137.5508       5.780072      148.6921       7.767891      453.8082 9.558448  471.2742 12.38033  -17.46603      15.64086  
1 1 1 8  6  11 o 213.1595 5.923390  30.32599       1.680844      30.46655       1.845130      29.64041       4.074869      213.6159 6.489690  209.7852 14.66935  3.830704       16.04075  
1 1 1 8  6  12 o 230.4615 5.374577  35.41560       1.650503      37.94938       2.021739      30.35248       2.857922      238.4392 6.368879  212.8955 10.10302  25.54366       11.94293  
1 1 1 8  6  13 o 654.4616 13.52677  286.8314       11.79646      311.3003       14.39150      236.7271       20.59374      681.1581 15.85567  589.8675 26.26624  91.29065       30.68090  
1 1 1 8  6  14 o 575.2657 10.08892  221.0908       7.733688      215.4532       12.39774      224.6819       9.894872      566.3683 16.44486  579.4326 12.81544  -13.06427      20.84872  
1 1 1 8  6  15 o 613.6978 10.54141  251.6552       8.620388      244.9067       15.31130      254.7871       10.43061      603.1473 19.07487  617.1066 12.68457  -13.95929      22.90740  
1 1 1 8  6  16 o 222.2542 7.451715  32.99419       2.203764      38.41524       5.777089      32.07100       2.384039      238.4274 18.32404  219.0619 8.181571  19.36546       20.06760  
1 1 1 8  6  17 o 389.4694 7.796263  101.2188       4.046070      102.1304       6.240795      100.5578       5.314246      390.6241 12.00392  387.8380 10.29205  2.786072       15.81203  
1 1 1 8  6  18 o 262.5179 6.713871  46.00059       2.346653      47.83965       4.470841      45.30127       2.756952      267.1064 12.59670  260.4160 7.954215  6.690308       14.89787  
1 1 1 8  6  19 o 228.0661 6.366622  34.72343       1.932939      38.26543       3.481164      33.14464       2.324141      238.9792 10.96097  222.7011 7.844141  16.27814       13.47862  
1 1 1 8  6  20 o 581.3599 5.965374  225.4598       4.621216      229.5853       5.201378      210.0000       10.06901      586.5663 6.654689  559.6543 13.50185  26.91199       15.05274  
1 1 1 8  6  21 o 150.6584 8.462377  15.21640       1.692038      15.61868       1.829041      12.82894       4.455849      152.5781 9.036646  134.7806 25.74873  17.79750       27.28843  
1 1 1 8  6  22 o 239.8523 9.385042  38.57006       2.993744      37.86209       3.539586      40.34934       5.611340      237.3182 11.22485  243.5120 17.40792  -6.193802      20.71311  
1 1 1 8  6  23 o 235.2431 9.884881  37.17841       3.091668      33.98152       6.734089      38.03220       3.480115      220.7560 23.24073  237.6967 11.01742  -16.94063      25.71993  
1 1 1 8  6  24 o 59.69521 12.29518  2.490005       0.9454442     3.533268       1.072628      -1.143268      2.001709      71.53141 11.65412  38.86295 17.67261  32.66846       21.16931  
1 1 1 8  6  25 f 150.4174 11.83209  15.37693       2.352475      15.24199       5.192075      15.41179       2.638887      143.6266 28.13581  150.1968 13.32327  -6.570251      31.13091  
1 1 1 8  6  26 o 115.2121 14.95601  9.216902       2.241946      11.18569       3.186973      7.288080       3.154458      125.4033 19.72246  99.37132 24.07829  26.03194       31.12458  
1 1 1 8  6  27 o 125.1141 13.90513  10.82969       2.279108      10.59737       3.155933      11.08292       3.294844      121.3531 20.22824  123.9651 20.67395  -2.612053      28.92393  
1 1 1 8  6  28 f 84.32789 17.33851  5.140901       1.883185      4.208874       2.544462      6.269805       2.800339      75.47512 23.12215  91.26518 23.03019  -15.79006      32.63470  
1 1 1 8  6  29 f 73.00413 20.21790  3.999404       2.034129      2.374984       2.281850      10.28598       4.488952      60.16168 21.93087  111.7401 29.65840  -51.57841      36.88609  
1 1 1 8  6  30 o 86.54282 14.47106  5.408233       1.609926      9.462549       3.739064      4.485547       1.783738      107.0363 26.38610  77.27400 17.70377  29.76228       31.77498  
1 1 1 8  6  31 o 73.93237 12.51228  3.947949       1.188737      0.8213812      3.263596      4.426208       1.276422      54.51404 23.79715  78.30287 12.66548  -23.78883      26.95772  
1 1 1 8  6  32 o 37.39051 15.25693  0.6034328      1.200652      -0.5051968     2.320171      1.008890       1.403135      41.56016 18.94846  42.34190 16.76192  -0.7817421     25.29834  
1 1 1 8  6  33 o 52.57330 16.56296  2.217738       1.295507      -3.456868      3.311012      3.243529       1.407739      39.67493 19.33883  63.27480 16.52090  -23.59988      25.43482  
1 1 1 8  6  34 o 35.08172 17.21418  -3.476103      2.756141      -3.128105      3.516607      -4.030273      4.437687      40.64816 19.83887  43.69184 21.51865  -3.043682      29.26830  
1 1 1 8  6  35 o 44.84099 21.61885  -1.074639      3.854136      0.6769791      4.337950      -7.639420      8.397982      49.99339 23.78576  48.96906 24.84894  1.024323       34.39814  
1 1 1 8  7  0  o 177.7565 8.340520  21.20421       1.965625      21.20421       1.965625      21.20421       1.965625      177.7565 8.340520  177.7565 8.340520  0.000000       0.000000  
1 1 1 8  7  1  o 383.4420 18.13922  98.77583       9.241850      98.77583       9.241850      0.000000       0.000000      383.4420 18.13922  ?        ?         0.000000       18.13922  
1 1 1 8  7  2  o 160.6885 6.765335  17.24880       1.445356      18.05891       3.553060      17.08817       1.582182      163.3877 16.54751  159.8924 7.446457  3.495300       18.14580  
1 1 1 8  7  3  o 332.8292 6.654366  73.86981       2.951220      74.40762       4.007337      73.23243       4.362565      333.7951 9.017796  331.0671 9.900120  2.727997       13.39153  
1 1 1 8  7  4  o 284.7444 4.835640  54.04632       1.834775      53.44044       1.985142      57.59729       4.805857      283.1312 5.261753  293.3002 12.32406  -10.16904      13.40032  
1 1 1 8  7  5  o 404.2227 8.526964  109.0401       4.592917      112.8679       5.707177      102.0046       7.737421      410.9606 10.43035  390.0362 14.91485  20.92444       18.20013  
1 1 1 8  7  6  o 261.2450 5.267868  45.50081       1.833818      44.75353       2.123220      47.69526       3.638443      259.0605 6.150639  267.0366 10.24419  -7.976074      11.94879  
1 1 1 8  7  7  o 348.3810 6.490899  80.94694       3.013233      80.37018       3.849590      81.85929       4.841724      347.0222 8.324990  349.9034 10.39586  -2.881134      13.31838  
1 1 1 8  7  8  o 494.5737 12.89235  163.7888       8.489192      169.7122       10.67326      153.5892       14.00570      502.7798 15.95128  476.5916 22.11416  26.18826       27.26682  
1 1 1 8  7  9  o 326.9434 6.557842  71.30038       2.856979      69.09221       3.397934      76.62717       5.277532      321.7551 7.925305  338.3056 11.72479  -16.55051      14.15207  
1 1 1 8  7  10 o 92.41328 2.782302  5.696384       0.3422293     5.730685       0.3455578     3.941514       2.471653      92.69065 2.800979  75.92194 22.69022  16.76871       22.86245  
1 1 1 8  7  11 o 147.7771 1.252366  14.55048       0.2466107     14.55414       0.2471537     13.71891       3.722668      147.7957 1.254965  141.2796 20.36136  6.516144       20.40000  
1 1 1 8  7  12 o 197.9007 5.542301  26.13657       1.460102      24.25574       1.807098      29.67341       2.478076      190.5357 7.130151  210.6248 8.849126  -20.08910      11.36425  
1 1 1 8  7  13 o 490.5387 9.042671  160.6756       5.910763      173.8941       9.126900      151.1266       7.757278      509.4606 13.45611  475.1432 12.26237  34.31738       18.20529  
1 1 1 8  7  14 o 668.6681 10.75229  298.7957       9.580434      296.4828       12.42901      302.1816       15.03846      665.3745 14.01835  670.7747 16.83823  -5.400208      21.90982  
1 1 1 8  7  15 o 600.5960 9.057700  240.8290       7.248930      229.4661       15.12177      244.2191       8.259829      583.7574 19.46725  604.6326 10.25194  -20.87512      22.00172  
1 1 1 8  7  16 o 550.2109 8.169933  202.0366       5.989923      217.6293       11.64913      196.4321       6.983922      569.6370 15.36095  542.3447 9.663857  27.29236       18.14798  
1 1 1 8  7  17 o 320.8523 5.642637  68.64501       2.412464      70.81917       6.068183      68.23687       2.629169      324.9049 14.04936  319.8715 6.168356  5.033417       15.34383  
1 1 1 8  7  18 o 121.9046 9.244739  9.981301       1.490522      8.338550       2.374060      11.05016       1.914989      110.2355 16.68317  128.0593 11.33937  -17.82383      20.17200  
1 1 1 8  7  19 o 494.9821 7.345615  163.5195       4.844971      153.3039       8.400702      168.6109       5.930691      478.1780 13.19678  502.4330 8.858366  -24.25500      15.89420  
1 1 1 8  7  20 o 85.43827 9.386976  4.938127       1.051108      5.871041       1.390605      3.694743       1.605409      92.94417 11.47132  72.63966 16.90437  20.30451       20.42912  
1 1 1 8  7  21 o 309.9843 7.986345  64.25687       3.296093      64.62130       4.429231      63.80458       4.934327      310.4066 10.72449  308.1723 12.03919  2.234283       16.12318  
1 1 1 8  7  22 o 281.4304 7.372324  52.97788       2.762325      55.50956       3.777189      50.06713       4.050110      287.6378 9.869452  272.8873 11.16163  14.75049       14.89926  
1 1 1 8  7  23 o 160.9734 10.99139  17.49785       2.343510      24.30231       5.549702      16.02118       2.585323      186.1902 22.84695  153.6382 12.74275  32.55202       26.16029  
1 1 1 8  7  24 o 46.86101 19.02305  0.6783655      1.855165      2.727413       2.666728      -1.243285      2.582497      66.49794 23.77871  44.77976 20.24757  21.71818       31.23125  
1 1 1 8  7  25 f 29.04689 13.96059  -2.268377      1.578102      -2.716413      2.453051      -1.952024      2.061273      38.24860 18.10703  36.29293 16.99889  1.955669       24.83600  
1 1 1 8  7  26 o 82.10105 17.62379  4.828879       1.870398      8.555752       3.819674      3.653383       2.145185      106.6213 26.89261  71.34550 21.09347  35.27576       34.17817  
1 1 1 8  7  27 o 141.4811 17.46414  14.11999       3.222636      10.74038       5.288743      16.11588       4.064316      115.8964 32.78477  149.5499 20.97069  -33.65355      38.91800  
1 1 1 8  7  28 o 78.49810 15.21330  4.411140       1.533846      3.508602       1.911944      6.040949       2.569275      69.08647 19.76840  89.71590 21.72528  -20.62943      29.37307  
1 1 1 8  7  29 o 128.0157 13.47664  11.50634       2.264448      10.90566       2.571521      13.58047       4.778483      123.3243 16.02708  128.8672 28.57688  -5.542931      32.76439  
1 1 1 8  7  30 o 129.6985 11.86245  11.79492       2.027461      12.11639       5.214576      11.73767       2.200606      113.9866 32.65687  128.7456 13.00545  -14.75899      35.15128  
1 1 1 8  7  31 o 47.08014 18.23486  1.343723       1.630484      -2.075359      2.320542      4.677579       2.291438      36.80735 17.47904  75.18574 21.68169  -38.37839      27.84982  
1 1 1 8  7  32 o 34.45747 14.53489  0.3268024      1.141812      1.196161       2.640528      0.1268586      1.266326      50.56635 21.73899  34.44701 14.93246  16.11933       26.37351  
1 1 1 8  7  33 o 62.81507 18.62846  3.364007       1.671021      2.329268       3.691005      3.630766       1.874080      56.95130 25.07072  64.35267 19.86725  -7.401367      31.98826  
1 1 1 8  7  34 o 40.29059 18.71287  -0.4712192     2.414584      1.657574       2.946816      -4.820718      4.212169      50.80901 22.38268  41.13853 20.38912  9.670483       30.27707  
1 1 1 8  7  35 o 43.01657 20.66363  -1.003748      3.446716      -0.5615629     3.613594      -5.462292      11.47450      44.67097 21.37851  52.99361 27.08448  -8.322647      34.50521  
1 1 1 8  8  0  o 197.8108 8.331439  26.22837       2.187176      26.22837       2.187176      26.22837       2.187176      197.8108 8.331439  197.8108 8.331439  0.000000       0.000000  
1 1 1 8  8  1  o 432.4490 12.61221  125.1413       7.259981      123.4392       7.946741      133.7317       17.85271      429.2938 13.91024  442.5254 30.46140  -13.23157      33.48719  
1 1 1 8  8  2  o 111.1943 9.645538  8.316525       1.415042      6.631915       2.354884      9.268557       1.770293      97.77872 18.75598  117.2180 11.48092  -19.43930      21.99087  
1 1 1 8  8  3  o 487.6060 11.38160  158.8766       7.395131      157.6687       8.494940      162.6564       15.02743      485.3349 13.14757  490.6204 23.05055  -5.285522      26.53652  
1 1 1 8  8  4  o 312.2178 3.845947  64.96947       1.600053      66.41832       1.804373      59.63685       3.461659      315.6666 4.289672  298.7910 8.703748  16.87552       9.703428  
1 1 1 8  8  5  o 249.2926 4.800530  41.42913       1.594675      36.45456       2.392389      45.40652       2.139210      233.6185 7.695632  260.9380 6.152372  -27.31960      9.852635  
1 1 1 8  8  6  o 277.3470 5.051625  51.28302       1.866930      51.27365       2.455535      51.29585       2.874064      277.2556 6.646490  277.1483 7.790075  0.1072693      10.24017  
1 1 1 8  8  7  o 362.8020 6.962321  87.80931       3.365869      87.96879       4.742364      87.64743       4.777952      362.7694 9.819522  362.0945 9.911858  0.6748962      13.95234  
1 1 1 8  8  8  o 325.4679 7.168966  70.67471       3.109125      68.29273       4.414500      73.01920       4.379641      319.5257 10.38196  330.4603 9.957297  -10.93460      14.38516  
1 1 1 8  8  9  o 450.6545 11.46744  135.8933       6.880672      136.2501       7.862584      134.7263       14.21881      450.9520 13.09851  445.4887 24.04170  5.463287       27.37835  
1 1 1 8  8  10 o 413.9059 8.203857  114.3567       4.524736      107.9749       6.617927      119.9585       6.200353      401.5219 12.38394  423.4651 10.99747  -21.94324      16.56220  
1 1 1 8  8  11 o 728.0325 9.769129  354.0680       9.477202      356.5915       11.29953      348.0817       17.40358      730.2266 11.61259  719.3101 18.17175  10.91650       21.56536  
1 1 1 8  8  12 o 473.8748 8.863191  149.9296       5.596638      148.0960       7.144925      152.8409       9.003010      470.6446 11.39282  477.4648 14.16620  -6.820282      18.17904  
1 1 1 8  8  13 o 221.4777 5.922702  32.73466       1.746358      31.73176       2.153508      34.66094       2.984544      217.9538 7.425801  227.5868 9.864842  -9.633041      12.34737  
1 1 1 8  8  14 o 363.7777 8.474362  88.32883       4.107869      82.52639       5.399662      96.30113       6.329259      351.1653 11.55509  379.2268 12.54233  -28.06152      17.05374  
1 1 1 8  8  15 o 369.7101 9.272413  91.31935       4.564411      90.93311       7.298619      91.56744       5.849406      368.1251 14.90978  369.8859 11.88323  -1.760864      19.06601  
1 1 1 8  8  16 o 130.4413 2.159481  11.33770       0.3753513     8.880555       2.990854      11.37702       0.3783426     113.1424 20.59647  130.6672 2.172927  -17.52474      20.71078  
1 1 1 8  8  17 o 536.2271 8.756857  191.9710       6.257063      223.6395       10.71928      175.6039       7.706171      577.8615 13.92094  512.5108 11.28397  65.35065       17.91984  
1 1 1 8  8  18 o 235.7992 6.929922  37.13029       2.175068      34.73948       3.742481      38.34974       2.672820      227.4866 12.39292  239.5169 8.387465  -12.03035      14.96443  
1 1 1 8  8  19 o 318.0699 7.415515  67.53558       3.142949      68.48930       4.378192      66.52151       4.514547      319.8578 10.28559  315.1528 10.76608  4.705048       14.88966  
1 1 1 8  8  20 o 365.0783 6.895247  88.98287       3.354357      90.84587       4.326448      86.17538       5.311094      368.6417 8.807518  358.5136 11.13093  10.12814       14.19401  
1 1 1 8  8  21 o 175.5936 8.583579  20.67282       2.002316      21.38756       2.610255      19.65092       3.121145      178.2489 11.04386  170.3143 13.87279  7.934540       17.73192  
1 1 1 8  8  22 o 114.6823 11.31073  8.920876       1.705989      8.548512       2.596996      9.203539       2.262673      110.6914 18.24183  115.7400 15.02547  -5.048660      23.63322  
1 1 1 8  8  23 o 171.7988 9.218687  19.85586       2.102662      18.14672       4.483201      20.33784       2.380749      160.8058 21.45753  173.6647 10.33468  -12.85887      23.81662  
1 1 1 8  8  24 o 81.52757 17.19238  4.716573       1.808829      3.015594       3.036059      5.652591       2.252179      69.97630 25.32756  88.84869 19.55420  -18.87239      31.99768  
1 1 1 8  8  25 o 171.9360 13.25527  20.20593       3.013460      22.61238       4.777539      18.61594       3.883419      179.0006 20.39305  163.1920 18.16593  15.80861       27.31076  
1 1 1 8  8  26 o 236.6470 10.72761  37.96033       3.374011      27.77118       7.436736      40.60127       3.786102      191.3578 30.16273  244.3813 11.66018  -53.02354      32.33806  
1 1 1 8  8  27 o 139.2983 11.26216  13.27415       2.072645      11.93404       2.407570      17.11070       4.073624      131.0969 13.99837  154.1202 20.33111  -23.02324      24.68418  
1 1 1 8  8  28 o 40.71502 18.20182  -0.5863777     2.021601      1.525015       4.350790      -1.167748      2.283022      66.64845 28.25531  41.00734 18.73452  25.64111       33.90199  
1 1 1 8  8  29 o 53.88107 21.68588  1.423884       2.387821      2.422437       3.769548      0.7546825      3.085903      66.07173 27.00563  55.02561 23.57572  11.04612       35.84856  
1 1 1 8  8  30 o 51.88949 19.66495  1.723457       1.868755      1.913743       2.414476      1.439162       2.951238      55.87687 22.02917  56.04011 23.48664  -0.1632423     32.20103  
1 1 1 8  8  31 o 83.71517 15.11805  5.276220       1.624403      3.867967       2.963434      5.881101       1.942180      67.34846 24.91814  86.97252 17.36687  -19.62406      30.37305  
1 1 1 8  8  32 o 38.33960 14.06387  0.9732522      0.9406113     -1.099030      3.344796      1.151207       0.9801666     45.79385 21.51402  40.55564 14.42549  5.238213       25.90266  
1 1 1 8  8  33 o 51.54106 15.28600  2.125113       1.125135      -4.449613      2.895273      3.294638       1.221112      34.53270 17.07719  64.72124 14.51752  -30.18853      22.41403  
1 1 1 8  8  34 o 46.49889 21.38921  0.5329837      3.045293      0.4570502      3.276094      1.015644       8.259623      47.15515 21.86524  57.02792 28.31376  -9.872768      35.77371  
1 1 1 8  8  35 o 61.25789 16.70475  3.283399       1.400872      3.240410       1.411335      6.150365       11.52560      60.70326 16.85198  58.18989 29.48286  2.513371       33.95922  
1 1 1 8  9  0  o 10.77052 7.279933  -0.1499624     0.3062988     -0.1499624     0.3062988     -0.1499624     0.3062988     10.77052 7.279933  10.77052 7.279933  -0.000000      0.000000  
1 1 1 8  9  1  o 472.8247 12.68928  149.6457       7.987632      146.3277       9.118501      160.5892       16.55997      467.1849 14.66558  486.3997 25.64067  -19.21475      29.53851  
1 1 1 8  9  2  o 89.14839 7.850710  5.344061       0.9230837     5.405933       0.9684992     4.730374       3.050179      89.62976 8.199862  83.32659 25.27410  6.303169       26.57099  
1 1 1 8  9  3  o 133.6452 14.84951  12.11136       2.599880      15.42101       3.286604      6.577213       4.249927      150.7127 16.64213  97.96528 29.85779  52.74746       34.18256  
1 1 1 8  9  4  o 110.0821 6.498221  8.110742       0.9489611     8.473570       1.430516      7.825593       1.268170      112.2261 9.659793  107.9013 8.899221  4.324760       13.13422  
1 1 1 8  9  5  o 380.7634 6.510754  96.70316       3.303391      89.41447       5.323210      101.2679       4.212670      365.5979 10.93919  389.5257 8.116108  -23.92780      13.62120  
1 1 1 8  9  6  o 326.2128 9.613584  71.13689       4.174320      66.84299       7.123315      73.38265       5.151541      315.0697 17.03018  331.0640 11.69592  -15.99429      20.65966  
1 1 1 8  9  7  o 188.0105 5.751010  23.59432       1.439093      22.51171       2.323699      24.26789       1.832899      183.3397 9.544383  190.5774 7.230727  -7.237717      11.97408  
1 1 1 8  9  8  o 280.2757 6.082061  52.39133       2.271484      51.27383       2.966703      53.97463       3.531285      277.0482 8.044618  284.1295 9.339710  -7.081360      12.32664  
1 1 1 8  9  9  o 100.8480 3.748376  6.788046       0.5028374     6.727136       1.505917      6.795689       0.5334547     99.64058 11.55609  100.8937 3.975674  -1.253166      12.22085  
1 1 1 8  9  10 o 575.4490 11.48355  221.4204       8.805549      239.1631       21.39661      217.8027       9.661648      592.6112 27.16805  570.4986 12.70934  22.11261       29.99384  
1 1 1 8  9  11 o 334.3120 6.283878  74.54196       2.799325      70.25002       3.351498      84.44461       5.090823      324.4566 7.751912  355.3061 10.76497  -30.84949      13.26562  
1 1 1 8  9  12 o 711.1974 10.60059  337.9687       10.04601      342.9341       11.86767      325.4153       18.86983      716.0145 12.43856  694.8745 20.40133  21.13995       23.89419  
1 1 1 8  9  13 o 537.0349 9.376326  192.5766       6.709786      186.3148       8.799680      201.2741       10.37087      527.7792 12.51241  548.0663 14.21265  -20.28711      18.93568  
1 1 1 8  9  14 o 263.6904 7.933998  46.44044       2.784618      46.77736       3.980870      46.11764       3.896573      264.3115 11.32914  262.4562 11.16725  1.855316       15.90776  
1 1 1 8  9  15 o 284.2422 6.637131  53.88876       2.513869      57.51545       3.298263      48.86156       3.883227      293.4308 8.444191  270.2005 10.80713  23.23032       13.71489  
1 1 1 8  9  16 o 787.1680 15.63642  415.4831       16.40130      418.0289       20.14496      410.4775       28.24718      788.3112 19.17764  776.8940 27.32856  11.41711       33.38611  
1 1 1 8  9  17 o 418.6309 7.435836  116.9503       4.147961      114.1318       8.416291      117.8546       4.767141      412.2019 15.34958  420.1416 8.515082  -7.939697      17.55324  
1 1 1 8  9  18 o 547.7928 7.837461  200.3390       5.720912      202.2328       9.179939      199.1365       7.315138      549.5004 12.53714  545.7852 10.05836  3.715210       16.07328  
1 1 1 8  9  19 o 400.0134 5.687236  106.7479       3.031443      112.3387       6.351275      105.0984       3.449752      409.3388 11.65593  396.8293 6.523950  12.50955       13.35749  
1 1 1 8  9  20 o 303.9785 6.637424  61.69882       2.688537      69.33617       4.056782      55.71734       3.590166      321.7430 9.472664  288.4090 9.354209  33.33408       13.31287  
1 1 1 8  9  21 o 157.5300 5.242881  16.57981       1.099009      20.93366       2.225290      15.17529       1.263905      176.5175 9.495696  150.6048 6.311985  25.91269       11.40217  
1 1 1 8  9  22 o 131.0455 10.01386  11.59312       1.735383      12.26496       2.263565      10.63521       2.702863      134.2700 12.80639  123.9890 16.79050  10.28104       21.11693  
1 1 1 8  9  23 o 28.70076 13.43783  -1.261805      1.286078      0.8123565      3.167506      -1.671236      1.407298      58.86071 24.47456  28.81299 13.66207  30.04772       28.02956  
1 1 1 8  9  24 o 81.28354 19.18231  4.747665       2.043971      4.565367       3.178665      4.876183       2.668918      80.37862 26.01215  82.01458 23.31991  -1.635963      34.93494  
1 1 1 8  9  25 o 82.20180 14.47218  4.743546       1.527344      8.135412       3.182508      3.728551       1.740934      105.2053 23.31499  71.99319 18.15400  33.21207       29.54922  
1 1 1 8  9  26 o 266.4824 10.81102  48.19380       3.830946      47.27610       5.625202      48.98761       5.231723      260.9497 16.25813  266.5710 14.78643  -5.621246      21.97647  
1 1 1 8  9  27 o 192.2977 9.199542  25.06849       2.350457      23.49803       3.156038      27.02440       3.522106      184.6278 12.90972  197.7806 13.44419  -13.15274      18.63886  
1 1 1 8  9  28 o 187.6118 11.53810  24.25840       2.870529      24.74248       3.533849      23.31945       4.921640      187.8819 14.22088  177.1375 21.27630  10.74446       25.59129  
1 1 1 8  9  29 o 169.5452 13.73233  20.35487       3.075908      19.62123       4.138476      21.26033       4.597647      161.6748 19.61033  166.8862 21.14904  -5.211426      28.84176  
1 1 1 8  9  30 o 40.23244 18.20580  -0.5535437     2.092801      0.6474310E-01  2.380219      -2.659901      4.393270      45.40387 20.05400  50.64949 24.05173  -5.245625      31.31531  
1 1 1 8  9  31 o 33.91711 14.11557  0.3684708      1.054981      -2.105339      1.331104      4.547429       1.730066      25.16023 12.26344  75.61949 17.51413  -50.45926      21.38075  
1 1 1 8  9  32 o 34.30583 14.20977  0.4568615      1.061972      -0.7932119     1.244864      3.798436       2.035306      28.74740 13.38035  65.51499 20.77567  -36.76759      24.71159  
1 1 1 8  9  33 o 25.01776 11.29230  -0.2610819     0.7991741     0.8404961E-01  1.082676      -0.6742502     1.184594      31.38838 13.70418  28.25784 13.11837  3.130537       18.97093  
1 1 1 8  9  34 o 34.92563 14.03434  0.6928151      0.9983659     4.073772       1.287164      -4.412676      1.581732      71.51423 14.00863  22.28542 11.24789  49.22881       17.96543  
1 1 1 8  10 0  o 202.7033 13.14075  27.78032       3.514720      27.78032       3.514720      27.78032       3.514720      202.7033 13.14075  202.7033 13.14075  -0.000000      0.000000  
1 1 1 8  10 1  o 594.7982 14.14722  236.9576       11.21280      236.9576       11.21280      0.000000       0.000000      594.7982 14.14722  ?        ?         0.000000       14.14722  
1 1 1 8  10 2  o 81.84875 9.398235  4.532331       1.006443      4.532331       1.006443      0.000000       0.000000      81.84875 9.398235  ?        ?         0.000000       9.398235  
1 1 1 8  10 3  o 517.6082 17.37455  180.1419       11.96664      181.0415       13.25000      176.1613       27.87215      518.3758 19.21542  500.9200 42.14751  17.45575       46.32111  
1 1 1 8  10 4  o 283.0378 5.690233  53.42118       2.146091      57.65906       3.414411      50.65359       2.759258      293.7468 8.732761  275.4159 7.525527  18.33090       11.52800  
1 1 1 8  10 5  o 243.9096 3.878561  39.65342       1.260588      38.24336       1.784285      41.05861       1.781199      239.4803 5.591405  248.1460 5.386809  -8.665695      7.764118  
1 1 1 8  10 6  o 304.3483 6.485415  61.78550       2.630160      61.19614       4.356704      62.12347       3.299212      302.3896 10.82978  304.9718 8.125764  -2.582153      13.53928  
1 1 1 8  10 7  o 524.4535 5.367225  183.3995       3.750855      185.5221       4.003115      168.1322       10.73598      527.4536 5.695610  500.3241 16.12443  27.12949       17.10080  
1 1 1 8  10 8  o 360.6469 6.507726  86.75722       3.127411      86.90643       3.695331      86.38057       5.871043      360.8754 7.684623  359.1288 12.28660  1.746643       14.49185  
1 1 1 8  10 9  o 356.7812 8.409576  84.96983       3.998063      83.97392       5.458202      86.12278       5.872761      354.1989 11.58012  358.6004 12.30842  -4.401489      16.89960  
1 1 1 8  10 10 o 440.8270 8.938709  129.7402       5.250691      131.0069       7.444323      128.4863       7.407016      442.3401 12.64274  438.0504 12.70295  4.289734       17.92216  
1 1 1 8  10 11 o 617.5734 9.822919  254.7277       8.083560      252.3110       10.66965      257.9838       12.38492      614.0693 13.03945  620.5109 14.97857  -6.441650      19.85912  
1 1 1 8  10 12 o 511.2019 8.261785  174.4050       5.627816      184.0757       7.830360      164.0720       8.094056      524.8148 11.19701  495.3266 12.26312  29.48816       16.60594  
1 1 1 8  10 13 o 382.5013 8.610573  97.65517       4.388727      97.42876       5.932752      97.92882       6.522237      381.5912 11.68143  382.4049 12.81781  -0.8137207     17.34221  
1 1 1 8  10 14 o 111.9225 12.57794  8.482969       1.843431      8.217934       2.090567      9.409347       3.908459      109.8152 14.65184  115.6538 25.99563  -5.838539      29.84039  
1 1 1 8  10 15 o 104.4665 8.986264  7.339786       1.238776      5.378340       1.554386      10.75418       2.050821      88.62730 13.59512  126.2027 12.35315  -37.57537      18.36920  
1 1 1 8  10 16 o 445.0714 12.01413  132.6165       7.118658      126.0224       8.625809      146.6986       12.60537      433.2793 14.96272  466.0665 20.34613  -32.78723      25.25566  
1 1 1 8  10 17 o 297.7197 8.011104  59.22068       3.175255      60.20314       4.900157      58.50955       4.168924      299.6168 12.29970  295.6151 10.60053  4.001709       16.23742  
1 1 1 8  10 18 o 332.4321 5.353862  73.71053       2.371612      79.12180       4.900970      72.05595       2.710043      343.6837 10.71471  328.6189 6.188853  15.06479       12.37364  
1 1 1 8  10 19 o 159.9967 7.327998  17.13388       1.558171      17.62976       2.060106      16.47097       2.381937      162.0410 9.583739  156.3319 11.51510  5.709076       14.98151  
1 1 1 8  10 20 o 187.3402 9.417173  23.56142       2.343312      23.76273       2.532637      22.36397       6.176880      188.0271 10.14590  177.7892 26.91396  10.23790       28.76284  
1 1 1 8  10 21 o 96.59208 6.095108  6.257039       0.7805060     7.535128       2.533888      6.123061       0.8203956     103.5079 19.07390  95.50660 6.484848  8.001343       20.14614  
1 1 1 8  10 22 o 216.3418 6.759693  31.33325       1.946290      30.99092       3.166726      31.54106       2.467301      214.2819 11.12864  216.7472 8.559528  -2.465317      14.03966  
1 1 1 8  10 23 o 155.4838 5.178976  16.16795       1.071510      12.47603       2.717068      16.84787       1.166009      134.4280 15.44880  158.6825 5.522834  -24.25443      16.40631  
1 1 1 8  10 24 o 64.90160 17.58469  3.004497       1.558245      4.268850       2.340810      1.998353       2.088151      76.84116 21.83634  57.78175 20.99189  19.05941       30.29002  
1 1 1 8  10 25 o 226.7943 8.791839  34.67580       2.651929      30.39988       3.617805      39.64154       3.898719      210.8772 12.93711  241.2459 12.16726  -30.36867      17.75982  
1 1 1 8  10 26 o 263.4330 11.24560  47.26627       3.938454      48.98907       5.603477      45.58426       5.536752      265.3336 15.92188  255.6288 16.33998  9.704758       22.81450  
1 1 1 8  10 27 o 200.4447 7.466698  27.11193       1.990842      25.75438       2.980730      28.20525       2.674974      193.6279 11.60591  203.4878 9.894903  -9.859970      15.25143  
1 1 1 8  10 28 o 129.3137 9.794020  11.48526       1.675089      10.63774       1.872064      14.88881       3.751565      123.7307 11.48567  140.7716 20.61020  -17.04092      23.59451  
1 1 1 8  10 29 o 122.0270 14.83933  10.79346       2.363378      12.21000       3.143219      8.950960       3.584785      126.6244 19.23278  102.5819 26.15046  24.04247       32.46146  
1 1 1 8  10 30 o 69.92710 13.50454  3.619277       1.212782      3.385237       1.236287      9.598950       6.249046      67.21904 14.24551  89.93513 35.44506  -22.71609      38.20061  
1 1 1 8  10 31 o ?        ?         -3.241718      0.1976185     -3.253104      0.2007682     -2.887325      1.120055      ?        ?         19.95841 9.989527  0.000000       9.989527  
1 1 1 8  10 32 o 46.77964 14.36594  1.700587       0.9814698     2.202836       1.206150      0.7162670      1.688535      52.35696 15.89591  41.33356 17.56593  11.02339       23.69054  
1 1 1 8  10 33 o 81.73107 8.565710  4.751686       0.9190347     5.440608       1.164802      3.615509       1.495858      86.31998 10.33166  65.31367 17.01872  21.00631       19.90930  
1 1 1 8  10 34 o ?        ?         -3.830807      0.8322511     -4.946923      1.142859      -2.570683      1.214353      ?        ?         21.60340 10.74767  0.000000       10.74767  
1 1 1 8  11 0  o 554.7739 23.09213  207.5955       17.00339      207.5955       17.00339      207.5955       17.00339      554.7739 23.09213  554.7739 23.09213  -0.000000      0.000000  
1 1 1 8  11 1  o 368.7879 10.29976  90.94575       5.056521      91.60291       5.505963      87.40625       12.77807      369.9990 11.18041  357.7162 27.00679  12.28284       29.22958  
1 1 1 8  11 2  o 391.8670 5.750445  102.4025       3.002712      103.7842       3.702491      99.74746       5.132409      394.4132 7.044805  386.2775 9.979579  8.135773       12.21562  
1 1 1 8  11 3  o 448.8370 10.34440  134.6112       6.186822      137.9336       7.649312      128.3266       10.52049      453.8409 12.66105  436.5618 18.12435  17.27911       22.10870  
1 1 1 8  11 4  o 689.6569 16.49139  319.2144       15.15527      413.5597       33.68986      295.2788       16.96918      776.1566 32.64730  662.1525 19.25266  114.0042       37.90133  
1 1 1 8  11 5  o 416.8763 5.730377  115.8888       3.183201      109.3960       4.107634      125.6500       5.036506      404.8935 7.613377  433.8271 8.712426  -28.93365      11.57022  
1 1 1 8  11 6  o 245.0038 7.062722  40.07999       2.303377      43.52491       3.838709      38.14183       2.879328      254.9054 11.32972  238.8317 9.063886  16.07373       14.50919  
1 1 1 8  11 7  o 227.6122 12.57215  34.76502       3.798292      36.23592       8.160276      34.35821       4.291524      229.4751 27.21609  226.0320 14.32212  3.443146       30.75449  
1 1 1 8  11 8  f 179.3598 8.880922  21.52913       2.115942      21.10223       2.392256      23.06352       4.535333      177.4453 10.15988  184.3063 18.72670  -6.860962      21.30522  
1 1 1 8  11 9  o 313.9941 6.921813  65.76747       2.896109      66.18633       3.449598      64.76723       5.330758      314.8068 8.230450  310.8698 12.89677  3.936920       15.29925  
1 1 1 8  11 10 o 752.4138 9.182526  377.9705       9.206455      383.6105       15.60210      374.9577       11.40335      756.5652 15.47616  748.9837 11.42580  7.581543       19.23696  
1 1 1 8  11 11 o 509.2369 8.896702  173.1073       6.037018      182.5781       8.716006      164.3739       8.369781      522.4920 12.51885  495.5751 12.68493  26.91687       17.82215  
1 1 1 8  11 12 o 411.2237 7.851737  112.8364       4.302466      112.3168       5.078396      114.1579       8.098626      410.1530 9.291957  412.5858 14.75446  -2.432831      17.43659  
1 1 1 8  11 13 o 173.0049 1.324878  19.94249       0.3054273     19.95776       0.3067205     18.14191       3.329638      173.0712 1.329978  163.8198 15.43498  9.251373       15.49217  
1 1 1 8  11 14 o 319.3567 7.661808  68.05490       3.260475      70.30976       3.806093      61.83784       6.319919      324.4053 8.812933  303.2837 15.69163  21.12158       17.99709  
1 1 1 8  11 15 o 166.1426 7.343271  18.45503       1.621698      18.20581       1.785255      19.63123       3.878402      164.9483 8.147511  170.0660 17.35751  -5.117752      19.17459  
1 1 1 8  11 16 o 132.7811 6.620018  11.79239       1.167608      11.60972       1.211159      14.19625       4.393642      131.7218 6.924651  142.8331 23.93030  -11.11128      24.91205  
1 1 1 8  11 17 f 430.7821 7.758048  123.9223       4.453318      132.9881       6.323689      115.0026       6.272508      445.8134 10.64496  414.2938 11.37288  31.51959       15.57746  
1 1 1 8  11 18 f 155.3451 5.747424  16.12434       1.187668      16.89592       1.921179      15.64706       1.510984      158.6870 9.124054  152.8761 7.439653  5.810913       11.77271  
1 1 1 8  11 19 o 234.2260 4.333305  36.59042       1.352471      36.42259       2.848490      36.63927       1.536738      233.0847 9.189231  234.3469 4.921156  -1.262131      10.42400  
1 1 1 8  11 20 o 115.7210 2.071568  8.924688       0.3194368     7.794686       1.351803      8.991519       0.3287472     107.4195 9.543236  116.1526 2.124025  -8.733055      9.776750  
1 1 1 8  11 21 o 150.4239 1.528138  15.07852       0.3063042     17.22485       2.189650      15.03568       0.3093459     159.7805 10.33988  150.2098 1.545513  9.570786       10.45475  
1 1 1 8  11 22 o 98.31248 5.868995  6.483417       0.7653578     5.212195       1.271060      7.206500       0.9586270     87.24551 11.19062  103.5298 6.989784  -16.28434      13.19420  
1 1 1 8  11 23 o 205.8835 6.042115  28.37952       1.655823      27.30455       2.464305      29.26431       2.235723      201.2928 9.211819  208.6794 8.055291  -7.386642      12.23705  
1 1 1 8  11 24 o 308.6068 7.705122  63.93053       3.168535      66.63083       4.270371      60.62300       4.726190      314.0094 10.21947  298.7558 11.89571  15.25360       15.68265  
1 1 1 8  11 25 o 290.4417 8.929825  56.92805       3.451908      51.86197       4.400975      65.02766       5.564745      275.7857 12.00453  307.8902 13.59717  -32.10449      18.13813  
1 1 1 8  11 26 o 125.2645 7.364315  10.59538       1.223809      11.11799       1.293767      6.151174       3.772779      128.2713 7.603365  88.92751 28.29613  39.34374       29.29987  
1 1 1 8  11 27 o 115.1956 6.537850  8.959070       0.9994420     8.745281       1.105672      9.914008       2.336800      113.6132 7.342710  117.9661 15.22022  -4.352966      16.89883  
1 1 1 8  11 28 o 85.00063 7.289969  4.926601       0.8177323     5.123193       0.8642548     3.246627       2.526449      86.61704 7.563787  65.78433 23.18242  20.83271       24.38514  
1 1 1 8  11 29 o 127.9702 6.139439  11.09923       1.043860      11.68310       1.204421      9.336801       2.092550      131.0012 6.924280  113.2642 14.17414  17.73702       15.77504  
1 1 1 8  11 30 o 21.98392 9.776328  -0.1625315     0.5752612     -0.1302816     0.5783049     -3.202111      5.614351      22.33316 9.873545  53.28566 25.78839  -30.95250      27.61390  
1 1 1 8  11 31 o 63.85418 8.385478  2.877790       0.6962686     2.917275       0.6993289     -1.603985      7.450599      64.30813 8.358561  58.24727 28.52358  6.060856       29.72306  
1 1 1 8  11 32 o 82.52961 5.252142  4.646293       0.5745933     4.494370       0.6080592     5.913607       1.756212      81.00853 5.668802  85.89151 15.93095  -4.882980      16.90948  
1 1 1 8  11 33 o 32.07486 15.21776  -1.194666      1.751087      1.810653       3.733520      -2.042208      1.982687      52.12885 23.86912  31.61801 15.30753  20.51084       28.35587  
1 1 1 8  11 34 f 40.62093 15.83555  1.201323       1.235844      -0.7435932     4.434817      1.365074       1.286818      46.65003 22.65735  42.23992 16.24205  4.410110       27.87759  
1 1 1 8  12 0  o 331.1887 28.08005  75.37948       12.17932      75.37948       12.17932      75.37948       12.17932      331.1887 28.08005  331.1887 28.08005  -0.000000      0.000000  
1 1 1 8  12 1  o 311.3659 12.58783  64.96814       5.211938      63.72355       6.025105      68.66810       10.38839      308.0362 14.72136  317.5617 24.74492  -9.525482      28.79288  
1 1 1 8  12 2  o 357.0583 9.044089  85.17912       4.299598      85.18282       6.182863      85.17564       5.983153      356.5322 13.03614  356.5829 12.61190  -0.5068970E-01 18.13839  
1 1 1 8  12 3  o 239.2901 7.136574  38.23443       2.273015      34.46994       4.265704      39.72715       2.686130      226.4219 14.21000  243.8287 8.279407  -17.40675      16.44605  
1 1 1 8  12 4  o 145.2261 2.574693  14.05423       0.4982457     14.09595       0.5086474     13.06524       2.476377      145.4410 2.624560  139.0591 13.53531  6.381927       13.78742  
1 1 1 8  12 5  o 454.1179 10.67941  137.7962       6.462333      140.7764       12.33458      136.6687       7.586969      456.8412 20.31294  451.8246 12.61392  5.016571       23.91080  
1 1 1 8  12 6  o 249.4426 6.670636  41.53149       2.215243      45.61039       4.653084      40.33605       2.519035      260.7135 13.43916  245.7484 7.702053  14.96513       15.48976  
1 1 1 8  12 7  o 336.6783 8.093538  75.64416       3.631007      76.35802       4.892385      74.76876       5.417748      337.8697 10.88089  334.1634 12.18750  3.706329       16.33796  
1 1 1 8  12 8  o 385.8380 8.282389  99.35231       4.258279      101.6318       4.780494      90.59559       9.369744      390.1635 9.195018  366.6098 19.24750  23.55374       21.33107  
1 1 1 8  12 9  o 466.2787 8.781572  145.1233       5.456213      145.6795       6.450343      143.7243       10.22962      467.0019 10.36551  462.6319 16.62099  4.369995       19.58829  
1 1 1 8  12 10 o 191.1422 6.160765  24.38940       1.567101      26.74973       1.986320      20.49822       2.550367      200.1004 7.462586  174.8062 11.00480  25.29420       13.29646  
1 1 1 8  12 11 o 396.1670 6.699738  104.6815       3.536793      103.8550       5.408463      105.2991       4.674902      394.1751 10.30585  397.1753 8.833173  -3.000183      13.57334  
1 1 1 8  12 12 o 365.9442 7.205805  89.33806       3.513751      84.84021       4.155446      100.6222       6.581869      356.5039 8.747416  387.6249 12.76017  -31.12094      15.47059  
1 1 1 8  12 13 f 416.5183 7.157703  115.7439       3.972659      115.1829       4.546218      117.5560       8.170550      415.4190 8.212785  418.6108 14.67031  -3.191864      16.81273  
1 1 1 8  12 14 o 537.1108 11.06524  192.8907       7.919509      189.1259       9.998232      199.2303       12.97423      531.0637 14.14131  544.0186 17.92204  -12.95483      22.82929  
1 1 1 8  12 15 o 324.1162 7.051643  70.10516       3.045542      72.56426       3.345201      58.19475       7.362025      329.7074 7.614125  293.2393 18.94223  36.46805       20.41526  
1 1 1 8  12 16 o 202.0719 5.559807  27.25813       1.495637      29.74660       1.816175      22.01438       2.636401      211.0314 6.466208  181.0287 10.98090  30.00278       12.74331  
1 1 1 8  12 17 o 540.7416 10.37966  195.7678       7.479047      198.4649       8.838454      188.9667       14.03527      543.9509 12.19391  527.4354 20.00627  16.51556       23.42952  
1 1 1 8  12 18 f 109.5728 4.100724  8.017818       0.5976813     8.469193       0.6537097     5.718100       1.475551      112.6022 4.365036  91.43806 12.43196  21.16413       13.17600  
1 1 1 8  12 19 o 272.4346 7.282413  49.65792       2.641322      51.72279       3.786931      47.70175       3.685904      277.4787 10.25965  266.4287 10.40219  11.05002       14.61048  
1 1 1 8  12 20 o 170.7355 3.473056  19.44013       0.7901490     14.42892       1.487259      21.41083       0.9326627     146.6327 7.638041  179.1582 3.906738  -32.52554      8.579176  
1 1 1 8  12 21 o 92.31999 1.964737  5.680524       0.2416983     4.303657       0.4492829     6.241285       0.2867232     80.19490 4.219201  96.76472 2.223680  -16.56982      4.769319  
1 1 1 8  12 22 o 92.54742 1.935815  5.708811       0.2387271     3.271848       0.4198892     6.872810       0.2901928     69.85424 4.535474  101.5404 2.144737  -31.68619      5.017013  
1 1 1 8  12 23 o 79.46809 3.185251  4.219475       0.3366116     4.288232       0.3560294     3.640229       1.033382      80.10259 3.342884  72.59766 11.02876  7.504936       11.52426  
1 1 1 8  12 24 o 55.43644 7.583241  2.101569       0.5455070     2.603302       2.020439      2.062119       0.5665475     61.91257 20.77147  54.82767 7.989435  7.084904       22.25500  
1 1 1 8  12 25 o 114.5511 6.978517  8.848213       1.060158      10.07782       2.186190      8.470152       1.212231      120.2753 13.89599  111.8139 8.192972  8.461418       16.13144  
1 1 1 8  12 26 f 177.0591 11.82542  21.60999       2.774032      20.12428       3.347244      24.86836       4.957012      169.1261 15.00829  184.0789 20.55953  -14.95279      25.45473  
1 1 1 8  12 27 o 160.8925 10.60988  17.85778       2.261981      19.73770       3.399349      16.36396       3.030226      166.0332 15.54558  151.2803 15.23955  14.75298       21.76945  
1 1 1 8  12 28 o 54.80930 18.87661  2.186591       1.669937      4.416203       2.818259      0.9801848      2.073066      73.19362 24.53182  48.12936 19.88682  25.06425       31.57999  
1 1 1 8  12 29 o 73.40190 20.63344  4.459184       2.101674      -0.7618260     3.463205      7.502884       2.644246      49.04867 22.65092  95.19558 21.37064  -46.14691      31.14111  
1 1 1 8  12 30 o 69.60593 20.90952  4.212414       2.094885      0.2824817      3.310684      6.836647       2.705368      49.92461 22.71259  87.10389 22.98019  -37.17928      32.31023  
1 1 1 8  12 31 f 24.29622 12.11450  -3.532029      1.579193      -1.126348      1.989938      -7.624388      2.595418      35.37737 16.61209  27.61833 13.99300  7.759041       21.72017  
1 1 1 8  12 32 o 18.00826 9.137784  -3.839521      1.134894      -1.047074      2.266154      -4.774325      1.311165      37.27541 17.57283  18.71816 9.529793  18.55725       19.99053  
1 1 1 8  12 33 o 39.69705 17.04229  0.7574465      1.618535      -2.101514      2.803038      2.187457       1.982415      37.35664 18.11309  50.04817 19.88805  -12.69153      26.90016  
1 1 1 8  13 0  o 9.448132 6.706644  -0.4823615     0.3574863     -0.4823615     0.3574863     -0.4823615     0.3574863     9.448132 6.706644  9.448132 6.706644  -0.000000      0.000000  
1 1 1 8  13 1  o 310.9659 6.589028  64.49600       2.730283      66.61456       3.084171      56.82096       5.870279      315.9921 7.324680  290.8173 15.20111  25.17477       16.87379  
1 1 1 8  13 2  o 554.5853 8.241666  205.2611       6.090555      197.3329       12.71118      207.6237       6.938958      541.8735 17.62758  557.6356 9.338352  -15.76208      19.94835  
1 1 1 8  13 3  o 517.9360 10.16026  179.1791       7.012202      177.9901       10.27174      180.2168       9.596195      515.2432 14.97681  518.6840 13.89678  -3.440735      20.43099  
1 1 1 8  13 4  o 295.9856 4.396823  58.39662       1.734136      57.71680       1.918412      61.43398       4.055009      294.2413 4.892883  303.1206 10.05319  -8.879303      11.18065  
1 1 1 8  13 5  o 519.4356 10.68164  180.2584       7.393385      187.9801       10.78690      173.4169       10.15347      529.4660 15.30527  508.5909 14.99848  20.87506       21.42909  
1 1 1 8  13 6  o 310.0179 5.608436  64.08291       2.316872      72.20467       4.194211      60.51628       2.779422      328.7026 9.586007  301.2081 6.924913  27.49457       11.82565  
1 1 1 8  13 7  o 530.8891 9.584971  188.1880       6.780600      190.1316       8.234578      184.0948       11.94993      533.3576 11.58642  523.5633 17.15178  9.794312       20.69852  
1 1 1 8  13 8  o 212.7422 8.471360  30.25325       2.396686      30.43016       2.756629      29.70541       4.850977      213.2538 9.726416  209.6772 17.52225  3.576614       20.04077  
1 1 1 8  13 9  o 452.3491 9.252887  136.6079       5.577306      148.2122       7.420373      121.5398       8.455645      470.7177 11.83959  425.7217 14.92863  44.99603       19.05361  
1 1 1 8  13 10 o 225.9181 8.166080  34.10504       2.454274      36.72707       3.135343      29.95637       3.943861      234.2802 10.06678  211.0649 14.10365  23.21532       17.32781  
1 1 1 8  13 11 o 84.00749 14.48122  4.859938       1.562530      3.625035       2.113204      6.349470       2.320867      72.51992 20.79302  95.55322 18.89740  -23.03329      28.09736  
1 1 1 8  13 12 o 352.0079 6.673243  82.65681       3.130134      80.09151       3.797349      88.09457       5.528696      346.3926 8.226940  362.7935 11.45075  -16.40091      14.09972  
1 1 1 8  13 13 o 461.0104 6.887197  141.8033       4.230842      144.9643       5.491693      137.1877       6.636075      465.9039 8.845785  452.9442 10.99495  12.95972       14.11158  
1 1 1 8  13 14 o 153.3802 6.499832  15.72484       1.325438      15.51513       1.391006      17.79332       4.368569      152.3231 6.870834  160.9447 20.86015  -8.621628      21.96256  
1 1 1 8  13 15 o 378.8153 7.731495  95.83556       3.902694      97.11346       5.312922      94.33791       5.751632      380.8136 10.47998  375.1291 11.51998  5.684479       15.57370  
1 1 1 8  13 16 o 408.3307 9.139868  111.5228       4.973081      112.6362       5.957690      108.9642       9.031211      409.8805 10.91777  401.3828 16.92346  8.497650       20.13955  
1 1 1 8  13 17 o 307.5744 7.935884  63.29265       3.249796      66.32364       4.285214      59.18969       4.985730      314.4267 10.24140  296.4749 12.64930  17.95172       16.27548  
1 1 1 8  13 18 o 122.9019 12.67292  10.27442       2.045711      10.44113       2.388287      9.815130       3.964189      123.4500 14.81407  116.6419 26.15233  6.808121       30.05663  
1 1 1 8  13 19 o 99.45140 9.522155  6.695146       1.246490      8.816164       2.443707      5.949213       1.449195      112.6651 16.78938  93.25047 11.93611  19.41464       20.59985  
1 1 1 8  13 20 o 36.19751 12.63247  0.7914415      0.7489888     -1.754668      1.549368      1.567893       0.8556050     30.52448 14.43249  47.42213 13.10448  -16.89765      19.49421  
1 1 1 8  13 21 o 54.81771 12.83603  2.116267       0.9210106     1.871275       1.571988      2.244320       1.136501      53.84745 18.32116  56.38318 14.90352  -2.535728      23.61736  
1 1 1 8  13 22 o 107.1621 3.024359  7.665499       0.4314331     10.31614       1.971698      7.532207       0.4421477     122.7814 12.21308  106.2186 3.127277  16.56275       12.60711  
1 1 1 8  13 23 o 168.6216 1.980357  18.95408       0.4449694     17.99312       2.295175      18.99161       0.4535752     162.7483 10.64179  168.7868 2.016682  -6.038483      10.83119  
1 1 1 8  13 24 o 80.82956 2.757010  4.363451       0.2965144     4.964242       2.127816      4.351553       0.2994360     82.20634 19.68524  80.71694 2.788164  1.489395       19.88172  
1 1 1 8  13 25 o 192.0757 7.929748  24.93837       2.025211      21.92098       3.021361      27.40016       2.729056      177.9919 12.82479  200.3963 10.25405  -22.40436      16.42014  
1 1 1 8  13 26 o 88.81186 15.84324  5.733043       1.806162      5.258014       1.865859      12.80244       7.197962      84.38615 17.17806  113.5641 39.18702  -29.17799      42.78678  
1 1 1 8  13 27 o 25.02214 11.64943  -0.7761710     0.9445730     7.144969       3.900894      -1.269539      0.9735450     89.89409 28.79095  23.12803 11.07604  66.76606       30.84797  
1 1 1 8  13 28 o 55.08552 19.68924  2.245928       1.828150      3.846357       3.330646      1.555849       2.187054      68.27200 26.16134  51.63920 20.76445  16.63280       33.40027  
1 1 1 8  13 29 o 46.19874 18.40279  1.291640       1.701361      2.401838       2.289008      -0.7881138E-01 2.543190      56.07659 21.63618  44.65264 20.15058  11.42395       29.56637  
1 1 1 8  13 30 f 59.42855 20.65579  3.053554       2.001466      -3.532572      3.676875      5.826772       2.385920      41.82813 20.38635  80.53944 21.73271  -38.71131      29.79789  
1 1 1 8  13 31 o 44.77147 19.44621  0.8960925      2.156271      1.407073       4.347763      0.7294105      2.483179      54.39905 25.21193  45.70713 20.31978  8.691917       32.38108  
1 1 1 8  13 32 o 37.92685 18.08224  -1.314974      2.533730      8.539432       7.353481      -2.642529      2.699007      66.14961 31.32574  35.77367 17.44233  30.37594       35.85439  
1 1 1 8  14 0  o 457.4295 14.32425  140.1514       8.711711      140.1514       8.711711      140.1514       8.711711      457.4295 14.32425  457.4295 14.32425  -0.000000      0.000000  
1 1 1 8  14 1  o 832.9693 21.69018  467.6596       24.05448      467.3430       66.34539      467.7076       25.81067      799.7593 62.75789  832.2774 23.29620  -32.51807      66.94226  
1 1 1 8  14 2  o 174.4544 7.641975  20.34355       1.772173      23.02643       3.228612      19.18669       2.120102      185.0683 13.17836  169.2618 9.437289  15.80646       16.20900  
1 1 1 8  14 3  o 84.48182 11.65756  4.859632       1.277392      10.42953       4.250006      4.306491       1.339319      121.7834 26.90760  79.19536 13.15261  42.58801       29.95012  
1 1 1 8  14 4  o 355.1664 8.280072  84.17874       3.918678      81.17187       4.733475      90.72842       6.986070      348.4728 10.20483  367.8720 14.27868  -19.39920      17.55048  
1 1 1 8  14 5  o 478.5538 7.474360  152.7824       4.766267      148.6292       6.996587      156.3788       6.510654      471.6289 11.13300  483.8924 10.09723  -12.26349      15.02990  
1 1 1 8  14 6  o 333.7146 6.990245  74.28368       3.108431      72.62843       3.894536      77.18893       5.159594      329.7413 8.871633  339.6627 11.41594  -9.921356      14.45786  
1 1 1 8  14 7  o 240.5310 6.772234  38.61922       2.168423      39.10331       3.288360      38.24675       2.884419      241.7454 10.23130  239.1886 9.066325  2.556763       13.67032  
1 1 1 8  14 8  o 354.4743 8.941133  83.93336       4.219918      85.07114       5.258657      81.87548       7.072190      356.6252 11.07941  349.2394 15.23362  7.385773       18.83657  
1 1 1 8  14 9  o 100.5970 9.220825  6.813312       1.222293      6.813736       1.693519      6.812850       1.765921      100.0844 13.00572  99.98141 13.60781  0.1030350      18.82343  
1 1 1 8  14 10 o 168.7851 6.510736  19.03059       1.461580      18.45366       1.780287      20.22340       2.559875      166.0845 8.068425  173.5803 11.12596  -7.495758      13.74360  
1 1 1 8  14 11 o 180.7698 7.748637  21.85010       1.862152      21.52918       2.008794      23.81051       4.964915      179.3757 8.427801  186.8659 20.26315  -7.490128      21.94591  
1 1 1 8  14 12 f 215.3113 5.391168  30.93538       1.545545      30.35019       1.781887      32.71289       3.105536      213.2041 6.278912  220.9349 10.57944  -7.730728      12.30241  
1 1 1 8  14 13 o 253.9490 4.634199  43.00097       1.568175      43.20296       1.718726      41.99718       3.831485      254.5251 5.067601  250.1967 11.52338  4.328430       12.58844  
1 1 1 8  14 14 o 219.3359 1.290886  32.05481       0.3772864     32.01271       0.3789784     36.73768       3.997128      219.1917 1.297528  233.6566 12.88789  -14.46492      12.95304  
1 1 1 8  14 15 o 62.71812 3.716230  2.631751       0.3091846     2.765034       0.3165510     -0.1324421     1.441585      64.29247 3.710727  37.14582 16.01685  27.14665       16.44108  
1 1 1 8  14 16 o 293.8796 9.701247  57.91711       3.793804      58.22365       4.030038      55.53000       11.24611      294.5392 10.28393  279.7867 30.66680  14.75253       32.34520  
1 1 1 8  14 17 o 32.30844 6.160800  0.7204596      0.2555550     0.7189180      0.2564741     0.9344234      3.021431      32.26908 6.189732  58.71731 24.10881  -26.44823      24.89071  
1 1 1 8  14 18 o 169.8185 6.559729  19.30703       1.481586      19.43485       1.606621      18.58036       3.830650      170.3110 7.094950  164.0823 17.80519  6.228668       19.16672  
1 1 1 8  14 19 o 242.5894 8.933860  39.54404       2.882982      40.09096       3.300684      37.78411       5.920922      243.9577 10.17585  233.5783 19.19233  10.37935       21.72311  
1 1 1 8  14 20 o 163.5127 6.173888  17.90897       1.342774      18.56311       1.579217      16.20183       2.551188      166.3279 7.141944  154.2093 12.52302  12.11859       14.41643  
1 1 1 8  14 21 o 95.50781 4.088122  6.100412       0.5190755     5.940520       0.5883520     6.661959       1.102597      94.18758 4.702685  99.23756 8.417441  -5.049973      9.642021  
1 1 1 8  14 22 o 109.0253 3.686751  7.942980       0.5348346     9.590613       0.7351328     6.090174       0.7795616     119.7185 4.616852  95.16650 6.180856  24.55195       7.714811  
1 1 1 8  14 23 o 85.28445 6.255080  4.901958       0.7059026     6.200614       2.312538      4.768518       0.7412824     92.20811 19.43487  84.04243 6.674064  8.165688       20.54890  
1 1 1 8  14 24 o 95.64803 5.740313  6.156517       0.7282527     3.639235       2.076557      6.509542       0.7776431     70.13370 20.75797  98.32362 5.963425  -28.18992      21.59759  
1 1 1 8  14 25 o 48.01534 4.460203  1.556711       0.2821073     7.032248       2.179349      1.463398       0.2845009     98.00134 17.32207  46.51318 4.652603  51.48816       17.93602  
1 1 1 8  14 26 o 39.19413 16.64991  0.2678185      1.515958      0.6733824      1.790206      -0.7601188     2.850078      44.41989 18.42873  46.67851 21.17182  -2.258617      28.06892  
1 1 1 8  14 27 o 26.69086 11.62971  -0.6930853E-01 0.7763349     -1.511374      1.686540      0.3183967      0.8744903     32.06388 15.12934  31.59079 12.97048  0.4730949      19.92813  
1 1 1 8  14 28 o 18.98000 9.579523  -3.549454      1.147200      1.622060       2.778644      -4.612106      1.259562      53.83279 22.68915  18.59990 9.457038  35.23289       24.58115  
1 1 1 8  14 29 o 29.10044 12.50695  0.9313674E-01  0.8735271     3.355132       3.658944      -0.1040197     0.8995379     62.20808 26.11675  27.96316 12.34050  34.24492       28.88551  
1 1 1 8  14 30 o 35.67536 16.96410  -1.570529      2.200371      3.463144       3.886428      -3.945268      2.669415      60.95026 26.28993  33.79433 16.65279  27.15593       31.12035  
1 1 1 8  14 31 o 47.67489 19.05522  1.744741       1.830305      2.541409       2.912764      1.224921       2.352845      54.14639 23.04328  46.56529 20.26832  7.581097       30.68872  
1 1 1 8  14 32 f 31.15848 14.80186  -1.169672      1.667106      2.198095       2.771388      -3.079318      2.086905      51.11295 22.12393  29.82367 14.70153  21.28928       26.56319  
1 1 1 8  15 0  o 90.83683 1.168364  5.500344       0.1413682     5.500344       0.1413682     5.500344       0.1413682     90.83683 1.168364  90.83683 1.168364  -0.000000      0.000000  
1 1 1 8  15 1  o 624.7023 10.52750  260.6852       8.763385      288.8961       15.62899      247.7483       10.58367      655.7931 17.90182  608.5813 13.05101  47.21179       22.15410  
1 1 1 8  15 2  o 678.9387 9.933768  307.8313       8.987069      282.9410       21.97612      312.8298       9.848216      646.2283 25.57112  684.2842 10.80059  -38.05591      27.75851  
1 1 1 8  15 3  o 479.7281 10.82929  153.7596       6.922589      147.9759       9.362121      160.7365       10.28252      469.7897 14.97450  489.4773 15.78563  -19.68753      21.75825  
1 1 1 8  15 4  o 255.0512 10.08879  43.51445       3.422018      42.16236       4.059313      46.83531       6.361727      250.8197 12.18199  263.4674 18.23315  -12.64775      21.92826  
1 1 1 8  15 5  o 418.2779 11.28242  117.0135       6.282664      120.7281       9.302103      113.8978       8.519452      423.9557 16.49745  411.9578 15.54768  11.99789       22.66928  
1 1 1 8  15 6  o 524.2653 8.070414  183.4250       5.637940      187.8710       6.491441      169.7740       11.37471      530.4528 9.183766  502.6825 17.00587  27.77032       19.32721  
1 1 1 8  15 7  o 212.5400 6.075331  30.15073       1.718852      27.42830       2.140251      35.09672       2.884781      202.5758 7.944131  229.0521 9.472033  -26.47629      12.36239  
1 1 1 8  15 8  o 359.3067 6.520220  86.11595       3.121772      87.88205       4.248928      84.04426       4.601868      362.7986 8.789014  354.5688 9.749278  8.229858       13.12613  
1 1 1 8  15 9  o 264.4267 6.273489  46.64027       2.210487      44.78825       2.814111      49.62397       3.571870      258.8907 8.167608  272.3436 9.858755  -13.45297      12.80253  
1 1 1 8  15 10 o 449.4434 7.906100  134.8559       4.734900      133.6258       5.837715      137.2212       8.094897      447.1475 9.797575  452.3096 13.44573  -5.162140      16.63671  
1 1 1 8  15 11 o 309.0234 8.714958  63.84854       3.585059      62.98033       4.068818      66.86228       7.580698      306.7476 9.967599  314.4240 18.17080  -7.676422      20.72513  
1 1 1 8  15 12 o 112.8758 5.047411  8.514441       0.7572569     8.189292       0.7950425     11.69327       2.485893      110.6699 5.407593  131.1524 14.46431  -20.48251      15.44209  
1 1 1 8  15 13 o 221.8300 5.445868  32.83073       1.609760      33.66541       1.828706      29.95774       3.392764      224.5089 6.118455  210.9902 12.11849  13.51875       13.57547  
1 1 1 8  15 14 o 135.8455 1.830471  12.29736       0.3313458     12.34223       0.3352616     10.40992       2.174291      136.0928 1.848737  123.7017 13.40468  12.39113       13.53157  
1 1 1 8  15 15 o 95.89046 5.246177  6.154895       0.6677813     5.894624       0.7071092     8.301373       2.030656      93.79589 5.684242  110.0726 14.17328  -16.27676      15.27065  
1 1 1 8  15 16 o 153.5498 4.964345  15.75251       1.014410      15.86858       1.036176      13.07653       4.975261      154.1074 5.052709  133.9685 28.73204  20.13890       29.17294  
1 1 1 8  15 17 o 126.6772 6.044057  10.74729       1.017292      10.55312       1.050659      13.65953       4.068936      125.4963 6.303038  138.7099 22.80594  -13.21360      23.66092  
1 1 1 8  15 18 o 141.5027 6.262935  13.41500       1.177983      13.23906       1.249089      14.82959       3.541908      140.5148 6.690324  145.7897 18.65929  -5.274841      19.82245  
1 1 1 8  15 19 o 182.6599 6.895305  22.37147       1.675289      21.46087       1.755128      31.70270       5.618449      178.8150 7.381867  212.8839 20.04196  -34.06894      21.35819  
1 1 1 8  15 20 o 237.5943 8.282014  37.95805       2.618068      38.01913       2.906347      37.69518       6.029467      237.5324 9.199685  231.9289 19.69580  5.603500       21.73842  
1 1 1 8  15 21 o 101.2768 5.850946  6.887690       0.7862428     7.258244       0.9249975     5.922961       1.492512      103.8475 6.720623  92.56461 12.41299  11.28291       14.11557  
1 1 1 8  15 22 o 87.30079 5.619016  5.124087       0.6501889     5.339223       0.7505568     4.477185       1.301505      89.00980 6.370201  80.07446 12.61466  8.935341       14.13185  
1 1 1 8  15 23 o 134.9219 4.753804  12.19663       0.8533323     13.70493       1.369208      11.23872       1.091165      142.5226 7.233270  129.2200 6.356556  13.30257       9.629435  
1 1 1 8  15 24 o 16.09448 7.740487  -0.7165356     0.4869888     -1.290040      0.6137591     0.2581600      0.8001367     16.24382 8.000710  30.35430 12.42851  -14.11048      14.78104  
1 1 1 8  15 25 o 16.52871 7.697594  -0.3704555     0.4129260     0.3892870      0.5930311     -1.085455      0.5753034     28.57032 11.01556  16.24323 7.948341  12.32709       13.58376  
1 1 1 8  15 26 o 128.6802 2.621568  11.06137       0.4495171     17.73446       1.492913      10.39606       0.4713934     161.5196 6.952709  124.7223 2.836388  36.79723       7.509012  
1 1 1 8  15 27 o 72.39870 6.408583  3.587466       0.6118742     3.350952       0.6168575     18.04893       4.823507      69.86405 6.708438  141.7950 26.50288  -71.93099      27.33872  
1 1 1 8  15 28 o 58.49699 6.854320  2.371332       0.5241622     2.951875       0.5917236     0.2556645      1.129602      65.32838 6.901619  33.67769 14.34181  31.65069       15.91603  
1 1 1 8  15 29 o 23.09183 10.75232  -0.5966956     0.8051565     0.3315889E-01  4.064031      -0.6224278     0.8214388     51.21840 23.95046  23.22607 10.83008  27.99232       26.28526  
1 1 1 8  15 30 o 77.13134 12.25612  4.492284       1.217580      12.26881       6.307091      4.191249       1.240923      82.32211 34.40639  73.86766 13.08609  8.454445       36.81095  
1 1 1 8  15 31 o 34.00190 13.37298  0.6892884      0.8879014     -7.261751      5.395880      0.9105726      0.9001721     42.15384 21.21184  36.42456 13.68254  5.729282       25.24191  
1 1 1 8  16 0  o 660.2916 14.30061  291.6555       12.56909      291.6555       12.56909      291.6555       12.56909      660.2916 14.30061  660.2916 14.30061  0.000000       0.000000  
1 1 1 8  16 1  o 381.4701 9.934042  97.26785       5.045338      87.62432       8.707453      102.1419       6.190419      360.6606 18.17696  390.6451 11.90615  -29.98447      21.72920  
1 1 1 8  16 2  o 543.8304 2.565714  197.0813       1.859282      187.9584       12.24840      197.2965       1.881081      528.7601 17.40762  544.1261 2.594384  -15.36603      17.59989  
1 1 1 8  16 3  o 275.7715 6.749157  50.73078       2.480119      52.59346       3.351133      48.47500       3.687828      280.5148 8.976808  269.1576 10.30132  11.35721       13.66383  
1 1 1 8  16 4  o 275.4456 8.225620  50.68810       3.015721      52.59281       3.782288      47.36393       4.996662      280.3807 10.14025  265.5227 14.17364  14.85803       17.42747  
1 1 1 8  16 5  o 765.8962 17.83734  394.3853       18.20428      380.6283       25.08204      409.6987       26.46291      748.6760 25.17756  776.5170 25.60989  -27.84100      35.91345  
1 1 1 8  16 6  o 161.5790 7.896707  17.46815       1.695068      16.59392       1.988591      19.79128       3.241691      157.3183 9.530920  171.2412 14.33810  -13.92290      17.21684  
1 1 1 8  16 7  f 726.2296 3.646929  351.5394       3.529187      351.5406       3.617437      351.5148       16.07562      726.2231 3.738156  723.1816 16.68195  3.041443       17.09565  
1 1 1 8  16 8  o 566.8391 7.939415  214.5340       5.996831      204.9937       8.386942      224.5135       8.577883      553.4681 11.37202  579.2775 11.11271  -25.80933      15.90016  
1 1 1 8  16 9  o 440.3279 7.710569  129.4672       4.524141      129.7620       6.092033      129.1047       6.755482      440.4325 10.38029  438.9546 11.55956  1.477875       15.53621  
1 1 1 8  16 10 o 374.9117 8.062224  93.89785       4.027702      93.90578       4.605114      93.87203       8.307660      374.7742 9.221407  372.8560 16.76394  1.918182       19.13280  
1 1 1 8  16 11 o 269.6411 8.521926  48.65152       3.058100      50.63454       3.578941      43.28674       5.886627      274.8995 9.785892  252.5070 17.60551  22.39258       20.14244  
1 1 1 8  16 12 o 238.0548 7.766063  37.91545       2.460197      42.25476       3.688073      34.43646       3.302293      250.7979 11.06298  226.3755 10.98019  24.42236       15.58698  
1 1 1 8  16 13 o 336.6982 7.292188  75.76778       3.271690      75.01437       4.077153      77.13020       5.482729      334.5961 9.153154  338.5552 12.17310  -3.959076      15.23039  
1 1 1 8  16 14 o 226.2358 4.470315  34.14654       1.347637      33.40123       1.459271      38.46630       3.513145      223.7234 4.894982  239.0546 11.05869  -15.33118      12.09361  
1 1 1 8  16 15 o 173.8167 1.332888  20.13189       0.3087157     20.14218       0.3103335     19.15222       3.027344      173.8610 1.339532  167.8420 13.65375  6.018997       13.71930  
1 1 1 8  16 16 o 209.0849 5.781538  29.23158       1.609246      26.80218       1.987420      33.85703       2.742308      199.9562 7.472155  224.4355 9.189049  -24.47935      11.84364  
1 1 1 8  16 17 o 272.1387 7.603282  49.65510       2.754477      49.42278       3.013151      50.83656       6.794925      271.3267 8.343943  271.0029 18.93556  0.3237610      20.69244  
1 1 1 8  16 18 o 232.8529 6.893026  36.34013       2.136420      37.01149       2.344805      33.05866       5.183968      234.8680 7.501821  218.3411 17.97687  16.52689       19.47935  
1 1 1 8  16 19 o 115.9329 9.645990  9.114409       1.476652      8.459839       1.568911      14.19404       4.370553      111.4348 10.69706  139.4630 24.40677  -28.02820      26.64804  
1 1 1 8  16 20 o 169.5987 8.906552  19.42284       2.005769      19.86176       2.214201      17.41526       4.735443      171.2874 9.741191  154.4649 23.76764  16.82256       25.68641  
1 1 1 8  16 21 o 58.71822 12.73515  2.443364       0.9676983     3.146888       1.000954      -7.619613      3.785627      67.09978 11.61527  39.82576 19.66375  27.27402       22.83808  
1 1 1 8  16 22 o 28.19415 11.57227  0.1987539      0.6958342     0.1987776      0.6972675     0.1930085      10.85770      28.21839 11.58342  87.70763 40.36054  -59.48924      41.98986  
1 1 1 8  16 23 o 102.8597 8.462956  7.216635       1.149703      7.671662       1.615104      6.749205       1.636967      104.9842 11.74636  97.98343 12.84673  7.000748       17.40734  
1 1 1 8  16 24 o 59.98423 10.46588  2.540578       0.8061293     2.283396       2.419748      2.572685       0.8549692     58.99643 22.37270  60.18724 11.06811  -1.190811      24.96078  
1 1 1 8  16 25 o 63.72205 11.43126  2.911093       0.9349763     4.156811       1.115693      -0.2741295E-01 1.713555      76.48393 11.28582  39.17440 17.16873  37.30953       20.54592  
1 1 1 8  16 26 o 41.17929 11.75158  1.237033       0.6765370     1.793145       1.151750      0.9440691      0.8359562     48.96954 15.64004  37.73018 13.33163  11.23936       20.55099  
1 1 1 8  16 27 o 112.7972 8.092378  8.830917       1.208239      8.459792       1.269966      12.37261       3.923168      110.0300 8.733383  114.5916 26.25686  -4.561584      27.67119  
1 1 1 8  16 28 f 62.13045 6.800445  2.676748       0.5538229     5.123204       0.8835919     1.093726       0.7107660     85.70529 7.823126  38.60735 12.28140  47.09794       14.56139  
1 1 1 8  16 29 o 59.55254 7.467368  2.493519       0.5795795     2.439208       0.6246411     2.829717       1.554129      58.57159 8.230030  57.40739 18.14824  1.164207       19.92717  
1 1 1 8  16 30 o 33.29127 11.45408  0.7883475      0.6148037     0.7431203      0.7822434     0.8614283      0.9943600     33.81923 12.74387  36.61263 14.22374  -2.793396      19.09767  
1 1 1 8  17 0  f 348.7284 10.00458  81.35313       4.640346      81.35313       4.640346      81.35313       4.640346      348.7284 10.00458  348.7284 10.00458  -0.000000      0.000000  
1 1 1 8  17 1  o 161.3929 2.994114  17.35947       0.6439115     17.44638       0.6929290     16.80959       1.743010      161.7928 3.214075  158.4503 8.284081  3.342484       8.885734  
1 1 1 8  17 2  f 236.3984 7.119210  37.32837       2.240035      30.04419       6.870596      38.19474       2.369508      208.7937 25.20403  239.1002 7.446196  -30.30644      26.28096  
1 1 1 8  17 3  o 341.3916 8.616836  77.89190       3.916760      83.17381       5.697407      73.15868       5.393361      352.2534 12.15625  330.3192 12.27462  21.93430       17.27544  
1 1 1 8  17 4  o 620.0869 12.26540  257.5072       10.13463      285.4171       20.03382      247.9083       11.74885      648.1318 23.23433  607.7963 14.50654  40.33545       27.39112  
1 1 1 8  17 5  o 465.3849 11.01595  144.9318       6.831366      138.8359       11.46657      148.2859       8.505614      453.1552 19.03184  470.0119 13.59502  -16.85675      23.38879  
1 1 1 8  17 6  o 380.1866 7.519126  96.51015       3.809235      90.29488       5.568964      101.9749       5.221911      367.0542 11.39981  390.3447 10.04775  -23.29047      15.19582  
1 1 1 8  17 7  o 188.6388 6.178673  23.77082       1.551006      22.60693       1.788713      27.29769       3.113707      183.8589 7.315607  201.5273 11.64458  -17.66841      13.75188  
1 1 1 8  17 8  o 48.79778 11.04423  1.658220       0.7013367     1.865534       0.8137245     1.059350       1.383022      51.72417 12.03355  45.48101 16.98536  6.243160       20.81607  
1 1 1 8  17 9  o 182.2800 7.285279  22.22927       1.765968      23.02416       2.246049      20.94222       2.858009      185.3004 9.124456  176.2366 12.24627  9.063736       15.27177  
1 1 1 8  17 10 o 170.2076 13.29600  19.60078       2.991685      27.41578       6.150688      17.17891       3.424011      198.5909 23.71083  158.6126 16.43837  39.97829       28.85175  
1 1 1 8  17 11 o 193.0158 13.03502  25.18213       3.332909      27.60500       4.459967      22.11782       5.015718      201.2118 16.78712  178.5884 21.50944  22.62337       27.28486  
1 1 1 8  17 12 o 293.8922 9.546026  57.95304       3.733426      54.59048       4.394415      66.67705       7.078218      284.7492 11.60583  312.9234 17.03939  -28.17419      20.61641  
1 1 1 8  17 13 o 62.80723 9.092703  2.697878       0.7388722     2.738114       0.7817582     2.361048       2.261893      63.19630 9.583679  62.06181 21.92940  1.134491       23.93210  
1 1 1 8  17 14 o 149.3555 3.146167  14.87430       0.6261473     14.97224       0.6375664     12.21359       3.323242      149.8445 3.193089  132.0919 19.46311  17.75266       19.72330  
1 1 1 8  17 15 o 145.8046 1.665944  14.16758       0.3236719     14.16973       0.3253973     13.96582       3.147259      145.8155 1.674699  142.0063 16.96765  3.809204       17.05010  
1 1 1 8  17 16 o 186.6753 6.451377  23.34250       1.602358      23.28256       2.008149      23.44754       2.658399      186.1457 8.115479  186.2137 10.75941  -0.6802368E-01 13.47686  
1 1 1 8  17 17 o 107.3428 9.338023  7.807828       1.322399      7.266774       1.718341      8.593707       2.070934      102.7522 12.82874  111.4780 14.26797  -8.725731      19.18728  
1 1 1 8  17 18 o 127.6778 8.616031  11.00913       1.457288      9.344185       1.618443      18.14258       3.350015      117.1864 10.47479  161.8682 15.72954  -44.68179      18.89814  
1 1 1 8  17 19 o 92.22036 12.60365  5.892704       1.508320      6.713470       1.733991      3.340735       3.057561      98.24415 13.61059  71.14663 25.45927  27.09752       28.86906  
1 1 1 8  17 20 o 79.42359 19.70487  4.639719       2.075392      4.639719       2.075392      0.000000       0.000000      79.42359 19.70487  ?        ?         0.000000       19.70487  
1 1 1 8  17 21 o 56.58568 13.60245  2.296999       1.012928      2.807319       1.093259      -0.7977030     2.692225      62.65691 13.49345  46.42707 20.86073  16.22984       24.84438  
1 1 1 8  17 22 o 161.5157 8.033572  17.69891       1.723581      19.68220       2.053694      12.97384       3.169910      169.9191 9.103497  133.1970 18.34672  36.72211       20.48111  
1 1 1 8  17 23 o 23.47483 11.05734  -0.9105835     0.8937938     -1.018208      0.9189473     0.9750205      3.846457      23.38197 11.07308  59.70637 25.95242  -36.32439      28.21597  
1 1 1 8  17 24 o 124.1477 10.05363  10.72073       1.648945      14.95431       3.898585      9.798358       1.819729      136.8931 22.12680  117.7514 11.75447  19.14167       25.05519  
1 1 1 8  17 25 o 17.88662 8.419753  -0.5270398     0.5167681     -0.7376353     0.6465388     -0.1545026     0.8599135     19.45946 9.236625  27.28042 12.05126  -7.820963      15.18381  
1 1 1 8  17 26 o 48.15835 10.21042  1.688509       0.6348646     4.028818       1.148587      0.6589651      0.7618158     74.10103 12.04563  33.41636 12.57977  40.68467       17.41689  
1 1 1 8  17 27 o 107.1105 9.711519  8.151050       1.371045      8.913733       1.755000      6.956589       2.196296      110.1726 12.15634  91.77823 18.59667  18.39435       22.21740  
1 1 1 8  17 28 o 36.26452 9.767746  0.9688050      0.4824981     1.461367       0.7909159     0.6768316      0.6089356     43.66919 12.78062  31.89260 11.36739  11.77659       17.10444  
1 1 1 8  17 29 o 37.49447 13.38060  1.015087       0.8439808     0.3303522      1.258511      1.574711       1.137743      34.63367 14.94965  44.61637 15.56951  -9.982704      21.58475  
1 1 1 8  18 0  o 10.08039 7.222857  -0.7316925     0.4534933     -0.7316925     0.4534933     -0.7316925     0.4534933     10.08039 7.222857  10.08039 7.222857  0.000000       0.000000  
1 1 1 8  18 1  o 457.6789 8.632058  139.9966       5.264399      135.6558       7.160104      145.1042       7.766819      449.7295 11.95859  464.9840 12.54668  -15.25452      17.33283  
1 1 1 8  18 2  o 89.62621 21.18218  5.667657       2.489455      8.383301       3.289573      2.027900       3.808372      108.9258 23.36446  70.17487 27.66646  38.75094       36.21231  
1 1 1 8  18 3  o 460.5280 9.095288  141.8169       5.581437      145.1621       8.881021      139.6332       7.175601      464.4589 14.36695  456.2528 11.81258  8.206024       18.59963  
1 1 1 8  18 4  o 218.4024 8.031777  31.91660       2.333470      35.07022       3.473843      29.32366       3.149933      228.4646 11.44731  208.8734 11.36010  19.59113       16.12740  
1 1 1 8  18 5  o 442.9054 9.541259  131.2652       5.631060      129.5400       11.22604      131.8452       6.509178      436.6517 19.34180  443.5640 11.01276  -6.912292      22.25727  
1 1 1 8  18 6  o 233.6314 9.358301  36.58630       2.907516      33.71563       4.707653      38.35659       3.696869      222.9711 15.94999  238.8376 11.65119  -15.86653      19.75227  
1 1 1 8  18 7  o 34.33007 12.98356  0.5697048      0.8136318     0.2807236      0.9011539     1.844376       1.892619      32.57577 13.24564  56.06864 20.03422  -23.49287      24.01702  
1 1 1 8  18 8  o 453.9676 6.396429  137.6343       3.869332      137.5524       5.142732      137.7411       5.874017      453.4174 8.511815  453.4385 9.721724  -0.2111816E-01 12.92141  
1 1 1 8  18 9  o 94.74840 14.88019  6.204202       1.816838      3.810005       2.307595      10.10867       2.946866      73.88919 21.88555  120.4581 18.98711  -46.56893      28.97391  
1 1 1 8  18 10 o 326.6065 9.218536  71.53872       4.007981      70.44326       6.262581      72.29868       5.216115      322.5057 14.61073  327.6068 11.96882  -5.101105      18.88719  
1 1 1 8  18 11 o 220.0653 9.030436  32.51482       2.642470      30.92850       3.193650      35.95829       4.705316      214.1701 11.22988  229.7965 15.45629  -15.62643      19.10516  
1 1 1 8  18 12 o 130.4064 8.904657  11.45551       1.538070      11.84439       1.661716      9.130328       4.063338      132.5175 9.472918  111.5755 27.50733  20.94199       29.09277  
1 1 1 8  18 13 o 88.81168 8.639603  5.339130       1.009532      6.257590       1.057484      -4.104825      3.390942      96.26197 8.325911  43.97672 20.95318  52.28525       22.54677  
1 1 1 8  18 14 f 167.8641 5.503648  18.84990       1.229403      19.06394       1.305981      17.18368       3.643845      168.7760 5.815699  157.3053 17.69000  11.47069       18.62146  
1 1 1 8  18 15 o 54.55147 10.69475  2.074275       0.7496107     2.110486       0.7746927     1.542061       2.969946      54.99082 10.95712  60.81993 24.28523  -5.829117      26.64265  
1 1 1 8  18 16 o 131.9769 6.040002  11.67838       1.059390      11.80000       1.175862      11.15408       2.441395      132.5715 6.677799  127.0163 14.69541  5.555252       16.14150  
1 1 1 8  18 17 o 100.9641 5.132392  6.832522       0.6882294     7.154354       0.7161521     2.945187       2.488956      103.3102 5.219125  66.51830 23.03906  36.79192       23.62282  
1 1 1 8  18 18 o 73.82569 15.47272  3.891062       1.473348      2.482453       1.667324      8.910226       3.147318      59.56442 18.79332  109.9740 22.24232  -50.40955      29.11889  
1 1 1 8  18 19 o 66.68508 18.34080  3.241940       1.680436      4.181870       1.934255      0.3489669      3.393424      75.38755 19.20418  56.92583 24.56007  18.46172       31.17687  
1 1 1 8  18 20 o 113.0904 13.57848  8.964967       2.005336      8.132631       2.370599      11.05906       3.760167      106.0099 17.38380  119.9154 24.36397  -13.90556      29.92991  
1 1 1 8  18 21 o 83.51569 17.24231  5.151288       1.855225      3.313486       2.293683      8.628486       3.154996      66.73343 22.12569  105.2399 23.13020  -38.50649      32.00863  
1 1 1 8  18 22 o 53.91282 19.76174  1.942153       1.856622      0.6490141      2.072523      7.196762       4.177793      46.65031 19.62477  90.22090 29.85906  -43.57059      35.73087  
1 1 1 8  18 23 o 71.41058 20.07176  4.061370       1.988906      4.880902       2.502668      2.656507       3.276706      76.77577 22.80474  62.81649 25.36062  13.95928       34.10598  
1 1 1 8  18 24 o 141.9159 14.95215  14.94127       2.785095      10.76008       4.968162      16.85741       3.363259      99.87480 32.53511  148.3036 17.34636  -48.42876      36.87044  
1 1 1 8  18 25 o 37.05214 14.06679  0.8279681      0.9572352     1.345999       1.402763      0.3765205      1.309513      44.87321 17.03030  36.58030 15.50444  8.292904       23.03082  
1 1 1 8  18 26 o 16.20000 7.783915  -0.6761847     0.4898116     -0.1821819     1.003059      -0.8308665     0.5612820     28.88027 12.87215  16.98780 8.205015  11.89247       15.26481  
1 1 1 8  18 27 o 36.27499 14.45679  0.7272555      1.050463      -1.311170      1.314868      4.323871       1.746553      27.26120 13.00523  71.22334 18.30442  -43.96214      22.45413  
1 1 1 8  18 28 o 97.21676 10.20104  6.881549       1.301815      7.529974       1.672842      5.885878       2.072923      99.28356 12.95314  81.27755 19.40827  18.00601       23.33377  
1 1 1 8  19 0  o 241.9882 10.71366  39.36802       3.439206      39.36802       3.439206      39.36802       3.439206      241.9882 10.71366  241.9882 10.71366  0.000000       0.000000  
1 1 1 8  19 1  o 279.5045 8.903811  52.33461       3.311950      50.61673       4.171818      55.26286       5.446698      274.3881 11.43509  286.0045 14.33752  -11.61642      18.33919  
1 1 1 8  19 2  o 359.5314 7.830134  86.42409       3.751281      84.27836       4.687586      90.24557       6.255728      354.5272 9.932405  366.0979 12.84341  -11.57074      16.23594  
1 1 1 8  19 3  o 423.7906 10.01142  120.3599       5.653540      119.4194       7.304814      121.7648       8.927813      421.0854 13.03433  424.1294 15.82470  -3.044037      20.50158  
1 1 1 8  19 4  o 384.2196 9.762425  98.98371       4.994119      95.08401       7.960339      101.5149       6.413264      374.5766 15.98517  388.3502 12.40909  -13.77362      20.23638  
1 1 1 8  19 5  o 91.75815 11.12745  5.734003       1.332778      0.2425357      3.943525      6.442127       1.416104      62.76049 26.76407  97.33676 11.11717  -34.57627      28.98115  
1 1 1 8  19 6  o 364.1114 11.09276  89.12639       5.375770      78.31226       11.48160      92.16264       6.083813      334.6350 25.95152  369.8699 12.36129  -35.23492      28.74514  
1 1 1 8  19 7  o 180.9861 5.729551  21.89544       1.380040      21.75391       1.735680      22.13869       2.275500      180.2237 7.242184  181.4850 9.441885  -1.261230      11.89951  
1 1 1 8  19 8  o 242.4977 6.943390  39.35040       2.241327      38.04659       2.783960      41.75232       3.778634      238.1304 8.788613  248.8857 11.42408  -10.75533      14.41351  
1 1 1 8  19 9  o 259.4296 9.010337  45.18280       3.110100      51.71703       6.008255      42.79111       3.634993      275.2175 16.45839  252.0314 10.84910  23.18605       19.71247  
1 1 1 8  19 10 o 427.9689 7.756421  122.6538       4.423307      117.9535       5.990982      128.2867       6.558466      418.5764 10.75002  436.3062 11.29022  -17.72974      15.58948  
1 1 1 8  19 11 o 382.1570 8.554080  97.95521       4.356008      93.04082       5.704156      104.8307       6.746967      371.2616 11.54426  393.4824 12.88534  -22.22076      17.30034  
1 1 1 8  19 12 o 316.5074 8.596545  67.27822       3.622255      67.60798       4.228926      66.36983       7.018830      316.8293 10.02948  310.7928 17.01295  6.036530       19.74921  
1 1 1 8  19 13 o 143.8681 7.189684  13.89961       1.373945      13.83981       1.424575      14.69635       5.199812      143.5118 7.475216  140.4344 28.75559  3.077438       29.71132  
1 1 1 8  19 14 o 139.3048 5.603846  12.99657       1.038098      13.38010       1.172167      11.60180       2.235330      141.2614 6.242615  130.0769 13.07347  11.18446       14.48744  
1 1 1 8  19 15 o 58.95644 6.154912  2.351845       0.4764195     2.391060       0.4874045     1.511152       2.256736      59.43754 6.247247  55.34264 21.44796  4.094898       22.33928  
1 1 1 8  19 16 o 175.3691 7.166143  20.67395       1.671076      20.80152       2.109015      20.45876       2.739165      175.4488 9.051618  173.0945 11.94908  2.354324       14.99041  
1 1 1 8  19 17 o 21.04139 10.06765  -1.086836      0.8004013     -0.9753987     0.8474976     -2.006711      2.434935      22.49615 10.64775  39.89204 18.61611  -17.39588      21.44608  
1 1 1 8  19 18 o 121.5861 12.08175  10.21730       1.931565      10.65972       2.445279      9.483160       3.149899      122.9472 15.25266  112.7821 21.74786  10.16516       26.56338  
1 1 1 8  19 19 o 61.88579 19.55346  2.789228       1.804339      5.288907       2.713724      0.8085184      2.415650      82.58391 23.52577  51.09472 21.31949  31.48919       31.74874  
1 1 1 8  19 20 f 48.65153 18.28250  1.415575       1.607506      2.709190       2.377917      0.3268617      2.181478      62.11380 22.42395  46.17037 19.80267  15.94343       29.91620  
1 1 1 8  19 21 o 48.23770 19.44083  1.128542       1.921827      2.177664       2.556762      -0.2341067     2.913863      58.42365 22.77663  48.90195 21.85783  9.521694       31.56802  
1 1 1 8  19 22 o 95.39973 14.82376  6.712310       1.823272      5.270087       2.446832      8.512918       2.733993      79.77571 22.20490  103.4169 20.56378  -23.64120      30.26428  
1 1 1 8  19 23 o 39.17855 17.62009  -0.3061768     1.925715      -0.8913758     2.689182      0.3097595      2.758902      43.26832 19.97380  48.18762 21.42062  -4.919304      29.28815  
1 1 1 8  19 24 o 66.55193 22.63881  3.922301       2.400200      5.083442       3.744644      3.112598       3.127023      71.44234 27.64424  61.39546 24.77899  10.04688       37.12414  
1 1 1 8  19 25 o 68.80890 20.72935  4.168017       2.056784      3.674897       2.659409      4.902010       3.244550      63.32156 23.57199  69.78455 26.02494  -6.462990      35.11320  
1 1 1 8  19 26 o 40.64902 17.79196  0.4494424      1.834935      1.426741       2.712092      -0.3755755     2.491854      49.97054 21.75549  41.68744 19.23796  8.283100       29.04135  
1 1 1 8  19 27 f 23.78588 10.60476  -0.1461658     0.6813480     -0.6832285E-02 2.656175      -0.1559797     0.7049348     43.17712 19.90271  24.11761 10.76743  19.05951       22.62864  
1 1 1 8  20 0  f 122.6773 3.227063  10.05156       0.5267026     10.05156       0.5267026     10.05156       0.5267026     122.6773 3.227063  122.6773 3.227063  -0.000000      0.000000  
1 1 1 8  20 1  o 454.2660 8.016625  138.1250       4.852610      135.9666       8.965275      139.0193       5.771073      447.8659 15.04385  455.3061 9.512169  -7.440247      17.79884  
1 1 1 8  20 2  o 228.4522 5.831638  34.88131       1.773798      37.08094       2.993305      33.69083       2.202094      234.9358 9.581654  224.3058 7.377565  10.62993       12.09283  
1 1 1 8  20 3  o 331.4946 7.626346  73.53230       3.368732      72.14690       4.044385      76.67122       6.087749      327.8916 9.265833  336.6511 13.59872  -8.759491      16.45542  
1 1 1 8  20 4  o 388.7510 8.578281  101.2586       4.443706      96.95586       7.169290      103.9429       5.662648      378.2836 14.24827  393.0735 10.82146  -14.78995      17.89182  
1 1 1 8  20 5  o 163.1641 8.048847  17.87146       1.744574      18.30898       3.123839      17.67315       2.103102      163.8118 14.45929  161.9631 9.790469  1.848694       17.46208  
1 1 1 8  20 6  f 193.2734 8.956334  25.10570       2.300348      26.79267       2.859365      22.01082       3.872912      199.2876 10.80797  179.0744 16.41280  20.21313       19.65177  
1 1 1 8  20 7  o 205.2205 6.559851  28.19331       1.791555      26.71236       2.074080      32.54564       3.555629      199.5523 7.815123  219.2702 12.21754  -19.71794      14.50326  
1 1 1 8  20 8  o 49.40864 13.06040  1.710766       0.8727628     2.653754       1.068746      -0.1769693     1.512139      61.45063 13.42803  37.58342 16.30466  23.86721       21.12236  
1 1 1 8  20 9  f 222.1448 7.066720  33.07016       2.089174      33.50448       2.844873      32.56177       3.077951      223.0591 9.593696  219.6501 10.54697  3.408951       14.25754  
1 1 1 8  20 10 o 115.8582 7.938566  9.041960       1.218176      5.832095       2.010194      10.90486       1.531401      90.81232 17.24233  127.0825 9.103666  -36.27015      19.49807  
1 1 1 8  20 11 o 154.0617 8.121954  15.96973       1.661468      21.76043       2.985055      13.37056       1.999880      178.7693 12.61195  140.3862 10.77301  38.38310       16.58672  
1 1 1 8  20 12 o 126.8188 10.70115  10.93201       1.791512      11.71382       1.948101      6.647017       4.560758      131.1712 11.25416  94.98000 31.18684  36.19119       33.15532  
1 1 1 8  20 13 o 115.4761 9.719723  9.052172       1.481744      9.321451       1.726723      8.299987       2.885910      116.8373 11.22902  107.0577 20.98033  9.779564       23.79632  
1 1 1 8  20 14 o 16.44819 8.281310  -2.575331      0.8285232     -2.529297      0.8944831     -2.853382      2.198331      17.70676 8.871913  34.82442 16.66843  -17.11766      18.88246  
1 1 1 8  20 15 o 39.58828 11.35227  1.091336       0.6298614     1.106720       0.6326160     -0.6637058     6.756744      39.84252 11.36165  73.46689 33.02596  -33.62437      34.92566  
1 1 1 8  20 16 o 89.79559 2.210321  5.377072       0.2644745     5.356702       0.2655665     7.838742       2.919406      89.62485 2.223675  102.3295 22.06045  -12.70463      22.17224  
1 1 1 8  20 17 o 53.32191 6.445401  1.938297       0.4486796     1.861085       0.4565400     4.122834       2.428366      52.18124 6.721823  73.93392 22.57671  -21.75268      23.55612  
1 1 1 8  20 18 o 34.72064 14.87818  0.5913153E-01  1.229321      0.4453020      1.563313      -0.5665588     1.989922      41.20854 17.16919  40.14633 17.99483  1.062210       24.87157  
1 1 1 8  20 19 o 107.4439 14.20191  8.270687       1.983559      7.328871       3.663825      8.661197       2.359213      92.84352 27.59625  108.5097 16.86382  -15.66621      32.34102  
1 1 1 8  20 20 o 72.36905 17.01318  3.982535       1.612806      6.215940       2.662394      2.687872       2.027062      87.22100 22.69377  59.87904 20.78888  27.34196       30.77636  
1 1 1 8  20 21 o 61.30515 19.45121  2.969901       1.783864      2.175695       3.132945      3.350911       2.169971      59.09971 24.43629  64.36935 21.52540  -5.269646      32.56494  
1 1 1 8  20 22 o 71.89574 18.20458  4.156310       1.745513      3.591212       2.520595      4.677012       2.419560      64.88118 23.12718  73.26788 22.56619  -8.386703      32.31253  
1 1 1 8  20 23 o 56.81793 16.59199  2.568113       1.334271      3.738724       1.695615      0.6646085      2.162211      67.41642 18.37584  45.10394 19.53231  22.31248       26.81758  
1 1 1 8  20 24 o 72.50172 20.64775  4.624409       2.090666      4.693274       3.012536      4.560426       2.903759      68.95585 25.18913  68.41057 24.76837  0.5452805      35.32653  
1 1 1 8  20 25 o 45.52201 19.07544  1.212650       1.946285      1.814415       3.077359      0.8114797      2.512635      52.67369 23.04844  46.34122 20.52952  6.332466       30.86570  
1 1 1 8  20 26 o 64.14094 22.39157  4.083566       2.353356      3.165587       3.416169      4.912675       3.246599      57.48528 24.72021  65.99030 25.68321  -8.505016      35.64710  
1 1 1 8  21 0  o 330.3954 10.36836  73.29537       4.554569      73.29537       4.554569      73.29537       4.554569      330.3954 10.36836  330.3954 10.36836  -0.000000      0.000000  
1 1 1 8  21 1  o 588.6230 12.30819  234.0072       9.653951      231.5933       13.09307      236.8832       14.29094      581.8785 16.90426  587.1987 18.28655  -5.320251      24.90285  
1 1 1 8  21 2  o 336.9521 6.304993  75.91940       2.830911      72.86272       4.780255      77.57046       3.513237      328.7351 10.92787  340.2826 7.748081  -11.54752      13.39594  
1 1 1 8  21 3  o 252.7434 8.070662  42.86039       2.714597      42.48816       3.619430      43.33898       4.104135      250.9346 10.85010  253.0177 12.20902  -2.083191      16.33355  
1 1 1 8  21 4  o 108.5682 6.467445  7.912008       0.9314000     7.394405       1.278096      8.498182       1.360125      104.5231 9.272635  112.1241 9.183857  -7.601051      13.05086  
1 1 1 8  21 5  o 292.0844 7.880065  57.22529       3.064183      55.93867       4.639464      58.22075       4.080893      287.4565 12.13950  293.8742 10.43783  -6.417664      16.00987  
1 1 1 8  21 6  o 59.66561 18.08650  2.473333       1.562333      4.219824       2.437946      1.256276       2.035150      76.78645 22.42921  52.25165 20.33496  24.53480       30.27507  
1 1 1 8  21 7  o 235.4763 7.314411  37.18470       2.292309      36.51948       2.731568      38.76870       4.215073      233.0169 8.813217  238.6803 13.30569  -5.663376      15.95977  
1 1 1 8  21 8  o 232.5560 6.073350  36.20208       1.880432      35.97469       2.309909      36.64887       3.237859      231.5409 7.496635  232.9245 10.45872  -1.383560      12.86796  
1 1 1 8  21 9  o 121.8766 7.880617  10.00802       1.272974      14.81068       2.427870      8.187148       1.494938      147.2787 12.48885  109.7091 10.34829  37.56963       16.21908  
1 1 1 8  21 10 o 163.2645 5.918616  17.85913       1.285483      19.21163       2.549327      17.39800       1.488583      168.0853 11.45047  160.9680 6.956431  7.117325       13.39795  
1 1 1 8  21 11 o 56.34193 10.20306  2.207929       0.7378172     4.811913       2.098611      1.840670       0.7881315     81.38326 19.58913  51.09365 11.81220  30.28961       22.87492  
1 1 1 8  21 12 o 129.0634 7.680111  11.23321       1.314849      14.03384       2.463279      10.11730       1.554887      142.7855 13.09219  122.0298 9.640500  20.75573       16.25868  
1 1 1 8  21 13 o 64.10542 14.64926  2.940642       1.223940      2.163149       2.047849      3.372709       1.526602      58.22212 20.83552  68.26786 16.87826  -10.04574      26.81407  
1 1 1 8  21 14 o 89.34478 9.043875  5.451747       1.061894      4.994849       1.257037      6.590270       1.984309      84.86077 11.40496  96.06001 16.06934  -11.19924      19.70525  
1 1 1 8  21 15 o 20.60979 9.844523  -0.9956002     0.7584324     -1.130516      0.7956552     0.3459674      2.508995      20.68644 9.934709  49.67240 21.26959  -28.98596      23.47539  
1 1 1 8  21 16 o 121.1493 2.840688  9.798214       0.4585828     10.00477       0.4658198     3.305032       2.611727      122.4183 2.855605  67.46188 23.58614  54.95641       23.75838  
1 1 1 8  21 17 o 70.92515 7.396132  3.439127       0.6887429     3.347096       0.7253273     4.283014       2.196382      69.82554 7.936179  74.27377 21.16693  -4.448235      22.60579  
1 1 1 8  21 18 o 163.4643 5.335946  17.99216       1.160715      18.74737       1.306548      15.16434       2.528220      166.6721 5.892137  146.2034 13.11653  20.46870       14.37917  
1 1 1 8  21 19 o 50.67332 16.61940  1.885889       1.295320      2.193348       1.672571      1.425141       2.047493      54.53315 18.88645  50.35721 20.14507  4.175934       27.61380  
1 1 1 8  21 20 o 128.1383 12.18077  11.77638       2.054843      8.789632       2.844050      15.03826       2.972156      103.3130 21.36477  141.4080 16.05734  -38.09499      26.72623  
1 1 1 8  21 21 o 27.88308 13.06011  -0.9597437     1.216802      1.307220       1.811595      -2.823145      1.642449      47.01669 18.90084  27.04157 13.27297  19.97511       23.09575  
1 1 1 8  21 22 o 43.49517 14.90593  1.384008       1.040907      1.324768       1.290841      1.494146       1.760074      43.94633 16.41008  47.60411 18.79578  -3.657787      24.95139  
1 1 1 8  21 23 o 37.63887 15.86594  0.5249045      1.359006      1.114756       2.006181      0.2469308E-01  1.847464      45.86137 19.30139  39.00372 17.42105  6.857651       26.00071  
1 1 1 8  21 24 o 55.06780 18.66425  2.598816       1.631255      2.552472       1.860471      2.752897       3.392361      54.43487 19.80878  56.90734 24.55418  -2.472466      31.54831  
1 1 1 8  21 25 o 34.73925 15.34255  0.1252698      1.392950      2.021188       1.759164      -3.061525      2.280728      49.64069 19.01519  31.96201 15.67846  17.67868       24.64531  
1 1 1 8  22 0  o 243.2751 9.980023  39.84114       3.222808      39.84114       3.222808      39.84114       3.222808      243.2751 9.980023  243.2751 9.980023  0.000000       0.000000  
1 1 1 8  22 1  o 357.0060 8.136033  85.52896       3.870452      85.74523       5.879044      85.36353       5.141993      355.5596 12.42765  355.5056 10.86730  0.5407715E-01  16.50893  
1 1 1 8  22 2  o 108.7490 1.134542  7.880532       0.1644066     7.658245       1.998946      7.882046       0.1649655     105.0347 14.68281  108.7594 1.138290  -3.724648      14.72686  
1 1 1 8  22 3  o 206.9724 7.385662  28.75070       2.033661      30.51681       2.922784      27.09324       2.831453      212.5050 10.35292  200.1164 10.65668  12.38860       14.85758  
1 1 1 8  22 4  o 254.9620 8.182460  43.68618       2.776324      43.52445       3.452629      43.98209       4.670262      253.8775 10.22685  253.8026 13.86193  0.7493591E-01  17.22618  
1 1 1 8  22 5  o 251.4354 7.992393  42.48011       2.674391      42.77372       3.222172      41.82999       4.794800      251.8275 9.619920  247.0649 14.62967  4.762589       17.50915  
1 1 1 8  22 6  o 192.1189 8.353053  24.84808       2.133290      27.49799       4.974711      24.25098       2.361436      197.9706 19.09456  189.5369 9.379076  8.433701       21.27368  
1 1 1 8  22 7  o 72.89662 12.89209  3.716897       1.206484      3.667727       1.349177      3.913161       2.695497      72.00109 14.56322  74.25724 23.94715  -2.256149      28.02772  
1 1 1 8  22 8  o 161.2460 7.960225  17.51495       1.705075      15.67034       4.711876      17.79290       1.829029      145.5754 25.20248  162.4039 8.481217  -16.82843      26.59128  
1 1 1 8  22 9  o 94.47002 7.648697  6.035706       0.9546143     5.117948       1.636176      6.509344       1.175409      85.11102 14.97330  97.83433 9.121321  -12.72331      17.53277  
1 1 1 8  22 10 o 148.4807 7.265150  14.84819       1.433071      13.75103       2.237842      15.61090       1.865837      141.5653 11.97536  151.7511 9.271417  -10.18579      15.14492  
1 1 1 8  22 11 o 157.2259 7.349368  16.66296       1.535480      19.43559       3.100608      15.76206       1.767422      167.3712 14.03153  152.5417 8.731646  14.82950       16.52650  
1 1 1 8  22 12 o 41.81627 4.489593  1.182944       0.2462515     3.974171       4.361688      1.174019       0.2466449     77.46461 29.87229  41.65267 4.515980  35.81194       30.21172  
1 1 1 8  22 13 o 70.88693 8.460174  3.446736       0.7833766     2.642634       2.040789      3.585695       0.8483689     61.28635 20.87465  72.18443 9.016036  -10.89808      22.73851  
1 1 1 8  22 14 o 144.9616 8.395959  14.29446       1.614858      13.48702       2.247005      15.15696       2.322368      139.1973 12.23882  147.7896 11.89305  -8.592239      17.06557  
1 1 1 8  22 15 o 77.71263 7.319871  4.120074       0.7490711     4.282958       0.7926934     2.761148       2.289627      79.17403 7.607117  62.04463 22.04988  17.12940       23.32521  
1 1 1 8  22 16 o 108.5555 3.773738  7.897843       0.5450497     7.985073       0.5488575     1.676562       4.635195      109.1531 3.779250  65.08163 28.38617  44.07147       28.63664  
1 1 1 8  22 17 o 133.1468 7.600198  12.11094       1.342832      12.65212       1.581045      10.70986       2.543920      135.5336 8.801954  120.0134 16.33070  15.52018       18.55171  
1 1 1 8  22 18 o 22.72216 10.69440  -0.8071662     0.8331521     -1.100990      0.9590128     0.9703907E-01  1.682343      23.45931 11.16774  39.13292 17.08422  -15.67361      20.41051  
1 1 1 8  22 19 o 42.70214 17.81940  0.7498351      1.687833      7.012869       5.176757      0.4866702E-02  1.785395      79.78663 31.99332  39.26584 17.35452  40.52079       36.39714  
1 1 1 8  22 20 o 93.65538 10.31236  6.247229       1.265684      6.698412       1.512852      5.194794       2.310560      95.88803 12.10975  77.25632 21.60505  18.63171       24.76740  
1 1 1 8  22 21 o 31.74858 13.89825  0.9320409E-02  1.120032      -1.013004      1.559070      1.099652       1.610091      31.72380 14.83445  43.80157 17.74361  -12.07777      23.12783  
1 1 1 8  22 22 o 32.60234 13.99004  0.2163900      1.089761      0.9665683      1.531306      -0.5534043     1.551197      41.88171 17.17613  33.33744 15.30954  8.544273       23.00872  
1 1 1 8  22 23 o 33.09743 14.13672  0.2950684      1.103327      0.2706692      1.841528      0.3087314      1.378045      39.53022 17.54040  35.91555 15.57311  3.614674       23.45607  
1 1 1 8  23 0  o 142.6624 15.38887  14.23797       2.839422      14.23797       2.839422      14.23797       2.839422      142.6624 15.38887  142.6624 15.38887  0.000000       0.000000  
1 1 1 8  23 1  o 132.2081 3.392666  11.67197       0.5971915     10.83624       2.244577      11.73564       0.6195212     125.2174 13.67429  132.5578 3.510425  -7.340424      14.11769  
1 1 1 8  23 2  o 134.3583 5.809527  12.10740       1.037651      8.937196       3.724548      12.37417       1.080427      108.7407 26.04737  135.8058 5.985104  -27.06512      26.72615  
1 1 1 8  23 3  o 153.9666 6.953476  15.93658       1.422917      17.39101       2.840205      15.44920       1.644131      158.9343 13.53971  151.3279 8.183949  7.606354       15.82090  
1 1 1 8  23 4  o 138.3341 12.34669  13.13556       2.252003      11.77510       2.834692      15.46338       3.707993      129.2825 16.85579  147.2358 19.36884  -17.95332      25.67625  
1 1 1 8  23 5  o 108.3624 16.79172  8.330334       2.346256      9.319099       2.666995      4.945228       4.934711      114.1952 18.13206  85.23383 32.03183  28.96135       36.80774  
1 1 1 8  23 6  o 34.33810 13.20372  0.5568008      0.8504116     0.4081737      0.8880130     2.201159       2.953715      33.29549 13.28451  63.32903 24.53901  -30.03354      27.90415  
1 1 1 8  23 7  o 47.08300 14.40844  1.540537       0.9883794     1.623302       1.118512      1.245642       2.111300      48.57507 15.40112  51.98354 20.56676  -3.408474      25.69409  
1 1 1 8  23 8  o 160.3986 9.597856  17.49441       2.042008      22.51925       3.024866      13.28708       2.767886      180.7737 12.63692  137.4852 15.37115  43.28848       19.89884  
1 1 1 8  23 9  o 119.5943 10.74767  9.823982       1.694520      8.300244       2.336072      11.51599       2.461685      107.5059 16.86134  127.9808 14.70159  -20.47483      22.37055  
1 1 1 8  23 10 o 50.71055 15.50060  1.822502       1.144323      2.141093       1.349392      1.006699       2.159305      54.73628 16.85118  50.34879 20.49197  4.387486       26.53080  
1 1 1 8  23 11 o 100.2515 12.50808  7.044368       1.634668      9.422434       2.027513      2.627413       2.763205      115.7559 13.39127  63.51804 23.94809  52.23782       27.43788  
1 1 1 8  23 12 o 128.1846 8.850841  11.22949       1.502517      12.62545       3.799596      10.97073       1.635853      127.4162 23.23475  126.3385 9.793487  1.077744       25.21440  
1 1 1 8  23 13 f 81.10542 1.792584  4.386997       0.1937327     4.035681       2.057815      4.390139       0.1945970     72.13232 20.46572  81.13412 1.799944  -9.001801      20.54472  
1 1 1 8  23 14 o ?        ?         -4.322421      0.9854667     -4.938027      1.052821      0.3225976E-01  2.800150      ?        ?         49.00637 21.69314  0.000000       21.69314  
1 1 1 8  23 15 o 64.82430 9.844479  2.963089       0.8236621     3.036027       0.8387615     0.9917875      4.360504      65.61211 9.901518  60.27192 26.85261  5.340195       28.61997  
1 1 1 8  23 16 o 104.1257 3.692375  7.276166       0.5115044     7.593426       0.5238301     0.7715133      2.371889      106.3725 3.701262  48.23950 20.66866  58.13298       20.99745  
1 1 1 8  23 17 o 57.55554 10.53936  2.388926       0.7785262     2.644063       0.8295337     0.5036128      2.254964      60.56876 10.66759  45.62113 19.84999  14.94764       22.53486  
1 1 1 8  23 18 o 60.99452 22.21482  3.104350       2.340582      3.839873       2.591218      -0.1554804     5.455109      66.03814 23.45840  57.92789 27.29540  8.110245       35.99076  
1 1 1 8  23 19 f 73.76186 23.63803  5.043241       2.629225      6.571596       3.515329      3.102779       3.961013      79.88441 27.39228  62.09214 26.65871  17.79227       38.22334  
1 1 1 8  23 20 o 29.31084 13.59939  -0.7409400     1.270270      -1.582654      1.569825      0.8554793      2.161934      29.57178 14.13566  45.39222 19.59381  -15.82044      24.16060  
1 1 1 8  23 21 o 76.56037 16.88936  4.812485       1.676708      4.251183       1.893858      6.847715       3.606249      69.39201 19.61493  77.32540 27.65184  -7.933395      33.90236  
1 1 1 8  23 22 o 32.31142 14.82515  -0.4718472     1.450178      -1.716471      2.098269      0.6663193      2.006527      33.98407 16.27115  42.52082 18.60840  -8.536747      24.71888  
1 1 1 8  24 0  o 92.76585 22.96224  6.902711       2.456739      6.902711       2.456739      6.902711       2.456739      92.76585 22.96224  92.76585 22.96224  -0.000000      0.000000  
1 1 1 8  24 1  o 41.64351 16.17251  0.8290141      1.285149      -0.3935969     2.405471      1.317389       1.520311      45.53774 20.13446  47.85397 17.82090  -2.316227      26.88831  
1 1 1 8  24 2  o 98.76161 1.950123  6.503449       0.2566396     5.503296       2.434827      6.514686       0.2580772     85.53961 21.41290  98.84655 1.959361  -13.30694      21.50236  
1 1 1 8  24 3  o 110.9872 4.265423  8.249086       0.6296504     4.602194       2.792049      8.444495       0.6462993     77.97031 24.27926  112.2877 4.327548  -34.31734      24.66191  
1 1 1 8  24 4  o 36.38689 17.25427  -2.382297      2.245229      -5.037724      3.642345      -0.7549232     2.851396      42.86279 20.75063  47.91883 21.50481  -5.056049      29.88386  
1 1 1 8  24 5  o 85.09953 20.97775  5.470728       2.363413      3.476804       3.567656      7.030068       3.154998      71.91344 27.18985  94.89737 24.71066  -22.98392      36.74105  
1 1 1 8  24 6  o 62.88267 26.67557  1.313356       3.881999      2.596488       7.605823      0.8613379      4.514277      81.59237 35.95071  64.55842 28.08774  17.03395       45.62208  
1 1 1 8  24 7  o 140.6279 7.299859  13.38059       1.363233      13.48577       1.544555      13.00984       2.899795      140.8797 8.264048  134.5597 16.51872  6.320038       18.47058  
1 1 1 8  24 8  o 92.21365 12.98199  6.011590       1.551084      7.669023       1.963749      3.262407       2.529123      103.6031 14.63140  66.73528 23.21806  36.86783       27.44370  
1 1 1 8  24 9  o 99.75198 15.01628  7.171496       1.934148      5.402214       2.854373      8.673536       2.629983      82.09133 24.34720  107.6137 19.03688  -25.52239      30.90613  
1 1 1 8  24 10 o 85.11479 13.86647  5.216625       1.518604      4.474123       1.744380      7.540933       3.086306      77.15636 17.38478  96.48528 24.08245  -19.32892      29.70176  
1 1 1 8  24 11 o 61.52029 18.34743  2.878489       1.617383      2.082925       1.725956      8.611702       4.633308      54.31522 19.15925  96.12117 31.42658  -41.80595      36.80634  
1 1 1 8  24 12 o 78.77738 6.778392  4.234803       0.7046318     4.110370       0.7301280     5.923707       2.689883      77.49995 7.150659  84.55097 23.18474  -7.051018      24.26240  
1 1 1 8  24 13 o 57.54301 17.82645  2.545324       1.507319      1.950453       4.465784      2.621807       1.601288      63.25458 27.71950  58.28243 18.42111  4.972153       33.28225  
1 1 1 8  24 14 o 52.43888 1.371838  1.834929       0.9577599E-01 -2.635687      3.678894      1.837961       0.9580846E-01 45.62118 21.76121  52.48225 1.371166  -6.861073      21.80437  
1 1 1 8  24 15 o 41.02139 8.290278  1.197470       0.4375541     1.410268       0.9552817     1.140972       0.4922238     43.93976 14.26318  39.75898 9.433683  4.180775       17.10066  
1 1 1 8  24 16 o 41.66899 9.240909  1.252534       0.4996483     0.1682370      0.6285982     3.113130       0.8234268     26.17068 10.89412  66.16085 9.621864  -39.99017      14.53486  
1 1 1 8  24 17 o 58.07798 6.173179  2.320485       0.4704323     2.332887       0.4750483     1.691620       3.382786      58.22094 6.219512  55.39698 24.20428  2.823956       24.99059  
1 1 1 8  24 18 o 37.74379 17.50019  -0.8092912     2.098102      -1.156692      3.760459      -0.6522660     2.528191      47.45629 22.45199  41.65773 19.27841  5.798557       29.59306  
1 1 1 8  24 19 o 63.50411 11.73378  3.010048       0.9563509     3.133788       1.034303      2.280725       2.511037      64.37759 12.50783  53.87262 22.03292  10.50497       25.33566  
1 1 1 8  24 20 o 13.16777 6.493425  -0.8515756     0.4084006     -1.722595      2.200228      -0.8204948     0.4156233     34.97463 16.72282  13.50910 6.639987  21.46553       17.99283  
1 1 1 8  25 0  o 77.14774 36.51437  6.731428       4.253512      6.731428       4.253512      6.731428       4.253512      77.14774 36.51437  77.14774 36.51437  0.000000       0.000000  
1 1 1 8  25 1  o 64.20869 20.23592  3.085359       1.933628      2.425971       4.280944      3.254366       2.167311      68.08771 28.39330  65.86896 21.49107  2.218750       35.60962  
1 1 1 8  25 2  o 105.3909 14.75702  7.965253       2.015687      9.868485       2.991382      6.382400       2.728012      114.1274 20.41992  90.03931 22.73635  24.08813       30.56002  
1 1 1 8  25 3  o 64.58108 1.588884  2.780765       0.1367323     0.9900684      2.525136      2.786031       0.1369332     52.21479 21.79285  64.64217 1.589715  -12.42739      21.85075  
1 1 1 8  25 4  o 52.81242 21.55540  1.276848       2.397363      0.8601522E-01  4.454635      1.762372       2.844406      60.13993 26.94267  58.09582 23.56561  2.044113       35.79449  
1 1 1 8  25 5  o 40.11850 18.50759  -1.266908      2.303403      0.9978994E-02  3.066747      -2.919577      3.488949      51.32538 22.71185  45.37358 21.51362  5.951797       31.28361  
1 1 1 8  25 6  o 72.00358 22.61724  4.107609       2.417430      3.168245       3.303937      5.189941       3.546458      66.97045 25.95223  78.91402 27.49165  -11.94357      37.80620  
1 1 1 8  25 7  f 21.05019 10.12001  -1.164236      0.8305857     -1.755777      0.8732824     4.445261       2.689207      19.48439 9.586409  73.98244 23.92441  -54.49805      25.77356  
1 1 1 8  25 8  o 66.52679 16.09094  3.338010       1.410705      3.856095       1.727377      2.300483       2.444479      70.64470 18.22848  58.31918 22.39594  12.32552       28.87656  
1 1 1 8  25 9  o 177.7042 7.708768  21.56317       1.821050      22.15009       2.462439      20.85472       2.705377      178.3512 10.40655  171.9216 11.88239  6.429565       15.79517  
1 1 1 8  25 10 o 53.01209 18.88752  2.037921       1.680966      1.003670       1.960970      4.903724       3.264232      46.95424 19.36561  74.70035 26.34853  -27.74611      32.69972  
1 1 1 8  25 11 o 125.0242 8.881639  10.83279       1.470023      10.61844       1.716738      11.42193       2.846136      122.7850 10.59623  121.4875 18.13581  1.297440       21.00447  
1 1 1 8  25 12 o 154.6021 8.553584  16.53119       1.755258      17.09901       2.051935      14.98234       3.388912      156.2763 9.904605  137.8761 18.94628  18.40022       21.37902  
1 1 1 8  25 13 o 53.36596 19.57030  2.138488       1.821154      3.219926       2.438825      0.7753789      2.738073      62.22147 22.67405  49.70243 21.74471  12.51904       31.41568  
1 1 1 8  25 14 o 57.09801 17.25617  2.596494       1.423675      2.756436       2.698784      2.534824       1.675819      59.07615 23.29019  56.23978 18.91768  2.836372       30.00519  
1 1 1 8  25 15 o 32.28170 13.43795  0.3354209      0.9564301     -0.7188520     1.040516      6.078823       2.428605      26.37973 12.26295  83.27626 21.67802  -56.89653      24.90615  
1 1 1 8  25 16 o 42.18645 7.939354  1.268679       0.4299311     0.6152940      0.7397460     1.601950       0.5283203     32.49105 12.35871  47.26137 8.709970  -14.77032      15.11956  
1 1 1 8  25 17 f 45.80211 20.36810  0.6168562      2.496896      -0.5457797     3.192432      2.448596       4.007113      45.52872 21.26941  57.70799 25.72391  -12.17927      33.37825  
1 1 1 8  25 18 f ?        ?         -1.420222      0.3687385     -2.446735      2.289408      -1.392884      0.3736163     33.84063 16.39915  ?        ?         0.000000       16.39915  
1 1 1 8  26 0  o 139.4913 18.16510  14.34855       3.218390      14.34855       3.218390      14.34855       3.218390      139.4913 18.16510  139.4913 18.16510  -0.000000      0.000000  
1 1 1 8  26 1  f 34.57397 15.59043  -0.4867721     1.519012      -0.1584772     1.976301      -0.9606978     2.374521      41.03526 18.19156  41.31802 18.96232  -0.2827606     26.27741  
1 1 1 8  26 2  f 79.57626 19.51871  4.999620       2.053734      7.445000       3.253506      3.379800       2.647963      92.76977 25.52216  65.53458 23.66245  27.23519       34.80362  
1 1 1 8  26 3  o 127.6012 15.01440  11.92752       2.504111      11.63720       5.265513      12.01237       2.846619      106.8422 33.35342  126.1982 17.38968  -19.35591      37.61451  
1 1 1 8  26 4  o 78.57729 18.83231  4.856118       1.946119      4.239632       3.120050      5.248709       2.489830      70.97935 25.67759  79.40165 22.50617  -8.422295      34.14478  
1 1 1 8  26 5  f 53.70030 22.07225  1.583822       2.535991      2.465873       4.449096      1.159322       3.086485      64.82971 28.04643  54.46740 23.46058  10.36232       36.56503  
1 1 1 8  26 6  o 46.46480 19.14763  0.9993160      1.914930      2.448921       3.267109      0.2407028      2.363464      60.79679 25.02758  45.71329 20.09486  15.08350       32.09647  
1 1 1 8  26 7  o 38.91052 17.19446  -0.6088350E-01 1.751876      -0.5859213     2.046335      1.379881       3.389830      39.28217 17.86530  56.25578 24.40861  -16.97360      30.24813  
1 1 1 8  26 8  o 26.49915 12.50482  -1.091681      1.152660      -1.356998      1.364602      -0.4309551     2.153449      28.36523 13.45077  40.76819 18.45605  -12.40296      22.83745  
1 1 1 8  26 9  o 32.46023 15.32841  -1.464022      1.737484      -3.803397      2.300029      1.645335       2.651665      31.83603 15.64246  53.60408 22.34932  -21.76804      27.27964  
1 1 1 8  26 10 f 61.26054 18.88845  3.043460       1.694613      2.069624       2.676312      3.695201       2.189433      55.63726 22.74959  65.95898 21.60544  -10.32171      31.37418  
1 1 1 8  26 11 o 50.75976 18.37334  1.924519       1.597748      0.2429410      1.971102      5.146209       2.728302      41.83953 18.37296  74.99322 24.08391  -33.15368      30.29191  
1 1 1 8  26 12 o 41.44211 15.64553  1.114256       1.180258      0.9289389      1.245562      2.743817       3.693540      40.22187 15.83301  60.53173 25.86024  -20.30986      30.32221  
1 1 1 8  26 13 o 46.02302 19.68660  0.9330941      2.145384      2.895534       3.281885      -0.5312906     2.834998      59.65453 24.86722  44.29691 20.46976  15.35761       32.20853  
1 1 1 8  26 14 o 38.96827 17.74396  -0.3127129     2.026296      1.645288       3.484056      -1.313527      2.490895      54.29990 24.10843  39.07671 18.42250  15.22319       30.34147  
1 1 1 8  26 15 o 19.94355 9.342358  -0.5426812     0.6229323     -0.6067759     0.6644441     -0.7728238E-01 1.790441      20.38254 9.579859  37.80587 16.99742  -17.42333      19.51117  
1 1 1 8  26 16 o 34.85751 13.34663  0.7424087      0.8664097     0.1493340      0.9229279     5.144667       2.514495      29.95389 12.86447  72.64941 23.09867  -42.69551      26.43942  
1 1 1 8  27 0  o 39.40234 23.79420  1.456874       2.285352      1.456874       2.285352      1.456874       2.285352      39.40234 23.79420  39.40234 23.79420  0.000000       0.000000  
1 1 1 8  27 1  o 46.12522 18.08426  1.288759       1.619346      1.757196       1.956343      0.2693569      2.885972      51.25603 19.94021  48.82295 21.79252  2.433075       29.53856  
1 1 1 8  27 2  o 65.06583 23.41232  3.575670       2.589606      5.150097       4.120562      2.547906       3.329216      73.46574 28.83445  60.44421 25.10876  13.02153       38.23448  
1 1 1 8  27 3  o 54.20851 1.791098  1.963070       0.1292003     8.660110       5.178647      1.958899       0.1292406     87.33733 32.81577  54.15063 1.793583  33.18670       32.86475  
1 1 1 8  27 4  o 94.50665 19.40829  7.218737       2.362246      2.815736       4.634839      8.763850       2.745620      64.33665 28.21519  103.1801 20.69044  -38.84341      34.98845  
1 1 1 8  27 5  o 59.88442 20.50662  2.920090       1.969978      2.049018       2.814519      3.756694       2.758271      56.03603 23.16457  65.81888 24.09325  -9.782848      33.42278  
1 1 1 8  27 6  o 46.10291 19.43784  0.9276375      2.040472      0.5808985      3.367139      1.128869       2.565121      52.03062 23.35796  50.20302 21.50169  1.827602       31.74771  
1 1 1 8  27 7  f 77.10773 23.50157  5.373727       2.633029      4.333261       3.539731      6.662558       3.939617      68.28503 26.74764  79.93778 28.86238  -11.65276      39.35065  
1 1 1 8  27 8  o 61.90892 15.05022  2.974711       1.229327      2.736611       1.445947      3.595621       2.335000      58.35828 17.33400  64.19920 22.31079  -5.840916      28.25313  
1 1 1 8  27 9  o 55.27800 20.24935  2.455417       1.948896      3.075045       2.782284      1.858529       2.730749      60.29835 23.68555  53.67439 22.54990  6.623962       32.70326  
1 1 1 8  27 10 o 48.21330 14.43412  1.794695       0.9995503     1.660377       1.128259      2.284705       2.154980      46.62742 15.51975  54.04267 20.95481  -7.415253      26.07617  
1 1 1 8  27 11 o 60.70908 14.84811  2.899358       1.191042      2.943182       1.890599      2.870520       1.533642      58.53609 20.08784  58.71370 17.94426  -0.1776047     26.93544  
1 1 1 8  27 12 o 76.29051 19.48978  5.028709       1.988260      7.321670       2.710105      2.355999       2.925929      88.84636 22.78437  55.35508 23.30402  33.49128       32.59148  
1 1 1 8  27 13 o 37.23468 17.21748  -0.6379858     2.010488      -5.960227      3.909451      1.275669       2.344230      38.70187 19.25908  47.93632 20.54347  -9.234451      28.15930  
1 1 1 8  28 0  o 123.0896 17.85128  11.54069       2.748728      11.54069       2.748728      11.54069       2.748728      123.0896 17.85128  123.0896 17.85128  -0.000000      0.000000  
1 1 1 8  28 1  o 72.31009 18.27125  4.301634       1.760929      3.060169       2.083157      7.409492       3.295987      60.02925 21.05898  86.62997 26.27207  -26.60072      33.67050  
1 1 1 8  28 2  o 78.41351 21.98188  5.473836       2.388787      4.688770       2.924167      7.048776       4.141721      70.05262 24.91632  79.57371 29.45525  -9.521088      38.58024  
1 1 1 8  28 3  o 60.65675 2.956167  2.469894       0.2382165     0.9769293      5.760155      2.472452       0.2384204     59.55938 28.05923  60.68808 2.957168  -1.128700      28.21463  
1 1 1 8  28 4  o 51.01975 20.46931  1.817303       2.120274      4.992338       5.625199      1.291521       2.289109      68.70553 30.56134  48.69480 20.56237  20.01073       36.83485  
1 1 1 8  28 5  o 43.42612 18.92103  0.5610199      2.054821      1.826545       3.949135      0.9120212E-01  2.406197      56.76757 25.40464  43.66555 19.66204  13.10202       32.12463  
1 1 1 8  28 6  o 55.16747 20.82826  2.490901       2.091775      5.585780       3.080483      -0.1571409     2.849440      74.35776 25.63677  45.36250 20.80132  28.99526       33.01423  
1 1 1 8  28 7  o 63.25392 22.48845  3.664091       2.381825      2.087879       3.790074      4.692904       3.062023      56.68377 25.15709  68.44791 25.32846  -11.76414      35.69888  
1 1 1 8  28 8  o 78.03962 14.79243  4.741211       1.481971      5.318459       1.612733      1.608328       3.757105      82.39850 15.24975  54.71507 24.60915  27.68343       28.95108  
1 1 1 8  28 9  o 48.04596 17.41479  1.783613       1.436022      1.237126       1.871084      2.566869       2.240036      45.63867 18.87881  55.31907 21.38755  -9.680397      28.52782  
1 1 1 9  0  1  o 549.9605 14.34250  202.2163       10.49450      202.2163       10.49450      202.2163       10.49450      549.9605 14.34250  549.9605 14.34250  0.000000       0.000000  
1 1 1 9  0  2  f 734.0813 27.92538  362.5798       27.22608      362.5798       27.22608      362.5798       27.22608      734.0813 27.92538  734.0813 27.92538  0.000000       0.000000  
1 1 1 9  0  3  o 816.0228 19.50651  445.6615       21.18335      445.6615       21.18335      445.6615       21.18335      816.0228 19.50651  816.0228 19.50651  -0.000000      0.000000  
1 1 1 9  0  4  o 322.9641 14.97009  70.06084       6.410832      70.06084       6.410832      70.06084       6.410832      322.9641 14.97009  322.9641 14.97009  0.000000       0.000000  
1 1 1 9  0  5  o 64.36120 28.69823  4.004423       2.610243      4.004423       2.610243      4.004423       2.610243      64.36120 28.69823  64.36120 28.69823  0.000000       0.000000  
1 1 1 9  0  6  o 601.8142 29.15315  244.7858       23.25315      244.7858       23.25315      244.7858       23.25315      601.8142 29.15315  601.8142 29.15315  -0.000000      0.000000  
1 1 1 9  0  7  o 233.1702 4.924678  36.28035       1.528576      36.28035       1.528576      36.28035       1.528576      233.1702 4.924678  233.1702 4.924678  -0.000000      0.000000  
1 1 1 9  0  8  o 490.9813 23.30397  162.6289       15.16785      162.6289       15.16785      162.6289       15.16785      490.9813 23.30397  490.9813 23.30397  0.000000       0.000000  
1 1 1 9  0  9  o 181.2659 5.095817  21.95002       1.228645      21.95002       1.228645      21.95002       1.228645      181.2659 5.095817  181.2659 5.095817  0.000000       0.000000  
1 1 1 9  0  10 o 321.1407 6.675388  68.84023       2.853788      68.84023       2.853788      68.84023       2.853788      321.1407 6.675388  321.1407 6.675388  0.000000       0.000000  
1 1 1 9  0  11 o 221.5666 13.51388  33.15115       3.955507      33.15115       3.955507      33.15115       3.955507      221.5666 13.51388  221.5666 13.51388  0.000000       0.000000  
1 1 1 9  0  12 o 591.4763 17.65085  234.7272       13.88352      234.7272       13.88352      234.7272       13.88352      591.4763 17.65085  591.4763 17.65085  0.000000       0.000000  
1 1 1 9  0  13 o 152.3099 4.936137  15.51007       0.9994324     15.51007       0.9994324     15.51007       0.9994324     152.3099 4.936137  152.3099 4.936137  0.000000       0.000000  
1 1 1 9  0  14 o 359.3672 8.933321  86.29926       4.271871      86.29926       4.271871      86.29926       4.271871      359.3672 8.933321  359.3672 8.933321  0.000000       0.000000  
1 1 1 9  0  15 f 964.7734 19.37108  624.0081       24.88041      624.0081       24.88041      624.0081       24.88041      964.7734 19.37108  964.7734 19.37108  -0.000000      0.000000  
1 1 1 9  0  16 o 149.7772 17.48179  15.60206       3.364978      15.60206       3.364978      15.60206       3.364978      149.7772 17.48179  149.7772 17.48179  0.000000       0.000000  
1 1 1 9  0  17 o 423.3391 11.72335  119.8857       6.601765      119.8857       6.601765      119.8857       6.601765      423.3391 11.72335  423.3391 11.72335  -0.000000      0.000000  
1 1 1 9  0  18 o 81.26772 28.30877  5.787333       2.770120      5.787333       2.770120      5.787333       2.770120      81.26772 28.30877  81.26772 28.30877  0.000000       0.000000  
1 1 1 9  0  19 o 457.5415 12.65310  140.1043       7.701039      140.1043       7.701039      140.1043       7.701039      457.5415 12.65310  457.5415 12.65310  -0.000000      0.000000  
1 1 1 9  0  20 o 201.2481 20.78473  28.01113       5.425688      28.01113       5.425688      28.01113       5.425688      201.2481 20.78473  201.2481 20.78473  0.000000       0.000000  
1 1 1 9  0  21 o 291.0600 12.71464  56.93742       4.909814      56.93742       4.909814      56.93742       4.909814      291.0600 12.71464  291.0600 12.71464  0.000000       0.000000  
1 1 1 9  0  22 o 291.6604 13.23227  57.25876       5.118456      57.25876       5.118456      57.25876       5.118456      291.6604 13.23227  291.6604 13.23227  0.000000       0.000000  
1 1 1 9  0  23 o 59.82339 29.17318  3.592793       2.739119      3.592793       2.739119      3.592793       2.739119      59.82339 29.17318  59.82339 29.17318  0.000000       0.000000  
1 1 1 9  0  24 o 208.2927 16.01917  29.68845       4.384127      29.68845       4.384127      29.68845       4.384127      208.2927 16.01917  208.2927 16.01917  -0.000000      0.000000  
1 1 1 9  0  25 o 92.70110 22.95163  6.779840       2.453858      6.779840       2.453858      6.779840       2.453858      92.70110 22.95163  92.70110 22.95163  0.000000       0.000000  
1 1 1 9  0  26 o 94.45103 31.37713  7.880075       3.513848      7.880075       3.513848      7.880075       3.513848      94.45103 31.37713  94.45103 31.37713  0.000000       0.000000  
1 1 1 9  0  27 o 108.4283 21.96533  8.922476       2.810242      8.922476       2.810242      8.922476       2.810242      108.4283 21.96533  108.4283 21.96533  -0.000000      0.000000  
1 1 1 9  0  28 o 139.1033 10.17043  13.19921       1.861515      13.19921       1.861515      13.19921       1.861515      139.1033 10.17043  139.1033 10.17043  0.000000       0.000000  
1 1 1 9  0  29 o 119.6242 10.85907  9.875251       1.696488      9.875251       1.696488      9.875251       1.696488      119.6242 10.85907  119.6242 10.85907  -0.000000      0.000000  
1 1 1 9  0  30 o 91.76354 11.93695  5.983938       1.391475      5.983938       1.391475      5.983938       1.391475      91.76354 11.93695  91.76354 11.93695  -0.000000      0.000000  
1 1 1 9  0  31 o 116.2874 16.09530  9.877067       2.357929      9.877067       2.357929      9.877067       2.357929      116.2874 16.09530  116.2874 16.09530  -0.000000      0.000000  
1 1 1 9  0  32 o 103.2963 31.99531  10.17652       3.855808      10.17652       3.855808      10.17652       3.855808      103.2963 31.99531  103.2963 31.99531  -0.000000      0.000000  
1 1 1 9  0  33 o 44.85681 17.40978  1.942900       0.9899482     1.942900       0.9899482     1.942900       0.9899482     44.85681 17.40978  44.85681 17.40978  -0.000000      0.000000  
1 1 1 9  0  34 o 24.64346 13.99790  0.5923516      0.7132853     0.5923516      0.7132853     0.5923516      0.7132853     24.64346 13.99790  24.64346 13.99790  0.000000       0.000000  
1 1 1 9  0  35 o 42.03500 19.84808  1.975479       1.256104      1.975479       1.256104      1.975479       1.256104      42.03500 19.84808  42.03500 19.84808  -0.000000      0.000000  
1 1 1 9  0  36 o 45.02115 30.16986  2.706885       5.052625      2.706885       5.052625      2.706885       5.052625      45.02115 30.16986  45.02115 30.16986  0.000000       0.000000  
1 1 1 9  1  0  o 494.5430 15.03098  163.6590       9.884508      163.6590       9.884508      163.6590       9.884508      494.5430 15.03098  494.5430 15.03098  0.000000       0.000000  
1 1 1 9  1  1  o 144.1639 2.630301  13.84840       0.5052841     13.75104       0.5189943     15.61835       2.212925      143.6559 2.711226  152.5864 10.95666  -8.930557      11.28712  
1 1 1 9  1  2  o 409.1145 10.42121  111.7621       5.676528      111.6677       6.639225      112.0189       10.94523      408.7739 12.20245  408.3485 20.17751  0.4253845      23.58033  
1 1 1 9  1  3  o 415.6891 3.229067  115.1459       1.788625      116.3356       1.884423      104.3293       5.682061      417.8279 3.384601  395.2236 10.79933  22.60425       11.31729  
1 1 1 9  1  4  o 409.5680 12.61497  112.1455       6.876504      117.0811       9.323380      106.2576       10.18308      417.9510 16.77481  397.7441 19.27064  20.20688       25.54901  
1 1 1 9  1  5  o 73.51553 7.656608  3.643270       0.7390699     1.739383       1.685259      4.096629       0.8223703     54.15383 18.94547  77.96091 8.030972  -23.80708      20.57735  
1 1 1 9  1  6  o 456.5557 18.06057  139.8967       10.96581      121.7529       20.11483      147.5693       13.08052      421.1651 36.19248  468.3317 21.01385  -47.16653      41.85066  
1 1 1 9  1  7  o 241.6814 0.9544116 38.91685       0.3073636     40.69333       3.705926      38.90455       0.3084262     246.5726 11.30932  241.6432 0.9578626 4.929367       11.34981  
1 1 1 9  1  8  o 147.1474 1.086635  14.42647       0.2130639     14.43970       0.2200187     14.22720       0.8541653     147.2147 1.121592  146.0325 4.394538  1.182220       4.535409  
1 1 1 9  1  9  o 325.3712 5.935672  70.59325       2.573490      73.25134       3.059497      64.16293       4.758627      331.3903 6.928461  309.6259 11.55403  21.76437       13.47216  
1 1 1 9  1  10 o 360.2106 5.668473  86.51940       2.720796      89.57890       3.091496      76.00772       5.730328      366.4868 6.330483  336.8147 12.79101  29.67218       14.27183  
1 1 1 9  1  11 o 222.2919 4.875552  32.94364       1.444179      33.65212       1.560640      28.72113       3.809990      224.6591 5.213210  206.6201 13.91936  18.03896       14.86359  
1 1 1 9  1  12 o 50.29345 17.03812  1.576082       1.359379      0.9536849      1.816014      2.369281       2.050107      48.90261 19.15755  61.57843 20.92308  -12.67582      28.36876  
1 1 1 9  1  13 o 512.0866 8.311521  175.0580       5.671494      167.9692       7.842375      182.8302       8.211777      501.1225 11.74438  522.8135 11.78737  -21.69095      16.63949  
1 1 1 9  1  14 o 445.8482 6.825114  132.6122       4.054810      129.8563       6.225163      134.6432       5.343922      440.7862 10.59862  449.0410 8.931009  -8.254883      13.85978  
1 1 1 9  1  15 o 597.6981 10.14642  238.6715       8.081057      222.7877       12.40313      250.3876       10.65232      576.0281 16.17499  611.6393 13.06999  -35.61121      20.79555  
1 1 1 9  1  16 o 560.3469 9.442190  209.6801       7.050230      205.5377       10.47439      213.1114       9.533021      553.8013 14.20561  564.3928 12.67581  -10.59155      19.03879  
1 1 1 9  1  17 o 246.5798 8.666256  40.63637       2.843066      42.82958       3.334275      34.79405       5.441947      253.0359 9.907997  226.8741 18.15228  26.16182       20.68028  
1 1 1 9  1  18 o 296.4565 9.292277  58.74234       3.666232      60.28085       5.701662      57.65782       4.787098      299.6679 14.32011  293.3551 12.27342  6.312836       18.86007  
1 1 1 9  1  19 o 123.7458 10.70418  10.31055       1.747712      10.57821       2.378332      9.996335       2.576865      124.8054 14.57506  120.9615 16.40996  3.843880       21.94810  
1 1 1 9  1  20 o 245.1013 13.03499  40.35360       4.241947      40.71959       6.495895      40.08149       5.601106      244.8598 20.08532  243.5041 17.37631  1.355682       26.55854  
1 1 1 9  1  21 o 299.9609 10.24096  60.25878       4.087348      62.73690       5.549229      57.31997       6.043060      305.4650 13.66781  291.5433 15.61230  13.92163       20.74977  
1 1 1 9  1  22 o 288.1724 10.57459  55.69810       4.053706      53.22341       6.310151      57.43701       5.289551      280.2180 16.97903  292.0069 13.63178  -11.78891      21.77413  
1 1 1 9  1  23 o 324.2977 12.69243  70.86693       5.474227      72.86968       7.841758      68.96320       7.645428      326.9870 18.06762  318.0575 18.11432  8.929535       25.58452  
1 1 1 9  1  24 o 261.0697 12.31098  46.03189       4.270684      44.73516       6.625165      46.95379       5.586194      254.7097 19.67225  262.4495 16.05013  -7.739807      25.38906  
1 1 1 9  1  25 o 182.2044 11.78007  22.49328       2.844765      23.89711       3.404901      19.24796       5.176969      187.2762 13.73984  164.0019 24.43412  23.27431       28.03230  
1 1 1 9  1  26 o 119.5100 13.99990  9.846589       2.187266      11.79525       4.799529      9.335796       2.457269      125.0022 29.32360  115.6089 16.41162  9.393288       33.60379  
1 1 1 9  1  27 o 82.50942 11.25182  4.690741       1.204886      4.129423       1.433293      6.043085       2.224713      76.49061 14.59454  91.63278 18.84947  -15.14217      23.83911  
1 1 1 9  1  28 o 141.5260 9.116193  13.57289       1.710043      11.85039       2.183413      16.30588       2.750268      131.1644 12.64913  153.6865 13.56891  -22.52211      18.55036  
1 1 1 9  1  29 o 56.71703 11.09235  2.266917       0.8082747     4.298410       1.041593      -0.8080722     1.281482      78.90666 10.14043  30.47081 13.96411  48.43585       17.25759  
1 1 1 9  1  30 o 31.47455 9.231231  0.6874484      0.4122375     -0.5463386     1.213360      0.8484474      0.4383098     30.67997 13.87482  34.69317 9.294498  -4.013206      16.70025  
1 1 1 9  1  31 o 100.8748 5.983091  6.887811       0.8006201     7.273193       1.548809      6.747281       0.9352711     101.5238 11.66013  99.51913 7.099357  2.004662       13.65135  
1 1 1 9  1  32 o 101.6138 10.70269  7.312598       1.427432      2.333651       5.171468      7.723215       1.485127      65.00819 29.08357  104.3773 10.83531  -39.36915      31.03640  
1 1 1 9  1  33 o 44.45727 9.890980  1.442844       0.5708276     0.5525204      0.6660136     3.907016       1.108012      31.01914 11.74335  72.87268 11.81477  -41.85354      16.65818  
1 1 1 9  1  34 o 137.7879 8.384095  13.32440       1.532076      12.07847       1.788923      16.75295       2.967565      129.3580 10.46761  146.1763 15.46973  -16.81824      18.67842  
1 1 1 9  1  35 o 51.62717 13.63501  2.128248       0.9517754     3.741390       1.406190      0.7644450      1.292956      66.99116 15.97760  37.88899 15.68519  29.10217       22.38993  
1 1 1 9  1  36 o 36.12888 17.90705  -3.880558      3.250429      -5.763019      4.130341      -0.8181267     5.268126      37.88224 18.99273  48.12476 23.65140  -10.24252      30.33335  
1 1 1 9  2  0  o 467.8580 27.34556  148.1064       16.91356      148.1064       16.91356      148.1064       16.91356      467.8580 27.34556  467.8580 27.34556  -0.000000      0.000000  
1 1 1 9  2  1  o 510.7823 14.01460  174.4546       9.529707      165.2505       24.59619      176.0803       10.33712      491.5492 37.84261  513.0049 15.13839  -21.45569      40.75824  
1 1 1 9  2  2  o 66.49140 15.29868  3.074135       1.327280      3.029138       3.290991      3.082876       1.450477      73.25381 26.38871  66.58035 16.44675  6.673470       31.09437  
1 1 1 9  2  3  o 538.6885 3.384544  193.3728       2.429470      192.8315       2.481914      205.7773       11.88083      537.9318 3.462469  554.4136 16.09902  -16.48181      16.46716  
1 1 1 9  2  4  o 301.2029 10.24252  60.61675       4.104943      71.85684       6.398551      52.75478       5.351336      327.5122 14.69903  280.5618 14.36176  46.95044       20.55047  
1 1 1 9  2  5  o 274.8022 12.98373  50.56943       4.740928      0.000000       0.000000      50.56943       4.740928      ?        ?         274.8022 12.98373  0.000000       12.98373  
1 1 1 9  2  6  o 339.2121 6.991127  76.73200       3.160036      73.06568       8.598546      77.30450       3.397814      329.4118 19.67870  340.4526 7.489787  -11.04080      21.05584  
1 1 1 9  2  7  o 580.1240 23.67542  227.1341       18.26327      225.7128       22.13673      230.1637       32.31857      576.4982 28.90879  575.9714 42.40659  0.5267944      51.32287  
1 1 1 9  2  8  o 327.0384 5.365219  71.30534       2.338082      72.25206       2.522339      65.52642       6.231803      329.1864 5.750268  312.4618 15.01120  16.72458       16.07488  
1 1 1 9  2  9  o 382.1613 5.682987  97.38101       2.893989      98.11851       3.227588      94.35644       6.536283      383.5708 6.314793  375.3278 13.08916  8.243011       14.53282  
1 1 1 9  2  10 o 200.6913 4.864386  26.85154       1.300858      28.83029       1.587898      22.81324       2.268434      207.8504 5.738708  184.6059 9.251096  23.24443       10.88648  
1 1 1 9  2  11 o 59.27400 12.41424  2.438351       0.9490532     2.217111       1.029536      3.689733       2.448521      56.42547 13.80736  73.86721 22.69182  -17.44174      26.56242  
1 1 1 9  2  12 o 157.2251 4.541255  16.49311       0.9504208     16.38611       0.9766260     18.40702       4.130515      156.7068 4.682247  164.2716 19.23357  -7.564774      19.79529  
1 1 1 9  2  13 o 63.52913 6.052558  2.716105       0.5061877     0.8847713      0.9534563     3.434851       0.5973168     39.59922 14.21148  71.48157 6.336583  -31.88234      15.56015  
1 1 1 9  2  14 o 225.2593 6.814181  33.88166       2.043009      30.93546       3.308338      35.69776       2.597449      214.7686 11.60329  231.0895 8.449384  -16.32085      14.35369  
1 1 1 9  2  15 o 352.8109 6.478458  83.02513       3.045700      80.21719       5.541015      84.24079       3.645862      346.1170 12.03245  355.3031 7.700657  -9.186096      14.28565  
1 1 1 9  2  16 o 183.9272 6.666477  22.59431       1.631161      23.99021       3.027512      22.02337       1.936219      189.0202 12.08326  181.4843 8.026338  7.535904       14.50611  
1 1 1 9  2  17 o 364.7195 9.667654  88.89699       4.694295      85.13138       9.599089      90.08064       5.381738      355.0358 20.37568  366.9748 11.01805  -11.93900      23.16389  
1 1 1 9  2  18 o 324.9506 7.494453  70.45458       3.245121      63.50606       6.221368      73.05172       3.803538      307.4427 15.23361  330.6947 8.638913  -23.25208      17.51268  
1 1 1 9  2  19 o 230.9165 8.574576  35.64840       2.633821      34.76345       3.401505      36.97338       4.162129      227.7461 11.24323  234.6108 13.36889  -6.864670      17.46819  
1 1 1 9  2  20 o 249.2576 8.537522  41.53995       2.831472      48.53246       5.615630      39.15622       3.278762      268.3675 15.77299  241.8073 10.19866  26.56015       18.78297  
1 1 1 9  2  21 o 339.5167 9.508305  77.13289       4.297441      74.64841       6.239133      79.37560       5.927808      333.1405 14.08655  343.7903 12.96300  -10.64984      19.14341  
1 1 1 9  2  22 o 351.2982 7.758451  82.46667       3.631821      80.13372       4.322703      88.06599       6.696850      345.9315 9.386277  361.5856 13.92511  -15.65408      16.79317  
1 1 1 9  2  23 o 134.2090 15.99740  12.35524       2.804660      13.17542       2.947605      4.509046       9.116876      138.5833 16.27152  103.2910 42.08147  35.29221       45.11776  
1 1 1 9  2  24 o 268.1895 12.49067  48.60116       4.451500      44.09975       7.246525      51.32927       5.641403      251.8395 21.80870  274.6137 15.47937  -22.77420      26.74379  
1 1 1 9  2  25 o 90.27256 18.74979  5.801003       2.181602      7.794871       2.700535      2.055364       3.701389      104.5971 20.10592  68.32202 27.16710  36.27509       33.79792  
1 1 1 9  2  26 o 32.49341 14.88602  -0.9617268     1.454636      6.536578       4.662094      -1.770434      1.531070      94.64200 31.54911  30.13209 14.27658  64.50990       34.62899  
1 1 1 9  2  27 o 62.16449 15.36547  2.756488       1.265442      2.052241       1.528924      4.288194       2.254816      55.11824 18.05472  76.72713 21.30065  -21.60888      27.92294  
1 1 1 9  2  28 o 36.05724 15.96525  -0.3955573     1.517626      -0.9963175     1.637479      3.263471       4.041179      34.59361 15.82777  74.09902 28.70550  -39.50542      32.77993  
1 1 1 9  2  29 o 162.0311 6.766804  17.68594       1.457801      21.86578       2.700533      15.96701       1.731807      178.4565 11.41635  153.4494 8.502803  25.00706       14.23484  
1 1 1 9  2  30 o 152.0332 6.402137  15.59683       1.294088      16.49556       2.145104      15.08259       1.622613      154.7572 10.46369  148.8967 8.209949  5.860443       13.30008  
1 1 1 9  2  31 o 76.79874 8.832762  4.087312       0.8874685     5.886990       2.459490      3.817916       0.9515762     85.61899 21.57082  73.82243 9.924650  11.79655       23.74445  
1 1 1 9  2  32 o 52.62515 12.37880  2.049909       0.8534242     -0.4070307E-01 2.544606      2.314873       0.9058926     45.43526 20.35844  55.94689 12.47009  -10.51163      23.87403  
1 1 1 9  2  33 o 32.10409 13.26225  0.3728629      0.9216875     10.98973       6.060978      0.1215359      0.9325330     87.36818 34.75647  30.13096 12.93573  57.23722       37.08564  
1 1 1 9  2  34 o 54.90688 25.36857  1.493059       4.351749      -7.334260      7.659369      5.700882       5.288194      50.80262 25.52479  67.32138 29.80548  -16.51876      39.24133  
1 1 1 9  2  35 o 52.59644 12.59332  2.162295       0.8709099     2.291471       0.8823209     -2.735098      5.432736      54.25649 12.46621  47.60836 23.51564  6.648129       26.61563  
1 1 1 9  2  36 o 45.76159 22.03591  -0.3165642     3.975492      -9.409690      11.72101      0.8655025      4.225998      50.44250 25.89521  48.85566 23.30937  1.586842       34.84091  
1 1 1 9  3  0  o 622.7648 28.13459  261.5200       23.23857      261.5200       23.23857      261.5200       23.23857      622.7648 28.13459  622.7648 28.13459  0.000000       0.000000  
1 1 1 9  3  1  o 631.0724 18.86853  267.0209       15.84903      292.3556       25.39371      250.8545       20.28498      657.5657 29.05273  610.1933 25.00083  47.37238       38.32887  
1 1 1 9  3  2  o 730.2677 16.38914  356.8032       15.94820      329.0598       29.55443      368.2007       18.94293      696.5460 31.92683  741.0184 19.20042  -44.47241      37.25558  
1 1 1 9  3  3  o 364.8405 9.787089  88.88564       4.753765      84.37595       12.79869      89.60735       5.120039      352.7012 27.44831  366.2573 10.50176  -13.55615      29.38871  
1 1 1 9  3  4  o 665.1093 17.06017  296.3731       15.10745      298.2020       34.42085      295.9367       16.81345      659.3661 39.35519  664.1740 19.01730  -4.807922      43.70914  
1 1 1 9  3  5  o 332.4678 7.240419  73.71422       3.207649      98.83543       9.532164      70.50630       3.406302      383.5037 18.70945  325.1258 7.862457  58.37790       20.29438  
1 1 1 9  3  6  o 262.1064 9.720001  45.91875       3.388946      44.82533       4.023690      48.58775       6.286419      258.7753 11.69911  268.6652 17.65763  -9.889893      21.18163  
1 1 1 9  3  7  o 273.5081 7.820718  49.94678       2.847372      52.97830       4.017507      46.88707       4.036142      281.4348 10.73253  264.6599 11.47195  16.77484       15.70964  
1 1 1 9  3  8  o 229.9747 3.332545  35.24643       1.021244      34.79557       1.213565      36.34045       1.890424      228.4865 3.985923  233.3676 6.084374  -4.881104      7.273733  
1 1 1 9  3  9  o 440.2832 8.001767  129.3594       4.694524      129.4482       5.470541      129.1113       9.143893      440.3093 9.323927  438.5999 15.67067  1.709381       18.23474  
1 1 1 9  3  10 o 155.9929 4.511869  16.23502       0.9368680     15.75908       1.001721      19.55769       2.646779      153.6682 4.898286  170.6210 11.71262  -16.95279      12.69562  
1 1 1 9  3  11 o 423.9451 8.029189  119.9594       4.535810      116.0276       5.813357      126.0775       7.251713      416.5488 10.48172  433.8862 12.55591  -17.33737      16.35596  
1 1 1 9  3  12 o 457.1274 7.095268  139.4236       4.321949      140.1402       5.332657      138.0518       7.378074      458.1327 8.735320  454.0790 12.20484  4.053680       15.00879  
1 1 1 9  3  13 o 286.3009 6.699510  54.68068       2.555873      55.69170       3.424282      53.40892       3.840525      288.6597 8.913135  282.5342 10.21790  6.125519       13.55911  
1 1 1 9  3  14 o 60.76796 7.630401  2.502826       0.6042802     4.032807       1.691211      2.278910       0.6469898     76.01331 17.11077  57.78968 8.668933  18.22363       19.18147  
1 1 1 9  3  15 o 232.1372 6.393281  35.96886       1.975733      35.85160       3.662444      36.01700       2.346440      231.2350 11.92652  232.2056 7.593602  -0.9705353     14.13877  
1 1 1 9  3  16 o 492.6558 9.184284  162.0546       6.029239      156.4988       8.905111      166.7570       8.192639      483.2849 13.84237  499.3264 12.31305  -16.04156      18.52626  
1 1 1 9  3  17 f 188.1676 8.016372  23.67125       2.005396      34.88108       5.385608      21.86677       2.160783      227.1985 17.93452  180.7561 8.999381  46.44247       20.06579  
1 1 1 9  3  18 f 191.1332 7.257515  24.40833       1.845049      25.29739       3.905199      24.15285       2.093429      193.6781 15.25481  190.0473 8.286442  3.630783       17.36014  
1 1 1 9  3  19 o 596.6754 8.873699  237.7363       7.055314      232.2250       8.526162      249.7066       12.56556      589.3904 10.85618  609.9258 15.47327  -20.53540      18.90182  
1 1 1 9  3  20 o 492.0506 10.78931  161.9344       7.074194      147.4570       10.81495      172.7611       9.352489      467.7932 17.38012  507.4170 13.84506  -39.62378      22.22058  
1 1 1 9  3  21 o 464.4036 8.989074  144.1666       5.562679      151.8538       8.382964      138.1187       7.435598      475.5302 13.24247  453.7423 12.30933  21.78796       18.07990  
1 1 1 9  3  22 o 252.3767 8.202181  42.62790       2.754704      42.64016       3.403999      42.60464       4.689200      252.1127 10.15337  251.2206 14.06395  0.8921661      17.34606  
1 1 1 9  3  23 o 270.2157 14.26494  49.41883       5.118149      49.55296       5.900423      49.01122       10.28618      269.8811 16.48596  262.3221 29.96381  7.559021       34.19966  
1 1 1 9  3  24 o 183.4718 9.302515  22.63886       2.266854      21.89207       3.593322      23.13254       2.921568      179.0180 15.20729  184.9185 11.92015  -5.900513      19.32231  
1 1 1 9  3  25 o 54.06214 19.51728  1.726433       1.801407      2.063919       2.653880      1.438081       2.453098      61.96082 23.44533  56.70399 22.25029  5.256824       32.32273  
1 1 1 9  3  26 o 52.89247 16.19804  1.930814       1.248861      1.737654       1.552198      2.285379       2.102989      52.40361 18.19172  60.06392 21.15191  -7.660309      27.89878  
1 1 1 9  3  27 o 29.06933 11.47454  0.3266544      0.6558087     2.153128       1.584307      -0.5101872E-01 0.7204282     56.29232 18.37509  26.33199 11.33812  29.96034       21.59159  
1 1 1 9  3  28 o 216.6813 7.498663  31.60787       2.161841      31.01774       3.114070      32.15684       3.003534      213.3875 10.98882  217.5303 10.39195  -4.142853      15.12438  
1 1 1 9  3  29 o 41.99656 11.63514  1.245790       0.6735289     2.818535       1.239020      0.5861109      0.8024454     62.37323 15.07610  33.93661 12.88042  28.43662       19.82912  
1 1 1 9  3  30 o 121.4878 8.258251  10.06407       1.328939      8.880426       2.504664      10.52785       1.567826      109.6997 17.73966  123.7859 9.579515  -14.08625      20.16092  
1 1 1 9  3  31 o 74.82797 11.48791  3.988129       1.108910      6.556447       2.463244      3.335321       1.241869      90.79456 20.80646  67.16663 14.31357  23.62793       25.25444  
1 1 1 9  3  32 o 32.54017 14.15976  0.1965518E-01  1.147673      0.7732020      3.054754      -0.1041895     1.238397      51.64761 22.76905  32.87019 14.49386  18.77743       26.99077  
1 1 1 9  3  33 o 17.89164 8.990390  -2.675144      0.9516794     0.2923233      4.058304      -2.847825      0.9789776     52.49961 24.34083  17.90944 9.015053  34.59017       25.95664  
1 1 1 9  3  34 o 67.78293 26.11818  5.023072       3.332411      9.906169       4.275623      -2.533609      5.318844      89.13042 30.21679  49.50838 24.21370  39.62204       38.72154  
1 1 1 9  3  35 o 69.53725 24.42715  5.396616       2.803437      5.420588       2.877147      4.946669       12.46500      69.20762 24.70450  59.86820 30.36842  9.339417       39.14783  
1 1 1 9  3  36 o 52.92756 25.71505  2.061513       5.725607      -5.546553      13.80358      3.642509       6.292454      52.97441 27.25129  55.57285 26.99050  -2.598438      38.35518  
1 1 1 9  4  0  o 409.4124 20.79344  112.9289       11.27674      112.9289       11.27674      112.9289       11.27674      409.4124 20.79344  409.4124 20.79344  -0.000000      0.000000  
1 1 1 9  4  1  f 154.5434 7.814318  15.96927       1.603997      15.89440       1.713852      16.49778       4.553426      154.1390 8.375716  155.1089 22.70283  -0.9699402     24.19858  
1 1 1 9  4  2  o 455.6214 10.17470  138.5491       6.177308      141.9442       9.800853      136.3114       7.956699      460.3094 16.00301  451.4642 13.24053  8.845184       20.77036  
1 1 1 9  4  3  o 174.1319 5.926624  20.23791       1.373174      20.68651       2.202164      19.95251       1.756476      175.8194 9.434150  172.7961 7.647365  3.023270       12.14436  
1 1 1 9  4  4  o 297.3954 8.508750  59.05239       3.368425      60.69282       4.232132      56.21709       5.563910      301.3302 10.55637  289.5699 14.46540  11.76028       17.90767  
1 1 1 9  4  5  o 355.3222 12.63841  84.48463       5.974424      83.67992       7.024461      86.58903       11.35936      353.3167 14.95404  357.7369 23.96787  -4.420166      28.25035  
1 1 1 9  4  6  o 634.5103 16.24670  269.9071       13.72524      257.9984       16.79009      293.8943       23.82920      619.2458 20.37549  658.4949 27.21576  -39.24902      33.99792  
1 1 1 9  4  7  o 378.2341 7.058914  95.42377       3.557723      99.97002       4.465033      87.51849       5.887854      387.0290 8.657803  361.6136 12.23672  25.41537       14.98982  
1 1 1 9  4  8  o 328.1667 5.730783  71.80875       2.506006      71.28960       2.861840      73.51566       5.189241      326.9376 6.569115  331.4147 11.76925  -4.477081      13.47844  
1 1 1 9  4  9  o 77.55033 3.499830  4.016355       0.3607311     4.041143       0.3671536     3.326369       1.937070      77.78706 3.551521  69.48748 19.90258  8.299576       20.21697  
1 1 1 9  4  10 o 503.8701 8.717976  169.5007       5.853395      165.4781       6.737692      181.8789       11.81920      497.6728 10.16000  520.1619 17.07517  -22.48907      19.86925  
1 1 1 9  4  11 o 134.5900 5.448721  12.09874       0.9751738     11.52164       1.034427      16.70758       2.923288      131.3048 5.927437  157.2983 14.09607  -25.99347      15.29162  
1 1 1 9  4  12 o 467.8374 7.095823  146.0326       4.423553      145.8830       5.868673      146.2294       6.731388      467.3448 9.423865  467.7161 10.80062  -0.3713379     14.33397  
1 1 1 9  4  13 o 410.9385 6.139455  112.6295       3.361864      113.0710       5.104954      112.2914       4.467371      411.4631 9.310809  410.1554 8.173914  1.307709       12.38967  
1 1 1 9  4  14 o 371.4400 7.017038  92.04317       3.473090      95.67831       7.654555      91.10080       3.897356      377.4800 15.24921  369.4674 7.916267  8.012604       17.18155  
1 1 1 9  4  15 o 442.7839 9.891106  130.9555       5.835932      130.2613       7.324090      132.1628       9.658531      441.1067 12.47305  443.5536 16.36957  -2.446869      20.58008  
1 1 1 9  4  16 o 135.4506 5.272020  12.25082       0.9497330     12.38978       1.863586      12.20206       1.103833      135.7907 10.37788  135.1267 6.146491  0.6639709      12.06150  
1 1 1 9  4  17 f 441.8006 8.237978  130.2695       4.849762      151.6582       8.279302      119.0969       5.983833      475.8954 13.06833  422.0542 10.64841  53.84125       16.85733  
1 1 1 9  4  18 o 737.1629 11.84623  363.3983       11.63636      351.4375       17.82597      372.2794       15.36050      722.7665 18.52421  745.1429 15.47007  -22.37640      24.13440  
1 1 1 9  4  19 o 507.7292 9.911612  172.2560       6.705790      174.3588       8.139130      167.8122       11.83217      510.4788 11.96539  499.2097 17.81578  11.26913       21.46095  
1 1 1 9  4  20 o 555.7924 9.361616  206.4414       6.933251      196.9672       10.47869      213.8188       9.246673      541.5338 14.53451  565.0143 12.28153  -23.48053      19.02861  
1 1 1 9  4  21 o 299.0934 8.751203  59.84892       3.484021      55.54683       4.787509      64.69229       5.079769      287.5023 12.52675  310.3540 12.30765  -22.85165      17.56125  
1 1 1 9  4  22 o 180.2942 7.993539  21.77474       1.915637      21.90344       2.493855      21.58950       2.991883      180.4902 10.41338  178.8035 12.63871  1.686691       16.37606  
1 1 1 9  4  23 o 176.3331 10.27918  20.93454       2.404798      20.56414       2.840911      21.87086       4.516840      174.3669 12.30605  177.9564 19.35961  -3.589462      22.93978  
1 1 1 9  4  24 o 213.4383 8.489151  30.58160       2.409589      25.67908       4.061677      33.24406       2.993210      193.6905 15.87626  222.2013 10.13590  -28.51077      18.83593  
1 1 1 9  4  25 o 165.1712 5.735794  18.25878       1.260497      16.15840       2.266547      19.19926       1.516671      154.3921 11.09097  169.2339 6.739069  -14.84178      12.97785  
1 1 1 9  4  26 o 201.6032 8.666333  27.37049       2.322688      34.75348       4.167104      24.04294       2.797567      225.3952 13.94272  188.2445 11.20350  37.15068       17.88625  
1 1 1 9  4  27 o 186.8921 7.480865  23.49002       1.859250      25.49739       2.912944      22.11004       2.415203      193.5802 11.34239  180.6237 10.07464  12.95644       15.17064  
1 1 1 9  4  28 o 119.1308 8.458943  9.618248       1.334073      5.047800       2.106617      12.67844       1.723776      82.87610 19.41757  136.5666 9.532305  -53.69049      21.63115  
1 1 1 9  4  29 o 115.5271 10.29438  9.168091       1.568156      11.89946       2.557562      7.522642       1.985082      129.6660 15.08344  102.8410 14.92088  26.82497       21.21657  
1 1 1 9  4  30 f 164.9993 11.39863  18.90527       2.490755      15.42991       3.246225      23.87988       3.883821      145.3747 17.08343  181.9293 16.18968  -36.55466      23.53613  
1 1 1 9  4  31 o 71.41896 13.46576  3.733155       1.234512      2.512362       2.125358      4.354751       1.516579      58.38310 21.18274  76.29150 15.44859  -17.90841      26.21769  
1 1 1 9  4  32 o 80.38650 16.24247  5.005844       1.679896      8.620505       2.942261      3.257596       2.046204      100.1535 22.58690  62.58249 20.90205  37.57096       30.77440  
1 1 1 9  4  33 o 57.31177 16.53742  2.662047       1.332701      6.489774       5.802033      2.448848       1.369313      71.68604 31.49934  54.89544 16.98820  16.79060       35.78837  
1 1 1 9  4  34 o 22.35497 11.15591  -3.101629      1.351262      1.367377       2.787839      -4.473948      1.544862      49.53937 21.79893  21.97677 11.09501  27.56259       24.46002  
1 1 1 9  4  35 o 34.38872 16.65983  -2.106154      2.358296      -2.255784      2.471724      -0.5871888     7.875275      34.86211 16.92813  53.67213 26.80707  -18.81002      31.70459  
1 1 1 9  5  0  o 1104.681 41.16944  828.6927       60.41043      828.6927       60.41043      828.6927       60.41043      1104.681 41.16944  1104.681 41.16944  0.000000       0.000000  
1 1 1 9  5  1  o 269.2429 7.082845  48.37539       2.538916      48.85766       3.591197      47.89346       3.589941      270.3711 9.985095  267.6779 10.08273  2.693146       14.19026  
1 1 1 9  5  2  o 1153.053 19.94758  892.3096       30.64878      904.5588       43.07447      879.7490       43.61848      1156.896 27.94165  1140.112 28.73397  16.78381       40.07963  
1 1 1 9  5  3  o 339.8364 7.659340  77.03179       3.468444      77.71463       6.754007      76.78721       4.042163      340.4839 14.92270  339.1093 8.953251  1.374664       17.40252  
1 1 1 9  5  4  o 45.02227 8.455955  1.396634       0.4886752     3.202469       1.232306      1.059668       0.5323192     67.95056 14.07323  39.11461 10.13258  28.83595       17.34143  
1 1 1 9  5  5  o 703.8348 21.96827  333.8128       20.57823      328.5110       22.77158      357.4254       48.05663      697.2427 24.54787  711.1420 51.05320  -13.89923      56.64827  
1 1 1 9  5  6  o 408.2556 8.847190  111.2450       4.812946      107.8101       5.151998      134.7949       13.49013      401.8381 9.621682  446.6175 22.74253  -44.77936      24.69412  
1 1 1 9  5  7  o 612.5258 14.53860  251.2410       11.86644      243.3907       13.48941      278.1031       24.95276      602.1341 16.82877  638.8481 29.39089  -36.71399      33.86786  
1 1 1 9  5  8  o 555.0469 15.31319  206.6463       11.31497      204.2153       14.50186      210.4293       18.09017      550.5303 19.80053  557.2419 24.42201  -6.711609      31.44035  
1 1 1 9  5  9  o 346.0669 8.884989  80.01402       4.093842      77.01482       5.318499      84.37470       6.413043      339.1558 11.78628  354.7301 13.59242  -15.57434      17.99084  
1 1 1 9  5  10 f 205.6320 2.984704  28.17939       0.8178347     28.10632       0.8318557     30.29247       4.473244      205.3642 3.039832  211.8983 15.95972  -6.534073      16.24664  
1 1 1 9  5  11 o 635.8879 9.695673  270.1160       8.215463      265.8185       9.926898      279.4577       14.63587      630.4061 11.81734  644.7963 17.04918  -14.39014      20.74426  
1 1 1 9  5  12 o 306.8232 6.572344  62.79725       2.687088      61.84811       3.410747      64.35028       4.362914      304.2629 8.420633  310.1206 10.57324  -5.857697      13.51667  
1 1 1 9  5  13 o 420.4529 7.454514  117.9601       4.176478      118.4975       5.825068      117.3916       5.991304      421.1108 10.38081  418.9618 10.74068  2.149048       14.93731  
1 1 1 9  5  14 o 521.6681 8.485868  181.6554       5.898805      187.8253       9.716643      178.0544       7.423254      529.4628 13.78405  516.1724 10.79260  13.29041       17.50657  
1 1 1 9  5  15 o 969.8480 15.00918  630.2705       19.39698      629.1983       26.88061      631.4354       28.01765      966.4601 20.87284  967.7347 21.72711  -1.274597      30.12877  
1 1 1 9  5  16 o 381.5670 7.142808  97.12695       3.631729      91.84778       4.964966      103.2020       5.326110      370.6844 10.06098  392.9299 10.18093  -22.24548      14.31344  
1 1 1 9  5  17 o 882.4202 15.04807  521.7938       17.69415      544.4851       31.68391      511.5095       21.33028      895.5891 26.57891  872.4610 18.34750  23.12805       32.29659  
1 1 1 9  5  18 o 575.4235 10.68870  221.2995       8.195698      214.3293       15.10030      224.2102       9.758015      563.6974 20.13559  578.8322 12.65130  -15.13477      23.78019  
1 1 1 9  5  19 o 394.8591 9.273963  104.1595       4.879564      106.0619       6.198156      101.0584       7.913400      397.9622 11.70089  387.7338 15.34669  10.22836       19.29849  
1 1 1 9  5  20 o 185.3672 8.379627  22.99998       2.064461      20.80690       3.959062      23.81901       2.419439      174.9371 17.20631  188.5035 9.664378  -13.56635      19.73467  
1 1 1 9  5  21 o 208.2919 6.424690  28.98855       1.781060      28.45668       2.869874      29.32173       2.271403      205.8797 10.49570  209.3049 8.159700  -3.425125      13.29437  
1 1 1 9  5  22 o 197.1803 8.681738  26.06808       2.275504      26.85441       3.239998      25.30271       3.196540      199.5255 12.24531  193.6116 12.45620  5.913895       17.46724  
1 1 1 9  5  23 o 256.2751 8.036448  44.00535       2.740986      40.15026       3.929871      47.65732       3.824938      243.8940 12.13022  266.1114 10.80917  -22.21744      16.24747  
1 1 1 9  5  24 o 222.0995 7.921489  33.08788       2.340625      32.58279       2.972939      33.91146       3.796283      219.9160 10.17264  223.6543 12.79154  -3.738251      16.34338  
1 1 1 9  5  25 o 181.3790 7.746475  22.09732       1.867942      24.81590       3.166882      20.64690       2.313175      191.0302 12.50986  174.8459 9.969728  16.18436       15.99663  
1 1 1 9  5  26 o 136.8289 7.742823  12.60532       1.405966      14.08133       2.154831      11.51115       1.855293      143.8178 11.33575  130.0818 10.80075  13.73595       15.65744  
1 1 1 9  5  27 o 189.4467 8.159403  24.18806       2.054942      22.06767       2.929302      26.24265       2.883494      179.6212 12.31311  196.4211 11.06155  -16.79988      16.55206  
1 1 1 9  5  28 o 219.8141 11.12348  32.99747       3.247549      27.89272       6.849570      34.47775       3.688478      190.4555 27.80961  224.0434 12.40337  -33.58794      30.45025  
1 1 1 9  5  29 o 39.96041 15.97375  0.6541920      1.286360      0.9966609      1.708744      0.2062452      1.954248      46.50901 18.46994  43.78533 18.76061  2.723679       26.32678  
1 1 1 9  5  30 o 93.89661 14.02070  6.342891       1.700595      6.194060       1.989267      6.746984       3.277830      91.27319 16.98075  89.83390 25.93967  1.439293       31.00343  
1 1 1 9  5  31 o 80.02061 12.28425  4.614221       1.268070      2.595521       2.165987      5.666945       1.564146      58.80409 21.37717  88.03724 13.78533  -29.23315      25.43656  
1 1 1 9  5  32 o 36.49778 16.01648  0.5294253E-01  1.495633      -0.9999081     2.295202      0.8299510      1.971744      39.30248 18.25068  44.94712 19.03675  -5.644638      26.37206  
1 1 1 9  5  33 o 72.48863 13.96121  4.039956       1.299631      4.272457       2.869039      3.979931       1.457772      66.09315 24.50622  70.58091 15.88462  -4.487755      29.20404  
1 1 1 9  5  34 f ?        ?         -4.017158      0.7850503     -3.499375      3.204576      -4.050216      0.8097236     37.91725 18.59660  ?        ?         0.000000       18.59660  
1 1 1 9  5  35 o 39.74667 18.94240  -1.038957      2.774860      -2.907635      3.559516      1.855943       4.430376      39.83189 19.54864  52.41990 24.66860  -12.58802      31.47521  
1 1 1 9  6  0  o 66.05069 4.398601  2.945739       0.3831387     2.945739       0.3831387     2.945739       0.3831387     66.05069 4.398601  66.05069 4.398601  -0.000000      0.000000  
1 1 1 9  6  1  o 444.6275 19.72817  133.0185       11.65934      133.0185       11.65934      0.000000       0.000000      444.6275 19.72817  ?        ?         0.000000       19.72817  
1 1 1 9  6  2  o 416.0731 5.499896  115.4138       3.049282      98.19836       6.699426      119.9122       3.424575      382.9954 13.14664  424.0753 6.060245  -41.07996      14.47622  
1 1 1 9  6  3  o 245.8382 0.9338353 40.26710       0.3059096     0.000000       0.000000      40.26710       0.3059096     ?        ?         245.8382 0.9338353 0.000000       0.9338353 
1 1 1 9  6  4  o 775.7589 2.872005  401.0305       2.968830      400.7428       3.003540      413.2609       19.58486      775.4788 2.906631  784.4886 18.73528  -9.009827      18.95941  
1 1 1 9  6  5  o 380.3145 6.208032  96.45356       3.146084      95.63156       3.824616      98.17371       5.532668      378.6071 7.580984  383.1866 10.84646  -4.579407      13.23318  
1 1 1 9  6  6  o 92.71066 11.15800  5.826244       1.350768      6.868536       2.115479      5.108792       1.755136      99.91843 16.46150  85.95625 15.90937  13.96217       22.89299  
1 1 1 9  6  7  o 366.8340 8.349743  89.81808       4.081466      89.78509       5.300808      89.86611       6.396486      366.3784 10.86974  366.2161 13.12907  0.1623840      17.04475  
1 1 1 9  6  8  o 548.6036 12.72597  201.3890       9.302999      199.1272       11.97042      204.8386       14.78318      544.4673 16.51835  551.1362 20.16360  -6.668945      26.06581  
1 1 1 9  6  9  o 454.1183 10.99777  137.8533       6.654988      144.6232       9.553701      131.4718       9.275607      464.1344 15.46898  442.4402 15.75826  21.69427       22.08194  
1 1 1 9  6  10 o 416.6096 8.219570  115.8567       4.563015      113.5893       5.670928      120.0205       7.684788      412.1591 10.33376  423.1137 13.64802  -10.95462      17.11885  
1 1 1 9  6  11 o 248.2503 1.497217  41.06293       0.4952768     40.98478       0.4973288     50.47557       5.457751      248.0138 1.504853  273.9885 15.00615  -25.97464      15.08141  
1 1 1 9  6  12 o 401.0298 8.173152  107.3471       4.367569      109.1544       5.320172      103.6113       7.648887      404.2218 9.877167  392.9323 14.63411  11.28949       17.65547  
1 1 1 9  6  13 o 518.3745 10.70184  179.5705       7.392231      173.4648       10.69230      185.1611       10.23131      508.3458 15.80398  525.4989 14.62543  -17.15314      21.53297  
1 1 1 9  6  14 o 580.1041 10.52794  224.8430       8.138095      233.2969       11.38733      216.0179       11.63466      590.1689 14.48012  567.4911 15.40007  22.67780       21.13849  
1 1 1 9  6  15 o 603.0750 11.35222  243.0966       9.122746      256.1196       15.32188      235.9443       11.35482      617.0663 18.65545  593.5679 14.35610  23.49841       23.53983  
1 1 1 9  6  16 o 517.8575 8.563614  179.0041       5.909366      177.9269       7.592251      180.6597       9.412202      515.9828 11.04236  519.3428 13.61251  -3.360046      17.52809  
1 1 1 9  6  17 o 344.9569 7.169039  79.38829       3.295333      80.67211       6.025320      78.84039       3.936190      346.9539 13.05600  343.5559 8.604923  3.398071       15.63662  
1 1 1 9  6  18 o 440.3166 8.942355  129.4722       5.246751      125.7599       9.231174      131.2438       6.376928      432.5622 16.04309  443.0844 10.80069  -10.52225      19.34000  
1 1 1 9  6  19 o 245.0299 6.339547  40.08247       2.068169      36.91391       4.610094      40.88085       2.314102      234.0589 14.85794  247.4035 7.026571  -13.34459      16.43567  
1 1 1 9  6  20 o 241.8055 9.076309  39.14188       2.919291      39.05381       5.591749      39.17488       3.422775      239.9704 17.60967  241.6914 10.65399  -1.721008      20.58174  
1 1 1 9  6  21 o 341.9081 6.171305  78.03731       2.811641      76.20651       5.037934      78.86549       3.388427      336.9371 11.23668  343.5721 7.401279  -6.634918      13.45518  
1 1 1 9  6  22 o 199.2526 6.624461  26.55417       1.756401      25.41813       2.940313      27.18445       2.190084      194.1948 11.41304  201.4038 8.177556  -7.209045      14.04030  
1 1 1 9  6  23 o 74.75545 13.45630  3.886240       1.291137      3.511182       1.359350      7.344460       4.127698      70.70747 14.89840  100.4282 29.14176  -29.72074      32.72926  
1 1 1 9  6  24 o 305.6761 12.12711  63.20736       4.929804      63.05195       5.112682      65.26382       18.59845      305.1161 12.60219  277.7569 52.16532  27.35922       53.66597  
1 1 1 9  6  25 o 190.5192 9.664856  24.49621       2.445606      22.91098       3.226158      26.63785       3.749835      183.1841 13.30749  197.2086 14.36821  -14.02454      19.58404  
1 1 1 9  6  26 o 182.1082 8.686689  22.35995       2.101858      25.13465       2.897163      19.27673       3.053985      192.3152 11.35595  167.5213 13.80355  24.79390       17.87444  
1 1 1 9  6  27 o 23.05391 11.12126  -1.559464      1.023497      -2.350106      1.147660      1.512861       2.262336      22.36012 10.99900  55.03146 21.43339  -32.67134      24.09083  
1 1 1 9  6  28 o 112.0946 15.30682  8.892901       2.226689      12.65798       3.203245      5.372424       3.097446      132.3465 18.68276  83.60961 25.49142  48.73687       31.60471  
1 1 1 9  6  29 o 125.1046 13.39061  11.01125       2.197590      12.51676       4.055165      10.38527       2.614848      125.9028 25.05282  119.6595 16.86665  6.243340       30.20145  
1 1 1 9  6  30 o 100.6662 17.40924  7.587156       2.250796      4.429043       2.961185      11.90832       3.463794      73.74538 25.14454  123.0288 21.93312  -49.28338      33.36629  
1 1 1 9  6  31 o 68.86542 20.58423  3.880856       2.034022      4.001559       3.551035      3.821915       2.481430      68.89639 26.84729  67.59943 23.01831  1.296951       35.36410  
1 1 1 9  6  32 o 96.71638 11.65930  6.790727       1.472332      5.549144       2.189852      7.814991       1.988992      80.74828 20.35985  101.0849 15.23958  -20.33662      25.43163  
1 1 1 9  6  33 o 44.04083 18.49430  1.014580       1.835542      4.039743       3.428523      -0.2008940     2.173230      63.61570 25.84746  40.34275 18.37223  23.27295       31.71167  
1 1 1 9  6  34 o 50.30412 15.64555  2.079039       1.159780      -1.156039      2.808069      2.744385       1.273471      40.50049 19.23135  57.36990 16.03798  -16.86941      25.04120  
1 1 1 9  6  35 o 35.90469 15.76427  0.3451537      1.450576      0.6675152      3.107094      0.2553106      1.640308      45.93602 21.29782  36.87939 16.44758  9.056622       26.90948  
1 1 1 9  7  0  o 119.4286 9.002177  9.672509       1.413448      9.672509       1.413448      9.672509       1.413448      119.4286 9.002177  119.4286 9.002177  0.000000       0.000000  
1 1 1 9  7  1  o 319.4611 13.59264  68.40364       5.773001      62.15311       6.863706      83.51762       10.67308      303.9608 17.01391  351.2327 22.92990  -47.27182      28.55265  
1 1 1 9  7  2  f 143.3507 0.8326410 13.69147       0.1590491     19.31563       3.084188      13.67648       0.1592610     169.3438 13.78697  143.2722 0.8342074 26.07158       13.81219  
1 1 1 9  7  3  o 264.4605 6.541705  46.64478       2.305289      47.85633       3.260680      45.43399       3.259662      267.5880 9.158168  260.6976 9.398819  6.890411       13.12287  
1 1 1 9  7  4  o 245.3429 9.102304  40.23988       2.970604      42.86624       4.749101      38.55182       3.807406      252.6451 14.16346  239.8373 11.95114  12.80775       18.53195  
1 1 1 9  7  5  o 377.7346 7.206449  95.18895       3.627284      92.72860       4.157553      103.0307       7.422438      372.7357 8.370728  391.9871 14.23387  -19.25143      16.51278  
1 1 1 9  7  6  o 220.8051 8.027127  32.58119       2.357868      32.36999       2.637037      33.42322       5.265489      220.0010 9.014441  222.3371 17.92450  -2.336014      20.06359  
1 1 1 9  7  7  o 532.3450 8.926062  189.2137       6.331790      191.0196       8.502239      186.9650       9.487581      534.4320 11.93898  528.2836 13.48870  6.148376       18.01345  
1 1 1 9  7  8  o 239.2450 9.370677  38.28542       2.981580      33.03835       4.070450      44.36005       4.379695      221.6759 13.84923  257.1384 12.82259  -35.46252      18.87379  
1 1 1 9  7  9  o 489.2072 12.30988  160.2219       8.018165      162.6099       10.59942      157.0273       12.25971      491.9821 16.19016  482.6715 19.09911  9.310638       25.03791  
1 1 1 9  7  10 f 268.7682 6.064215  48.17687       2.171830      45.41012       2.495135      56.82607       4.411609      260.7846 7.187086  291.3070 11.38702  -30.52237      13.46545  
1 1 1 9  7  11 o 264.4189 5.846276  46.62659       2.059896      45.67949       2.249300      51.55042       5.128623      261.6932 6.450323  277.0819 13.93528  -15.38870      15.35573  
1 1 1 9  7  12 f 539.1140 10.21454  194.1744       7.337916      192.0932       10.52183      196.1450       10.23872      535.2213 14.76725  540.9678 14.21599  -5.746460      20.49796  
1 1 1 9  7  13 o 267.3648 6.634302  47.68030       2.363595      48.58261       2.933537      46.01064       3.990513      269.6815 8.172753  262.1037 11.45333  7.577789       14.07028  
1 1 1 9  7  14 o 381.1098 8.496160  96.94462       4.314658      97.34168       6.428886      96.61919       5.820125      381.2631 12.67189  380.0130 11.50697  1.250092       17.11686  
1 1 1 9  7  15 o 676.0343 11.88049  305.5606       10.70229      307.5347       14.36462      303.0976       16.04507      677.2770 15.91675  671.5723 17.94588  5.704712       23.98745  
1 1 1 9  7  16 f 83.70074 5.138148  4.688380       0.5703105     2.053950       1.582295      5.081722       0.6114060     56.31998 18.36205  87.14302 5.290226  -30.82304      19.10893  
1 1 1 9  7  17 o 343.9460 6.140047  78.89920       2.814074      73.15170       6.628808      80.16272       3.108040      329.9818 15.11565  346.6532 6.728493  -16.67142      16.54556  
1 1 1 9  7  18 o 515.1616 8.696187  177.2383       5.969609      183.1095       14.32520      176.0045       6.566977      520.3702 20.70057  513.2325 9.602356  7.137756       22.81926  
1 1 1 9  7  19 o 145.2608 5.139932  14.08980       0.9933314     16.37767       3.486250      13.88765       1.036287      155.0303 17.16307  144.1967 5.402811  10.83357       17.99337  
1 1 1 9  7  20 o 321.7362 8.094084  69.21437       3.467339      72.23447       6.492469      68.00928       4.101178      327.2993 14.92574  318.6780 9.669091  8.621307       17.78395  
1 1 1 9  7  21 o 269.9490 5.924893  48.64782       2.131257      44.21767       3.948235      50.46951       2.531806      256.3965 11.58620  274.7720 6.920383  -18.37546      13.49562  
1 1 1 9  7  22 o 218.6298 7.279834  31.99887       2.117865      31.75030       3.222248      32.18792       2.810102      217.0784 11.17722  218.8809 9.658539  -1.802505      14.77219  
1 1 1 9  7  23 o 95.67971 9.303354  6.200147       1.171173      5.623918       1.420780      7.421819       2.068743      90.55576 12.07503  103.4422 15.48392  -12.88640      19.63564  
1 1 1 9  7  24 o 160.5950 7.537488  17.31906       1.608491      16.62269       2.134398      18.23434       2.447012      156.7964 10.27222  164.0163 11.26473  -7.219955      15.24508  
1 1 1 9  7  25 o 38.29411 14.38269  0.7563500      0.9945751     1.071554       1.089123      -0.8262806     2.440456      42.52918 15.19760  44.74163 20.00056  -2.212452      25.11950  
1 1 1 9  7  26 o 104.1169 11.64228  7.442756       1.587605      7.349266       1.688432      8.156141       4.664054      103.2134 12.53302  102.6557 31.27698  0.5577011      33.69460  
1 1 1 9  7  27 o 38.45707 17.35546  -0.8083574     1.886833      -2.377772      4.007054      -0.3612395     2.138786      52.54813 24.30148  43.29131 19.06987  9.256821       30.89048  
1 1 1 9  7  28 o 26.11132 12.72439  -2.461495      1.430979      -2.612666      1.779504      -2.184846      2.407298      30.24747 14.60942  38.66845 18.19310  -8.420979      23.33290  
1 1 1 9  7  29 o 146.9725 14.69220  15.38132       2.838849      16.76925       4.809146      14.63904       3.516985      144.5278 25.92385  140.1829 19.34290  4.344910       32.34492  
1 1 1 9  7  30 o 60.63943 20.97170  2.787818       2.061993      3.201305       3.345013      2.534396       2.618724      66.16377 25.97627  60.30666 23.17496  5.857113       34.81157  
1 1 1 9  7  31 f 42.35023 18.22757  0.4367954      1.860424      1.362038       2.053591      -3.798888      4.393878      49.12735 19.98808  47.09793 22.79857  2.029411       30.31993  
1 1 1 9  7  32 o 83.31670 14.69933  5.330328       1.572305      6.946273       3.693074      4.972579       1.737654      80.40616 28.05142  78.62219 17.07602  1.783966       32.84011  
1 1 1 9  7  33 o 50.55219 19.52928  2.012918       1.866619      -5.293913      3.644696      4.610890       2.173272      38.01733 18.86370  70.65816 21.31309  -32.64083      28.46203  
1 1 1 9  7  34 o 25.18115 11.98473  -1.051418      1.103207      2.663772       2.349145      -2.102613      1.249571      53.89971 21.57271  23.45864 11.52696  30.44107       24.45920  
1 1 1 9  7  35 o 20.52191 10.33100  -3.449898      1.287164      -0.6807683     3.448955      -3.897998      1.387405      43.41273 20.80556  20.87897 10.53758  22.53376       23.32191  
1 1 1 9  8  0  o 180.7130 8.529855  21.92283       2.043555      21.92283       2.043555      21.92283       2.043555      180.7130 8.529855  180.7130 8.529855  0.000000       0.000000  
1 1 1 9  8  1  f 139.5596 0.9545395 12.97696       0.1775118     17.95115       2.323707      12.94776       0.1780320     163.5602 10.72090  139.4025 0.9584160 24.15767       10.76365  
1 1 1 9  8  2  o 170.9531 8.028404  19.54614       1.823748      18.73574       6.081313      19.62623       1.911741      163.6784 28.94099  171.2726 8.402239  -7.594223      30.13601  
1 1 1 9  8  3  o 100.6473 8.781291  6.813746       1.165917      6.778486       2.264498      6.826465       1.360036      98.98328 17.82409  100.5631 10.29447  -1.579773      20.58335  
1 1 1 9  8  4  o 155.0601 4.654947  16.04280       0.9607186     18.68347       1.237608      12.03866       1.523983      167.2987 5.559307  134.0194 8.578780  33.27928       10.22259  
1 1 1 9  8  5  o 368.6002 6.773607  90.63220       3.326972      95.05397       3.867287      78.04118       6.525877      377.4186 7.689703  341.0137 14.39366  36.40491       16.31898  
1 1 1 9  8  6  o 575.0023 8.988537  220.7644       6.887032      212.7868       10.51538      226.7570       9.113765      563.6432 14.00062  582.3060 11.74554  -18.66272      18.27498  
1 1 1 9  8  7  o 374.8277 7.594537  93.75563       3.793207      95.64066       5.068064      91.35474       5.719654      378.2172 10.06499  369.4215 11.63364  8.795715       15.38329  
1 1 1 9  8  8  o 489.6126 8.195057  160.0110       5.346605      162.8856       7.143527      156.3497       8.061997      493.6472 10.85982  483.2230 12.53107  10.42419       16.58202  
1 1 1 9  8  9  o 440.3204 13.33395  129.9183       7.814487      129.5685       9.756485      130.5442       13.05184      439.0129 16.70844  439.1153 22.37970  -0.1023865     27.92889  
1 1 1 9  8  10 f 481.5008 11.53665  155.0221       7.402020      158.8215       9.123480      147.7047       12.66150      486.7394 14.08145  467.8064 20.36041  18.93295       24.75547  
1 1 1 9  8  11 o 342.0296 7.506547  78.05614       3.421192      78.69238       4.089139      76.57166       6.246101      343.1991 8.949171  337.8799 13.90279  5.319183       16.53406  
1 1 1 9  8  12 o 224.3860 1.364061  33.54713       0.4078525     33.54192       0.4110613     33.87740       3.270515      224.3684 1.374901  224.8885 10.94667  -0.5201111     11.03267  
1 1 1 9  8  13 o 222.6942 6.817728  33.11049       2.020739      35.08606       3.251549      31.86734       2.579321      228.9097 10.68941  218.3084 8.885253  10.60130       13.90004  
1 1 1 9  8  14 o 200.1885 5.920667  26.74698       1.577632      25.58700       1.958745      28.88915       2.661814      195.6889 7.525727  207.7717 9.640586  -12.08278      12.23019  
1 1 1 9  8  15 o 216.5454 5.276032  31.26393       1.522404      29.07722       2.247466      33.11811       2.069533      208.5803 8.101640  222.7072 6.982350  -14.12683      10.69532  
1 1 1 9  8  16 o 258.0467 8.107450  44.48611       2.784306      41.76316       3.488557      49.26447       4.621321      249.7808 10.50471  271.0302 12.83246  -21.24944      16.58376  
1 1 1 9  8  17 o 246.4215 5.051607  40.48813       1.658753      42.79720       4.128791      40.04370       1.811363      252.5869 12.30402  245.0463 5.547328  7.540649       13.49673  
1 1 1 9  8  18 o 199.6217 1.664052  26.55220       0.4426375     31.30479       5.389149      26.51992       0.4441381     214.6183 19.04173  199.5003 1.670710  15.11803       19.11488  
1 1 1 9  8  19 o 215.1920 1.325912  30.85514       0.3802020     40.12157       4.578911      30.79081       0.3815195     243.9877 14.14447  214.9675 1.331896  29.02020       14.20704  
1 1 1 9  8  20 o 187.8050 6.737200  23.58418       1.683278      22.01768       4.026977      23.91583       1.852919      179.6914 17.02107  189.0563 7.369268  -9.364899      18.54786  
1 1 1 9  8  21 o 114.9447 6.097202  8.848061       0.9305439     8.337574       2.434789      8.935380       1.006989      109.5965 17.24093  115.4646 6.572031  -5.868065      18.45105  
1 1 1 9  8  22 o 185.9837 5.376816  23.11599       1.331121      20.78681       2.374086      24.18395       1.607581      175.6493 10.18694  190.1220 6.354444  -14.47270      12.00636  
1 1 1 9  8  23 o 183.1223 8.360885  22.53138       2.034790      20.14808       2.580920      26.44595       3.307704      172.5363 11.28787  197.4024 12.64122  -24.86610      16.94746  
1 1 1 9  8  24 o 227.5988 7.725746  34.77559       2.339666      33.97281       2.846692      36.44673       4.107224      224.5093 9.537247  231.2878 13.38385  -6.778488      16.43431  
1 1 1 9  8  25 o 247.8809 9.512549  41.46058       3.136222      39.62075       3.827453      45.22006       5.471242      241.4379 11.93380  255.9320 16.12504  -14.49409      20.06072  
1 1 1 9  8  26 o 115.3166 14.89569  9.286239       2.235478      10.34743       5.983340      9.114075       2.410003      112.8641 35.60011  113.6955 16.37937  -0.8314590     39.18739  
1 1 1 9  8  27 o 145.2829 16.13396  14.89073       3.070801      -4.091086      11.78289      16.27392       3.180718      84.50148 39.90765  152.0458 15.93566  -67.54428      42.97168  
1 1 1 9  8  28 o 60.00772 20.74932  2.519484       2.018457      5.641440       3.754412      1.250268       2.393846      84.06548 28.31574  53.29570 21.61868  30.76979       35.62511  
1 1 1 9  8  29 o 105.8281 17.98036  8.370279       2.444927      10.15870       3.470257      6.607617       3.445177      112.4560 23.89591  88.37185 26.87240  24.08411       35.96026  
1 1 1 9  8  30 o 81.11094 16.68593  5.010329       1.743233      7.833012       2.454584      2.137795       2.476164      100.1860 19.08310  56.78102 22.33229  43.40493       29.37509  
1 1 1 9  8  31 o 49.41189 19.29380  1.633915       1.836961      0.3909659      2.184157      4.638128       3.395648      44.23642 19.38544  70.23343 26.53265  -25.99701      32.85996  
1 1 1 9  8  32 o 45.88017 20.15791  0.7051441      2.375538      6.871893       3.529434      -4.402204      3.211994      79.84721 27.44487  37.20266 18.31969  42.64456       32.99746  
1 1 1 9  8  33 o 43.47479 17.42193  1.244070       1.534089      -0.3092068     2.461262      2.230882       1.961781      41.42843 19.11881  51.92421 20.03112  -10.49578      27.69070  
1 1 1 9  8  34 o 15.09509 7.515579  -1.419184      0.5984865     -3.469037      3.097913      -1.339713      0.6099777     36.52058 17.98529  15.61695 7.743389  20.90363       19.58138  
1 1 1 9  9  0  f 579.7560 57.38813  239.7128       43.26499      239.7128       43.26499      239.7128       43.26499      579.7560 57.38813  579.7560 57.38813  0.000000       0.000000  
1 1 1 9  9  1  o 484.2626 17.99391  157.7926       11.59109      156.9274       13.57876      160.1162       22.25211      482.0184 21.19268  481.3857 34.92759  0.6327209      40.85421  
1 1 1 9  9  2  o 114.9356 8.040929  8.859414       1.223731      7.029666       1.806755      10.41025       1.663359      101.5631 13.69927  124.4232 10.11985  -22.86008      17.03177  
1 1 1 9  9  3  o 140.8103 9.665073  13.30519       1.802484      12.75494       1.876742      19.84869       6.471824      137.7859 10.29622  168.2383 29.96763  -30.45244      31.68708  
1 1 1 9  9  4  o 237.1166 4.028512  37.47651       1.272859      35.81200       1.433008      43.69976       2.770850      231.7744 4.639911  255.7456 8.141135  -23.97118      9.370531  
1 1 1 9  9  5  o 233.9152 6.713773  36.53033       2.090495      35.18975       3.075596      37.68153       2.850079      229.2788 10.09153  237.3810 9.026710  -8.102203      13.53959  
1 1 1 9  9  6  o 274.8942 6.197151  50.39984       2.270027      49.24889       3.535680      51.20697       2.960870      271.3495 9.794525  276.8722 8.033892  -5.522675      12.66792  
1 1 1 9  9  7  o 626.3417 10.18013  262.1100       8.496462      267.1597       10.78791      253.8605       13.78852      631.8299 12.81338  614.6863 16.85001  17.14355       21.16851  
1 1 1 9  9  8  o 375.1713 7.915200  93.93664       3.956990      97.60306       5.546546      90.13640       5.646860      381.9794 10.90823  366.9737 11.56221  15.00571       15.89573  
1 1 1 9  9  9  o 502.8623 11.53105  169.0687       7.726652      177.3615       10.75678      160.2289       11.10586      514.0405 15.72252  488.2258 17.09734  25.81470       23.22750  
1 1 1 9  9  10 o 485.9723 9.276448  157.6949       6.007126      159.8092       6.895121      151.0356       12.23689      489.0584 10.58053  473.4613 19.43736  15.59708       22.13050  
1 1 1 9  9  11 f 256.9691 7.186738  44.08635       2.458439      43.21726       2.929513      46.15589       4.520629      254.3022 8.657759  262.3355 12.97231  -8.033279      15.59608  
1 1 1 9  9  12 o 911.4027 12.20689  555.4533       14.82480      563.0983       17.97896      539.2146       26.20294      916.8976 14.71534  894.3364 21.98748  22.56122       26.45734  
1 1 1 9  9  13 o 438.7886 8.304827  128.4945       4.855785      126.4881       6.677046      130.7468       7.074401      434.8589 11.53310  442.0494 12.02122  -7.190582      16.65900  
1 1 1 9  9  14 o 149.6936 4.453076  14.95017       0.8872656     14.11944       1.018751      17.55967       1.805590      145.4301 5.265719  161.9869 8.393623  -16.55676      9.908618  
1 1 1 9  9  15 o 951.4393 15.55835  606.9377       19.72505      595.3673       22.90848      640.1074       38.78745      941.2083 18.26573  968.3495 30.09631  -27.14117      35.20546  
1 1 1 9  9  16 o 374.7039 7.540884  93.69778       3.765165      83.30532       6.170632      99.86208       4.752395      352.4836 13.16075  386.6768 9.223396  -34.19324      16.07098  
1 1 1 9  9  17 o 168.6806 6.324619  19.00859       1.419068      18.65184       2.720009      19.14201       1.663386      166.4505 12.35144  169.1886 7.396034  -2.738174      14.39651  
1 1 1 9  9  18 o 418.0120 8.486969  116.7463       4.727319      123.4178       8.076739      113.2698       5.830318      428.4880 14.16515  411.2739 10.64763  17.21411       17.72071  
1 1 1 9  9  19 o 398.0075 6.984559  105.7871       3.704279      115.6265       7.710674      102.8349       4.223594      414.4359 13.98247  392.2610 8.080413  22.17490       16.14938  
1 1 1 9  9  20 o 230.3180 1.366080  35.34655       0.4192544     27.96769       2.999185      35.49362       0.4234118     203.8538 11.08275  230.7965 1.376766  -26.94266      11.16793  
1 1 1 9  9  21 o 157.4109 6.346491  16.58275       1.328467      12.57218       2.772576      17.77787       1.513516      135.3365 15.66309  162.9181 6.988035  -27.58163      17.15124  
1 1 1 9  9  22 o 55.28131 6.480234  2.071051       0.4683055     2.696559       1.031150      1.908507       0.5256420     62.06859 12.88940  52.84539 7.690101  9.223198       15.00914  
1 1 1 9  9  23 o 211.3600 6.264946  29.90774       1.762521      28.67665       3.032167      30.53596       2.166036      205.9010 11.09245  213.3232 7.632284  -7.422211      13.46455  
1 1 1 9  9  24 o 182.8969 8.645661  22.53021       2.101101      22.62328       2.800678      22.41040       3.177717      182.5005 11.57629  181.0996 13.26004  1.400955       17.60225  
1 1 1 9  9  25 o 136.6242 15.63134  12.99628       2.794588      11.20657       3.459989      16.35472       4.739707      124.3221 21.67341  149.1258 24.71706  -24.80370      32.87354  
1 1 1 9  9  26 o 60.10269 21.16897  2.368562       2.106444      4.709396       3.232806      0.6414820      2.776837      79.95728 26.25700  53.87991 22.69386  26.07737       34.70507  
1 1 1 9  9  27 o 192.5464 13.63505  25.76808       3.475740      31.36528       17.84361      25.54733       3.543617      147.6789 59.33560  191.5134 13.98225  -43.83447      60.96078  
1 1 1 9  9  28 o 80.47144 15.24950  4.708573       1.575363      1.071785       3.766426      5.479721       1.734360      60.37598 25.95983  86.82464 15.56238  -26.44866      30.26716  
1 1 1 9  9  29 o 63.61031 22.14166  3.090874       2.300200      3.892014       3.461097      2.457112       3.078380      70.54089 26.75565  61.80991 24.70981  8.730980       36.42031  
1 1 1 9  9  30 o 42.91059 19.02498  0.1472274E-01  2.162112      -1.598451      3.792945      0.7912239      2.631522      48.81424 22.92575  49.78975 21.55480  -0.9755058     31.46743  
1 1 1 9  9  31 o 31.96741 14.74334  -0.7160780     1.460305      -1.588171      1.668131      2.144301       3.021069      30.89425 14.71324  56.06967 23.64651  -25.17541      27.85025  
1 1 1 9  9  32 o 33.91423 16.54540  -3.033017      2.438672      -2.038548      2.921259      -5.319473      4.429512      39.93142 19.13999  42.50481 21.03817  -2.573383      28.44194  
1 1 1 9  9  33 o 30.28266 14.24273  -0.9639607     1.473117      -2.669416      2.962428      -0.4037101     1.697926      37.85823 18.41714  34.92465 16.03062  2.933578       24.41663  
1 1 1 9  9  34 o 45.94501 19.02383  1.592402       1.902454      3.103303       3.397700      0.9023795      2.296142      55.07285 24.15502  43.83399 19.51013  11.23886       31.05013  
1 1 1 9  10 0  o 127.0066 5.837744  10.82011       0.9832038     10.82011       0.9832038     10.82011       0.9832038     127.0066 5.837744  127.0066 5.837744  0.000000       0.000000  
1 1 1 9  10 1  o 161.0099 5.943323  17.31222       1.272944      17.23449       1.363220      17.84151       3.557167      160.6190 6.382060  162.1941 16.69698  -1.575089      17.87511  
1 1 1 9  10 2  o 391.8681 8.514890  102.5117       4.446235      110.8742       12.58994      101.3201       4.752466      404.2890 23.47089  389.5244 9.156107  14.76459       25.19359  
1 1 1 9  10 3  o 22.72036 8.766822  0.2212268      0.3758291     0.1773528      0.3777639     4.471495       3.718132      22.06703 8.709319  83.62601 28.17863  -61.55898      29.49385  
1 1 1 9  10 4  o 320.5402 4.897837  68.49966       2.091994      70.29948       2.454998      63.72750       3.997548      324.6883 5.674283  308.7285 9.729401  15.95981       11.26316  
1 1 1 9  10 5  o 600.0425 2.874652  239.9406       2.298481      239.6215       2.381328      244.2877       8.790408      599.6385 2.980274  604.5574 10.91184  -4.918884      11.31151  
1 1 1 9  10 6  o 304.5108 6.796891  61.85625       2.757951      64.55390       4.235476      59.87046       3.633929      310.6697 10.24529  299.2976 9.122354  11.37213       13.71799  
1 1 1 9  10 7  o 345.4854 7.812336  79.65214       3.596534      80.58733       4.527704      78.05311       5.920470      347.2119 9.795896  341.2673 13.04332  5.944611       16.31220  
1 1 1 9  10 8  o 260.3824 7.157164  45.26480       2.480927      48.57157       3.684045      42.52074       3.355980      269.4460 10.27962  252.1072 10.00978  17.33881       14.34804  
1 1 1 9  10 9  o 573.5404 9.864202  219.7014       7.538753      225.7596       10.17565      212.3306       11.22410      580.8441 13.14708  562.7449 14.98142  18.09912       19.93210  
1 1 1 9  10 10 o 272.2957 6.567338  49.45206       2.382889      48.62127       3.290280      50.36845       3.455623      269.7088 9.168452  274.4892 9.461879  -4.780396      13.17527  
1 1 1 9  10 11 o 211.5765 6.940448  29.89153       1.954071      28.66010       2.508037      31.79377       3.117186      206.9971 9.115119  217.8800 10.77010  -10.88287      14.10959  
1 1 1 9  10 12 o 307.9281 6.066888  63.23083       2.489367      63.26005       2.828463      63.13041       5.243371      307.9594 6.892606  306.9425 12.84818  1.016937       14.58025  
1 1 1 9  10 13 o 391.6572 6.176278  102.2973       3.223343      99.84929       3.792396      108.6680       6.117967      386.8666 7.356629  403.0534 11.40270  -16.18677      13.56988  
1 1 1 9  10 14 o 91.39253 5.993580  5.594068       0.7258840     5.005720       0.7666305     10.69160       2.256570      86.36833 6.713987  125.6384 13.70058  -39.27002      15.25724  
1 1 1 9  10 15 o 358.8078 10.89530  86.14400       5.203207      84.91720       7.630009      87.21048       7.113959      355.3323 16.15677  360.3685 14.84643  -5.036194      21.94215  
1 1 1 9  10 16 o 306.4791 8.585074  62.77861       3.502599      58.41810       4.248341      72.03356       6.189252      295.3587 10.81259  327.4448 14.21880  -32.08612      17.86299  
1 1 1 9  10 17 o 273.9232 9.509690  50.22299       3.465848      46.94543       5.027054      53.19228       4.784813      264.0391 14.34185  281.3988 12.79401  -17.35974      19.21914  
1 1 1 9  10 18 o 250.9569 9.565590  42.19526       3.192924      42.01050       6.217452      42.26144       3.721078      248.4100 18.92567  250.9030 11.15776  -2.492996      21.96990  
1 1 1 9  10 19 o 158.9522 3.739556  16.84667       0.7920638     19.85166       2.117615      16.35788       0.8540561     171.9570 9.276073  156.5637 4.097277  15.39333       10.14067  
1 1 1 9  10 20 o 189.9333 3.451816  24.05430       0.8736197     33.47427       6.157675      23.86080       0.8825470     219.9030 21.27977  189.1657 3.501241  30.73729       21.56588  
1 1 1 9  10 21 o 192.5557 7.538484  24.85303       1.930519      24.02154       2.467916      26.16405       3.098902      188.9003 9.838377  196.7146 11.87752  -7.814285      15.42301  
1 1 1 9  10 22 o 360.9936 8.216748  87.37914       3.952510      87.64732       5.469484      87.08601       5.718193      360.3154 11.40611  358.9195 11.97282  1.395874       16.53625  
1 1 1 9  10 23 o 93.87084 6.397453  5.924367       0.7954413     2.374985       2.476498      6.332669       0.8399478     62.76317 22.85196  97.04784 6.533274  -34.28467      23.76754  
1 1 1 9  10 24 o 138.7113 6.132648  12.90507       1.130729      6.904537       2.641078      14.25179       1.251199      97.46481 20.95889  145.7314 6.459223  -48.26656      21.93164  
1 1 1 9  10 25 o 94.98441 16.26788  6.402731       1.984985      7.329100       3.123848      5.775388       2.570694      98.90764 23.95822  88.32420 21.94065  10.58344       32.48674  
1 1 1 9  10 26 o 141.8700 13.28231  13.95762       2.481754      15.26883       4.106415      13.20312       3.114999      143.7558 22.14717  135.9786 17.60426  7.777191       28.29146  
1 1 1 9  10 27 o 135.5881 13.28212  12.86699       2.368977      15.90775       4.069219      11.30805       2.913631      145.5841 21.63263  124.5420 18.08508  21.04208       28.19646  
1 1 1 9  10 28 o 82.59669 15.84298  5.025211       1.680290      4.134361       2.442189      5.825999       2.315451      72.39978 22.73151  86.66683 20.39224  -14.26705      30.53793  
1 1 1 9  10 29 o 30.77530 13.77696  -0.3339842     1.162397      -1.296995      1.359751      2.280130       2.240299      28.75008 13.57150  56.95441 21.54336  -28.20433      25.46177  
1 1 1 9  10 30 o 44.75555 17.92885  1.130719       1.624068      2.437722       2.529418      0.2139587      2.118410      57.23053 22.55217  43.02914 18.96564  14.20139       29.46686  
1 1 1 9  10 31 o 44.53481 19.77137  0.4078740      2.342821      0.5618089      2.581319      -0.3115748     5.580499      46.61087 20.71973  55.94272 26.71681  -9.331856      33.80969  
1 1 1 9  10 32 o 46.87914 16.94206  1.707020       1.357839      0.6866371      1.558050      4.929579       2.768855      39.93319 16.91812  69.54205 24.28721  -29.60885      29.59884  
1 1 1 9  10 33 o 25.99464 11.89604  -0.3819079     0.9256648     -1.408141      1.234228      0.9374949      1.399462      25.52471 12.28781  39.84325 16.38872  -14.31854      20.48367  
1 1 1 9  10 34 o 21.50155 10.22995  -0.8124601     0.8024058     -1.021150      0.8774546     0.2533322      1.982942      21.76061 10.44597  39.17138 17.72399  -17.41077      20.57323  
1 1 1 9  11 0  o 685.6648 24.79627  316.9882       22.58809      316.9882       22.58809      316.9882       22.58809      685.6648 24.79627  685.6648 24.79627  0.000000       0.000000  
1 1 1 9  11 1  o 327.7971 5.899584  71.65600       2.576915      71.65600       2.576915      0.000000       0.000000      327.7971 5.899584  ?        ?         0.000000       5.899584  
1 1 1 9  11 2  o 610.4247 8.621944  248.7472       7.013113      218.4313       15.57268      256.4598       7.854719      569.0543 20.57080  619.6843 9.512324  -50.63000      22.66368  
1 1 1 9  11 3  o 195.2010 3.164394  25.39344       0.8230878     25.39344       0.8230878     0.000000       0.000000      195.2010 3.164394  ?        ?         0.000000       3.164394  
1 1 1 9  11 4  o 227.7430 7.899468  34.65409       2.393637      36.35909       3.576193      33.27035       3.221718      232.9199 11.55845  222.8589 10.88175  10.06100       15.87484  
1 1 1 9  11 5  o 141.1781 4.991243  13.30439       0.9374880     15.40132       2.109837      12.78852       1.046470      151.4646 10.51892  138.3706 5.687693  13.09398       11.95815  
1 1 1 9  11 6  o 408.0998 7.309782  111.1106       3.975065      113.9831       5.935457      108.7743       5.352772      412.8764 10.79775  403.5569 9.954064  9.319519       14.68587  
1 1 1 9  11 7  o 188.7869 9.775270  23.86535       2.450713      31.28799       5.244511      21.79174       2.771975      215.0233 18.48317  180.1821 11.60702  34.84123       21.82545  
1 1 1 9  11 8  o 540.1316 7.112164  194.6152       5.118878      198.9943       6.084375      184.0073       9.469854      546.0462 8.362056  524.1817 13.56917  21.86450       15.93883  
1 1 1 9  11 9  o 462.7682 7.494333  142.8750       4.621363      137.6712       6.337263      148.7853       6.753792      453.9709 10.47611  471.9080 10.74031  -17.93701      15.00344  
1 1 1 9  11 10 o 486.2511 8.129036  157.7781       5.267120      159.2392       6.494628      154.9705       9.002837      488.3030 9.981399  480.9518 14.06277  7.351257       17.24500  
1 1 1 9  11 11 o 236.8612 6.948631  37.45482       2.190771      37.90215       3.107680      37.01291       3.088841      238.0350 9.818731  235.2157 9.876962  2.819305       13.92702  
1 1 1 9  11 12 o 529.0839 9.640123  186.9363       6.796428      181.4450       9.389435      192.9799       9.850320      520.4973 13.54930  536.7494 13.78367  -16.25214      19.32804  
1 1 1 9  11 13 o 575.9838 8.170146  221.4227       6.270666      222.6448       7.741096      219.0903       10.69418      577.3110 10.06281  571.9707 14.03137  5.340271       17.26672  
1 1 1 9  11 14 o 409.2432 9.079332  111.8476       4.951183      106.5075       7.735138      115.5541       6.444335      398.3523 14.59696  415.4926 11.65119  -17.14035      18.67676  
1 1 1 9  11 15 o 203.2027 7.132249  27.58954       1.928216      27.33800       2.115789      28.82249       4.684217      202.2104 7.867283  206.3175 17.19452  -4.107147      18.90887  
1 1 1 9  11 16 o 180.6310 10.99633  21.91695       2.634214      20.09670       3.211566      25.65935       4.604964      172.4708 14.09710  194.2663 17.99360  -21.79553      22.85822  
1 1 1 9  11 17 o 130.5194 7.062656  11.40828       1.223759      12.77874       1.642099      9.696401       1.835284      137.9540 8.981712  119.7205 11.65155  18.23351       14.71156  
1 1 1 9  11 18 o 318.5916 9.553942  68.01833       4.051348      80.01153       6.605536      60.78645       5.129394      344.3237 14.42883  300.4536 12.84157  43.87015       19.31572  
1 1 1 9  11 19 o 195.7748 6.647854  25.63879       1.731735      23.38372       2.885342      26.90848       2.165040      186.1606 11.69053  200.3743 8.125540  -14.21371      14.23703  
1 1 1 9  11 20 o 247.1267 9.507766  41.03119       3.125077      55.00772       9.335683      39.26741       3.316405      279.5544 25.33629  241.5673 10.32664  37.98708       27.35996  
1 1 1 9  11 21 o 218.1957 3.677111  31.75896       1.069120      35.35196       2.695109      31.08797       1.164678      229.3742 8.834276  215.8504 4.049297  13.52377       9.718088  
1 1 1 9  11 22 o 78.51035 7.046887  4.160851       0.7293871     -0.4715121     2.037966      4.841393       0.7811290     42.17565 18.59524  84.74448 6.979121  -42.56884      19.86180  
1 1 1 9  11 23 o 251.4796 2.564497  42.16893       0.8593667     36.21082       4.125270      42.43922       0.8786431     230.2479 13.50499  252.2804 2.613698  -22.03253      13.75559  
1 1 1 9  11 24 f 323.1477 7.369098  70.10328       3.173138      74.73982       4.695339      66.20557       4.305014      332.1526 10.62220  312.7287 10.34502  19.42389       14.82736  
1 1 1 9  11 25 o 231.4290 10.51364  36.42934       3.233768      37.40324       3.713640      33.37452       6.577100      233.8108 11.95933  213.0013 23.56652  20.80951       26.42738  
1 1 1 9  11 26 o 43.70659 13.26181  1.334232       0.8396982     -1.300619      1.523922      2.482984       1.006232      31.54667 14.72355  58.87548 13.15752  -27.32882      19.74597  
1 1 1 9  11 27 o 49.59578 15.04042  1.765410       1.080240      1.514332       1.222649      2.658794       2.306307      47.28001 16.15622  61.54332 22.10085  -14.26331      27.37647  
1 1 1 9  11 28 o 21.13005 10.00603  -0.8340415     0.7501611     -0.7553582     0.7868952     -1.618251      2.484228      22.27055 10.45399  40.22747 18.78286  -17.95692      21.49609  
1 1 1 9  11 29 o 23.25780 10.67389  -0.4630272     0.7523930     -0.9135629     0.7967123     3.251852       2.287754      21.47867 10.21181  63.18380 22.07592  -41.70513      24.32339  
1 1 1 9  11 30 o 53.98347 13.59249  2.223739       0.9770004     2.324644       1.068798      1.710863       2.409595      54.86213 14.42979  51.86485 21.43626  2.997288       25.84052  
1 1 1 9  11 31 o 51.55676 14.25183  2.080898       1.011798      1.966254       1.127216      2.556288       2.295393      49.84851 15.41125  55.44166 21.59047  -5.593151      26.52649  
1 1 1 9  11 32 o 20.22258 9.011118  -0.1325647     0.4912508     -0.1877319     0.5085106     0.6389672      1.901677      20.09332 9.044077  41.61423 18.16570  -21.52092      20.29256  
1 1 1 9  11 33 o 43.60750 15.20967  1.521115       1.085683      1.637877       1.135008      0.2646374      3.723268      44.89470 15.55762  47.28110 22.36063  -2.386398      27.24036  
1 1 1 9  12 0  o 638.1515 20.92942  273.6606       17.75391      273.6606       17.75391      273.6606       17.75391      638.1515 20.92942  638.1515 20.92942  0.000000       0.000000  
1 1 1 9  12 1  o 350.8522 10.38442  82.30446       4.849554      83.55968       6.137929      80.21909       7.911399      353.1594 13.06553  345.3033 17.24869  7.856110       21.63852  
1 1 1 9  12 2  o 357.5911 5.919834  85.26913       2.820783      82.02527       3.264980      94.81709       5.601507      350.6638 6.987408  376.4996 11.17758  -25.83585      13.18189  
1 1 1 9  12 3  o 451.8240 8.441957  136.2517       5.082600      137.5267       5.359343      124.8536       16.02393      453.8927 8.861042  427.8351 28.26566  26.05759       29.62205  
1 1 1 9  12 4  o 290.6825 7.116312  56.36583       2.756432      58.61436       4.201010      54.66600       3.652631      296.0062 10.66818  285.9618 9.599314  10.04437       14.35120  
1 1 1 9  12 5  o 568.2485 10.88589  215.7540       8.242821      195.3193       17.13071      221.9106       9.402891      537.2137 23.99119  576.0807 12.24911  -38.86700      26.93730  
1 1 1 9  12 6  f 347.4858 7.288140  80.55054       3.374639      76.06206       5.769844      82.88428       4.160451      336.9703 12.87355  352.2651 8.870393  -15.29483      15.63369  
1 1 1 9  12 7  o 149.5290 11.47058  15.03006       2.268064      15.97216       3.620177      14.42135       2.909952      153.2055 18.08090  145.9525 15.18408  7.252945       23.61091  
1 1 1 9  12 8  o 467.9948 12.51416  146.5652       7.796981      131.2271       9.795172      173.0911       12.88132      442.0528 16.65874  507.1782 19.09425  -65.12546      25.33977  
1 1 1 9  12 9  o 469.3142 8.405079  146.9940       5.256287      143.6889       6.082042      156.7472       10.44788      463.8640 9.839777  483.2591 16.24772  -19.39511      18.99499  
1 1 1 9  12 10 o 236.2734 7.829927  37.28983       2.461760      41.62962       2.889374      25.79605       4.702196      249.5861 8.701108  195.1462 18.29623  54.43997       20.25985  
1 1 1 9  12 11 o 389.7825 7.759139  101.3781       4.030041      101.1868       5.464672      101.6061       5.967089      389.0238 10.55153  389.7007 11.50359  -0.6769714     15.60985  
1 1 1 9  12 12 o 278.3969 7.722098  51.76019       2.861894      52.06316       4.370286      51.53272       3.786793      278.7759 11.79133  277.5343 10.25721  1.241577       15.62837  
1 1 1 9  12 13 o 177.4795 3.045404  20.99223       0.7202225     20.95386       0.7529171     21.40546       2.470894      177.3149 3.186606  178.6556 10.42449  -1.340698      10.90066  
1 1 1 9  12 14 o 160.1567 1.406105  17.09079       0.3000794     17.13786       0.3012753     11.19724       3.371253      160.3771 1.409768  127.1973 20.59374  33.17981       20.64194  
1 1 1 9  12 15 o 251.3893 9.134619  42.29549       3.054837      42.95733       3.556095      40.43164       5.967597      253.1602 10.56477  244.0739 18.48613  9.086273       21.29205  
1 1 1 9  12 16 f 431.9015 8.967615  124.7334       5.161015      123.4383       5.654014      131.2034       12.63732      429.4878 9.879444  438.6393 21.68817  -9.151489      23.83233  
1 1 1 9  12 17 o 225.1505 7.076491  33.89884       2.120434      33.28641       2.312310      37.13639       5.316477      223.0181 7.792924  233.6338 17.19764  -10.61577      18.88091  
1 1 1 9  12 18 o 169.5698 8.134182  19.28258       1.832600      19.01668       1.992258      20.74493       4.672077      168.2837 8.916258  172.9728 20.67949  -4.689102      22.51979  
1 1 1 9  12 19 o 99.65592 7.926187  6.689425       1.043880      4.217768       1.439856      9.427938       1.515593      77.76862 14.42546  118.1480 9.712494  -40.37940      17.39041  
1 1 1 9  12 20 o 111.9628 6.089693  8.403803       0.9051172     8.293696       1.458507      8.472765       1.154273      110.6463 10.00016  112.2073 7.767889  -1.560982      12.66268  
1 1 1 9  12 21 o 231.2385 6.912381  35.83139       2.127519      32.00252       2.915857      40.19036       3.111164      217.8108 10.07375  244.2800 9.576429  -26.46924      13.89922  
1 1 1 9  12 22 o 120.1944 3.742086  9.650196       0.5986073     13.92263       3.177662      9.493002       0.6095200     141.2049 17.24566  119.2020 3.842363  22.00282       17.66852  
1 1 1 9  12 23 o 21.45125 9.417997  -0.1279700     0.5176934     -0.4223239     0.6794844     0.2793185      0.7992739     22.53307 10.26605  30.80788 12.49370  -8.274811      16.17048  
1 1 1 9  12 24 o 37.83659 9.920786  1.003989       0.5062284     3.067789       0.8846827     -0.7379908E-03 0.6172734     66.55313 10.30884  24.79006 10.58076  41.76307       14.77243  
1 1 1 9  12 25 o 109.4820 8.521358  8.148041       1.233371      7.834283       1.472824      8.884595       2.256604      106.7961 10.48455  111.9070 15.55275  -5.110878      18.75670  
1 1 1 9  12 26 o 147.1554 6.701519  14.62074       1.310635      14.78388       2.014332      14.50097       1.725942      146.6400 10.37573  145.8095 8.925918  0.8305054      13.68677  
1 1 1 9  12 27 o 99.10394 6.559038  6.662532       0.8612996     6.181070       1.073013      7.534689       1.444182      94.83463 8.583974  104.0043 10.56726  -9.169708      13.61439  
1 1 1 9  12 28 o 26.75883 10.84391  0.2451554      0.6016287     0.9960137      0.7749542     -0.8939137     0.9544915     38.17368 12.86458  24.42826 11.48155  13.74541       17.24307  
1 1 1 9  12 29 o 18.52986 9.025940  -1.207343      0.7178494     -1.028197      0.7538627     -2.949109      2.350622      20.03349 9.633814  34.12349 16.55520  -14.09001      19.15424  
1 1 1 9  12 30 o 31.28399 12.82739  0.3775697      0.8538473     0.6640684      0.9048663     -1.950286      2.579295      34.65569 13.53859  38.07514 18.17815  -3.419456      22.66580  
1 1 1 9  12 31 o 23.40375 9.709167  0.1487363      0.4968738     -0.1912672     0.5144668     4.866526       1.916394      20.24455 9.105816  74.82427 19.14444  -54.57972      21.19966  
1 1 1 9  12 32 o 18.95586 9.045579  -0.7334416     0.6370082     -0.7814044     0.6498719     0.4422382      3.217510      18.95295 9.069283  46.68752 21.65548  -27.73457      23.47790  
1 1 1 9  13 0  o 40.06159 24.61951  0.8592058      2.541942      0.8592058      2.541942      0.8592058      2.541942      40.06159 24.61951  40.06159 24.61951  0.000000       0.000000  
1 1 1 9  13 1  o 782.6142 21.02573  412.5955       21.90679      425.5680       28.62517      394.2575       34.03387      791.9417 27.16595  758.4824 33.75840  33.45935       43.33149  
1 1 1 9  13 2  o 200.9131 3.259270  26.90100       0.8725739     27.01598       0.9039776     25.33179       3.339489      201.3403 3.369406  194.1779 12.98100  7.162445       13.41117  
1 1 1 9  13 3  o 502.7436 8.697480  168.6949       5.826578      178.5171       8.032337      157.7868       8.464705      516.8096 11.66374  485.5023 13.09615  31.30722       17.53716  
1 1 1 9  13 4  o 529.5214 11.55033  187.3939       8.149883      201.4291       15.73984      182.2526       9.526349      546.4572 21.65867  521.6987 13.71545  24.75842       25.63613  
1 1 1 9  13 5  o 203.1224 5.150898  27.52368       1.393041      28.72404       1.658265      24.64535       2.567842      207.4613 6.004827  191.8393 10.08054  15.62196       11.73351  
1 1 1 9  13 6  o 201.1811 6.927314  27.02831       1.854288      25.69448       2.896104      27.95501       2.413965      195.7811 11.14726  204.4561 8.881672  -8.674957      14.25292  
1 1 1 9  13 7  o 418.9137 8.922565  117.1402       4.980670      117.5968       6.742824      116.5920       7.388890      419.2302 12.08284  417.2453 13.30669  1.984924       17.97395  
1 1 1 9  13 8  o 423.8137 12.81205  120.2521       7.227170      122.9409       12.21542      118.8041       8.964486      426.6635 21.55554  420.6801 16.02118  5.983368       26.85739  
1 1 1 9  13 9  o 191.0320 5.578475  24.35344       1.418501      26.31842       2.089562      22.67390       1.931836      198.4390 7.918221  184.1663 7.890313  14.27271       11.17834  
1 1 1 9  13 10 o 350.6680 6.652263  82.02341       3.108416      82.05846       3.808795      81.95348       5.378912      350.6414 8.151750  349.9229 11.55165  0.7184753      14.13831  
1 1 1 9  13 11 o 322.8160 6.507033  69.51380       2.799056      67.70472       3.283458      74.32433       5.354249      318.5093 7.736345  333.0977 12.08297  -14.58835      14.34745  
1 1 1 9  13 12 o 78.72541 8.369713  4.184608       0.8645676     5.137352       0.9951182     1.251315       1.746081      87.28301 8.670528  50.46402 19.03459  36.81900       20.91635  
1 1 1 9  13 13 o 384.6228 7.010876  98.73222       3.593195      101.9636       4.818659      94.68503       5.392758      390.6172 9.257662  376.0663 10.77260  14.55087       14.20399  
1 1 1 9  13 14 o 373.1098 6.489697  92.90771       3.226522      96.15736       3.676837      82.02523       6.728530      379.4970 7.270973  349.1096 14.49542  30.38742       16.21679  
1 1 1 9  13 15 o 300.2638 7.935801  60.28832       3.172389      58.55117       3.678226      65.33343       6.268370      295.6940 9.346914  311.1108 15.16619  -15.41681      17.81511  
1 1 1 9  13 16 o 287.8267 7.187804  55.35384       2.756771      57.09364       2.968872      44.46624       7.426925      292.1631 7.632462  254.0208 22.16321  38.14236       23.44061  
1 1 1 9  13 17 o 147.6172 5.824769  14.57274       1.143499      13.87553       1.236752      18.67997       3.001757      143.9737 6.463002  165.8934 13.70122  -21.91963      15.14905  
1 1 1 9  13 18 o 158.9419 6.842956  16.92176       1.445896      16.66243       1.515924      19.53570       4.812824      157.6673 7.234713  166.8724 22.19401  -9.205124      23.34341  
1 1 1 9  13 19 o 125.2047 6.252321  10.50595       1.039822      10.35234       1.082908      12.32189       3.723370      124.2463 6.564140  131.6873 21.99384  -7.441002      22.95249  
1 1 1 9  13 20 o 309.9848 10.09602  64.74496       4.164705      63.30859       5.175707      67.38320       7.014472      305.5135 12.74149  313.1451 16.87263  -7.631592      21.14311  
1 1 1 9  13 21 o 159.9499 6.448788  17.15351       1.371653      17.18876       1.603896      17.05755       2.646458      159.9289 7.547497  158.0920 12.66860  1.836823       14.74646  
1 1 1 9  13 22 o 158.6258 6.687004  16.89128       1.410275      16.26902       3.569455      17.00638       1.535176      152.1982 17.94482  159.0596 7.262266  -6.861481      19.35865  
1 1 1 9  13 23 o 135.2890 3.871165  12.23262       0.6971578     9.636502       1.082928      14.07008       0.9110578     119.6480 6.820613  144.9964 4.721661  -25.34837      8.295471  
1 1 1 9  13 24 o 129.6799 2.730238  11.22020       0.4717878     7.341128       0.8163177     13.16575       0.5781183     104.4643 5.888158  140.4461 3.089112  -35.98177      6.649287  
1 1 1 9  13 25 o 74.44923 20.69123  4.202260       2.126348      6.190780       2.874365      1.798700       3.160126      88.96351 23.78725  60.91656 24.79123  28.04695       34.35751  
1 1 1 9  13 26 o 115.4897 7.891513  9.092841       1.207146      5.779154       1.981490      11.04849       1.522236      87.93112 17.52668  126.9145 9.060736  -38.98339      19.73021  
1 1 1 9  13 27 o 29.45551 12.51481  0.1023999      0.8566974     -0.2211131     2.081020      0.1684146      0.9400496     41.70419 18.56724  31.22342 13.18044  10.48077       22.76986  
1 1 1 9  13 28 o 35.79496 14.33734  0.5947956      1.038427      1.895800       1.624560      -0.3040095     1.350297      51.01478 18.51821  33.08472 14.82692  17.93005       23.72260  
1 1 1 9  13 29 o 72.85284 10.64157  3.834724       1.002580      2.476374       2.102199      4.234648       1.140661      55.57788 20.90254  76.07877 11.61969  -20.50088      23.91513  
1 1 1 9  13 30 o 71.24906 8.480301  3.588792       0.7893454     2.906229       3.650262      3.622275       0.8084744     58.89625 25.44164  71.49750 8.662432  -12.60125      26.87592  
1 1 1 9  13 31 f 41.12846 18.40820  0.3308978      2.074194      -1.081032      3.107800      1.465020       2.785328      42.49614 20.19413  49.38890 21.75877  -6.892761      29.68580  
1 1 1 9  13 32 o 35.50447 16.22955  -0.2030862     1.716445      1.626915       3.186621      -0.9510390     2.037238      49.82168 22.51282  35.22553 16.62327  14.59615       27.98500  
1 1 1 9  14 0  o 937.0042 76.99738  635.6649       94.59276      635.6649       94.59276      635.6649       94.59276      937.0042 76.99738  937.0042 76.99738  0.000000       0.000000  
1 1 1 9  14 1  o 234.6789 8.129491  36.79383       2.538368      37.32738       3.081653      35.66787       4.476675      236.2307 9.811158  230.3425 14.66114  5.888153       17.64109  
1 1 1 9  14 2  o 621.0323 9.885017  257.5460       8.180223      242.4804       12.66617      268.3263       10.71440      601.3298 15.82110  633.4321 12.69388  -32.10229      20.28402  
1 1 1 9  14 3  o 371.6102 7.147231  92.11619       3.539150      85.57705       5.299824      97.37924       4.754665      357.7025 11.13256  381.9177 9.342792  -24.21521      14.53347  
1 1 1 9  14 4  o 506.8786 10.47654  171.6218       7.076124      164.2170       9.986266      179.0889       10.02817      494.8975 15.16096  516.9636 14.57208  -22.06604      21.02856  
1 1 1 9  14 5  o 322.7887 8.801862  69.59968       3.782342      72.72632       5.777905      67.25510       5.003385      329.4406 13.18859  316.9625 11.86725  12.47815       17.74178  
1 1 1 9  14 6  o 313.4432 8.051656  65.60403       3.360144      57.97918       5.517280      70.09958       4.236436      293.9477 14.12715  323.8381 9.828837  -29.89035      17.20995  
1 1 1 9  14 7  o 385.4251 7.345213  99.10943       3.772402      97.96883       7.724176      99.46671       4.323045      382.0514 15.20284  386.0381 8.404002  -3.986664      17.37106  
1 1 1 9  14 8  o 757.2385 13.76685  383.9569       13.89123      367.9715       16.57327      421.7093       25.46945      740.4048 16.79831  789.1076 24.25077  -48.70276      29.50056  
1 1 1 9  14 9  o 494.7656 9.968449  163.5523       6.572046      163.7344       7.472201      162.9302       13.81151      494.8391 11.33212  490.9889 21.16005  3.850159       24.00343  
1 1 1 9  14 10 o 284.3531 9.129168  54.06314       3.454613      50.91388       4.785447      57.49046       4.992232      275.4170 13.07677  292.7409 12.82903  -17.32391      18.31900  
1 1 1 9  14 11 o 267.9256 7.151779  47.94351       2.551017      45.67749       3.317293      51.22290       3.990689      261.2612 9.544780  276.5145 10.85177  -15.25323      14.45212  
1 1 1 9  14 12 o 346.2410 7.373027  80.03856       3.401715      83.54076       4.553421      75.61525       5.117303      353.3399 9.680125  335.8557 11.45119  17.48413       14.99448  
1 1 1 9  14 13 o 395.2930 6.543958  104.2998       3.446935      102.0351       4.090413      109.8478       6.402126      390.8190 7.854490  404.6416 11.88642  -13.82260      14.24711  
1 1 1 9  14 14 o 253.6165 4.912700  42.90641       1.660242      42.34721       1.852849      45.18438       3.739647      251.9186 5.519582  259.4355 10.84141  -7.516876      12.16561  
1 1 1 9  14 15 o 297.3799 4.805982  58.99959       1.904440      58.98414       1.988001      59.17181       6.638505      297.3230 5.017814  295.0985 16.95358  2.224518       17.68057  
1 1 1 9  14 16 o 151.5307 5.198473  15.34409       1.048108      14.90440       1.082690      21.89902       4.180377      149.3189 5.450613  178.5757 17.80494  -29.25682      18.62055  
1 1 1 9  14 17 o 188.4195 8.697120  23.84090       2.177719      25.88959       2.608818      19.13240       3.955002      196.1190 10.01593  166.4616 18.12255  29.65739       20.70618  
1 1 1 9  14 18 o 93.44348 18.17201  6.175602       2.181198      6.347152       3.493041      6.065957       2.792570      93.38821 26.71927  91.58134 22.93593  1.806877       35.21330  
1 1 1 9  14 19 o 47.73441 15.55783  1.507511       1.135954      5.034718       3.629193      1.124411       1.196054      84.54271 27.82314  44.07517 15.90448  40.46754       32.04808  
1 1 1 9  14 20 o 140.9219 15.48954  13.73831       2.860747      16.10792       4.177784      11.64634       3.925412      150.3578 21.46013  126.3330 24.19897  24.02484       32.34389  
1 1 1 9  14 21 o 39.85320 15.08102  0.8058479      1.098112      3.839236       2.427246      0.2521032E-01  1.231330      73.21563 22.61114  35.00737 14.94287  38.20826       27.10264  
1 1 1 9  14 22 o 83.75001 9.227823  4.787879       1.012763      3.353844       1.961873      5.308864       1.182506      68.16612 20.17688  87.99978 10.27766  -19.83366      22.64370  
1 1 1 9  14 23 o 121.1579 7.075511  9.902632       1.137337      5.929935       2.575283      10.86522       1.267659      88.87900 21.89099  126.8262 7.534973  -37.94724      23.15148  
1 1 1 9  14 24 o 92.86499 6.725583  5.834419       0.8266138     6.065305       2.198624      5.796411       0.8920624     90.41609 18.85991  92.43549 7.301669  -2.019394      20.22401  
1 1 1 9  14 25 o 74.19571 14.62459  4.005954       1.394465      5.958533       2.709883      3.302695       1.626313      86.57328 23.07344  66.22924 17.97320  20.34404       29.24756  
1 1 1 9  14 26 o 90.99857 7.270648  5.656450       0.8742917     6.628260       2.499764      5.521005       0.9332317     91.29776 20.98754  89.70125 7.887848  1.596512       22.42086  
1 1 1 9  14 27 o 54.61627 7.711818  2.078238       0.5456449     3.427310       1.758474      1.934507       0.5739762     65.31663 19.04043  52.41515 8.509523  12.90148       20.85545  
1 1 1 9  14 28 o 73.60385 9.884043  3.863004       0.9449319     3.428741       1.300750      4.348266       1.375011      66.57739 15.02048  75.76489 14.13953  -9.187500      20.62865  
1 1 1 9  14 29 o 23.76887 11.21928  -0.8646160     0.9289359     2.169327       3.058932      -1.172835      0.9749801     55.27135 23.57118  23.08838 11.06428  32.18298       26.03879  
1 1 1 9  14 30 f 26.37836 12.50729  -1.065932      1.179287      2.939864       2.066954      -2.999223      1.435936      57.12628 20.86520  23.64668 11.75135  33.47960       23.94683  
1 1 1 9  14 31 o 23.71472 11.48298  -1.464873      1.116791      -3.738110      2.344165      -0.7974275     1.270204      30.83723 15.27061  28.45036 13.33154  2.386875       20.27119  
1 1 1 9  15 0  o 234.9591 23.53290  38.11535       7.185346      38.11535       7.185346      38.11535       7.185346      234.9591 23.53290  234.9591 23.53290  0.000000       0.000000  
1 1 1 9  15 1  f 307.4826 7.090036  63.07044       2.904976      62.95000       3.000866      64.86517       11.58405      307.1756 7.331391  307.6772 28.58156  -0.5015869     29.50686  
1 1 1 9  15 2  o 271.5596 7.793132  49.24770       2.817093      47.22504       3.954615      51.33155       4.013992      265.5861 11.19957  276.9468 10.89822  -11.36069      15.62694  
1 1 1 9  15 3  o 179.5779 8.367973  21.57029       1.996875      21.61052       3.146438      21.54315       2.583938      179.2152 13.26975  179.2231 10.87080  -0.7965088E-02 17.15403  
1 1 1 9  15 4  o 864.5599 15.38870  501.0671       17.72844      502.4064       29.86302      500.3382       22.03066      860.4354 26.07615  862.4781 19.16928  -2.042725      32.36398  
1 1 1 9  15 5  o 258.2212 8.278500  44.55209       2.844825      43.77368       4.327118      45.14467       3.775451      255.4511 12.75243  259.6604 10.93612  -4.209320      16.79950  
1 1 1 9  15 6  o 218.7494 7.029972  31.95822       2.046490      27.70501       2.596693      38.93088       3.324766      203.4319 9.606309  241.1442 10.37115  -37.71231      14.13655  
1 1 1 9  15 7  f 392.1068 7.569345  102.6091       3.954906      103.9878       5.462263      101.0900       5.733773      394.3004 10.40523  388.6623 11.08251  5.638123       15.20167  
1 1 1 9  15 8  o 581.0866 9.740754  225.6430       7.542355      221.2115       10.17080      231.0577       11.24254      574.6163 13.28324  586.9880 14.37347  -12.37164      19.57143  
1 1 1 9  15 9  o 225.0526 7.622566  33.85122       2.282608      34.08770       2.789348      33.37183       3.971494      225.6666 9.295928  222.7140 13.44498  2.952606       16.34570  
1 1 1 9  15 10 o 469.9126 8.728705  147.5470       5.465632      149.8512       7.685436      145.1891       7.774476      472.7618 12.21002  465.2617 12.55155  7.500092       17.51073  
1 1 1 9  15 11 o 275.4619 7.243059  50.70219       2.656318      52.42261       3.898536      49.21134       3.629118      279.6608 10.48010  271.0113 10.06690  8.649506       14.53186  
1 1 1 9  15 12 o 657.2671 9.701153  289.1251       8.496473      293.2489       11.69607      284.5174       12.36333      660.6375 13.28628  650.3095 14.26730  10.32800       19.49567  
1 1 1 9  15 13 o 312.5263 7.095011  65.25539       2.954699      70.07410       3.881978      58.61945       4.555527      323.4622 9.015293  295.3069 11.59944  28.15530       14.69090  
1 1 1 9  15 14 o 115.4471 3.540196  8.895190       0.5439641     8.952455       0.5530040     7.186471       3.020791      115.8158 3.587659  100.3042 23.08082  15.51160       23.35799  
1 1 1 9  15 15 o 247.1546 2.976211  40.72420       0.9801803     40.72638       0.9941573     40.64822       5.866025      247.1591 3.018596  243.5365 18.20796  3.622604       18.45648  
1 1 1 9  15 16 o 179.7327 7.103819  21.64313       1.697995      22.22902       1.908260      19.41536       3.721017      182.0365 7.885643  168.0231 16.84656  14.01340       18.60081  
1 1 1 9  15 17 o 353.3503 8.559504  83.74240       4.030209      80.22803       4.822532      91.88048       7.338587      345.1250 10.49858  367.3065 15.02547  -22.18152      18.32989  
1 1 1 9  15 18 o 158.1555 14.18478  17.13554       2.957661      17.15198       3.626398      17.10289       5.111513      157.0807 17.62911  153.3341 25.94129  3.746567       31.36457  
1 1 1 9  15 19 o 55.81275 19.44200  1.976684       1.773659      0.8357328      2.071927      5.105920       3.431311      49.67199 20.12579  84.24284 27.00467  -34.57086      33.67937  
1 1 1 9  15 20 o 98.08856 17.80891  6.853502       2.242007      6.105074       2.457674      10.56518       5.473114      91.59109 20.63389  115.8232 33.54124  -24.23212      39.37985  
1 1 1 9  15 21 o 109.3017 13.25488  8.278837       1.891124      7.698102       2.203968      9.900000       3.682386      104.2962 16.39925  114.8772 24.78453  -10.58099      29.71883  
1 1 1 9  15 22 o 61.10945 19.14129  2.663597       1.732697      2.614665       1.799957      3.281863       6.398148      60.82106 19.56473  82.09232 34.50460  -21.27126      39.66543  
1 1 1 9  15 23 o 182.6395 8.750213  22.65549       2.123350      22.36323       2.778892      23.06552       3.291515      180.1477 11.63857  181.8291 13.68542  -1.681458      17.96516  
1 1 1 9  15 24 o 144.3654 6.799067  14.09504       1.304260      10.67371       2.045990      16.43710       1.692801      123.2947 12.63171  155.4097 8.203427  -32.11493      15.06175  
1 1 1 9  15 25 o 78.69154 14.83139  4.557479       1.498162      2.829742       2.125474      6.263429       2.112031      61.30968 21.28743  90.69284 18.11089  -29.38316      27.94922  
1 1 1 9  15 26 o 97.22172 6.836583  6.456763       0.8800317     2.803168       2.256299      7.112293       0.9557243     60.11501 21.82344  101.9711 7.077590  -41.85611      22.94242  
1 1 1 9  15 27 o 37.30396 16.33284  0.1010759      1.547359      -0.9354848     2.030061      1.538314       2.390430      37.19421 17.23451  51.25414 21.28235  -14.05993      27.38552  
1 1 1 9  15 28 o 45.43723 11.30832  1.538494       0.6819441     0.8592736      0.9976915     2.134093       0.9342598     37.45428 14.32682  52.80394 13.28982  -15.34967      19.54168  
1 1 1 9  15 29 o 53.84332 21.64154  2.367144       2.374639      0.5475014      2.669881      9.256577       5.195061      46.14729 20.75126  80.30001 32.10047  -34.15272      38.22374  
1 1 1 9  15 30 o 32.05096 14.44154  -0.1653957     1.300490      4.574848       3.380692      -0.9886874     1.408906      63.31172 25.68764  29.37390 13.85031  33.93783       29.18366  
1 1 1 9  16 0  o 54.89925 11.09685  2.239994       0.7190892     2.239994       0.7190892     2.239994       0.7190892     54.89925 11.09685  54.89925 11.09685  0.000000       0.000000  
1 1 1 9  16 1  o 180.2022 7.709538  21.71236       1.846958      27.02580       6.238886      21.20196       1.933632      198.3486 24.09890  178.0281 8.172819  20.32053       25.44704  
1 1 1 9  16 2  o 628.0350 8.883123  263.4047       7.434008      252.2950       16.51012      266.2299       8.325759      611.3275 20.29576  631.2164 9.898560  -19.88892      22.58095  
1 1 1 9  16 3  o 60.75924 13.19093  2.567726       1.037287      3.552499       1.443082      1.515007       1.492034      71.39159 15.60593  50.63439 17.81766  20.75719       23.68574  
1 1 1 9  16 4  o 348.3787 9.781849  81.16847       4.536448      75.48286       14.12193      81.82269       4.790337      329.7099 32.56808  349.7107 10.29097  -20.00082      34.15529  
1 1 1 9  16 5  o 216.3753 9.384162  31.34170       2.699248      35.27555       4.040302      28.17048       3.627590      229.0559 13.29442  204.5943 13.37952  24.46161       18.86142  
1 1 1 9  16 6  o 598.3275 11.01259  239.5207       8.780151      243.8917       11.62951      233.7264       13.38973      602.8443 14.47715  589.0779 17.07592  13.76642       22.38693  
1 1 1 9  16 7  o 328.8327 6.544756  72.15812       2.867755      71.09553       3.787901      73.58505       4.389516      326.0853 8.725381  331.5755 9.946080  -5.490204      13.23090  
1 1 1 9  16 8  o 369.7697 10.40698  91.56394       5.122679      91.59849       7.824814      91.53802       6.776803      368.5723 15.97018  369.0045 13.80658  -0.4322815     21.11086  
1 1 1 9  16 9  o 349.4670 6.919073  81.54005       3.222016      87.75175       4.703261      76.04687       4.422889      362.0275 9.758436  336.9828 9.860346  25.04477       13.87276  
1 1 1 9  16 10 o 211.9857 6.906619  30.04143       1.948344      30.12146       2.408233      29.88978       3.314857      212.0801 8.539135  210.7618 11.85093  1.318298       14.60689  
1 1 1 9  16 11 o 308.4652 7.491409  63.58912       3.079238      64.23409       3.740386      62.23280       5.424130      309.6741 9.074165  303.8461 13.43004  5.828003       16.20822  
1 1 1 9  16 12 o 111.7818 9.106395  8.421510       1.344669      8.353920       1.439069      8.886574       3.774820      111.2269 9.809972  111.1350 25.96135  0.9191132E-01  27.75297  
1 1 1 9  16 13 o 323.5071 6.834681  69.94980       2.946291      68.15644       3.542302      73.97523       5.307117      318.9793 8.341084  331.3741 12.03896  -12.39481      14.64617  
1 1 1 9  16 14 f 136.6190 5.136330  12.47786       0.9333906     13.14873       0.9962090     7.656020       2.670772      140.2297 5.341111  104.0201 19.99463  36.20956       20.69572  
1 1 1 9  16 15 o 174.3757 1.781810  20.26434       0.4140196     20.36825       0.4164414     11.40849       3.844554      174.8221 1.787657  126.0676 23.75714  48.75444       23.82431  
1 1 1 9  16 16 o 146.4927 6.841988  14.39258       1.331896      15.07586       1.484270      11.56788       3.017862      149.8461 7.456939  128.6387 18.10606  21.20738       19.58151  
1 1 1 9  16 17 o 209.6362 6.588165  29.44289       1.838081      29.81308       2.059185      27.99144       4.077392      210.8110 7.341618  201.9722 15.26313  8.838806       16.93701  
1 1 1 9  16 18 o 342.3055 8.762448  78.81612       3.993518      90.37202       6.364766      71.31287       5.128681      364.4312 13.12815  324.2949 11.88852  40.13626       17.71116  
1 1 1 9  16 19 o 259.7810 8.167212  45.40283       2.823676      44.58538       3.066987      49.95029       7.233757      257.1750 8.963426  265.8117 20.58311  -8.636688      22.45011  
1 1 1 9  16 20 o 138.5952 13.63261  13.27920       2.485132      13.88008       2.812715      11.14091       5.305966      141.1193 15.19701  117.7713 32.66778  23.34802       36.02961  
1 1 1 9  16 21 o 81.67867 24.18783  5.055173       2.818866      5.599315       3.673736      4.276166       4.395648      85.48361 27.98585  79.43554 30.14696  6.048073       41.13450  
1 1 1 9  16 22 o 126.1348 12.90239  11.09917       2.138075      9.846583       2.370477      16.56396       4.951303      117.5712 15.50862  145.1631 26.57609  -27.59200      30.77021  
1 1 1 9  16 23 o 111.0827 13.82628  8.768809       2.002390      7.090215       2.461409      12.05361       3.443223      96.66920 19.77560  125.6421 21.32812  -28.97292      29.08545  
1 1 1 9  16 24 o 105.1125 10.41263  7.703236       1.439292      9.258750       3.428751      7.370513       1.585770      105.5845 24.79589  102.1280 11.87369  3.456459       27.49219  
1 1 1 9  16 25 o 38.13655 16.79792  -0.5625340E-01 1.659229      -1.699212      2.029954      3.250924       2.880060      35.06673 16.56201  64.21303 24.39480  -29.14629      29.48570  
1 1 1 9  16 26 o 47.81718 11.39182  1.686074       0.7154673     1.098524       1.871264      1.786672       0.7742987     46.03339 18.94464  49.06384 11.95475  -3.030453      22.40124  
1 1 1 9  16 27 o 32.28354 12.24570  0.6048827      0.7250484     0.9274354      1.499418      0.5064451      0.8283287     41.85187 17.06020  32.31161 12.85058  9.540260       21.35856  
1 1 1 9  16 28 o 59.75013 8.059964  2.522691       0.6253690     2.537823       2.377650      2.521566       0.6481915     55.18587 21.82812  59.59696 8.394448  -4.411083      23.38661  
1 1 1 9  16 29 o 47.93288 14.19057  1.832456       0.9703525     4.816200       2.437934      1.270784       1.057748      69.21549 22.80526  41.33599 14.95121  27.87950       27.26937  
1 1 1 9  16 30 o 39.85352 13.78088  1.209845       0.8903625     -0.3057885E-01 2.647954      1.367966       0.9454096     42.42514 19.66702  41.85593 14.20864  0.5692062      24.26267  
1 1 1 9  17 0  o 228.4477 7.238869  34.90936       2.198577      34.90936       2.198577      34.90936       2.198577      228.4477 7.238869  228.4477 7.238869  0.000000       0.000000  
1 1 1 9  17 1  o 223.4002 0.9658273 33.25263       0.2875125     33.24211       0.2883747     35.00332       3.720782      223.3649 0.9688772 228.2424 12.27909  -4.877487      12.31726  
1 1 1 9  17 2  o 320.5263 8.510658  68.68627       3.631749      67.34251       5.157742      70.00768       5.114667      316.7889 12.24149  323.0683 11.90125  -6.279388      17.07319  
1 1 1 9  17 3  o 388.4638 7.854183  100.7834       4.065604      100.2136       4.920726      102.0090       7.216876      387.1434 9.538581  389.5748 13.92464  -2.431335      16.87839  
1 1 1 9  17 4  o 370.6921 9.517564  91.94759       4.697354      91.46417       9.568854      92.10107       5.391724      367.1648 19.62939  370.7489 10.92568  -3.584106      22.46516  
1 1 1 9  17 5  o 504.3657 11.22209  170.3926       7.542109      164.9748       12.04435      173.8874       9.673502      493.7693 18.33754  508.4767 14.29125  -14.70737      23.24877  
1 1 1 9  17 6  o 379.9552 8.354546  96.48942       4.229887      94.49289       5.069712      101.0632       7.673356      375.5892 10.13898  387.2505 14.89809  -11.66132      18.02088  
1 1 1 9  17 7  o 352.5367 6.372688  82.96675       2.993646      80.63282       3.508512      89.21472       5.740476      347.4016 7.579099  364.5085 11.83430  -17.10681      14.05324  
1 1 1 9  17 8  o 253.9662 5.789681  43.04868       1.959315      45.30076       2.494711      39.42319       3.165268      260.3011 7.199263  242.4418 9.818130  17.85927       12.17477  
1 1 1 9  17 9  o 168.9291 4.808950  19.05344       1.081399      18.68577       1.238981      20.22930       2.215737      167.2292 5.567816  173.5302 9.619945  -6.300934      11.11503  
1 1 1 9  17 10 o 313.4781 8.014789  65.77692       3.345156      67.20000       4.079427      62.85591       5.844553      316.5177 9.683644  304.8505 14.42863  11.66718       17.37695  
1 1 1 9  17 11 o 90.55747 2.449787  5.469993       0.2953432     5.492517       0.2959122     -0.3695108     4.764652      90.74387 2.449455  66.23066 28.83519  24.51321       28.93904  
1 1 1 9  17 12 o 197.3354 6.842879  26.06662       1.796634      27.14319       1.965666      20.60221       4.428518      201.3041 7.340261  172.3727 19.62978  28.93137       20.95728  
1 1 1 9  17 13 f 30.97630 7.752871  0.6676340      0.3192247     0.6487651      0.3218366     1.816012       2.510757      30.55330 7.860207  59.68730 22.75292  -29.13400      24.07235  
1 1 1 9  17 14 o 83.66358 3.445759  4.676506       0.3833226     4.665038       0.3866363     5.336901       2.934130      83.55845 3.480089  85.95316 24.45489  -2.394714      24.70127  
1 1 1 9  17 15 o 164.8234 2.574916  18.11216       0.5655296     18.00861       0.5805895     20.03083       2.499197      164.3483 2.651127  172.0210 10.95999  -7.672714      11.27607  
1 1 1 9  17 16 o 174.1775 1.444262  20.21749       0.3352058     20.28816       0.3384400     16.57276       2.430493      174.4814 1.455657  156.1116 11.77055  18.36983       11.86022  
1 1 1 9  17 17 o 187.0669 7.358675  23.50412       1.830721      23.92805       2.079242      22.04194       3.861526      188.5446 8.296250  178.3022 16.43773  10.24243       18.41268  
1 1 1 9  17 18 o 96.18894 4.358066  6.193205       0.5571381     6.615381       0.5725570     -1.330032      2.416988      99.42249 4.332158  42.31300 19.31014  57.10950       19.79012  
1 1 1 9  17 19 o 67.82829 5.861366  3.104788       0.5245720     3.085989       0.5251325     11.89656       11.35642      67.61738 5.886857  117.6823 47.31792  -50.06490      47.68270  
1 1 1 9  17 20 o 112.2323 5.632961  8.464321       0.8397259     8.611650       0.8491499     1.937125       5.652031      113.2048 5.647018  74.51440 31.91558  38.69042       32.41131  
1 1 1 9  17 21 o 89.07040 5.154796  5.335989       0.6091987     5.483958       0.6147661     -2.722947      4.536933      90.30496 5.129970  54.20143 25.33237  36.10353       25.84658  
1 1 1 9  17 22 o 91.11297 5.186364  5.591055       0.6270747     5.471826       0.6405960     8.326302       3.068246      90.10014 5.359847  102.7758 22.98135  -12.67568      23.59810  
1 1 1 9  17 23 o 114.5928 6.711328  8.915723       1.020315      8.733532       1.042144      13.12863       5.011363      113.3409 6.933467  119.2980 31.18205  -5.957123      31.94360  
1 1 1 9  17 24 o 90.81931 19.54076  6.562756       2.294616      6.125992       3.331608      6.956916       3.164955      82.05158 26.63667  88.50694 25.46853  -6.455360      36.85320  
1 1 1 9  17 25 o 89.87580 5.764737  5.496260       0.6867517     5.504606       0.6902688     4.683458       6.811759      89.93590 5.790628  71.50171 32.54834  18.43419       33.05943  
1 1 1 9  17 26 o 80.21712 11.58257  4.699208       1.202259      3.453959       3.880626      4.831420       1.264473      63.09581 26.71422  81.05904 12.07464  -17.96323      29.31632  
1 1 1 9  17 27 o 21.37001 10.11668  -0.7758924     0.7657674     0.8414090E-01  3.027676      -0.8346685     0.7915019     46.73870 21.43597  21.52879 10.21912  25.20992       23.74724  
1 1 1 9  17 28 o 67.08342 9.295692  3.246159       0.8086396     6.049495       4.703732      3.160784       0.8208607     67.65723 29.04943  66.01251 9.614147  1.644722       30.59904  
1 1 1 9  17 29 o 62.12176 12.92596  3.011029       1.035116      -4.084455      2.933326      4.020271       1.106285      34.58443 17.11833  72.86302 11.79729  -38.27859      20.78974  
1 1 1 9  18 0  o 678.8489 12.95131  308.6426       11.70587      308.6426       11.70587      308.6426       11.70587      678.8489 12.95131  678.8489 12.95131  0.000000       0.000000  
1 1 1 9  18 1  o 185.3513 8.516776  23.02001       2.097887      21.31485       2.477347      27.34265       3.944383      178.0721 10.48684  200.9540 14.83480  -22.88194      18.16714  
1 1 1 9  18 2  o 211.8861 9.013596  30.08882       2.539105      31.20722       4.092160      29.38870       3.237738      214.8376 14.37725  208.9851 11.67299  5.852432       18.51929  
1 1 1 9  18 3  o 334.0662 8.886024  74.71235       3.952097      74.37883       5.190965      75.17226       6.095613      332.7297 11.72634  333.9907 13.72575  -1.260986      18.05279  
1 1 1 9  18 4  o 127.8560 6.945327  10.95153       1.178837      13.47238       2.282961      10.03502       1.376551      141.1145 12.26260  122.1973 8.507021  18.91715       14.92450  
1 1 1 9  18 5  o 369.2339 8.887552  91.23531       4.372776      80.18061       5.667633      107.4941       6.873412      345.2235 12.34033  399.6035 12.92532  -54.38000      17.87030  
1 1 1 9  18 6  o 204.5075 7.507051  27.99523       2.042276      27.95427       2.348072      28.12249       4.138672      204.2026 8.648903  203.4772 15.37795  0.7254486      17.64327  
1 1 1 9  18 7  o 308.1184 5.909598  63.39135       2.426326      59.26594       3.206694      68.91625       3.710961      297.5300 8.095748  320.7415 8.690766  -23.21149      11.87731  
1 1 1 9  18 8  o 116.2425 2.247272  9.005742       0.3480919     9.144356       0.3575952     6.501306       1.520001      117.1329 2.291075  97.61537 11.93347  19.51748       12.15141  
1 1 1 9  18 9  o 290.5490 5.908286  56.38533       2.287464      56.35660       2.645450      56.47045       4.553749      290.3521 6.837558  289.4501 11.83146  0.9020691      13.66512  
1 1 1 9  18 10 o 201.3594 6.898248  27.14465       1.848172      26.91983       2.118028      27.86213       3.783735      200.3646 7.948769  202.4759 14.11240  -2.111282      16.19700  
1 1 1 9  18 11 o 119.2923 9.812649  9.620413       1.546034      8.921839       1.656385      14.34532       4.307764      114.6355 10.97744  141.8284 23.62432  -27.19292      26.05019  
1 1 1 9  18 12 o 353.7392 9.248024  84.07573       4.355450      79.81009       5.101570      95.54372       8.364796      343.9887 11.14448  373.5344 16.84887  -29.54568      20.20108  
1 1 1 9  18 13 o 151.0821 5.821601  15.28123       1.169811      15.42573       1.270739      14.47844       2.995164      151.7340 6.298621  144.8551 15.77157  6.878891       16.98279  
1 1 1 9  18 14 o 122.0230 9.908978  10.08791       1.597326      10.41645       1.727072      8.144464       4.200495      123.8684 10.56421  104.2159 29.12533  19.65250       30.98205  
1 1 1 9  18 15 f 205.9604 4.087644  28.31755       1.121838      28.40187       1.167241      27.29654       4.061792      206.2508 4.247089  199.1207 15.42862  7.130157       16.00250  
1 1 1 9  18 16 o 18.95281 8.853254  -0.5320233     0.5529046     -0.7976796     0.5702623     3.633637       2.258169      17.69813 8.476022  71.26114 21.77325  -53.56301      23.36487  
1 1 1 9  18 17 o 205.7961 7.435749  28.48427       2.035734      27.67765       2.412115      30.48107       3.795160      202.4274 8.964657  210.6301 13.59445  -8.202728      16.28417  
1 1 1 9  18 18 o 108.5140 9.685580  8.032592       1.385800      7.232902       1.556152      11.09695       3.046217      102.3975 11.60946  124.0724 19.03166  -21.67486      22.29313  
1 1 1 9  18 19 o 121.2254 11.01493  10.11026       1.759891      10.01205       2.309707      10.24621       2.717430      119.1221 14.87417  119.2379 17.63404  -0.1158066     23.06947  
1 1 1 9  18 20 o 108.0764 7.941433  7.942946       1.135691      7.932421       1.168192      8.124248       4.848332      107.9373 8.183084  97.17802 32.16631  10.75933       33.19088  
1 1 1 9  18 21 o 129.1184 8.773592  11.41062       1.500554      11.09647       1.562174      15.15879       5.395946      127.1185 9.286535  131.0420 31.32742  -3.923576      32.67487  
1 1 1 9  18 22 o 42.47343 12.64688  1.295543       0.7689509     1.039920       0.7860245     6.988623       3.709451      38.98682 12.95318  88.49313 28.04576  -49.50630      30.89255  
1 1 1 9  18 23 o 100.9649 7.444057  6.992674       0.9944642     6.892282       1.025006      8.602360       4.104374      100.1167 7.743425  93.97285 29.46365  6.143806       30.46420  
1 1 1 9  18 24 o 37.61706 16.94942  -0.3171660     1.791358      -2.159218      2.422871      1.903926       2.660496      36.87212 17.60778  54.52746 22.52954  -17.65534      28.59396  
1 1 1 9  18 25 o 73.66519 7.840121  3.784083       0.7577792     3.980168       0.7784330     0.2353108      3.311601      75.56592 7.844767  49.64369 22.63542  25.92223       23.95626  
1 1 1 9  18 26 f 136.9021 7.282135  12.96159       1.323662      12.96946       1.377818      12.86731       4.768103      136.7273 7.592273  103.6712 31.63137  33.05606       32.52977  
1 1 1 9  18 27 o 24.24146 10.18437  0.1327152      0.5570037     -0.3458975     0.6566558     1.360485       1.051730      21.86663 10.01163  42.42958 14.95693  -20.56295      17.99841  
1 1 1 9  18 28 o 47.08421 7.266179  1.573042       0.4412310     0.7410190      0.5150904     3.866325       0.8551547     32.07662 10.47779  73.33179 8.935712  -41.25517      13.77066  
1 1 1 9  19 0  o 170.0167 1.088378  19.26178       0.2465498     19.26178       0.2465498     19.26178       0.2465498     170.0167 1.088378  170.0167 1.088378  0.000000       0.000000  
1 1 1 9  19 1  o 109.9973 1.968197  8.063367       0.2884856     8.052234       0.2951420     8.301882       1.366058      109.9207 2.015014  110.9300 9.327920  -1.009285      9.543080  
1 1 1 9  19 2  f 313.8950 7.643521  65.89756       3.197064      64.04568       3.908931      69.63943       5.556454      308.9883 9.505154  321.2725 13.00617  -12.28418      16.10926  
1 1 1 9  19 3  o 220.3474 6.991972  32.48669       2.050364      31.30636       2.723845      34.02994       3.114586      215.9153 9.490468  224.9514 10.41884  -9.036041      14.09330  
1 1 1 9  19 4  o 263.2111 8.448334  46.43206       2.959279      47.09733       4.517027      45.93182       3.916935      264.0703 12.87570  261.1864 11.28100  2.883911       17.11854  
1 1 1 9  19 5  o 415.2350 9.028982  115.5443       4.995814      112.8388       7.290108      117.9398       6.859807      408.7150 13.40379  418.3018 12.32032  -9.586884      18.20582  
1 1 1 9  19 6  o 90.28294 7.212612  5.486048       0.8604941     6.467381       0.9721445     1.934849       1.849311      98.03631 7.498578  56.31183 19.83480  41.72448       21.20490  
1 1 1 9  19 7  o 278.6376 7.460413  51.99069       2.767484      52.39685       3.615786      51.41621       4.300225      279.2306 9.732640  276.0715 11.71614  3.159119       15.23129  
1 1 1 9  19 8  o 173.3988 6.180922  20.12132       1.425863      18.65046       1.853627      22.25296       2.231488      166.6193 8.375648  181.8838 9.237439  -15.26445      12.46923  
1 1 1 9  19 9  o 129.8131 7.363091  11.31699       1.268434      11.93428       1.506210      9.811603       2.352152      133.1407 8.534826  119.2545 15.14286  13.88614       17.38245  
1 1 1 9  19 10 o 130.0374 0.7932348 11.26693       0.1374496     11.26745       0.1375608     10.94586       3.419436      130.0403 0.7938582 123.9587 21.47947  6.081604       21.49413  
1 1 1 9  19 11 o 231.2156 9.299417  35.98405       2.859299      41.31519       3.850786      29.43280       4.268756      247.0532 11.73081  207.1326 15.58025  39.92055       19.50271  
1 1 1 9  19 12 o 226.9861 7.864088  34.59539       2.375005      34.80372       2.795216      34.05450       4.503934      227.3338 9.246664  222.8371 15.26020  4.496658       17.84305  
1 1 1 9  19 13 o 144.7843 10.45419  14.21355       2.003325      14.38881       2.219841      13.44431       4.650597      145.4022 11.55206  134.6204 26.86720  10.78181       29.24545  
1 1 1 9  19 14 o 222.3753 7.998232  33.25676       2.366171      32.64969       2.566924      36.68879       6.103345      220.1267 8.768729  228.0076 20.30044  -7.880875      22.11331  
1 1 1 9  19 15 o 38.53957 12.86725  0.9615110      0.7754411     1.019916       0.7808853     -3.183328      6.578319      39.36757 12.90346  67.47353 31.18029  -28.10595      33.74477  
1 1 1 9  19 16 o 79.73414 5.813492  4.281343       0.6134237     4.504882       0.6327859     0.7953291      2.498879      81.79528 5.844212  52.48797 21.77418  29.30731       22.54484  
1 1 1 9  19 17 o 111.6002 8.917168  8.474133       1.315044      8.461943       1.449409      8.530892       3.127399      111.2588 9.879090  106.4101 22.74563  4.848694       24.79839  
1 1 1 9  19 18 o 53.26132 14.62894  2.044557       1.069905      1.631784       1.151378      4.655433       2.895713      48.52896 15.65113  77.87025 24.79124  -29.34130      29.31832  
1 1 1 9  19 19 o 67.08756 11.64045  3.185989       1.002890      3.322109       1.033377      0.9806728      4.159420      68.50501 11.74282  62.16581 27.00483  6.339199       29.44748  
1 1 1 9  19 20 o 158.6450 7.992104  17.15049       1.684069      17.76074       1.866585      14.47986       3.904835      161.1071 8.727387  136.0480 22.31235  25.05904       23.95847  
1 1 1 9  19 21 o 100.9670 9.839856  7.102503       1.307081      7.431393       1.409541      5.083806       3.492114      103.0354 10.40896  76.51432 27.22724  26.52112       29.14909  
1 1 1 9  19 22 o 43.07200 13.32756  1.351758       0.8428013     1.406481       0.8775484     0.7015060      3.025021      43.86816 13.60380  51.65225 22.71874  -7.784084      26.48027  
1 1 1 9  19 23 o 46.01859 13.88362  1.590177       0.9221382     1.299912       0.9746803     4.066755       2.847025      42.50559 14.42695  67.30013 24.50221  -24.79454      28.43405  
1 1 1 9  19 24 o 27.50177 11.68286  0.1226457      0.7463773     -0.2251177     0.7686917     5.853034       3.120342      25.00637 11.19827  76.89388 25.81359  -51.88751      28.13792  
1 1 1 9  19 25 o 28.30961 12.29410  0.3363914E-01  0.8615526     -0.8025399E-01 0.9003264     1.271144       2.967732      28.00820 12.35375  50.81980 22.42166  -22.81160      25.59973  
1 1 1 9  19 26 o 69.15514 12.76443  3.655819       1.132927      3.995206       1.188070      0.2522003      3.762400      72.34230 12.79257  49.22707 23.02750  23.11523       26.34228  
1 1 1 9  19 27 o 39.96616 14.40637  1.181023       0.9810275     1.083568       1.030116      2.131062       3.216297      39.13739 14.65030  52.69088 23.29025  -13.55349      27.51485  
1 1 1 9  20 0  o 319.6760 14.32274  69.05647       6.073161      69.05647       6.073161      69.05647       6.073161      319.6760 14.32274  319.6760 14.32274  0.000000       0.000000  
1 1 1 9  20 1  o 115.8202 4.911468  8.970948       0.7562794     8.876919       1.975916      8.987087       0.8186150     113.8801 13.26939  115.8875 5.315296  -2.007385      14.29437  
1 1 1 9  20 2  o 294.5529 9.306870  58.27499       3.648338      57.75060       3.863898      62.58531       11.07777      293.0659 9.908589  295.6832 28.46733  -2.617310      30.14248  
1 1 1 9  20 3  o 250.9626 8.710274  42.27995       2.908409      41.83820       3.431708      43.40618       5.479513      249.2604 10.35453  251.9083 16.41335  -2.647949      19.40656  
1 1 1 9  20 4  o 366.5621 9.897243  90.34367       4.829895      91.57707       7.763866      89.56496       6.168933      366.4274 15.93884  363.8950 12.74181  2.532410       20.40589  
1 1 1 9  20 5  o 234.9547 7.057559  36.97559       2.207087      33.54401       4.344573      38.16924       2.562355      221.7737 14.78602  238.5269 8.073368  -16.75327      16.84653  
1 1 1 9  20 6  o 210.9897 8.468955  29.90214       2.376190      28.52085       3.246410      31.49611       3.487399      205.2311 11.92231  215.6271 12.18698  -10.39600      17.04887  
1 1 1 9  20 7  o 156.6944 9.054213  16.54089       1.882454      15.08644       3.337061      17.21974       2.279820      147.4532 17.31330  159.5253 10.78847  -12.07202      20.39954  
1 1 1 9  20 8  f 39.54063 15.03469  0.7648515      1.094529      0.8399483      1.493699      0.6777721      1.608460      44.35669 17.37514  44.29814 17.80908  0.5854416E-01  24.88089  
1 1 1 9  20 9  o 183.5475 10.04202  22.74907       2.446728      20.44501       3.327261      25.46204       3.610453      172.6809 14.59661  192.9919 14.13750  -20.31100      20.32068  
1 1 1 9  20 10 o 78.72495 14.35050  4.346302       1.449955      3.551425       1.646371      7.094096       3.061048      70.46146 17.59040  98.34200 23.65020  -27.88054      29.47464  
1 1 1 9  20 11 o 149.2759 2.781545  14.86017       0.5532856     14.87209       0.5583047     14.20611       4.135578      149.3345 2.805676  140.2110 22.92668  9.123596       23.09772  
1 1 1 9  20 12 o 180.2311 6.679268  21.79713       1.601328      19.11801       2.488611      23.69024       2.091932      167.6766 11.20236  187.5263 8.392935  -19.84969      13.99765  
1 1 1 9  20 13 o 165.8407 10.05045  18.65546       2.210582      17.68388       2.460100      22.72938       5.037531      160.9911 11.54436  177.7253 21.72228  -16.73413      24.59939  
1 1 1 9  20 14 o 101.6312 9.597335  7.043468       1.284332      7.231019       1.322654      3.946846       5.374405      102.9474 9.758287  81.96298 32.68836  20.98443       34.11382  
1 1 1 9  20 15 o 122.4144 5.719022  10.06598       0.9303055     9.908621       0.9450238     15.00004       5.291763      121.4274 5.857813  137.3337 29.77658  -15.90633      30.34730  
1 1 1 9  20 16 o 70.16756 19.62087  3.663244       1.905742      3.086108       2.099231      6.368136       4.544607      65.19312 21.14227  89.28046 31.11972  -24.08733      37.62223  
1 1 1 9  20 17 o 147.3023 10.95618  14.96262       2.135113      16.53850       2.425932      9.546652       4.497344      154.4540 11.87824  105.9876 30.31608  48.46642       32.56005  
1 1 1 9  20 18 o 43.00579 13.84271  1.285231       0.9009689     1.213143       0.9272208     2.504515       3.813315      42.23061 14.06962  66.03951 27.09649  -23.80890      30.53152  
1 1 1 9  20 19 o 46.88257 17.40619  1.388489       1.448289      2.257140       1.650005      -1.526884      3.022800      55.52772 18.77152  45.13614 20.95450  10.39158       28.13291  
1 1 1 9  20 20 o 74.88353 14.95968  4.191953       1.440469      3.912931       1.673225      4.990808       2.831193      70.86964 17.75663  76.14638 24.54128  -5.276733      30.29145  
1 1 1 9  20 21 f 54.26979 15.77642  2.264462       1.208749      2.082674       1.372048      2.894691       2.554680      52.24154 17.10287  60.58722 22.98523  -8.345680      28.65012  
1 1 1 9  20 22 o 35.94108 14.38841  0.6278201      1.045280      0.4084606      1.141400      1.768129       2.602381      35.09714 14.65038  53.28016 22.17158  -18.18302      26.57466  
1 1 1 9  20 23 o 57.56586 16.27641  2.650856       1.303862      2.740398       1.368796      1.773704       4.284114      58.30095 16.74047  57.78073 26.10684  0.5202179      31.01307  
1 1 1 9  20 24 o 45.52669 14.71244  1.600973       1.017084      1.758032       1.066928      0.3688186E-01  3.366934      47.39399 15.04362  48.11178 22.25904  -0.7177963     26.86588  
1 1 1 9  20 25 o 57.09748 14.17895  2.589718       1.073853      2.704678       1.198641      2.122240       2.417106      57.64655 15.33715  51.86068 21.45541  5.785873       26.37352  
1 1 1 9  21 0  o 245.1748 8.523037  40.33662       2.776839      40.33662       2.776839      40.33662       2.776839      245.1748 8.523037  245.1748 8.523037  0.000000       0.000000  
1 1 1 9  21 1  o 207.8101 3.467883  28.80657       0.9602947     32.42136       2.353362      28.08444       1.051849      219.7483 8.050529  205.1608 3.847562  14.58749       8.922710  
1 1 1 9  21 2  o 124.4289 9.100701  10.45438       1.498497      10.04294       1.810506      11.34923       2.670077      121.4991 11.31286  127.9806 16.00592  -6.481499      19.60026  
1 1 1 9  21 3  o 216.3467 7.627602  31.40630       2.195491      34.91053       3.799881      29.65028       2.689916      226.7534 12.62586  209.7568 9.649709  16.99661       15.89117  
1 1 1 9  21 4  o 274.7330 10.74699  50.96169       3.926745      40.41797       7.682505      54.69039       4.568614      237.9751 24.58022  284.1254 12.09471  -46.15033      27.39470  
1 1 1 9  21 5  o 221.8803 8.812576  33.12077       2.600342      26.54790       7.272579      34.08426       2.784413      189.2617 29.82320  224.9643 9.308632  -35.70251      31.24218  
1 1 1 9  21 6  o 198.7359 8.980568  26.59980       2.372084      20.09793       6.325279      27.66385       2.558832      163.8400 30.08068  202.5497 9.507145  -38.70970      31.54732  
1 1 1 9  21 7  o 143.5713 9.619532  13.93890       1.829708      13.61614       2.255898      14.55946       3.128036      141.2875 12.09869  144.7376 16.51385  -3.450089      20.47158  
1 1 1 9  21 8  o 95.62843 11.50637  6.274449       1.436795      4.073613       2.102724      8.201997       1.967845      75.05598 20.46534  108.8806 13.87836  -33.82464      24.72729  
1 1 1 9  21 9  o 136.4320 8.974947  12.58258       1.622568      11.79388       1.781094      16.43092       3.934300      131.7831 10.22258  152.1283 19.88358  -20.34517      22.35750  
1 1 1 9  21 10 o 91.93395 12.57506  5.853414       1.500160      5.513459       1.871178      6.465057       2.509887      88.01334 16.56252  94.14422 20.58253  -6.130882      26.41889  
1 1 1 9  21 11 o 53.87554 18.22734  1.927479       1.555738      1.773684       1.820508      2.343884       2.995560      54.01229 19.60366  64.59751 24.79597  -10.58522      31.60923  
1 1 1 9  21 12 o 231.0594 8.854383  36.09377       2.721140      36.93158       3.652882      35.04920       4.078797      232.4162 11.83389  225.4586 13.64043  6.957581       18.05830  
1 1 1 9  21 13 f 73.24591 9.058719  3.682447       0.8653205     2.070682       1.518283      4.457860       1.053097      54.76418 17.99471  80.44566 10.04220  -25.68149      20.60716  
1 1 1 9  21 14 o 46.72866 13.49270  1.548354       0.8868689     1.691897       0.9140898     -0.7546545     3.661385      48.69076 13.57906  54.10958 24.31883  -5.418827      27.85312  
1 1 1 9  21 15 o 91.68052 7.231291  5.706002       0.8762707     5.761229       0.9546039     5.410325       2.208815      91.97137 7.864681  84.57885 19.92801  7.392517       21.42379  
1 1 1 9  21 16 o 119.5068 14.14283  10.16987       2.208580      9.680326       2.627296      11.34917       4.077789      114.5003 17.79767  117.5313 26.65314  -3.031006      32.04913  
1 1 1 9  21 17 o 70.75027 21.45230  3.948428       2.197720      4.059638       2.741765      3.748547       3.675737      71.32826 24.19697  70.64141 27.37388  0.6868515      36.53523  
1 1 1 9  21 18 o 91.14954 6.614443  5.657391       0.7979144     5.951320       0.8189268     0.1491783      3.545108      93.49842 6.615778  53.58005 24.01716  39.91837       24.91170  
1 1 1 9  21 19 o 102.8630 13.09555  7.684965       1.754328      11.13736       2.405228      3.760498       2.564404      122.5535 15.04365  66.99097 23.37487  55.56251       27.79741  
1 1 1 9  21 20 o 35.79613 16.23807  -0.4724343     1.677192      -4.416140      2.279025      4.186795       2.477159      30.28671 15.00841  69.14519 22.99575  -38.85848      27.46010  
1 1 1 9  21 21 o 54.88480 20.12646  2.375099       1.926103      4.720667       3.351093      1.217943       2.353739      69.96430 26.37411  49.10103 20.79778  20.86327       33.58782  
1 1 1 9  21 22 o 43.63091 17.75598  1.081346       1.621001      4.447734       2.919749      -0.4186076     1.948958      67.85293 24.79630  38.03814 17.35187  29.81479       30.26457  
1 1 1 9  21 23 o 56.10669 20.58395  2.731090       2.015025      -5.683422      4.719957      4.606505       2.228292      43.12426 21.40952  70.41248 21.65035  -27.28822      30.44840  
1 1 1 9  21 24 o 53.07741 15.04875  2.282453       1.113031      3.250749       1.245148      -1.567786      2.482910      63.57624 14.95055  37.45131 17.86786  26.12492       23.29763  
1 1 1 9  22 0  o 218.6118 6.900238  32.02726       2.005532      32.02726       2.005532      32.02726       2.005532      218.6118 6.900238  218.6118 6.900238  0.000000       0.000000  
1 1 1 9  22 1  o 52.83420 9.714149  1.938609       0.6587073     0.9289541      1.044609      2.605088       0.8487118     40.60140 14.83260  61.23370 10.79588  -20.63231      18.34549  
1 1 1 9  22 2  o 82.83709 10.20267  4.696928       1.102424      5.554952       2.235236      4.421126       1.267279      87.67742 19.62265  79.84869 12.30527  7.828735       23.16178  
1 1 1 9  22 3  o 70.39963 8.630493  3.381061       0.7927007     2.327768       1.212857      4.166517       1.047360      57.29018 15.51032  77.90881 10.34407  -20.61862      18.64322  
1 1 1 9  22 4  o 72.77246 14.68713  3.747050       1.375068      4.280314       1.830857      3.057012       2.082667      77.08375 18.13037  66.09418 21.02274  10.98956       27.76087  
1 1 1 9  22 5  o 110.2597 10.43671  8.286768       1.515143      8.021067       1.859828      8.811101       2.612643      107.7283 13.23368  111.3088 18.24643  -3.580536      22.54024  
1 1 1 9  22 6  o 148.3653 5.248528  14.74035       1.035998      15.24250       2.357910      14.62023       1.153280      149.3273 11.94953  147.6647 5.872883  1.662598       13.31473  
1 1 1 9  22 7  o 100.3033 14.36481  7.032207       1.865201      7.825099       2.391147      5.799988       2.980869      104.7109 17.77195  88.01225 24.51272  16.69869       30.27731  
1 1 1 9  22 8  o 80.21375 14.91235  4.564870       1.535273      5.153360       2.117590      3.912765       2.229108      83.97823 19.32507  73.12675 21.47106  10.85148       28.88710  
1 1 1 9  22 9  f 101.3320 10.68934  7.046594       1.421625      7.771270       1.654272      4.999932       2.780084      106.1119 11.90458  81.60966 23.98266  24.50227       26.77475  
1 1 1 9  22 10 o 28.23721 13.61949  -2.258246      1.533470      -2.932483      1.720113      0.3526483      3.384897      28.67903 13.97013  56.73376 24.50343  -28.05473      28.20607  
1 1 1 9  22 11 o 76.47005 16.46906  4.251385       1.628523      3.471145       1.970331      5.933551       2.893074      68.51070 20.20520  87.73127 24.03952  -19.22057      31.40300  
1 1 1 9  22 12 o 61.99323 17.98627  2.821198       1.572489      3.093775       1.729037      1.517135       3.781895      64.70351 18.88569  63.15885 26.53616  1.544655       32.57049  
1 1 1 9  22 13 o 88.71200 18.08821  5.847146       2.065639      6.427454       2.366820      3.992355       4.231395      92.23047 19.84699  75.23122 29.30920  16.99924       35.39678  
1 1 1 9  22 14 o 42.13197 14.82796  1.147704       1.033360      2.013950       2.314346      0.9320027      1.154872      56.87907 21.80466  40.87046 15.46589  16.00860       26.73270  
1 1 1 9  22 15 o 65.43605 21.35843  3.307837       2.140534      4.195915       3.100458      2.499031       2.958849      72.38081 25.66525  61.93614 24.39613  10.44466       35.41012  
1 1 1 9  22 16 o 52.71882 19.08378  1.945368       1.723735      -1.459106      2.206128      7.281334       2.761927      37.94626 17.71198  94.47738 22.29968  -56.53112      28.47789  
1 1 1 9  22 17 o 21.68350 10.46095  -1.301555      0.9059733     -1.627697      0.9641429     1.159224       2.648344      21.39552 10.43037  51.88411 22.02236  -30.48859      24.36753  
1 1 1 9  22 18 o 97.53441 6.788521  6.510925       0.8767735     6.972427       0.9482588     3.791596       2.301817      100.8219 7.103746  66.81622 22.16528  34.00568       23.27580  
1 1 1 9  22 19 o 21.43638 10.19820  -0.9044940     0.7971408     -0.5211624     0.9155786     -2.105287      1.620475      25.60538 11.75990  28.78743 13.91331  -3.182051      18.21744  
1 1 1 9  22 20 o 47.09822 17.33116  1.610972       1.430233      2.957469       1.795815      -0.7244368     2.365051      59.46299 19.57198  40.50656 18.71046  18.95643       27.07663  
1 1 1 9  22 21 o 74.91818 15.24243  4.406913       1.469808      5.364298       2.063173      3.420304       2.094424      78.96286 19.67939  61.97988 21.14644  16.98298       28.88686  
1 1 1 9  22 22 o 26.63072 13.22420  -3.551593      1.804875      -2.658228      2.912738      -4.108412      2.299557      38.06939 18.45996  30.26136 15.00981  7.808031       23.79211  
1 1 1 9  22 23 f 59.66792 19.73134  3.219936       1.824459      4.481207       3.326287      2.677202       2.181970      63.97741 25.64839  54.83384 21.13282  9.143574       33.23306  
1 1 1 9  23 0  o 43.84027 18.93871  1.866914       1.138779      1.866914       1.138779      1.866914       1.138779      43.84027 18.93871  43.84027 18.93871  0.000000       0.000000  
1 1 1 9  23 1  o 97.75589 1.289492  6.368626       0.1679713     5.444252       1.423302      6.381682       0.1691533     88.51132 12.40804  97.85587 1.297239  -9.344551      12.47567  
1 1 1 9  23 2  o 49.39447 19.50961  1.095802       1.896914      -0.8280308     2.412170      4.213652       3.070803      44.03336 19.76874  76.39409 25.60742  -32.36073      32.35032  
1 1 1 9  23 3  o 99.94363 8.269207  6.775254       1.091419      6.335534       1.603972      7.154393       1.489389      95.39426 12.95260  102.0077 11.13802  -6.613441      17.08289  
1 1 1 9  23 4  o 104.9195 8.429838  7.469935       1.168642      7.209285       1.781495      7.666824       1.548342      101.6417 13.48589  105.5921 11.17360  -3.950371      17.51339  
1 1 1 9  23 5  o 184.6517 6.672894  22.92775       1.639178      24.02031       2.143805      21.38998       2.543368      188.4521 8.559455  177.0103 10.83485  11.44177       13.80790  
1 1 1 9  23 6  o 51.47939 11.91820  1.882573       0.8014072     0.9456541      1.847328      2.099779       0.8894644     47.71714 19.11938  54.29807 12.54551  -6.580933      22.86790  
1 1 1 9  23 7  o 95.34769 9.675949  6.230466       1.212350      6.839406       2.720171      6.079524       1.354296      95.19198 21.90071  93.78127 11.04920  1.410713       24.53010  
1 1 1 9  23 8  o 85.99329 1.031297  4.928019       0.1181739     3.847275       3.068090      4.929625       0.1182617     72.74495 25.55413  86.00729 1.031895  -13.26234      25.57496  
1 1 1 9  23 9  f 72.82112 8.922822  3.648974       0.8477601     5.322529       1.487977      2.844643       1.031558      86.73853 13.29729  63.13663 12.70181  23.60189       18.38896  
1 1 1 9  23 10 o 108.0289 10.39643  8.057172       1.478113      4.855472       2.379145      10.06986       1.886336      79.25286 21.83332  120.2456 11.92984  -40.99271      24.88001  
1 1 1 9  23 11 o 211.2061 9.635372  30.55324       2.704599      27.94469       3.723130      33.46781       3.935458      198.8721 14.14177  218.1686 13.60493  -19.29651      19.62355  
1 1 1 9  23 12 o 96.99075 11.00219  6.576715       1.396855      3.660420       1.811970      10.84860       2.193033      69.08734 19.06219  123.5079 13.54737  -54.42061      23.38586  
1 1 1 9  23 13 f 71.61239 15.33697  3.812899       1.419427      1.107285       2.539984      5.041547       1.711637      52.08502 21.80621  82.17387 16.20772  -30.08885      27.16985  
1 1 1 9  23 14 f 35.56056 16.69475  -1.545914      2.008040      -1.014982      4.764542      -1.660590      2.214303      56.44675 26.24034  37.26400 17.50607  19.18275       31.54390  
1 1 1 9  23 15 o 33.64597 13.69042  0.4319091      0.9634916     11.18102       6.128434      0.1594891      0.9756243     97.51578 35.87699  31.47843 13.36402  66.03735       38.28518  
1 1 1 9  23 16 o 38.02288 17.62531  -1.038513      2.126267      -1.891770      2.564863      0.8363709      3.801994      39.10501 18.51324  55.46645 24.86670  -16.36144      31.00150  
1 1 1 9  23 17 o 64.32616 11.01725  2.999083       0.9104043     3.878506       1.064600      0.6056175      1.756310      73.20514 11.27509  42.18076 17.92006  31.02438       21.17205  
1 1 1 9  23 18 o 81.98219 10.66831  4.831554       1.137821      4.105039       1.227834      9.248603       3.027496      74.27207 12.87248  102.5284 22.75417  -28.25633      26.14294  
1 1 1 9  23 19 o 50.01842 12.63980  1.898979       0.8426684     2.450324       0.9248985     -0.7946004     2.044313      56.98847 12.52221  37.34365 17.30068  19.64482       21.35695  
1 1 1 9  23 20 o 70.37030 16.39988  4.024998       1.509239      3.358017       2.591252      4.367419       1.856664      60.25725 23.07915  71.00510 19.17624  -10.74786      30.00626  
1 1 1 9  23 21 o 44.52238 17.37077  1.404566       1.488067      3.295322       2.083726      -0.5633036     2.125793      59.83620 21.05623  38.16059 17.66621  21.67561       27.48562  
1 1 1 9  24 0  o 17.13229 11.73243  -0.5378463     0.8517659     -0.5378463     0.8517659     -0.5378463     0.8517659     17.13229 11.73243  17.13229 11.73243  0.000000       0.000000  
1 1 1 9  24 1  o 185.7622 6.857674  23.26243       1.694578      23.29581       2.414493      23.23002       2.378895      184.7611 9.842647  184.5589 9.707254  0.2022247      13.82420  
1 1 1 9  24 2  o 66.14011 22.77623  3.134953       2.431147      3.373424       2.532149      0.3233370      8.694612      68.12901 23.25127  79.82217 36.50267  -11.69315      43.27894  
1 1 1 9  24 3  o 112.9533 12.90135  8.927616       1.907030      8.173810       2.513118      9.950913       2.928087      105.4233 18.56766  115.9418 19.65393  -10.51851      27.03766  
1 1 1 9  24 4  o 50.93616 17.10123  1.782676       1.369491      2.748237       1.857022      0.6314463      2.027721      61.49775 19.88046  46.84384 19.53829  14.65391       27.87432  
1 1 1 9  24 5  o 90.02258 14.73121  5.814152       1.706046      3.897253       1.982704      11.28127       3.348401      71.75175 19.99454  122.1189 21.35408  -50.36715      29.25369  
1 1 1 9  24 6  f 105.5470 11.10178  7.737960       1.538040      8.640111       1.687703      3.317455       3.735875      111.4130 11.53472  70.38670 27.50570  41.02628       29.82639  
1 1 1 9  24 7  o 83.00059 24.38711  5.526731       2.874858      1.940014       3.771155      10.50315       4.442058      63.73510 26.61902  110.6299 29.56670  -46.89480      39.78394  
1 1 1 9  24 8  o 161.0512 8.940416  17.74444       1.911119      15.92437       4.767260      18.09295       2.086081      139.3460 26.64518  162.2613 9.692292  -22.91524      28.35324  
1 1 1 9  24 9  o 47.54730 16.78319  1.518906       1.324579      1.694522       1.401132      0.4225132E-01  4.062902      49.61740 17.28031  57.25812 25.68506  -7.640724      30.95693  
1 1 1 9  24 10 o 20.58978 8.918114  -0.4331918E-01 0.4509238     0.1397983      0.9814177     -0.9232064E-01 0.5076841     31.65590 13.42001  21.36517 9.354849  10.29074       16.35879  
1 1 1 9  24 11 o 25.15630 10.42679  0.1452955      0.5723151     -0.1272102     2.546015      0.1597980      0.5873468     45.98671 20.50146  25.58897 10.58046  20.39774       23.07068  
1 1 1 9  24 12 o 90.15562 11.72537  5.806525       1.375277      7.478785       2.715896      5.229850       1.594875      95.41718 21.83434  83.87496 14.81131  11.54221       26.38396  
1 1 1 9  24 13 o 63.01374 17.06281  3.104864       1.467657      -2.118842      2.771935      5.139718       1.730057      40.37427 19.15278  81.83703 16.43620  -41.46276      25.23842  
1 1 1 9  24 14 o 84.70506 16.02159  5.504070       1.742151      8.985299       3.314090      4.174716       2.047945      100.1001 24.93848  70.70184 20.52997  29.39829       32.30182  
1 1 1 9  24 15 o 25.82492 12.63545  -2.412129      1.452571      9.234709       6.603950      -3.004252      1.489038      83.66717 35.10381  24.71313 12.22584  58.95404       37.17188  
1 1 1 9  24 16 o 116.6611 5.922604  9.270757       0.9176754     10.17210       1.007298      4.871049       2.225489      122.0815 6.212480  74.77596 21.30564  47.30550       22.19291  
1 1 1 9  24 17 o 76.66087 10.41082  4.236837       1.036030      5.394219       1.299626      2.219061       1.715997      85.85962 11.66049  52.78810 19.05009  33.07152       22.33546  
1 1 1 9  24 18 o 93.40976 9.546029  6.222377       1.171509      7.336694       1.422506      3.873508       2.065281      100.6224 10.77695  65.53394 20.94485  35.08847       23.55481  
1 1 1 9  24 19 o 24.83864 11.70536  -0.8593050     1.003793      -3.271659      1.324270      2.398598       1.538952      21.67278 10.84973  53.44752 18.12839  -31.77473      21.12712  
1 1 1 9  25 0  o 21.32685 15.03487  -1.843907      1.695974      -1.843907      1.695974      -1.843907      1.695974      21.32685 15.03487  21.32685 15.03487  0.000000       0.000000  
1 1 1 9  25 1  o 63.93719 1.565894  2.725741       0.1334103     1.458057       2.033130      2.731223       0.1336984     51.35968 20.22508  64.00140 1.567701  -12.64171      20.28575  
1 1 1 9  25 2  o 81.13094 22.59749  5.276151       2.533184      3.583675       3.925670      6.483713       3.315946      70.73990 28.02644  87.73026 26.29597  -16.99036      38.43122  
1 1 1 9  25 3  o 70.10122 20.17730  3.826004       1.986248      8.808117       3.769983      1.911697       2.336891      101.3370 27.30707  55.86938 21.77687  45.46764       34.92718  
1 1 1 9  25 4  o 66.52770 16.70088  3.339857       1.478118      2.591991       2.357381      3.824366       1.897442      60.34424 22.24269  70.14380 19.56487  -9.799561      29.62299  
1 1 1 9  25 5  o 40.33865 18.72555  -1.403741      2.413082      -3.844164      3.275504      1.492837       3.568521      41.10235 19.84455  59.44400 25.40779  -18.34166      32.23914  
1 1 1 9  25 6  o 151.1603 14.01765  16.42665       2.791328      15.91523       3.122995      18.45801       6.224123      147.0049 16.21176  137.6602 34.10725  9.344711       37.76408  
1 1 1 9  25 7  o 107.6556 10.96382  8.150833       1.550870      7.547600       1.688396      11.40775       3.923151      102.7078 12.60033  115.0609 26.17942  -12.35309      29.05393  
1 1 1 9  25 8  o 236.2431 12.31117  39.58148       3.862165      39.51079       7.407492      39.60787       4.526041      214.2982 26.50495  233.4558 14.62268  -19.15759      30.27102  
1 1 1 9  25 9  o 126.3499 9.101348  11.07065       1.522069      9.696791       1.747709      15.38460       3.096964      116.9396 11.35882  143.0437 16.55289  -26.10409      20.07539  
1 1 1 9  25 10 o 190.9412 7.913956  25.03384       2.009205      24.75119       2.841376      25.31653       2.841515      186.8502 11.46723  189.1150 11.32780  -2.264847      16.11882  
1 1 1 9  25 11 o 193.9111 7.686066  25.81262       1.982071      26.90065       3.155106      25.10330       2.547508      193.6049 12.29343  189.1764 10.14298  4.428497       15.93764  
1 1 1 9  25 12 o 118.6077 9.773289  9.888297       1.530945      8.623870       2.660860      10.51400       1.871795      102.5979 20.18235  120.9481 11.76250  -18.35026      23.35987  
1 1 1 9  25 13 f 98.74614 11.19857  7.008289       1.447534      7.875353       2.218884      6.365875       1.909926      100.1172 17.25517  90.44433 16.45347  9.672844       23.84234  
1 1 1 9  25 14 o 75.80712 17.98491  4.682004       1.789182      7.452195       3.946249      3.965219       2.007354      83.00137 28.99431  67.86379 20.48624  15.13758       35.50150  
1 1 1 9  25 15 o 19.93119 7.878893  0.1640970      0.3096069     0.5246945E-01  1.026610      0.1752655      0.3247260     30.80146 13.39778  20.44527 8.073082  10.35619       15.64209  
1 1 1 9  25 16 o 24.79693 11.44913  -0.5300903     0.8841924     -0.7732572     0.8970181     7.791403       5.247466      23.66177 11.12418  75.84064 31.51538  -52.17888      33.42105  
1 1 1 9  25 17 o 56.15390 9.329903  2.278804       0.6736326     2.297381       0.6826696     1.591047       4.153759      56.34376 9.425316  54.83372 25.13343  1.510036       26.84261  
1 1 1 9  26 0  o 60.04384 17.58228  3.063127       1.221806      3.063127       1.221806      3.063127       1.221806      60.04384 17.58228  60.04384 17.58228  0.000000       0.000000  
1 1 1 9  26 1  o 69.80529 19.74336  3.920082       1.918164      4.186120       2.221220      3.139792       3.804064      71.20992 21.56145  65.58357 27.00290  5.626343       34.55506  
1 1 1 9  26 2  o 36.96785 17.24942  -1.323843      2.089519      -2.597235      2.627721      0.8660390      3.445948      38.07267 18.22333  54.89494 24.19255  -16.82226      30.28811  
1 1 1 9  26 3  o 43.56903 18.63826  0.5026489      1.923236      -0.2135295     3.395770      0.8408619      2.333581      50.73559 23.05061  48.36422 20.60542  2.371368       30.91786  
1 1 1 9  26 4  o 64.17786 20.78081  3.344138       2.028528      5.502096       3.090438      1.710580       2.688846      78.21883 25.67159  54.69799 22.62930  23.52084       34.22157  
1 1 1 9  26 5  o 48.08217 20.38655  0.9136710      2.265371      1.033018       2.875610      0.7184417      3.677868      52.22007 22.56955  55.00085 24.57220  -2.780777      33.36432  
1 1 1 9  26 6  o 54.96592 22.32237  1.928536       2.555701      0.3321705      3.149912      5.003993       4.372071      50.74263 22.70000  73.16647 29.38009  -22.42384      37.12788  
1 1 1 9  26 7  o 49.73536 20.33071  1.390571       2.136710      0.5685291      2.425320      4.241034       4.516267      47.14505 20.54856  69.64712 29.11230  -22.50207      35.63382  
1 1 1 9  26 8  o 37.56916 14.46612  0.8054957      1.021793      0.8474976      1.088072      0.4919049      2.973066      38.54149 14.90468  49.95717 22.22012  -11.41568      26.75599  
1 1 1 9  26 9  o 83.13344 13.56321  5.137528       1.450735      5.132858       1.619416      5.156506       3.264620      81.91866 15.40070  73.68749 26.31417  8.231163       30.48962  
1 1 1 9  26 10 o 89.58921 15.74174  6.178230       1.810691      4.832664       2.333805      8.213048       2.869954      74.21751 22.01624  97.00660 22.62039  -22.78909      31.56575  
1 1 1 9  26 11 o 59.92194 15.76313  2.831430       1.275309      -0.3035403     2.190508      4.438902       1.568555      40.83321 18.53658  75.12445 16.14980  -34.29124      24.58498  
1 1 1 9  26 12 o 97.13625 3.541262  6.343180       0.4575993     7.154703       1.724265      6.281693       0.4746183     97.58598 13.63141  96.62592 3.692985  0.9600601      14.12280  
1 1 1 9  26 13 o ?        ?         -0.6628714     0.7572594E-01 4.168892       1.879599      -0.6707268     0.7578748E-01 69.48663 19.50581  ?        ?         0.000000       19.50581  
1 1 1 9  26 14 o 59.71232 13.24773  2.740411       1.026515      -8.014899      6.267037      3.036921       1.040569      46.78271 23.44652  63.21033 12.79365  -16.42762      26.70987  
1 1 1 9  26 15 o 41.82162 15.69531  1.225636       1.183903      0.8309129      1.355733      2.493451       2.429717      39.53324 16.18137  54.71035 21.92511  -15.17711      27.24972  
1 1 1 9  27 0  o 145.9623 12.23087  15.01999       2.339034      15.01999       2.339034      15.01999       2.339034      145.9623 12.23087  145.9623 12.23087  0.000000       0.000000  
1 1 1 9  27 1  f 23.45543 8.703832  0.3049874      0.3620464     1.738853       1.858299      0.2484141      0.3691196     50.39958 19.48158  22.61746 8.698391  27.78212       21.33527  
1 1 1 9  27 2  o 39.87479 18.09018  -0.4164912     2.082286      1.143759       2.535636      -3.647922      3.649113      50.17752 21.43143  42.57588 20.64914  7.601635       29.76060  
1 1 1 9  27 3  o 44.21791 20.57812  -1.039236      2.942773      -0.6059628     4.004584      -1.547873      4.338911      51.50066 23.98011  50.80522 24.06029  0.6954460      33.96975  
1 1 1 9  27 4  o 98.24490 18.62407  7.750435       2.348932      6.494460       3.516509      8.762330       3.156378      80.82723 27.40339  98.81037 24.17420  -17.98314      36.54227  
1 1 1 9  27 5  f 50.20532 21.94061  0.9418343      2.780930      5.347494       6.402984      -0.8242106E-01 3.087316      71.94055 32.25996  47.98305 21.86946  23.95750       38.97408  
1 1 1 9  27 6  o 82.16595 23.27814  6.110825       2.664233      3.041153       3.508837      10.28992       4.094100      61.57077 25.69292  99.73996 29.04641  -38.16919      38.77912  
1 1 1 9  27 7  o 32.59862 16.01157  -3.702792      2.403166      -3.372518      3.191227      -4.135434      3.652455      39.51929 19.19999  41.06338 20.07953  -1.544094      27.78178  
1 1 1 9  27 8  o 66.77577 20.67259  3.890620       2.027449      6.170277       2.947313      1.842884       2.793370      79.76771 24.96142  53.54343 22.66720  26.22428       33.71756  
1 1 1 9  27 9  o 113.2426 8.129994  8.940156       1.218636      9.945574       1.390628      5.613033       2.529716      119.0014 8.832689  77.81494 22.87990  41.18641       24.52562  
1 1 1 9  27 10 o 66.52036 19.16452  3.799357       1.791068      1.685234       2.396272      6.475535       2.696053      50.73514 21.20638  82.82368 23.40044  -32.08854      31.57992  
1 1 1 9  27 11 o 80.07345 21.84110  5.865027       2.394444      6.453333       3.248159      5.164831       3.543607      78.09117 26.33764  69.25200 26.86585  8.839172       37.62241  
1 1 1 9  27 12 o 44.15803 16.94019  1.366000       1.397583      4.568657       2.340155      -0.4095869     1.742450      69.61801 22.29981  35.83045 16.36848  33.78756       27.66241  
1 1 1 9  28 0  o 46.70089 24.44935  2.574865       1.999899      2.574865       1.999899      2.574865       1.999899      46.70089 24.44935  46.70089 24.44935  0.000000       0.000000  
1 1 1 9  28 1  o 94.44132 13.14588  6.665240       1.609561      4.963110       2.287402      8.334612       2.265285      74.25582 21.73562  102.0424 17.27554  -27.78661      27.76475  
1 1 1 9  28 2  o 39.33209 17.35331  0.1803493      1.777687      -0.5369697E-03 2.746119      0.3108291      2.332319      45.36952 20.65790  44.02989 19.62611  1.339626       28.49444  
1 1 1 9  28 3  o 46.85007 21.36293  0.1100048      2.950296      -2.611231      5.490224      1.214864       3.498327      51.58874 25.09115  53.08461 23.82167  -1.495872      34.59824  
1 1 1 9  28 4  o 52.44057 20.97047  2.056016       2.217845      -0.1159119E-01 2.948909      4.748529       3.365164      46.34044 21.21666  68.25155 26.25992  -21.91111      33.75989  
1 1 1 9  28 5  o 49.58184 20.71954  1.542778       2.286723      3.908172       5.438133      1.034694       2.520379      64.37122 29.21586  48.09550 20.95534  16.27571       35.95404  
1 1 1 9  28 6  o 44.85067 20.63770  -0.2091251     2.838260      2.538461       4.461220      -2.077465      3.678798      59.23766 26.71448  44.52917 21.37922  14.70849       34.21600  
1 1 1 9  28 7  o 43.20800 19.44243  0.1784539      2.348097      -0.3288462     3.110748      0.8503013      3.579873      45.88364 21.28625  51.62715 23.53772  -5.743507      31.73529  
1 1 1 10 0  0  f 598.7867 47.69864  245.7176       37.48631      245.7176       37.48631      245.7176       37.48631      598.7867 47.69864  598.7867 47.69864  0.000000       0.000000  
1 1 1 10 0  1  o 208.8440 11.53307  29.35823       3.186990      29.35823       3.186990      29.35823       3.186990      208.8440 11.53307  208.8440 11.53307  0.000000       0.000000  
1 1 1 10 0  2  o 182.7784 8.407672  22.41346       2.037837      22.41346       2.037837      22.41346       2.037837      182.7784 8.407672  182.7784 8.407672  0.000000       0.000000  
1 1 1 10 0  3  o 70.38387 16.58589  3.807088       1.351124      3.807088       1.351124      3.807088       1.351124      70.38387 16.58589  70.38387 16.58589  0.000000       0.000000  
1 1 1 10 0  4  o 220.8886 9.587761  32.72067       2.809918      32.72067       2.809918      32.72067       2.809918      220.8886 9.587761  220.8886 9.587761  0.000000       0.000000  
1 1 1 10 0  5  o 349.6864 22.40093  82.89413       10.33854      82.89413       10.33854      82.89413       10.33854      349.6864 22.40093  349.6864 22.40093  0.000000       0.000000  
1 1 1 10 0  6  o 139.1454 18.71898  13.62866       3.294373      13.62866       3.294373      13.62866       3.294373      139.1454 18.71898  139.1454 18.71898  0.000000       0.000000  
1 1 1 10 0  7  o 25.00014 11.41407  0.6061242      0.4133050     0.6061242      0.4133050     0.6061242      0.4133050     25.00014 11.41407  25.00014 11.41407  0.000000       0.000000  
1 1 1 10 0  8  o 126.1099 1.361719  10.59996       0.2287685     10.59996       0.2287685     10.59996       0.2287685     126.1099 1.361719  126.1099 1.361719  0.000000       0.000000  
1 1 1 10 0  9  o 343.0806 14.44959  79.05425       6.579086      79.05425       6.579086      79.05425       6.579086      343.0806 14.44959  343.0806 14.44959  0.000000       0.000000  
1 1 1 10 0  10 o 64.16618 3.831251  2.772963       0.3248824     2.772963       0.3248824     2.772963       0.3248824     64.16618 3.831251  64.16618 3.831251  0.000000       0.000000  
1 1 1 10 0  11 o 926.3158 16.90425  574.5421       20.84982      574.5421       20.84982      574.5421       20.84982      926.3158 16.90425  926.3158 16.90425  0.000000       0.000000  
1 1 1 10 0  12 o 1200.004 24.36706  968.4620       38.92736      968.4620       38.92736      968.4620       38.92736      1200.004 24.36706  1200.004 24.36706  0.000000       0.000000  
1 1 1 10 0  13 o 249.5671 7.951716  41.65888       2.638282      41.65888       2.638282      41.65888       2.638282      249.5671 7.951716  249.5671 7.951716  0.000000       0.000000  
1 1 1 10 0  14 o 678.3420 12.54805  307.5208       11.33348      307.5208       11.33348      307.5208       11.33348      678.3420 12.54805  678.3420 12.54805  0.000000       0.000000  
1 1 1 10 0  15 o 234.4182 6.518126  36.71668       2.032486      36.71668       2.032486      36.71668       2.032486      234.4182 6.518126  234.4182 6.518126  0.000000       0.000000  
1 1 1 10 0  16 o 38.19694 19.49286  1.430824       1.249655      1.430824       1.249655      1.430824       1.249655      38.19694 19.49286  38.19694 19.49286  0.000000       0.000000  
1 1 1 10 0  17 o 283.2180 7.443549  53.59042       2.804762      53.59042       2.804762      53.59042       2.804762      283.2180 7.443549  283.2180 7.443549  0.000000       0.000000  
1 1 1 10 0  18 o 783.0889 15.88933  410.4762       16.56481      410.4762       16.56481      410.4762       16.56481      783.0889 15.88933  783.0889 15.88933  0.000000       0.000000  
1 1 1 10 0  19 o 211.1551 25.39537  31.24576       6.871789      31.24576       6.871789      31.24576       6.871789      211.1551 25.39537  211.1551 25.39537  0.000000       0.000000  
1 1 1 10 0  20 o 107.9589 21.77116  8.700813       2.775353      8.700813       2.775353      8.700813       2.775353      107.9589 21.77116  107.9589 21.77116  0.000000       0.000000  
1 1 1 10 0  21 f 34.74642 21.89188  0.3857576      2.140573      0.3857576      2.140573      0.3857576      2.140573      34.74642 21.89188  34.74642 21.89188  0.000000       0.000000  
1 1 1 10 0  22 o 519.7803 14.24661  181.4596       9.850692      181.4596       9.850692      181.4596       9.850692      519.7803 14.24661  519.7803 14.24661  0.000000       0.000000  
1 1 1 10 0  23 o 255.1389 15.73704  44.24109       5.303093      44.24109       5.303093      44.24109       5.303093      255.1389 15.73704  255.1389 15.73704  0.000000       0.000000  
1 1 1 10 0  24 o 242.7360 16.18365  40.21492       5.180406      40.21492       5.180406      40.21492       5.180406      242.7360 16.18365  242.7360 16.18365  0.000000       0.000000  
1 1 1 10 0  25 o 265.4815 18.83118  48.51405       6.583245      48.51405       6.583245      48.51405       6.583245      265.4815 18.83118  265.4815 18.83118  0.000000       0.000000  
1 1 1 10 0  26 o 379.1961 14.85812  97.52488       7.481370      97.52488       7.481370      97.52488       7.481370      379.1961 14.85812  379.1961 14.85812  0.000000       0.000000  
1 1 1 10 0  27 o 208.4564 15.05462  29.86515       4.130619      29.86515       4.130619      29.86515       4.130619      208.4564 15.05462  208.4564 15.05462  0.000000       0.000000  
1 1 1 10 0  28 o 104.2818 38.14279  10.46918       4.887067      10.46918       4.887067      10.46918       4.887067      104.2818 38.14279  104.2818 38.14279  0.000000       0.000000  
1 1 1 10 0  29 o 33.96841 23.45204  -2.265303      3.568717      -2.265303      3.568717      -2.265303      3.568717      33.96841 23.45204  33.96841 23.45204  0.000000       0.000000  
1 1 1 10 0  30 o 203.4247 12.17683  28.48610       3.273395      28.48610       3.273395      28.48610       3.273395      203.4247 12.17683  203.4247 12.17683  0.000000       0.000000  
1 1 1 10 0  31 o 113.0587 11.97209  9.033857       1.752853      9.033857       1.752853      9.033857       1.752853      113.0587 11.97209  113.0587 11.97209  0.000000       0.000000  
1 1 1 10 0  32 f 26.55383 15.33847  0.6556388      0.8774924     0.6556388      0.8774924     0.6556388      0.8774924     26.55383 15.33847  26.55383 15.33847  0.000000       0.000000  
1 1 1 10 0  33 o 92.94994 16.08576  6.653725       1.813619      6.653725       1.813619      6.653725       1.813619      92.94994 16.08576  92.94994 16.08576  0.000000       0.000000  
1 1 1 10 0  34 o 107.0839 6.146692  7.824008       0.8704131     7.824008       0.8704131     7.824008       0.8704131     107.0839 6.146692  107.0839 6.146692  0.000000       0.000000  
1 1 1 10 0  35 f 70.48888 15.17072  4.001746       1.250512      4.001746       1.250512      4.001746       1.250512      70.48888 15.17072  70.48888 15.17072  0.000000       0.000000  
1 1 1 10 1  0  o 119.0539 6.520165  9.531691       1.027230      9.531691       1.027230      9.531691       1.027230      119.0539 6.520165  119.0539 6.520165  0.000000       0.000000  
1 1 1 10 1  1  o 283.8197 7.716774  53.76645       2.915739      54.53966       3.606211      52.30671       4.954936      285.7242 9.484905  279.4319 13.34583  6.292267       16.37299  
1 1 1 10 1  2  o 479.1561 10.03591  153.2489       6.407774      160.3382       8.444504      143.6264       9.838256      489.6441 12.95394  462.9453 15.97224  26.69879       20.56495  
1 1 1 10 1  3  o 509.2210 3.087853  172.7964       2.095253      179.7342       12.90674      172.6086       2.123420      517.3338 18.75389  508.9430 3.131073  8.390839       19.01347  
1 1 1 10 1  4  o 605.2692 11.78487  244.7635       9.504884      246.2959       14.46273      243.5985       12.61067      605.7963 17.93613  602.9768 15.70848  2.819519       23.84242  
1 1 1 10 1  5  o 101.7365 19.88772  7.189917       2.599424      0.000000       0.000000      7.189917       2.599424      ?        ?         101.7365 19.88772  0.000000       19.88772  
1 1 1 10 1  6  o 133.3175 15.36055  12.05988       2.678949      0.000000       0.000000      12.05988       2.678949      ?        ?         133.3175 15.36055  0.000000       15.36055  
1 1 1 10 1  7  o 100.3685 1.203776  6.712016       0.1609966     7.402476       1.469558      6.703629       0.1619715     104.7254 10.68012  100.3057 1.211824  4.419708       10.74865  
1 1 1 10 1  8  o 51.27167 3.868235  1.762079       0.2623304     3.607851       0.3748343     -0.9889156E-02 0.3672640     73.47318 3.841923  19.15852 8.168823  54.31465       9.027184  
1 1 1 10 1  9  o 316.4237 5.685455  66.76609       2.397219      65.80553       2.647465      71.13868       5.648555      314.1071 6.325270  325.7663 13.03875  -11.65924      14.49200  
1 1 1 10 1  10 o 517.4908 10.74465  178.9877       7.409151      156.7895       18.42599      183.2691       8.092175      478.7867 29.01743  523.5065 11.60031  -44.71985      31.25026  
1 1 1 10 1  11 o 214.6404 1.265012  30.69630       0.3618092     30.67148       0.3657934     31.81697       2.458082      214.5535 1.279460  218.1458 8.472322  -3.592255      8.568387  
1 1 1 10 1  12 o 585.1724 9.729331  228.7422       7.586481      235.1173       11.27812      223.4736       10.25283      592.3773 14.28778  577.7355 13.31807  14.64178       19.53232  
1 1 1 10 1  13 o 256.0577 6.311639  43.73087       2.153543      43.39835       2.460118      44.82117       4.454698      254.9358 7.249243  258.4594 12.97609  -3.523575      14.86373  
1 1 1 10 1  14 o 349.2557 7.526803  81.38993       3.502899      79.27960       4.703052      84.01923       5.249581      344.3289 10.26166  354.3697 11.13098  -10.04074      15.13937  
1 1 1 10 1  15 o 269.1557 6.101354  48.31247       2.188282      50.13277       3.083421      46.46529       3.106101      273.9311 8.457432  263.6756 8.852959  10.25549       12.24349  
1 1 1 10 1  16 o 705.4644 10.78258  332.5441       10.13611      336.5562       15.37505      329.4600       13.48036      708.3975 16.28793  701.3866 14.42349  7.010925       21.75624  
1 1 1 10 1  17 o 239.8770 6.508499  38.40664       2.078459      37.38757       2.902583      39.47908       2.977622      236.4526 9.230005  242.9877 9.212958  -6.535080      13.04115  
1 1 1 10 1  18 o 242.1069 6.286718  39.12178       2.026455      34.87231       3.442070      41.37598       2.506969      228.0984 11.36038  248.8932 7.567760  -20.79480      13.65025  
1 1 1 10 1  19 o 334.8520 9.566128  74.97861       4.264000      71.00114       7.579920      76.81999       5.157415      324.4196 17.60003  338.6773 11.44450  -14.25769      20.99375  
1 1 1 10 1  20 o 44.65047 17.44311  0.8136070      1.502052      2.637250       2.016839      -1.457704      2.250813      63.52457 20.73196  40.80305 18.62620  22.72152       27.87023  
1 1 1 10 1  21 o 301.5334 10.46193  60.95438       4.197225      59.07753       5.212142      64.41666       7.079181      296.2984 13.23460  308.3647 17.29774  -12.06635      21.77995  
1 1 1 10 1  22 o 103.1491 14.44182  7.308405       1.930683      8.606502       2.525023      5.481236       2.995718      111.3763 17.59756  87.86871 24.61077  23.50758       30.25499  
1 1 1 10 1  23 o 259.6685 10.03240  45.31604       3.464813      40.71472       4.017587      58.67135       6.844643      245.5659 12.31722  293.0004 17.61241  -47.43449      21.49211  
1 1 1 10 1  24 o 79.54173 19.65005  4.523778       2.070390      2.389562       2.771049      7.220659       3.114985      64.87693 24.07870  99.78736 23.76775  -34.91043      33.83326  
1 1 1 10 1  25 o 59.73425 21.96584  2.075590       2.296805      7.739355       3.320184      -3.122142      3.180654      102.6520 24.59532  44.40195 20.89736  58.25008       32.27428  
1 1 1 10 1  26 o 167.3233 12.62464  19.11930       2.794045      23.23523       3.695834      13.62902       4.268500      183.5670 15.24680  136.4952 24.36231  47.07178       28.73999  
1 1 1 10 1  27 o 134.7139 14.48911  12.58842       2.560085      13.07513       3.406814      11.95704       3.880219      135.2727 19.45934  127.2305 23.76072  8.042229       30.71217  
1 1 1 10 1  28 o 128.9506 21.57804  12.25134       3.576843      12.26064       5.411086      12.24412       4.766791      122.0456 32.63945  124.2184 29.27997  -2.172813      43.84804  
1 1 1 10 1  29 o 60.88787 14.93516  2.696622       1.202412      1.614304       1.320568      7.945807       2.908234      49.04572 16.78989  101.9826 22.04448  -52.93687      27.71027  
1 1 1 10 1  30 o 110.6574 13.46731  8.719806       1.944951      7.089983       2.158961      15.73962       4.480612      97.68935 17.21401  139.7145 24.98421  -42.02512      30.34028  
1 1 1 10 1  31 o 60.55751 15.31931  2.773685       1.236881      0.1284722      2.263036      3.900481       1.477011      44.65873 19.64617  71.74398 15.87096  -27.08525      25.25588  
1 1 1 10 1  32 o 22.48178 9.893197  -0.1022010     0.5742747     0.7412947      1.158739      -0.3768402     0.6611887     38.03719 15.17547  21.99740 10.06194  16.03980       18.20817  
1 1 1 10 1  33 o 51.32267 10.41223  1.935837       0.6877012     1.991298       1.353972      1.916555       0.7983457     50.06741 17.00376  50.37261 12.05496  -0.3051987     20.84346  
1 1 1 10 1  34 o 20.15390 9.938200  -1.837880      0.9564120     -0.5106547     2.993841      -1.988724      1.009299      43.70739 20.47644  20.50396 10.12921  23.20343       22.84481  
1 1 1 10 1  35 o 25.26538 10.16741  0.2808022      0.5248162     -0.4117134     0.6068402     2.335694       1.045331      20.27749 9.405213  53.36966 14.37813  -33.09217      17.18106  
1 1 1 10 2  0  o 340.2117 17.53106  77.94338       7.899074      77.94338       7.899074      77.94338       7.899074      340.2117 17.53106  340.2117 17.53106  0.000000       0.000000  
1 1 1 10 2  1  o 352.5798 9.226846  83.01144       4.331226      86.88757       5.781491      78.05344       6.538727      360.4403 12.05437  341.3186 14.40913  19.12170       18.78645  
1 1 1 10 2  2  o 114.4269 9.178078  8.793468       1.387710      8.909817       1.740242      8.590279       2.299744      114.9258 11.51876  112.1963 15.82121  2.729568       19.57020  
1 1 1 10 2  3  o 263.4782 3.249354  46.26186       1.140815      42.09898       7.875701      46.35108       1.152975      248.8419 24.05097  263.7316 3.280834  -14.88969      24.27371  
1 1 1 10 2  4  o 438.9622 13.84080  129.0163       8.085719      0.000000       0.000000      129.0163       8.085719      ?        ?         438.9622 13.84080  0.000000       13.84080  
1 1 1 10 2  5  o 363.5740 11.91203  88.43968       5.763226      83.48523       7.686235      94.80238       8.710360      352.5639 16.40570  375.5573 17.45322  -22.99344      23.95333  
1 1 1 10 2  6  f 522.7853 11.65499  182.6615       8.119119      177.3610       15.51421      184.6608       9.528056      512.4088 22.77857  525.1638 13.62709  -12.75494      26.54357  
1 1 1 10 2  7  o 430.8512 11.22735  124.1419       6.440326      130.2399       18.73784      123.3251       6.858145      435.4475 32.52816  429.3165 12.00001  6.131012       34.67105  
1 1 1 10 2  8  o 131.9843 3.451128  11.61767       0.6064346     11.26880       0.9808457     11.83355       0.7715846     129.8736 5.681437  133.1671 4.354088  -3.293488      7.157990  
1 1 1 10 2  9  o 227.9992 4.513059  34.65346       1.371127      34.52179       1.411572      36.85284       5.769215      227.5617 4.655116  233.3705 18.70888  -5.808807      19.27933  
1 1 1 10 2  10 o 424.9740 9.234657  120.6125       5.229458      109.3529       11.57397      123.5008       5.861934      401.9581 21.68900  429.9170 10.23253  -27.95886      23.98161  
1 1 1 10 2  11 o 132.8799 1.240907  11.76470       0.2197213     11.84364       0.2222738     8.386651       1.454035      133.3250 1.251132  111.6104 9.878704  21.71458       9.957616  
1 1 1 10 2  12 o 331.3239 7.679966  73.25807       3.390671      72.79539       4.707542      73.75687       4.887802      329.8489 10.72466  331.9775 11.06467  -2.128601      15.40926  
1 1 1 10 2  13 o 286.2859 4.618369  54.63764       1.761822      47.65094       2.615986      60.43724       2.383408      267.1376 7.355978  301.0404 5.941554  -33.90283      9.455817  
1 1 1 10 2  14 o 527.7423 6.246292  185.7489       4.392560      186.8725       6.278172      184.6714       6.147913      529.0602 8.905423  525.9512 8.772203  3.109070       12.50032  
1 1 1 10 2  15 f 557.1755 9.840343  207.3394       7.305934      205.3138       8.919052      211.4702       12.73706      554.1069 12.07957  561.0838 17.05582  -6.976929      20.90017  
1 1 1 10 2  16 o 485.3415 11.27236  157.4390       7.290140      144.0683       13.02653      163.5363       8.796683      461.9533 21.21869  494.1544 13.37156  -32.20114      25.08050  
1 1 1 10 2  17 o 32.45461 11.37318  0.6201256      0.6074830     -0.6075745     1.513797      0.8557845      0.6632289     35.48447 15.81463  36.47243 11.88780  -0.9879646     19.78440  
1 1 1 10 2  18 o 381.0633 7.276030  96.88879       3.694580      97.18783       5.544794      96.65002       4.954711      381.1460 10.92871  380.2437 9.786873  0.9023438      14.67037  
1 1 1 10 2  19 o 268.4566 7.357373  48.13482       2.629425      50.98985       4.914073      46.98946       3.112478      275.5374 13.42446  265.0976 8.823330  10.43979       16.06447  
1 1 1 10 2  20 o 486.6183 7.892993  158.1433       5.118040      175.1263       8.741852      149.2861       6.313125      510.9245 12.85044  472.4513 10.02799  38.47327       16.30013  
1 1 1 10 2  21 o 139.2729 13.25452  13.14471       2.430204      12.99619       2.945231      13.46154       4.301702      137.8739 16.34897  138.3934 24.20773  -0.5195313     29.21135  
1 1 1 10 2  22 o 162.4159 9.436393  17.72693       2.033451      18.23095       3.160444      17.37088       2.656286      163.7495 14.63843  160.2448 12.53971  3.504730       19.27506  
1 1 1 10 2  23 o 47.54958 19.67487  0.4846206      2.033001      2.995801       2.776175      -2.419349      2.985409      69.14256 24.30652  44.91438 20.84225  24.22818       32.01884  
1 1 1 10 2  24 o 116.9158 16.88649  9.513910       2.554653      6.778464       3.563792      12.40526       3.663939      96.28790 26.79695  132.2629 21.52893  -35.97497      34.37400  
1 1 1 10 2  25 o 102.2190 18.80990  7.427303       2.467695      8.607927       3.544452      6.316729       3.437691      108.1263 25.08663  92.60043 26.51085  15.52589       36.49883  
1 1 1 10 2  26 o 71.41571 21.05321  3.660555       2.139560      2.610176       2.577591      5.987628       3.836595      64.65990 23.34600  90.04486 28.52048  -25.38496      36.85720  
1 1 1 10 2  27 o 144.0690 15.11297  14.43400       2.858173      11.37201       4.032693      17.52462       4.051507      123.0920 25.42810  156.6625 19.85303  -33.57047      32.26036  
1 1 1 10 2  28 o 88.77642 20.61757  5.860643       2.392146      6.557883       5.427420      5.692539       2.664960      92.27796 33.79376  86.77100 22.76772  5.506966       40.74785  
1 1 1 10 2  29 o 31.67633 14.28289  -0.5385886     1.274670      -1.543018      1.609806      1.149620       2.087022      31.60907 14.87352  50.47673 20.28855  -18.86766      25.15644  
1 1 1 10 2  30 o 52.97475 18.22812  1.980097       1.557052      -0.2748389     2.127966      4.578643       2.284351      42.39405 18.83074  76.11238 21.55195  -33.71833      28.61963  
1 1 1 10 2  31 o 23.34923 9.193749  0.2287531      0.4200762     0.9827593      1.098572      0.9962309E-01  0.4546262     40.30288 15.12041  22.28822 9.270267  18.01466       17.73597  
1 1 1 10 2  32 f ?        ?         -3.207684      0.6803130     -3.163388      0.9625874     -3.251891      0.9616291     17.03533 8.618729  16.84129 8.531063  0.1940403      12.12689  
1 1 1 10 2  33 o 34.92701 11.97896  0.8514259      0.6722855     1.382393       3.439548      0.8303353      0.6855075     52.99311 23.71271  34.71275 12.08714  18.28036       26.61563  
1 1 1 10 2  34 o 29.12251 12.49043  0.1537893      0.8678323     4.903087       2.577248      -0.4535817     0.9216552     69.35461 23.46030  25.65466 11.78853  43.69996       26.25558  
1 1 1 10 2  35 f 39.71325 14.86701  1.164594       1.060859      3.970664       2.529780      0.5658460      1.168572      60.75032 22.91213  35.13770 14.75609  25.61262       27.25267  
1 1 1 10 3  0  o 432.2426 13.85214  125.0942       7.959864      125.0942       7.959864      125.0942       7.959864      432.2426 13.85214  432.2426 13.85214  0.000000       0.000000  
1 1 1 10 3  1  o 383.7085 9.013129  98.25109       4.608404      98.82204       7.865768      97.95267       5.686599      383.9312 15.40625  382.8018 11.16013  1.129456       19.02370  
1 1 1 10 3  2  o 657.9530 14.89909  289.7108       13.06256      282.8747       19.22299      295.5756       17.80489      647.9936 22.29586  663.0554 20.17537  -15.06183      30.06910  
1 1 1 10 3  3  o 356.1157 8.722175  84.62797       4.138942      84.28107       5.344035      85.14799       6.542987      355.0149 11.31107  356.5207 13.79871  -1.505737      17.84222  
1 1 1 10 3  4  o 247.9375 6.879305  41.03091       2.270598      40.32195       2.640063      43.04550       4.450390      245.7003 8.074681  253.3539 13.22830  -7.653625      15.49801  
1 1 1 10 3  5  f 358.6004 12.09659  86.05820       5.771986      90.70809       8.327052      81.75787       8.007940      367.3808 17.05643  348.7029 17.28813  18.67789       24.28583  
1 1 1 10 3  6  o 335.2479 6.382000  74.95416       2.850995      61.25523       9.479823      76.31639       2.989388      300.2765 23.88899  338.2676 6.632060  -37.99112      24.79250  
1 1 1 10 3  7  o 321.2557 12.17728  69.11533       5.203406      72.42524       6.345361      62.32008       9.091840      328.5175 14.53116  303.0746 22.67717  25.44296       26.93341  
1 1 1 10 3  8  o 407.7547 10.50195  111.1705       5.701390      107.5866       7.391423      116.4353       8.958695      400.5917 13.86781  416.2984 16.18059  -15.70667      21.31027  
1 1 1 10 3  9  o 269.0380 4.634488  48.25286       1.661457      47.55934       1.896145      50.54581       3.447754      267.0727 5.328053  274.9457 9.424499  -7.873047      10.82633  
1 1 1 10 3  10 o 112.2639 1.608719  8.397595       0.2406543     8.430836       0.2427890     6.532113       1.818817      112.4858 1.619787  97.70640 14.40123  14.77938       14.49204  
1 1 1 10 3  11 o 504.2146 14.41412  170.4957       9.674562      183.9856       12.80154      152.5308       14.77306      522.7356 18.40708  474.3236 23.44609  48.41199       29.80838  
1 1 1 10 3  12 o 311.9959 6.141901  64.92183       2.553438      66.91650       2.864835      57.21375       5.631671      316.7163 6.788215  291.8420 14.52725  24.87427       16.03499  
1 1 1 10 3  13 o 492.0116 8.572611  161.5978       5.620332      158.5888       7.729213      164.9740       8.187250      486.9711 11.91128  496.6046 12.37240  -9.633514      17.17425  
1 1 1 10 3  14 o 847.0996 8.647074  479.0075       9.760615      482.6423       18.73149      477.6526       11.43589      848.1459 16.57403  845.5961 10.14924  2.549744       19.43465  
1 1 1 10 3  15 o 278.0946 4.289725  51.54990       1.589628      55.52201       5.676915      51.21195       1.655871      287.5077 14.86851  277.1758 4.483299  10.33191       15.52973  
1 1 1 10 3  16 o 491.3292 11.11024  161.3336       7.273935      163.2626       10.83202      159.7494       9.816576      493.0733 16.50963  488.0441 15.11302  5.029144       22.38238  
1 1 1 10 3  17 o 344.7516 6.352951  79.27025       2.918470      84.34985       4.695524      76.07262       3.725485      355.2205 9.929764  337.6033 8.281377  17.61713       12.92986  
1 1 1 10 3  18 o 324.4292 6.713706  70.21604       2.902390      70.25825       4.678921      70.18964       3.700350      324.0146 10.85228  324.1253 8.575075  -0.1107483     13.83126  
1 1 1 10 3  19 o 375.3199 7.757550  94.03685       3.879714      98.14403       6.111510      91.26437       5.021246      382.7219 11.99855  369.3411 10.21239  13.38080       15.75621  
1 1 1 10 3  20 o 200.7806 8.757451  26.99097       2.337368      29.50422       9.616259      26.83316       2.409632      202.3184 37.03383  200.1574 9.058003  2.160980       38.12548  
1 1 1 10 3  21 o 455.6940 8.835410  138.8850       5.365047      137.0315       7.766174      140.5770       7.420282      451.4801 12.92237  457.5150 12.18227  -6.034912      17.75937  
1 1 1 10 3  22 o 125.1591 14.85994  10.72024       2.429981      11.90951       2.808071      7.174371       4.848734      131.6608 16.35751  100.8495 32.07693  30.81130       36.00691  
1 1 1 10 3  23 o 126.6604 13.59547  10.95702       2.258737      15.46800       3.374496      7.295388       3.040259      149.7778 17.22082  100.7292 23.13835  49.04860       28.84337  
1 1 1 10 3  24 o 42.90103 18.12695  0.1755603      1.780758      1.092147       2.764011      -0.4748775     2.328391      57.14910 23.21232  45.37456 19.94561  11.77454       30.60456  
1 1 1 10 3  25 o 200.7436 11.38212  27.31227       3.032181      30.31537       3.979063      23.15327       4.682638      210.5296 14.26814  181.7011 19.65253  28.82851       24.28583  
1 1 1 10 3  26 f 297.3367 11.46429  59.96962       4.533720      61.06537       6.003242      58.51507       6.916633      298.0749 15.16408  289.9723 17.98907  8.102661       23.52777  
1 1 1 10 3  27 o 154.5524 11.96664  16.35100       2.445274      18.18634       3.464327      14.52872       3.451986      161.2500 16.34869  142.9780 18.55596  18.27205       24.73061  
1 1 1 10 3  28 o 71.03907 15.59102  3.642547       1.435273      4.944117       1.817245      1.484380       2.340035      82.52673 17.08813  54.92928 21.67722  27.59745       27.60264  
1 1 1 10 3  29 o 14.21238 7.121454  -1.628619      0.5767100     -2.687196      1.582346      -1.466463      0.6193079     27.40848 13.36182  15.67618 7.777894  11.73230       15.46072  
1 1 1 10 3  30 o 43.56520 12.16092  1.366259       0.7327655     2.526136       1.339421      0.8708421      0.8753799     58.11421 16.51902  37.62487 13.60242  20.48934       21.39869  
1 1 1 10 3  31 o 92.42184 12.75574  6.180045       1.529076      5.932967       1.825891      6.760164       2.797799      88.57462 16.06135  89.10815 23.30272  -0.5335236     28.30165  
1 1 1 10 3  32 o 32.41251 12.27302  0.6052022      0.7275242     3.417612       2.486206      0.3418259      0.7608274     62.75247 22.88932  29.89411 12.16497  32.85836       25.92118  
1 1 1 10 3  33 o 35.98804 14.28393  0.7081109      1.021443      -0.7084191     2.346991      1.039113       1.134525      39.79379 18.47080  39.94015 15.27772  -0.1463623     23.97038  
1 1 1 10 3  34 o 103.8861 12.45238  8.142487       1.689478      8.652668       3.408898      7.976369       1.945179      88.14082 26.71579  100.3000 15.01527  -12.15916      30.64623  
1 1 1 10 3  35 f 33.05854 14.76320  0.3545417E-01  1.326170      -0.6686714     4.321458      0.1086597      1.393405      46.71812 22.61356  34.10234 15.18733  12.61578       27.24019  
1 1 1 10 4  0  o 313.5611 17.57115  66.33292       7.288572      66.33292       7.288572      66.33292       7.288572      313.5611 17.57115  313.5611 17.57115  0.000000       0.000000  
1 1 1 10 4  1  o 139.5605 10.20839  13.07471       1.885293      13.89231       1.980468      5.176353       6.155555      143.8606 10.40148  97.22474 35.92364  46.63589       37.39918  
1 1 1 10 4  2  o 385.3408 5.779768  99.00323       2.967760      104.9763       7.453190      97.87772       3.235306      395.8267 14.15348  383.1159 6.337406  12.71075       15.50754  
1 1 1 10 4  3  o 348.3853 8.957271  81.06290       4.154787      78.15685       6.367238      83.21780       5.482938      341.4715 14.02323  352.6899 11.68279  -11.21841      18.25208  
1 1 1 10 4  4  o 405.3903 4.532447  109.5453       2.448385      108.3980       2.709744      114.6469       5.714029      403.2393 5.043034  414.3136 10.34999  -11.07422      11.51323  
1 1 1 10 4  5  o 79.07207 1.244407  4.165870       0.1311170     3.696401       1.408608      4.169973       0.1316888     72.97147 14.98844  79.11100 1.249218  -6.139526      15.04040  
1 1 1 10 4  6  o 20.57370 8.803604  -0.2315421E-01 0.4293015     1.136926       1.445155      -0.1354353     0.4495972     46.87392 17.39028  19.83961 8.741186  27.03431       19.46356  
1 1 1 10 4  7  o 289.0420 7.667998  55.78771       2.950752      46.66678       4.402806      63.22517       3.975778      263.8159 12.56042  307.5188 9.714535  -43.70291      15.87880  
1 1 1 10 4  8  o 140.3321 1.135726  13.12118       0.2123754     13.06455       0.2181679     14.14528       0.9277954     140.0289 1.169230  145.5850 4.789094  -5.556168      4.929759  
1 1 1 10 4  9  o 273.2148 7.695502  49.85429       2.798865      52.19983       4.216065      48.00608       3.742501      279.1824 11.35673  267.8159 10.50741  11.36642       15.47194  
1 1 1 10 4  10 o 135.1862 1.345153  12.17671       0.2423135     12.17596       0.2433748     12.26210       2.597436      135.1820 1.351087  134.4683 14.73725  0.7136688      14.79905  
1 1 1 10 4  11 f 323.7718 5.688276  69.90488       2.454106      70.51727       2.628219      65.73689       6.856579      325.1671 6.065708  312.5143 16.52381  12.65283       17.60196  
1 1 1 10 4  12 o 506.1325 8.004296  170.9703       5.398349      173.7910       6.871552      166.4229       8.724970      510.0289 10.11082  498.4570 13.14747  11.57190       16.58567  
1 1 1 10 4  13 o 376.9522 7.065770  94.79317       3.549109      95.07845       4.238105      94.12342       6.493693      377.4162 8.427092  374.8162 13.02147  2.600037       15.51047  
1 1 1 10 4  14 o 469.5117 8.220284  147.1209       5.142884      144.1379       7.183083      150.2584       7.366664      464.1898 11.62207  474.0843 11.66116  -9.894409      16.46375  
1 1 1 10 4  15 o 247.8023 4.269262  40.93075       1.409716      33.65892       3.140578      42.76562       1.577576      224.2117 10.54133  253.2844 4.674211  -29.07274      11.53117  
1 1 1 10 4  16 o 728.2258 11.71112  354.5358       11.36418      368.2963       21.11808      348.9268       13.48280      738.9523 21.46966  721.9100 14.01598  17.04230       25.63970  
1 1 1 10 4  17 o 396.9086 9.363588  105.2028       4.952293      105.0228       6.887748      105.3954       7.125503      395.9232 13.07340  396.5520 13.50442  -0.6287842     18.79583  
1 1 1 10 4  18 o 197.1032 6.280822  25.94015       1.647513      30.18233       4.664476      25.33549       1.761018      211.3354 16.69931  194.7537 6.796271  16.58173       18.02932  
1 1 1 10 4  19 o 26.77565 11.21114  0.7421941E-01  0.6714830     1.375780       2.958634      0.3535733E-02  0.6894750     61.12915 24.29473  26.42428 11.22705  34.70486       26.76342  
1 1 1 10 4  20 f 233.8098 8.889539  36.59478       2.764545      28.25121       5.892552      38.94960       3.130452      202.7184 22.17543  241.1107 9.763738  -38.39235      24.22974  
1 1 1 10 4  21 o 224.7347 9.685043  33.87630       2.893507      32.06658       4.015522      35.83084       4.173100      217.8580 13.90489  230.3930 13.65425  -12.53502      19.48807  
1 1 1 10 4  22 o 50.02638 17.80537  1.476603       1.493497      -0.9370567     2.196325      3.552617       2.036919      42.11986 18.89025  71.18612 20.41542  -29.06626      27.81422  
1 1 1 10 4  23 o 130.7840 12.19322  11.62582       2.100455      11.30139       3.002327      11.93685       2.939647      127.4059 18.20128  131.2859 17.21824  -3.879982      25.05503  
1 1 1 10 4  24 o 51.85872 19.88952  1.317573       1.926272      1.077520       2.447137      1.708593       3.123224      54.52350 21.95038  62.94822 24.97954  -8.424717      33.25351  
1 1 1 10 4  25 o 210.4031 9.382927  29.84504       2.624038      27.49348       3.588616      32.54701       3.846715      200.6617 13.49968  218.4814 13.27567  -17.81972      18.93370  
1 1 1 10 4  26 o 131.6474 14.91197  12.01952       2.569885      12.64337       3.292845      11.04747       4.110343      133.4781 19.05358  121.5072 26.16108  11.97099       32.36419  
1 1 1 10 4  27 o 18.86697 8.999212  -0.8229451     0.6290513     -0.7659284     1.316203      -0.8398240     0.7161341     31.33066 14.27959  20.63164 9.771918  10.69902       17.30309  
1 1 1 10 4  28 o 37.80608 16.94450  -0.6005173     1.764022      -2.950462      1.915833      12.48925       4.521627      30.99280 15.01494  125.7322 27.73405  -94.73944      31.53769  
1 1 1 10 4  29 o 28.73464 11.33984  0.3388033      0.6403702     1.700825       0.9838587     -0.6623186     0.8434982     48.69011 14.25577  23.99673 11.11579  24.69337       18.07727  
1 1 1 10 4  30 o 90.65602 9.449163  5.698502       1.124732      1.204745       1.646982      9.625679       1.539658      46.73148 18.26260  117.8558 9.895212  -71.12428      20.77108  
1 1 1 10 4  31 o 37.38081 13.64814  0.8800326      0.8842450     5.477811       1.399889      -2.172226      1.140592      86.98579 12.43041  22.34573 10.98661  64.64007       16.58978  
1 1 1 10 4  32 o 44.76213 17.95665  1.193100       1.631485      1.500896       2.167010      0.7903465      2.478839      49.54050 20.38727  47.48589 20.73418  2.054604       29.07829  
1 1 1 10 4  33 o 34.84195 15.26331  0.1309678      1.352995      2.116930       2.745421      -0.5060848     1.554931      53.58174 22.56652  33.55927 15.38042  20.02247       27.30943  
1 1 1 10 4  34 o 63.89342 19.06586  3.679110       1.746147      1.262691       2.919914      5.024355       2.178636      48.79390 21.83988  72.61649 21.20051  -23.82259      30.43751  
1 1 1 10 4  35 o 44.33582 16.60060  1.585681       1.322816      2.303370       4.516534      1.518340       1.383484      53.12045 24.96985  43.86686 16.84789  9.253590       30.12217  
1 1 1 10 5  0  o 268.7960 22.60769  49.42022       7.960827      49.42022       7.960827      49.42022       7.960827      268.7960 22.60769  268.7960 22.60769  0.000000       0.000000  
1 1 1 10 5  1  o 343.7499 8.366927  78.85281       3.832499      80.03790       4.834229      76.84786       6.287912      346.0082 10.49711  338.5889 13.96670  7.419342       17.47163  
1 1 1 10 5  2  o 287.9677 5.591979  55.28952       2.145768      59.43821       4.797559      54.25207       2.399107      297.9385 12.10950  285.2251 6.312311  12.71338       13.65596  
1 1 1 10 5  3  o 152.7680 5.573913  15.58119       1.132759      18.51157       1.925291      14.02975       1.400887      166.3112 8.718077  144.8398 7.281773  21.47137       11.35910  
1 1 1 10 5  4  o 649.9837 9.990364  282.1590       8.652813      257.9103       16.45244      291.4309       10.17345      618.8871 19.97628  660.3073 11.56242  -41.42010      23.08119  
1 1 1 10 5  5  o 279.4476 4.000138  52.04976       1.489529      49.33290       4.417796      52.39823       1.582172      271.3271 12.25069  280.3746 4.234884  -9.047546      12.96201  
1 1 1 10 5  6  o 301.9233 8.732215  60.90640       3.509442      57.13346       4.948756      64.72340       4.977570      291.9401 12.75198  310.8607 12.03926  -18.92053      17.53730  
1 1 1 10 5  7  o 464.2491 12.02806  144.2442       7.434543      149.9005       8.382468      123.3927       16.09447      473.0328 13.31187  424.8653 28.59491  48.16751       31.54164  
1 1 1 10 5  8  o 383.6800 22.68227  99.78724       11.54482      99.78724       11.54482      0.000000       0.000000      383.6800 22.68227  ?        ?         0.000000       22.68227  
1 1 1 10 5  9  o 183.3876 6.663350  22.46394       1.625599      22.77119       1.971162      21.81068       2.874195      184.5336 8.035550  180.1737 12.04069  4.359970       14.47578  
1 1 1 10 5  10 o 370.6399 10.17409  91.85506       5.020077      78.51830       6.959365      106.3225       7.248374      341.8575 15.31635  398.2240 13.67996  -56.36652      20.53611  
1 1 1 10 5  11 o 200.5047 1.345786  26.78637       0.3595622     26.75183       0.3606615     32.42693       4.608524      200.3753 1.350772  219.3002 15.87817  -18.92491      15.93552  
1 1 1 10 5  12 f 501.4512 8.955129  167.8845       5.983758      169.7767       7.494695      164.5576       9.937676      503.9777 11.16013  495.2835 15.07521  8.694183       18.75661  
1 1 1 10 5  13 o 430.9098 8.157455  123.9223       4.683976      123.6823       6.262921      124.2269       7.056063      430.0655 10.93759  430.8026 12.30427  -0.7370911     16.46286  
1 1 1 10 5  14 o 20.44488 9.558083  -0.6437632     0.6466230     1.624432       1.044259      -2.054296      0.8234926     49.05511 14.76878  17.87935 8.887578  31.17576       17.23676  
1 1 1 10 5  15 o 159.6835 5.571924  17.02249       1.183784      14.74154       2.934130      17.46595       1.293753      147.5707 15.13552  161.7266 6.013862  -14.15596      16.28652  
1 1 1 10 5  16 o 105.0765 2.202092  7.357118       0.3083291     7.938133       2.724364      7.349580       0.3103229     106.9591 19.84549  105.0225 2.217470  1.936554       19.96899  
1 1 1 10 5  17 o 286.8034 4.701352  54.83698       1.796721      52.45405       4.687085      55.24745       1.945325      279.7017 12.60817  287.8606 5.071498  -8.158905      13.58993  
1 1 1 10 5  18 o 185.5872 5.939514  22.99637       1.466942      24.67225       2.961521      22.45149       1.688659      191.6808 11.64980  183.3026 6.925985  8.378128       13.55312  
1 1 1 10 5  19 o 80.91280 7.248306  4.405154       0.7732269     4.456314       3.311050      4.402203       0.7952147     81.85052 26.55306  80.86136 7.464436  0.9891663      27.58229  
1 1 1 10 5  20 o 268.1689 7.843733  48.08647       2.799869      60.90426       8.522347      46.53560       2.964416      298.5217 21.56992  263.7292 8.446326  34.79248       23.16467  
1 1 1 10 5  21 o 266.4966 9.343392  47.60619       3.312817      50.29421       5.152293      45.71167       4.325482      272.8558 14.21985  260.5087 12.49704  12.34714       18.93093  
1 1 1 10 5  22 o 233.1279 9.339336  36.48572       2.895369      38.98975       4.211506      34.24149       3.987047      240.1159 13.21358  224.9368 13.36223  15.17911       18.79223  
1 1 1 10 5  23 o 154.4561 9.613401  16.07758       1.968781      18.82857       3.495813      14.79974       2.382554      165.6171 16.04113  147.6392 12.22001  17.97792       20.16548  
1 1 1 10 5  24 o 106.2026 10.05052  7.656374       1.405398      9.022774       2.349578      6.895147       1.753712      113.9240 15.91090  99.96690 13.51078  13.95715       20.87338  
1 1 1 10 5  25 o 89.12527 5.070960  5.325249       0.5997480     7.185419       2.233429      5.180688       0.6226162     100.8405 17.24025  87.87303 5.342546  12.96750       18.04907  
1 1 1 10 5  26 o 218.1103 8.122899  32.02423       2.356684      30.31926       3.602807      33.29935       3.115712      210.5726 12.90196  221.6307 10.58059  -11.05812      16.68560  
1 1 1 10 5  27 o 26.67153 11.61324  -0.1172856     0.7730008     -0.3503200     1.695027      -0.5609474E-01 0.8685802     38.45613 16.95685  28.83126 12.43216  9.624865       21.02601  
1 1 1 10 5  28 o 82.63898 11.61365  4.763511       1.243633      5.165783       1.304588      0.7579888      4.116638      86.09691 11.67166  62.35365 26.97672  23.74326       29.39338  
1 1 1 10 5  29 o 176.7541 7.982453  21.22470       1.875241      21.50120       2.826157      21.00722       2.506507      175.7071 12.14546  174.4380 10.83688  1.269104       16.27729  
1 1 1 10 5  30 o 66.56028 13.51044  3.243294       1.157295      5.036171       1.421605      -0.2795345     1.992734      83.48924 13.21802  40.72867 18.14874  42.76057       22.45201  
1 1 1 10 5  31 o 65.15861 20.63513  3.506144       2.008448      3.225404       2.762239      3.821059       2.925540      62.98333 23.89923  66.75386 24.74725  -3.770535      34.40348  
1 1 1 10 5  32 o 38.24103 16.75883  0.1897385      1.632529      0.2245826      1.855047      0.7007515E-01  3.437725      40.32452 17.76159  49.50436 22.75486  -9.179840      28.86620  
1 1 1 10 5  33 o 28.61536 13.16814  -0.5454881     1.155826      0.4636694      2.210297      -0.9253091     1.356003      43.24364 19.20077  29.35901 13.76281  13.88463       23.62381  
1 1 1 10 5  34 o 36.73499 16.33012  0.1873776      1.603553      2.091127       3.016384      -0.5626034     1.893245      51.92855 22.76807  35.74342 16.59034  16.18513       28.17134  
1 1 1 10 5  35 o 67.20988 16.28321  3.877885       1.442772      1.676907       3.893756      4.228162       1.553341      50.52343 23.56540  69.65026 16.90883  -19.12683      29.00408  
1 1 1 10 6  0  o 533.0630 30.13560  193.1807       21.24813      193.1807       21.24813      193.1807       21.24813      533.0630 30.13560  533.0630 30.13560  0.000000       0.000000  
1 1 1 10 6  1  o 422.7764 18.78228  120.3396       10.55473      127.2910       13.55536      109.6353       16.82102      433.5665 23.55132  399.5752 31.85579  33.99130       39.61636  
1 1 1 10 6  2  o 298.6522 5.150452  59.46463       2.049673      62.02977       2.949413      57.06871       2.850469      304.9275 7.258812  292.3850 7.321995  12.54248       10.31028  
1 1 1 10 6  3  o 157.4790 8.431293  16.59972       1.762805      15.89067       6.182837      16.66245       1.839140      149.8228 31.94572  157.7461 8.784183  -7.923233      33.13142  
1 1 1 10 6  4  o 351.0867 6.589658  82.21684       3.082838      92.06909       11.93975      81.51309       3.191041      368.1136 24.48018  349.5650 6.850637  18.54865       25.42067  
1 1 1 10 6  5  o 78.23288 4.388309  4.092640       0.4556336     3.886364       1.925416      4.104877       0.4689533     74.61865 19.24052  78.34203 4.511300  -3.723381      19.76233  
1 1 1 10 6  6  o 228.7217 6.786364  34.92777       2.066034      35.10608       2.404645      34.42501       4.037856      229.2213 7.884415  226.3709 13.44677  2.850403       15.58780  
1 1 1 10 6  7  o 162.5893 1.038182  17.61329       0.2249258     17.63448       0.2253898     12.48237       3.506924      162.6871 1.039699  134.6992 20.15706  27.98788       20.18386  
1 1 1 10 6  8  o 66.14632 1.991269  2.918069       0.1753131     2.924175       0.1772690     2.645915       1.183447      66.21487 2.011442  61.61235 14.63343  4.602524       14.77102  
1 1 1 10 6  9  o 480.3018 12.31026  154.4348       7.872214      145.5129       10.63020      165.2698       11.71461      465.1571 17.17969  495.6124 17.76705  -30.45535      24.71457  
1 1 1 10 6  10 o 229.8555 7.998274  35.30428       2.446033      38.10288       3.125276      30.87957       3.929703      238.6278 9.849821  214.2911 13.83596  24.33672       16.98390  
1 1 1 10 6  11 o 252.3117 4.911211  42.44173       1.651200      41.72995       1.773615      47.07063       4.522960      250.1733 5.320407  264.9182 12.85094  -14.74490      13.90875  
1 1 1 10 6  12 o 556.4826 11.18291  206.9806       8.292396      205.8356       9.153378      212.2220       19.58479      554.7421 12.38274  558.8588 26.37365  -4.116760      29.13592  
1 1 1 10 6  13 o 155.6081 5.052428  16.15994       1.046236      16.26856       1.079168      14.46121       4.267646      156.1232 5.194613  144.6907 22.89583  11.43256       23.47771  
1 1 1 10 6  14 o 225.2778 6.874823  33.88322       2.061318      34.80748       3.064205      33.11922       2.785914      228.0605 10.10822  222.5165 9.417050  5.544037       13.81509  
1 1 1 10 6  15 o 291.8807 6.287952  56.81716       2.445616      55.79042       3.205021      58.24824       3.783847      289.0052 8.331153  295.1834 9.632748  -6.178131      12.73570  
1 1 1 10 6  16 o 224.4448 6.763442  33.63347       2.020483      25.71177       3.779067      36.80428       2.390898      195.3668 14.62252  234.7293 7.654226  -39.36243      16.50471  
1 1 1 10 6  17 o 350.3788 6.588043  81.89567       3.075869      79.61494       5.360754      83.01505       3.755581      344.8093 11.68426  352.6616 7.991816  -7.852325      14.15596  
1 1 1 10 6  18 o 520.2430 9.247613  180.8357       6.410759      188.5576       9.487918      174.3488       8.696109      530.2358 13.43936  510.0087 12.80612  20.22711       18.56376  
1 1 1 10 6  19 o 342.1794 7.457562  78.18386       3.400355      81.87921       6.357141      76.70289       4.024454      348.9914 13.69675  338.6440 8.926246  10.34741       16.34867  
1 1 1 10 6  20 o 200.4821 8.588492  26.92486       2.289068      39.02371       6.517741      25.22255       2.444806      238.6764 20.69781  193.9106 9.490529  44.76575       22.76992  
1 1 1 10 6  21 o 63.14678 8.542063  2.716376       0.7003506     -0.7861720     2.566717      2.998123       0.7279742     46.75100 20.72818  66.41586 8.414213  -19.66486      22.37088  
1 1 1 10 6  22 o 133.1395 10.45171  11.97737       1.839394      14.44063       3.162353      10.71789       2.261263      144.8343 16.69058  125.2308 13.77822  19.60349       21.64289  
1 1 1 10 6  23 f 272.9861 7.044276  49.90308       2.560279      45.06643       5.301265      51.37439       2.923880      256.8790 15.56033  276.7962 7.935500  -19.91724      17.46700  
1 1 1 10 6  24 o 279.5648 7.652416  52.43436       2.848039      56.75470       5.851811      51.09335       3.260220      287.9310 15.30706  275.6319 8.888165  12.29913       17.70044  
1 1 1 10 6  25 o 88.64302 7.849474  5.314949       0.9175947     3.794181       1.354504      6.604820       1.247446      73.35345 14.37179  98.55631 9.621066  -25.20287      17.29490  
1 1 1 10 6  26 o 133.4187 7.594321  11.99634       1.344565      9.349576       2.228085      13.51225       1.686205      115.8039 14.77497  141.3085 9.001863  -25.50462      17.30125  
1 1 1 10 6  27 o 208.9615 8.603786  29.52621       2.390559      27.93581       3.080052      31.93577       3.791182      202.0862 11.48522  215.1839 13.28662  -13.09767      17.56259  
1 1 1 10 6  28 o 66.74301 15.35024  3.242101       1.336698      3.154735       1.439256      3.790418       3.605637      65.55688 16.49261  73.36295 27.41983  -7.806061      31.99771  
1 1 1 10 6  29 o 121.4817 13.11020  10.43979       2.088665      12.25776       2.402154      4.806331       4.228590      131.2443 13.94898  77.74449 29.55371  53.49980       32.68021  
1 1 1 10 6  30 o 118.7536 14.24256  10.25415       2.208852      12.45615       3.188809      8.223030       3.062589      126.7202 19.50966  99.28059 23.51454  27.43957       30.55422  
1 1 1 10 6  31 o 135.1710 15.06146  13.70053       2.666810      12.78383       3.419929      15.12274       4.259758      123.8823 21.49647  129.7616 25.54549  -5.879303      33.38668  
1 1 1 10 6  32 o 35.72218 16.08784  -0.2268857     1.611644      -0.9839519     1.758327      3.751135       4.030568      33.87266 15.81122  63.48834 27.06563  -29.61568      31.34555  
1 1 1 10 6  33 o 34.94124 16.04975  -0.4866326     1.706169      0.4809763      2.214070      -1.901292      2.677117      43.13053 19.17998  38.18877 18.30947  4.941761       26.51619  
1 1 1 10 6  34 o 29.54713 13.97142  -1.031013      1.452456      -0.6114281     3.174346      -1.142120      1.633481      43.28503 20.52259  31.04303 14.71935  12.24200       25.25541  
1 1 1 10 7  0  o 181.1625 11.88114  22.18659       2.839437      22.18659       2.839437      22.18659       2.839437      181.1625 11.88114  181.1625 11.88114  0.000000       0.000000  
1 1 1 10 7  1  o 216.2688 14.41195  31.46665       4.129568      31.46665       4.129568      0.000000       0.000000      216.2688 14.41195  ?        ?         0.000000       14.41195  
1 1 1 10 7  2  o 382.4705 8.603261  97.65097       4.384646      79.88158       10.18214      101.6962       4.858158      343.3258 22.37856  390.2447 9.342457  -46.91885      24.25039  
1 1 1 10 7  3  o 253.2925 8.869582  42.88541       2.989016      48.10325       4.183824      37.44591       4.271762      267.9609 11.74586  236.1109 13.63543  31.85001       17.99695  
1 1 1 10 7  4  o 432.6361 13.85487  125.4668       7.976980      131.9259       16.24043      123.4130       9.157805      439.6580 27.86437  428.6299 16.06218  11.02808       32.16235  
1 1 1 10 7  5  o 429.7713 7.577677  123.2507       4.339573      123.7577       5.100388      121.9213       8.258965      430.5292 8.890518  426.3183 14.55982  4.210938       17.05959  
1 1 1 10 7  6  o 371.5361 7.238830  92.10198       3.583793      92.01929       3.889615      92.56667       9.220532      371.3215 7.861093  370.5010 18.73722  0.8204956      20.31946  
1 1 1 10 7  7  o 162.5966 1.184343  17.61501       0.2566034     17.62634       0.2569735     13.68749       4.783126      162.6489 1.185670  139.7749 26.65332  22.87395       26.67968  
1 1 1 10 7  8  o 390.1178 8.862525  101.6144       4.607090      96.80806       5.206980      118.9424       9.886721      380.5032 10.27903  420.3842 17.68903  -39.88092      20.45874  
1 1 1 10 7  9  o 281.5391 8.236982  52.95195       3.086833      55.89045       3.696899      46.18636       5.609549      289.1150 9.609422  261.8858 16.15330  27.22919       18.79548  
1 1 1 10 7  10 o 242.1287 11.20884  39.27131       3.606621      42.91281       4.844953      34.74540       5.401357      252.6957 14.44881  226.7080 18.02816  25.98764       23.10374  
1 1 1 10 7  11 o 177.4728 5.282679  21.01833       1.247889      21.10009       1.319769      20.32847       3.833554      177.8018 5.577322  173.2592 16.81596  4.542664       17.71675  
1 1 1 10 7  12 o 298.9221 5.200876  59.57313       2.071611      58.97231       2.130579      69.97884       8.866666      297.4041 5.376220  321.7204 20.79413  -24.31625      21.47789  
1 1 1 10 7  13 o 327.9475 7.234279  71.74712       3.161354      69.68471       3.531540      80.06645       7.092841      323.0367 8.210902  345.3192 15.45353  -22.28247      17.49944  
1 1 1 10 7  14 o 324.8113 7.162082  70.38044       3.099874      73.67957       3.701496      62.63286       5.672324      332.1559 8.369662  305.5603 13.96821  26.59564       16.28380  
1 1 1 10 7  15 o 728.6425 11.25404  354.8694       10.92689      362.7253       15.05764      346.1307       15.88113      735.6454 15.36084  718.2634 16.59297  17.38196       22.61155  
1 1 1 10 7  16 o 134.5891 4.775259  12.09147       0.8550498     11.43996       1.386685      12.49115       1.086101      130.6781 8.001823  136.7270 5.975750  -6.048950      9.986930  
1 1 1 10 7  17 o 281.9953 8.919311  53.16523       3.347343      57.84621       4.915857      49.11853       4.570684      293.6696 12.59148  270.5483 12.71391  23.12128       17.89383  
1 1 1 10 7  18 o 113.6392 2.017542  8.605275       0.3055093     8.609254       2.510832      8.605215       0.3077962     111.7724 17.42625  113.6387 2.032654  -1.866310      17.54440  
1 1 1 10 7  19 o 199.4030 1.552699  26.49434       0.4125651     21.60136       3.765397      26.55379       0.4150640     178.3621 16.01315  199.6265 1.560355  -21.26442      16.08900  
1 1 1 10 7  20 o 293.4399 8.016381  57.61296       3.131583      66.82528       8.303810      56.08551       3.381248      312.7001 20.03394  289.3988 8.778275  23.30133       21.87275  
1 1 1 10 7  21 o 429.4163 9.937778  123.6688       5.686452      127.3550       7.999937      119.9042       8.084444      434.2196 13.84392  421.0652 14.43011  13.15439       19.99705  
1 1 1 10 7  22 o 160.3755 4.810900  17.18363       1.026943      10.46812       4.359458      17.57818       1.056680      119.4746 27.89254  162.2001 4.894590  -42.72548      28.31873  
1 1 1 10 7  23 o 97.43202 4.766230  6.353652       0.6169221     8.740129       3.736613      6.286777       0.6255062     109.0088 26.07531  96.90794 4.859445  12.10089       26.52425  
1 1 1 10 7  24 o 114.1751 7.637706  8.780545       1.155321      11.04194       1.717715      6.912441       1.561217      127.6021 10.18681  100.3941 11.90155  27.20801       15.66582  
1 1 1 10 7  25 o 72.97928 10.05204  3.659564       0.9515864     3.419424       1.524066      3.812995       1.218224      69.06995 16.73680  73.86653 12.84271  -4.796577      21.09634  
1 1 1 10 7  26 o 132.5404 8.747150  11.89309       1.536221      12.25879       2.121563      11.49000       2.227387      133.6394 12.04279  128.9865 13.14259  4.652863       17.82573  
1 1 1 10 7  27 o 126.4702 9.565681  10.90594       1.600094      12.63388       2.391104      9.504625       2.153283      134.7175 13.50167  116.4173 14.17235  18.30026       19.57423  
1 1 1 10 7  28 o 267.6218 10.02816  48.99502       3.569829      47.14225       3.748033      67.10067       11.71656      261.9916 10.75889  283.1217 31.59440  -21.13013      33.37604  
1 1 1 10 7  29 o 86.15944 21.71705  5.908193       2.492125      4.084807       3.247853      8.518806       3.886228      71.85799 26.16895  98.73869 28.16130  -26.88070      38.44311  
1 1 1 10 7  30 o 67.87421 21.52983  3.781842       2.185618      3.917375       2.625599      3.475995       3.944194      68.43815 23.66507  67.27717 27.57571  1.160980       36.33807  
1 1 1 10 7  31 o 52.11556 18.45488  2.094586       1.602632      2.354629       2.358042      1.871351       2.184788      55.74420 21.83237  52.17493 20.83057  3.569267       30.17557  
1 1 1 10 7  32 o 49.67724 18.39602  1.910475       1.615775      3.342211       1.779202      -4.826457      3.859446      62.22972 19.38204  40.42220 19.93873  21.80752       27.80677  
1 1 1 10 7  33 o 50.70085 18.28677  2.141198       1.580972      2.694618       2.069254      1.365108       2.450432      55.04036 20.72996  48.03984 20.79857  7.000515       29.36515  
1 1 1 10 7  34 o 39.44083 15.75740  1.028273       1.251056      1.097531       2.132976      0.9919527      1.544653      44.20732 19.26921  40.77563 17.03349  3.431690       25.71852  
1 1 1 10 8  0  o 215.2124 15.32166  31.41979       4.341716      31.41979       4.341716      31.41979       4.341716      215.2124 15.32166  215.2124 15.32166  0.000000       0.000000  
1 1 1 10 8  1  o 48.77327 6.705612  1.616563       0.4242835     1.619859       2.089162      1.616422       0.4333135     56.07195 20.88873  48.74912 6.860047  7.322830       21.98634  
1 1 1 10 8  2  o 307.0600 7.391680  62.91126       3.024405      65.12964       11.67345      62.75164       3.131325      307.9940 28.77664  306.6534 7.663141  1.340546       29.77950  
1 1 1 10 8  3  o 131.8325 5.773029  11.61207       1.011685      14.45777       1.476413      9.093146       1.389057      147.0016 7.562662  116.3490 9.030151  30.65262       11.77869  
1 1 1 10 8  4  o 543.3980 2.693425  196.7728       1.950278      196.6528       1.993680      199.4393       9.397910      543.2299 2.754217  545.8856 12.91981  -2.655762      13.21012  
1 1 1 10 8  5  o 480.2919 5.894816  153.8375       3.772672      150.4122       4.433865      162.8223       7.181042      474.8226 7.007732  493.5550 10.91889  -18.73233      12.97422  
1 1 1 10 8  6  o 386.2435 6.959185  99.52483       3.581732      91.94724       4.494277      112.7155       5.929627      371.0782 9.089100  410.5191 10.84929  -39.44095      14.15340  
1 1 1 10 8  7  o 88.26833 4.481707  5.207180       0.5254099     5.417803       0.5716062     4.059864       1.334090      90.02154 4.782313  76.75638 13.53823  13.26516       14.35807  
1 1 1 10 8  8  o 89.86528 5.157915  5.402033       0.6150514     5.054015       0.6428345     9.169106       2.114951      86.88122 5.582180  116.1954 13.93740  -29.31423      15.01372  
1 1 1 10 8  9  o 316.3140 10.12880  66.90570       4.263731      68.57249       5.477195      64.34219       6.792574      319.8785 12.87621  309.2439 16.54411  10.63461       20.96436  
1 1 1 10 8  10 o 318.9183 14.46787  68.25920       6.132325      66.68307       7.929630      70.60438       9.672625      314.3765 19.01802  322.6955 22.63820  -8.318970      29.56642  
1 1 1 10 8  11 o 687.8028 14.31076  316.7743       13.11596      304.7115       18.71704      328.4129       18.38496      672.3572 20.91665  698.4660 19.77340  -26.10883      28.78356  
1 1 1 10 8  12 o 604.6392 9.511253  244.1088       7.663155      244.3714       9.550251      243.6342       12.84080      604.6000 11.85422  602.6417 16.00457  1.958252       19.91655  
1 1 1 10 8  13 o 155.0510 9.583366  16.11399       1.970328      16.16699       2.191564      15.89052       4.500078      155.1965 10.66217  151.8303 22.95894  3.366150       25.31393  
1 1 1 10 8  14 o 402.0186 8.659945  107.8822       4.639112      107.2840       5.815399      108.9289       7.693176      400.5360 10.90608  403.0556 14.34698  -2.519592      18.02161  
1 1 1 10 8  15 o 207.3093 6.755185  28.69899       1.863585      26.37115       2.312817      33.00802       3.146691      198.5548 8.763116  221.9914 10.66885  -23.43663      13.80640  
1 1 1 10 8  16 o 59.74726 11.75508  2.470759       0.9025232     -0.1197091     1.694649      3.496411       1.066328      40.56116 17.42622  71.39434 11.60696  -30.83318      20.93788  
1 1 1 10 8  17 o 251.0152 9.440816  42.16769       3.152161      42.40459       4.360877      41.90849       4.561548      251.2101 13.07254  249.6169 13.76734  1.593246       18.98502  
1 1 1 10 8  18 o 86.59344 3.260244  5.005149       0.3755194     4.244660       2.202351      5.027921       0.3811001     77.78865 20.83174  86.78844 3.301385  -8.999794      21.09171  
1 1 1 10 8  19 o 236.8831 5.093913  37.43494       1.607900      44.42058       5.686973      36.82800       1.676296      255.8819 16.77137  234.9389 5.354540  20.94305       17.60540  
1 1 1 10 8  20 f 196.1455 1.765767  25.63795       0.4615143     22.06472       5.271546      25.66554       0.4632932     177.8768 22.76140  196.2509 1.771621  -18.37407      22.83024  
1 1 1 10 8  21 o 188.6776 6.423834  23.81796       1.612702      26.35817       3.852853      23.27836       1.775746      196.7850 14.80170  186.4305 7.161416  10.35458       16.44312  
1 1 1 10 8  22 o 253.5907 7.233130  43.07767       2.441682      36.19373       5.814463      44.55152       2.690395      228.6423 19.26346  257.7749 7.841645  -29.13266      20.79837  
1 1 1 10 8  23 o 77.28345 7.751379  4.043600       0.7874854     4.295939       1.257126      3.880635       1.010260      78.76899 12.38542  75.21985 10.35359  3.549141       16.14297  
1 1 1 10 8  24 o 141.0151 10.09934  13.47601       1.885154      13.04432       2.273727      14.42536       3.371793      138.1107 12.48970  143.3913 18.04548  -5.280533      21.94611  
1 1 1 10 8  25 o 101.4294 10.25012  7.022244       1.366382      5.635524       1.755711      9.152200       2.175925      89.38937 15.28898  114.6843 14.56677  -25.29496      21.11738  
1 1 1 10 8  26 o 114.0563 9.419129  8.855568       1.418790      9.585959       1.798012      7.650328       2.309678      118.0775 11.57612  103.3217 17.39308  14.75581       20.89320  
1 1 1 10 8  27 o 115.2000 10.21385  9.107581       1.551657      9.648177       1.996556      8.283076       2.465709      117.5836 12.95726  106.6556 17.98871  10.92802       22.16945  
1 1 1 10 8  28 o 155.4110 11.52436  16.76975       2.369576      17.23781       3.172129      16.17884       3.564206      155.0646 15.56213  148.1263 18.45677  6.938324       24.14191  
1 1 1 10 8  29 o 50.91748 19.52526  1.617085       1.856151      -2.736435      3.649419      3.136302       2.155824      46.25440 21.95207  63.56761 21.45679  -17.31321      30.69670  
1 1 1 10 8  30 o 44.92219 18.71195  0.8721240      1.856233      0.6197169      2.259635      1.395926       3.255152      46.37587 20.02510  55.34502 23.96646  -8.969147      31.23133  
1 1 1 10 8  31 o 28.74822 13.76440  -1.628839      1.501609      -4.303883      2.874667      -0.6250317     1.760952      35.24536 17.35103  35.55036 16.32063  -0.3050041     23.82061  
1 1 1 10 8  32 o 40.50703 18.91382  -0.8270563     2.519224      0.1359467      3.226742      -2.330407      4.031630      47.64502 21.95292  45.41890 21.95008  2.226116       31.04411  
1 1 1 10 8  33 o 46.83186 20.65066  1.153458       2.514112      2.481076       2.976451      -2.152257      4.696723      53.87806 23.12026  46.80654 22.86249  7.071526       32.51522  
1 1 1 10 8  34 o 42.44148 19.61740  0.1873552      2.606264      1.089143       4.330288      -0.3248618     3.263561      50.29141 23.88083  43.83913 20.79222  6.452278       31.66402  
1 1 1 10 9  0  o 146.6669 8.355685  14.48434       1.620785      14.48434       1.620785      14.48434       1.620785      146.6669 8.355685  146.6669 8.355685  0.000000       0.000000  
1 1 1 10 9  1  o 178.0731 1.844615  21.12904       0.4377009     20.98851       6.058589      21.12977       0.4388476     173.8587 27.02960  178.0761 1.849416  -4.217361      27.09280  
1 1 1 10 9  2  o 206.4485 7.791763  28.48313       2.139641      27.73094       3.345224      29.00390       2.783457      203.2212 12.41250  208.1205 10.06667  -4.899353      15.98149  
1 1 1 10 9  3  o 443.0140 11.44151  131.3043       6.748556      131.2275       8.810596      131.4134       10.49723      442.2337 14.97293  441.8884 17.86425  0.3452759      23.30922  
1 1 1 10 9  4  o 321.8088 6.710526  69.08108       2.877584      70.29590       6.478544      68.78251       3.211797      323.5003 15.07038  321.0643 7.507280  2.436035       16.83674  
1 1 1 10 9  5  o 352.5391 6.528438  82.89890       3.066833      84.05695       3.718555      80.43584       5.423076      354.9027 7.863056  346.6265 11.75816  8.276184       14.14504  
1 1 1 10 9  6  o 559.0406 13.76274  209.2585       10.25231      199.2160       19.19145      213.2689       12.12789      541.1578 26.69642  563.6171 16.16502  -22.45929      31.20908  
1 1 1 10 9  7  o 376.3907 8.542401  94.56564       4.284423      91.16582       5.472117      99.95132       6.887275      369.1553 11.13704  386.2041 13.40343  -17.04883      17.42657  
1 1 1 10 9  8  o 1074.027 17.86722  774.7032       25.57087      792.6447       31.85857      742.2153       42.87051      1084.142 22.05294  1042.642 30.89079  41.50000       37.95488  
1 1 1 10 9  9  o 482.7532 10.34664  155.6823       6.655765      157.9312       8.598411      152.3205       10.51296      485.6310 13.29987  476.2453 16.59146  9.385651       21.26413  
1 1 1 10 9  10 o 324.5953 11.01841  70.48513       4.758880      60.48778       6.954486      79.28870       6.526071      299.7029 17.49009  343.8332 14.27500  -44.13031      22.57607  
1 1 1 10 9  11 o 384.7835 11.03507  99.01319       5.652182      100.0621       6.621248      96.19569       10.85166      386.5599 12.87229  377.2603 21.67774  9.299591       25.21151  
1 1 1 10 9  12 o 318.2597 7.284766  67.57137       3.089376      65.07607       3.576756      74.90168       6.130410      312.1310 8.607830  334.2456 13.79382  -22.11459      16.25928  
1 1 1 10 9  13 o 665.3068 10.00839  295.6420       8.872779      286.1324       10.18911      325.4789       18.04808      654.2241 11.68789  695.4006 19.49626  -41.17657      22.73127  
1 1 1 10 9  14 o 99.85031 5.996721  6.672853       0.7942019     7.657640       0.9054728     3.388449       1.653608      106.9607 6.382001  69.69976 17.75702  37.26096       18.86906  
1 1 1 10 9  15 o 157.3835 4.511553  16.52626       0.9451708     17.41271       1.228682      15.24134       1.479278      161.4856 5.718975  150.9495 7.376692  10.53607       9.333930  
1 1 1 10 9  16 o 280.7178 8.350452  52.66996       3.120113      50.89959       4.468486      54.35431       4.358579      275.4557 12.20435  284.7728 11.50982  -9.317169      16.77564  
1 1 1 10 9  17 o 360.5107 10.48790  87.03872       5.032898      88.38502       7.474464      85.92200       6.807399      362.1914 15.52304  357.3965 14.32313  4.794952       21.12148  
1 1 1 10 9  18 o 439.3779 8.552197  129.0677       5.007137      125.7834       7.700421      131.4736       6.590704      432.4746 13.37836  442.7760 11.17948  -10.30133      17.43449  
1 1 1 10 9  19 o 375.9082 9.357183  94.62186       4.687058      90.45744       8.887053      96.22656       5.516684      364.5139 18.35567  378.5776 10.94727  -14.06375      21.37225  
1 1 1 10 9  20 o 106.4180 4.119793  7.565377       0.5830998     9.728590       5.383166      7.539694       0.5865510     114.9361 33.25857  106.2348 4.151475  8.701378       33.51667  
1 1 1 10 9  21 o 123.0630 2.098903  10.09380       0.3441860     11.24609       2.882868      10.07714       0.3466656     127.2530 17.46131  122.9610 2.115777  4.291962       17.58903  
1 1 1 10 9  22 f 23.54574 10.02194  0.1585647E-02  0.5511035     1.275453       1.253646      -0.3035558     0.6135689     46.07758 16.32178  22.07829 9.936268  23.99929       19.10837  
1 1 1 10 9  23 o 138.4876 6.532433  12.86727       1.202080      10.74982       2.223767      13.74144       1.428828      125.0540 13.56183  142.9659 7.526739  -17.91182      15.51048  
1 1 1 10 9  24 o 31.84132 14.44387  -0.7176211     1.326975      -1.035435      1.439308      1.083304       3.426218      31.87086 14.67650  61.23602 25.45769  -29.36516      29.38526  
1 1 1 10 9  25 f 124.2872 5.606999  10.36233       0.9262127     13.74769       1.805888      9.153934       1.078927      142.3385 9.577017  116.5756 6.977545  25.76282       11.84928  
1 1 1 10 9  26 o 160.2556 5.233068  17.21854       1.115990      18.79454       2.450741      16.80625       1.253495      165.6394 11.16880  158.1764 5.957776  7.463013       12.65849  
1 1 1 10 9  27 o 74.01322 20.28229  4.153215       2.059308      3.100663       3.395962      4.765355       2.589801      68.59740 26.38323  78.39167 23.17652  -9.794266      35.11732  
1 1 1 10 9  28 o 50.93292 18.83867  1.673750       1.693573      -1.208936      2.977067      3.052976       2.059243      46.11890 21.19019  63.47358 20.96140  -17.35467      29.80611  
1 1 1 10 9  29 o 89.47176 20.37097  6.416169       2.374058      11.20352       4.522518      4.595140       2.789274      108.3976 30.19436  73.47114 24.40051  34.92643       38.82118  
1 1 1 10 9  30 o 50.33690 17.52795  1.910658       1.441548      1.215285       1.787605      3.203782       2.437713      46.27354 18.71380  61.85266 22.64862  -15.57912      29.37969  
1 1 1 10 9  31 o 49.19693 19.70653  1.666623       1.961937      2.165668       2.856672      1.221075       2.699214      54.89463 23.06334  49.95700 21.72723  4.937634       31.68581  
1 1 1 10 9  32 o 30.86833 14.59095  -1.179334      1.581486      -2.449197      2.243528      0.7487310E-01  2.229655      33.40524 16.19897  41.51308 18.78785  -8.107841      24.80706  
1 1 1 10 9  33 o 62.56965 21.54822  3.892827       2.176070      3.832366       2.775440      3.989295       3.505809      60.04713 23.63530  59.64735 25.32851  0.3997841      34.64334  
1 1 1 10 10 0  o 10.16168 7.313678  -0.8605793     0.4879427     -0.8605793     0.4879427     -0.8605793     0.4879427     10.16168 7.313678  10.16168 7.313678  0.000000       0.000000  
1 1 1 10 10 1  o 346.6510 7.733199  80.18777       3.572113      86.89310       9.320548      79.03332       3.867413      358.8248 19.56735  344.0956 8.434666  14.72919       21.30786  
1 1 1 10 10 2  o 345.0651 10.72666  79.64557       4.926191      71.34915       13.14488      81.00115       5.313426      321.8518 31.03414  347.8931 11.47758  -26.04132      33.08856  
1 1 1 10 10 3  o 69.61084 20.27505  3.325524       1.994665      2.487175       2.208137      7.043312       4.650032      63.40727 21.71089  101.4670 31.28942  -38.05973      38.08400  
1 1 1 10 10 4  o 420.6402 8.017016  118.0801       4.493628      107.6768       6.644076      126.8510       6.100555      401.0293 12.44833  435.7267 10.50707  -34.69745      16.28986  
1 1 1 10 10 5  o 182.5743 1.279648  22.20960       0.3113177     22.23937       0.3139190     20.43587       2.423266      182.6966 1.289477  174.5848 10.46451  8.111740       10.54366  
1 1 1 10 10 6  o 363.0867 7.895066  87.97010       3.819791      85.72819       6.398651      89.21143       4.761260      357.6563 13.45004  365.3579 9.788615  -7.701630      16.63492  
1 1 1 10 10 7  o 154.3380 4.840784  15.89513       0.9943166     16.11387       1.057777      14.23448       2.914536      155.3833 5.115740  144.9587 15.32021  10.42462       16.15177  
1 1 1 10 10 8  o 387.6257 7.824623  100.2557       4.041564      97.06799       5.590094      103.7467       5.850033      380.9795 11.02303  393.8606 11.15784  -12.88116      15.68453  
1 1 1 10 10 9  o 396.6169 7.099699  104.9314       3.752189      104.5080       4.129015      106.9383       8.990088      395.7649 7.829531  398.9206 16.95098  -3.155731      18.67183  
1 1 1 10 10 10 o 468.8910 9.166879  146.7759       5.727524      137.2672       8.217329      155.7600       7.987446      452.6983 13.63778  482.4659 12.43455  -29.76755      18.45554  
1 1 1 10 10 11 o 337.1612 8.842832  75.93257       3.969424      74.78262       4.627405      79.13576       7.723054      334.4331 10.39639  343.0515 16.94738  -8.618408      19.88212  
1 1 1 10 10 12 o 186.7408 5.307748  23.26888       1.319418      24.17473       1.640216      21.60795       2.220999      190.2753 6.478570  179.6556 9.309321  10.61971       11.34175  
1 1 1 10 10 13 o 330.3128 5.333040  72.74772       2.347328      70.40034       2.682888      80.41031       4.847280      324.8974 6.197018  346.7429 10.50311  -21.84543      12.19501  
1 1 1 10 10 14 o 567.4920 8.103633  214.9750       6.127919      209.3091       7.962901      223.2036       9.596221      559.5726 10.67927  577.5018 12.47020  -17.92926      16.41806  
1 1 1 10 10 15 o 151.0834 5.150064  15.23896       1.035303      14.82675       1.238647      16.19449       1.885857      148.9510 6.254581  155.4271 9.146027  -6.476120      11.08014  
1 1 1 10 10 16 o 264.4706 10.93534  46.89348       3.845434      47.62583       6.211813      46.43845       4.896458      265.2126 17.67817  262.6519 14.04136  2.560699       22.57604  
1 1 1 10 10 17 o 132.3351 9.145955  11.76745       1.602869      14.10956       2.285181      9.499208       2.248853      144.5698 11.96950  117.9602 14.61981  26.60955       18.89465  
1 1 1 10 10 18 o 365.5205 9.085903  89.42076       4.425408      86.89938       7.127754      91.00239       5.645276      358.6481 14.94733  368.0557 11.52481  -9.407654      18.87442  
1 1 1 10 10 19 o 293.0326 8.856526  57.55698       3.454252      52.44595       6.410387      59.64826       4.100488      277.2936 17.43714  297.9893 10.34237  -20.69574      20.27359  
1 1 1 10 10 20 o 224.0249 9.460507  33.72871       2.817770      25.32724       7.006255      35.34984       3.077644      187.1810 29.02951  229.2178 10.10100  -42.03687      30.73667  
1 1 1 10 10 21 o 277.2502 6.360707  51.40295       2.349908      52.43502       4.432860      50.99955       2.771352      278.4730 11.97412  275.8521 7.546580  2.620911       14.15381  
1 1 1 10 10 22 o 123.3071 3.266715  10.14883       0.5362780     7.243889       1.856971      10.41315       0.5601447     102.3278 13.98426  124.8964 3.368787  -22.56857      14.38431  
1 1 1 10 10 23 o 113.0369 7.952189  8.619496       1.190146      9.753898       1.439753      6.171713       2.114905      120.0678 9.065845  93.10707 17.69313  26.96075       19.88055  
1 1 1 10 10 24 o 122.4848 9.173341  10.16907       1.486336      8.910078       1.928871      12.00938       2.332048      113.6143 12.97305  131.9479 13.45153  -18.33366      18.68806  
1 1 1 10 10 25 o 57.78234 8.483165  2.298111       0.6337338     -1.148909      1.376689      3.224956       0.7138676     30.30615 14.09406  68.75880 7.936911  -38.45265      16.17520  
1 1 1 10 10 26 o 76.28530 10.39013  4.035497       1.028750      -4.775997      3.409485      4.918064       1.079041      41.37922 20.04290  84.51881 9.760092  -43.13960      22.29298  
1 1 1 10 10 27 o 140.5627 6.281597  13.33414       1.173587      11.33874       3.164067      13.65245       1.263731      122.7011 20.04322  142.1120 6.692244  -19.41090      21.13094  
1 1 1 10 10 28 o 31.32136 14.69679  -1.316994      1.552634      -1.978876      2.420461      -0.8542339     2.023886      38.44423 18.13527  38.54728 17.62149  -0.1030426     25.28646  
1 1 1 10 10 29 o 49.15475 19.62596  1.435279       1.939523      6.833895       4.317028      0.7001778E-01  2.170959      82.23448 30.13541  43.17223 19.10630  39.06225       35.68184  
1 1 1 10 10 30 o 33.35391 15.55865  -1.015896      1.697996      1.595506       4.726791      -1.402813      1.819444      58.95745 26.94344  33.18939 15.67667  25.76807       31.17221  
1 1 1 10 10 31 o 52.10168 18.77657  2.200554       1.666384      2.155625       1.933710      2.330186       3.284644      52.12492 19.94386  56.06737 24.17628  -3.942448      31.34086  
1 1 1 10 10 32 o 26.47674 12.83170  -1.793071      1.402444      -2.061504      1.724441      -1.268692      2.410195      29.29831 14.20612  37.67682 17.86914  -8.378508      22.82805  
1 1 1 10 10 33 f 36.07730 15.83016  0.3314285      1.460664      1.467062       1.773223      -2.065647      2.576233      44.91697 18.45882  36.00132 17.43428  8.915649       25.39059  
1 1 1 10 11 0  o 31.59912 12.01817  0.9026631      0.4758654     0.9026631      0.4758654     0.9026631      0.4758654     31.59912 12.01817  31.59912 12.01817  0.000000       0.000000  
1 1 1 10 11 1  o 32.13533 10.09586  0.6806992      0.4816623     1.241226       0.5255923     -2.258179      1.203488      42.28032 9.554741  23.74260 11.59179  18.53772       15.02207  
1 1 1 10 11 2  o 216.0699 5.400211  31.12736       1.554814      32.88749       7.363194      31.04522       1.590682      218.9790 25.72426  215.7097 5.538594  3.269272       26.31375  
1 1 1 10 11 3  o 425.6044 14.39812  121.4348       8.153795      124.7917       9.592662      112.6947       15.47864      430.9901 16.73495  406.2169 28.78213  24.77328       33.29368  
1 1 1 10 11 4  o 338.5552 6.785794  76.45154       3.061285      76.67806       3.595365      75.85442       5.837345      338.9855 7.959548  336.4767 13.04398  2.508759       15.28070  
1 1 1 10 11 5  o 170.1119 1.141910  19.28087       0.2588453     19.21367       0.2621255     21.91546       1.641307      169.8151 1.158402  181.1367 6.812156  -11.32152      6.909946  
1 1 1 10 11 6  o 287.9279 6.204991  55.28500       2.380665      58.64196       3.318702      51.72626       3.416987      296.3085 8.413767  278.2007 9.230248  18.10788       12.48955  
1 1 1 10 11 7  o 208.4018 9.144311  29.04887       2.533189      27.38250       4.079118      30.09495       3.231934      201.6047 15.29841  211.8954 11.48934  -10.29071      19.13233  
1 1 1 10 11 8  o 154.1610 6.429075  15.87693       1.317778      15.00507       1.415532      21.54335       3.608693      149.8140 7.111074  178.6843 15.30340  -28.87025      16.87487  
1 1 1 10 11 9  o 375.7139 7.430793  94.17289       3.720197      90.12493       5.492320      97.60448       5.056917      367.0709 11.24202  382.1729 9.938504  -15.10202      15.00523  
1 1 1 10 11 10 o 221.8314 6.336147  32.84443       1.871012      34.05132       2.673236      31.68549       2.619600      225.6813 8.906807  217.6749 9.051105  8.006332       12.69857  
1 1 1 10 11 11 o 570.3759 8.987762  217.1931       6.831031      215.4609       8.087620      221.5048       12.75985      567.8588 10.68826  574.3507 16.68998  -6.491882      19.81904  
1 1 1 10 11 12 o 557.3693 9.686194  207.5001       7.193988      206.8554       9.860555      208.2338       10.51901      555.8845 13.31200  557.3807 14.17431  -1.496216      19.44532  
1 1 1 10 11 13 o 542.2654 10.80746  196.5913       7.809249      211.3813       12.61770      187.4084       9.942262      560.6508 16.90872  528.6201 14.12724  32.03070       22.03370  
1 1 1 10 11 14 o 333.2056 5.785030  74.05427       2.568570      73.11612       2.842276      78.23358       5.999054      331.0441 6.443278  341.4306 13.21074  -10.38651      14.69828  
1 1 1 10 11 15 o 184.2582 7.573622  22.70829       1.855570      23.79048       2.347983      20.90812       3.028303      188.4138 9.381600  176.1058 12.99639  12.30801       16.02874  
1 1 1 10 11 16 o 324.6998 8.798545  70.54045       3.803347      65.94571       4.677530      79.50546       6.533726      313.5231 11.21434  343.5704 14.30285  -30.04733      18.17506  
1 1 1 10 11 17 o 160.6208 11.18091  17.38703       2.378114      17.46756       2.660818      17.06732       5.301675      160.7631 12.51960  155.1689 26.59769  5.594193       29.39690  
1 1 1 10 11 18 o 403.7786 8.915498  109.1799       4.796919      108.2959       5.933860      110.8472       8.149201      401.4293 11.10381  404.6479 15.14017  -3.218567      18.77550  
1 1 1 10 11 19 o 455.8646 12.60565  140.2161       7.649932      136.3196       9.075908      149.7767       14.21666      448.1968 15.21872  464.4375 23.04386  -16.24069      27.61574  
1 1 1 10 11 20 o 189.1026 7.505980  23.98067       1.887621      27.12214       3.139792      22.20257       2.362172      200.1974 11.82243  181.5246 9.802040  18.67279       15.35741  
1 1 1 10 11 21 o 198.9746 7.058013  26.54488       1.868380      24.19465       3.030951      27.98529       2.372826      188.7819 12.11275  203.9679 8.750686  -15.18600      14.94300  
1 1 1 10 11 22 o 129.6399 4.363050  11.23484       0.7526329     8.382959       2.005743      11.70221       0.8119648     110.1086 13.98548  132.2863 4.613325  -22.17774      14.72673  
1 1 1 10 11 23 o 126.2030 2.920961  10.62377       0.4912122     13.64564       2.377007      10.48896       0.5020491     141.0386 12.78672  125.3956 3.004625  15.64295       13.13499  
1 1 1 10 11 24 o 138.4939 9.553080  13.02433       1.752180      9.296254       2.438402      17.00452       2.519500      114.6697 16.42678  157.4931 12.09811  -42.82346      20.40106  
1 1 1 10 11 25 f 56.67682 14.83760  2.314656       1.133505      2.969752       3.783804      2.250072       1.188066      70.51339 27.64437  55.90156 15.43980  14.61183       31.66384  
1 1 1 10 11 26 o 119.2968 8.704593  9.711990       1.374206      11.34283       3.381654      9.389406       1.503988      122.2691 21.54250  116.9409 9.740067  5.328148       23.64208  
1 1 1 10 11 27 o 56.75253 15.22298  2.387013       1.174901      6.205602       3.255933      1.815349       1.259780      85.81356 26.12988  50.31885 16.38273  35.49471       30.84095  
1 1 1 10 11 28 o 37.44813 14.65501  0.7188260      1.061779      0.6444700      2.251294      0.7400967      1.204109      47.03473 20.14408  38.99581 15.49864  8.038921       25.41637  
1 1 1 10 11 29 o 52.95589 10.79880  2.044012       0.7361551     1.785268       1.828177      2.094085       0.8042383     50.51769 19.37615  53.28926 11.65143  -2.771576      22.60953  
1 1 1 10 11 30 o 42.94498 17.29934  1.075376       1.520945      -0.8097209     2.197569      2.808558       2.107162      38.59671 17.90068  57.59571 21.06236  -18.99900      27.64159  
1 1 1 10 11 31 o 55.37771 20.20885  2.655994       1.938336      2.551923       2.813527      2.750015       2.674217      55.43724 23.06006  56.30199 22.84543  -0.8647461     32.46044  
1 1 1 10 11 32 o 36.97719 15.93196  0.4841357      1.424236      1.238239       2.407017      0.7788211E-01  1.766698      46.50761 20.36638  37.46399 16.86057  9.043617       26.43990  
1 1 1 10 12 0  o 94.21429 9.846030  6.111641       1.202344      6.111641       1.202344      6.111641       1.202344      94.21429 9.846030  94.21429 9.846030  0.000000       0.000000  
1 1 1 10 12 1  o 685.0269 18.70631  315.4404       17.05936      310.5031       19.43935      331.9813       35.58098      678.6697 21.52282  692.8806 38.69139  -14.21088      44.27477  
1 1 1 10 12 2  o 294.8789 6.556036  57.99191       2.576076      55.27030       2.774800      74.97690       6.931896      287.7538 7.242398  334.1518 15.61122  -46.39804      17.20937  
1 1 1 10 12 3  o 410.4475 11.13939  112.6489       6.086826      110.5118       6.596831      124.8892       15.78762      406.3867 12.19591  428.2632 27.81560  -21.87643      30.37182  
1 1 1 10 12 4  o 312.0995 5.055483  64.93624       2.102468      65.58778       2.205857      58.47050       6.948888      313.6530 5.277817  294.6391 17.78187  19.01385       18.54859  
1 1 1 10 12 5  o 110.8657 3.228802  8.198051       0.4764851     10.15988       0.8939523     7.419516       0.5631485     123.3247 5.453384  105.4316 4.015812  17.89313       6.772455  
1 1 1 10 12 6  o 129.0231 7.219812  11.13930       1.236320      13.30511       2.795029      10.61248       1.378509      140.1278 15.21265  125.8377 8.266795  14.29010       17.31371  
1 1 1 10 12 7  o 320.4565 7.297176  68.50503       3.115999      69.47662       4.746006      67.76889       4.131086      322.2719 11.06821  318.4265 9.747498  3.845367       14.74853  
1 1 1 10 12 8  o 442.1501 16.27132  131.2458       9.570280      134.5822       16.67556      129.6072       11.68649      444.3738 28.30887  438.5167 20.05282  5.857117       34.69161  
1 1 1 10 12 9  o 288.4554 9.360780  55.61440       3.593261      45.52964       5.239742      64.56758       4.937033      260.2431 15.17559  310.5331 11.95354  -50.28998      19.31801  
1 1 1 10 12 10 o 249.6037 6.442000  41.58151       2.140829      42.77520       2.750013      39.74530       3.410757      253.0315 8.166874  243.6673 10.52946  9.364197       13.32544  
1 1 1 10 12 11 o 349.9688 6.566438  81.69996       3.062194      85.77954       3.754419      73.59288       5.292581      358.5073 7.859072  331.4735 12.00225  27.03381       14.34639  
1 1 1 10 12 12 o 172.0011 5.976936  19.75610       1.367801      19.14484       1.614051      21.31352       2.576373      169.2293 7.173885  178.2047 10.90183  -8.975372      13.05046  
1 1 1 10 12 13 o 166.6622 6.128633  18.55512       1.358733      18.94352       1.611219      17.59889       2.528104      168.3164 7.200444  161.7124 11.81366  6.604019       13.83506  
1 1 1 10 12 14 o 167.2081 2.623530  18.63272       0.5845435     18.76415       0.6083791     17.05332       2.108982      167.7950 2.720957  159.3639 9.981501  8.431168       10.34572  
1 1 1 10 12 15 o 150.7963 6.582052  15.20951       1.319406      16.60913       1.593805      12.16153       2.351992      157.4952 7.617002  133.9063 13.35950  23.58893       15.37839  
1 1 1 10 12 16 o 296.0316 14.39564  59.18289       5.661594      61.72231       8.507172      57.16401       7.585299      299.9221 21.42761  289.1976 19.80311  10.72452       29.17714  
1 1 1 10 12 17 o 134.1972 12.80528  12.23067       2.262114      10.93425       2.448730      19.77688       5.907883      126.3955 14.82019  166.3860 27.61423  -39.99049      31.33981  
1 1 1 10 12 18 o 249.4366 8.730720  41.73896       2.897434      42.11400       3.677412      41.12499       4.705132      250.0407 11.06458  246.1497 14.40794  3.890991       18.16628  
1 1 1 10 12 19 o 235.6052 14.83818  37.82760       4.634766      35.88651       6.052332      40.57991       7.206907      227.3128 20.19124  240.5408 22.75519  -13.22801      30.42178  
1 1 1 10 12 20 f 189.9021 9.280241  24.28979       2.341238      25.02313       3.297404      23.54423       3.324787      191.7764 12.97985  185.8333 13.51908  5.943100       18.74146  
1 1 1 10 12 21 o 100.9693 8.470547  6.894076       1.129162      9.911991       1.829847      5.038195       1.434949      120.5475 11.53198  85.22454 13.05051  35.32298       17.41558  
1 1 1 10 12 22 o 151.2477 6.511935  15.35226       1.309344      17.73120       2.351859      14.28374       1.576202      161.5289 10.99216  145.5753 8.158147  15.95354       13.68879  
1 1 1 10 12 23 o 43.52119 12.34721  1.325227       0.7490389     -0.1692697E-01 1.141459      2.340268       0.9926611     33.36772 14.31824  57.40539 13.24619  -24.03767      19.50573  
1 1 1 10 12 24 f 129.1177 8.978800  11.32643       1.535195      14.39482       3.299777      10.47880       1.734324      141.9212 17.84211  123.6866 10.62574  18.23461       20.76649  
1 1 1 10 12 25 o 20.68098 10.21104  -2.196600      1.020737      4.686836       2.698411      -3.346028      1.102672      77.90338 23.80091  19.02447 9.575190  58.87891       25.65478  
1 1 1 10 12 26 o 94.69572 2.470481  5.989433       0.3114686     8.734314       2.904516      5.957501       0.3132751     106.2623 21.25557  94.44075 2.491566  11.82153       21.40110  
1 1 1 10 12 27 o 86.24410 10.76729  5.240897       1.210516      5.335001       2.503668      5.212187       1.382900      80.55149 22.47632  85.20100 12.55676  -4.649506      25.74601  
1 1 1 10 12 28 o 21.79786 10.07284  -0.4879249     0.6864799     1.087197       1.249491      -1.168935      0.8215859     42.08904 16.04939  20.69824 9.979689  21.39080       18.89913  
1 1 1 10 12 29 o 65.74007 10.30637  3.117326       0.8731844     2.647166       1.214875      3.619763       1.255884      58.01978 15.44259  68.81154 14.16887  -10.79176      20.95783  
1 1 1 10 12 30 f 26.49638 11.25558  0.1195099      0.6927609     -1.528538      0.9483461     2.005173       1.014411      21.20236 10.33805  50.57196 14.37605  -29.36960      17.70724  
1 1 1 10 12 31 o 24.61811 10.57120  0.6151705E-01  0.6230194     -0.5479660E-02 0.6332479     2.085312       3.480408      24.16494 10.51662  53.63358 23.93636  -29.46864      26.14477  
1 1 1 10 12 32 o 46.50167 12.96117  1.713582       0.8330507     1.547614       0.8589677     4.340081       3.417067      44.12879 13.41788  60.80193 25.36207  -16.67314      28.69275  
1 1 1 10 13 0  o 149.0123 6.810497  14.89441       1.345851      14.89441       1.345851      14.89441       1.345851      149.0123 6.810497  149.0123 6.810497  0.000000       0.000000  
1 1 1 10 13 1  f 338.1219 8.670427  76.35310       3.903273      73.82642       4.715015      81.85569       6.958127      332.2720 10.66298  349.2919 14.98448  -17.01990      18.39113  
1 1 1 10 13 2  o 698.9684 10.70011  326.3682       9.965966      290.8915       28.82178      331.1859       10.62112      651.6656 33.30159  703.9972 11.32207  -52.33160      35.17365  
1 1 1 10 13 3  o 543.0083 12.17656  197.1255       8.810582      191.4024       9.676324      224.8836       21.31026      534.6727 13.59256  575.1870 27.88702  -40.51434      31.02328  
1 1 1 10 13 4  f 124.1197 1.265485  10.26457       0.2093009     10.25713       0.2108368     10.76996       1.737170      124.0746 1.275234  126.5592 10.39236  -2.484596      10.47031  
1 1 1 10 13 5  o 458.2134 9.208181  140.1670       5.622315      142.8463       8.257601      137.8516       7.676474      461.8604 13.43171  453.8285 12.70645  8.031891       18.48958  
1 1 1 10 13 6  o 399.3069 6.938726  106.3555       3.691986      113.8879       6.446011      102.6781       4.503925      412.5960 11.73637  392.2198 8.617635  20.37619       14.56043  
1 1 1 10 13 7  o 125.2868 5.933469  10.49068       0.9877607     10.82088       1.084769      8.888308       2.389647      127.2146 6.419969  114.0192 16.18232  13.19538       17.40929  
1 1 1 10 13 8  f 594.9080 13.58172  236.9238       10.76659      237.4557       15.08705      236.3718       15.36938      593.9052 19.08877  592.4151 19.49615  1.490112       27.28518  
1 1 1 10 13 9  o 297.9327 18.93446  59.95450       7.478106      51.18731       9.046055      78.87762       13.29001      273.7412 25.07800  338.7838 29.74092  -65.04257      38.90281  
1 1 1 10 13 10 o 283.6875 8.776428  53.79355       3.313667      51.19832       4.230255      57.91473       5.330768      276.4274 11.50968  293.7047 13.65829  -17.27737      17.86117  
1 1 1 10 13 11 o 301.1456 6.668500  60.51032       2.675951      61.20066       3.304360      59.19495       4.561236      302.6353 8.201529  297.2024 11.53939  5.432953       14.15707  
1 1 1 10 13 12 o 650.7360 4.569222  282.3492       3.962056      267.2238       10.87847      284.6625       4.254253      631.3707 12.93033  653.3602 4.886491  -21.98956      13.82285  
1 1 1 10 13 13 o 166.3788 6.082730  18.49645       1.346289      17.99206       1.514862      20.39191       2.936619      164.0190 6.946882  173.8979 12.76189  -9.878845      14.53014  
1 1 1 10 13 14 o 222.7760 3.940191  33.09087       1.169659      32.70313       1.241546      36.15126       3.488033      221.4553 4.207297  231.9453 11.31970  -10.49007      12.07630  
1 1 1 10 13 15 o 214.2913 1.391237  30.59849       0.3972639     30.68023       0.4006921     25.88285       3.043439      214.5772 1.401373  196.0013 11.70618  18.57588       11.78977  
1 1 1 10 13 16 o 309.9447 13.46361  64.88090       5.547303      58.38602       8.089030      70.64734       7.621933      291.1719 20.98929  321.8336 17.84281  -30.66171      27.54844  
1 1 1 10 13 17 o 211.1614 10.06988  30.00025       2.825265      28.33273       3.043203      40.40741       7.602585      204.9599 11.18504  240.0524 24.09277  -35.09250      26.56250  
1 1 1 10 13 18 o 150.8688 9.734822  15.35106       1.946600      14.86596       2.233636      16.88301       3.969359      148.1202 11.40458  155.5305 19.58614  -7.410278      22.66454  
1 1 1 10 13 19 o 204.8028 11.41886  28.39000       3.103912      27.21997       3.380331      34.67913       7.837097      200.1407 12.74122  218.8060 27.48445  -18.66528      30.29412  
1 1 1 10 13 20 o 213.2015 8.007709  30.54229       2.270908      31.07971       3.007985      29.83000       3.462959      214.4081 10.56086  209.4450 12.46443  4.963074       16.33689  
1 1 1 10 13 21 o 49.69625 11.88173  1.740391       0.7761481     1.742676       0.8090158     1.713973       2.750935      49.70792 12.28536  59.98643 23.55513  -10.27851      26.56641  
1 1 1 10 13 22 o 111.4575 10.42381  8.478660       1.530177      10.62468       3.131128      7.805325       1.753880      121.4143 20.05283  106.3035 12.62813  15.11078       23.69780  
1 1 1 10 13 23 o 86.94678 7.642508  5.127188       0.8764473     8.131694       1.514578      3.614564       1.074659      108.9145 10.56865  71.95222 11.60324  36.96228       15.69496  
1 1 1 10 13 24 o 131.0113 11.04108  11.82069       1.909575      11.89684       2.131589      11.51121       4.297315      130.9008 12.36707  119.9544 27.47660  10.94640       30.13152  
1 1 1 10 13 25 o 24.57876 9.419524  0.2868371      0.4318185     0.5465799      0.5701268     -0.6266812E-01 0.6613427     30.46473 10.98233  24.88524 10.78937  5.579485       15.39552  
1 1 1 10 13 26 o 123.3890 5.929480  10.29249       0.9720611     7.574786       1.677218      11.66709       1.192824      103.2189 12.44516  131.0764 6.853139  -27.85748      14.20730  
1 1 1 10 13 27 o 39.83101 11.57748  1.148073       0.6509883     0.2349612E-01  0.8499888     2.743612       1.012447      28.54613 12.30372  60.97437 12.86603  -32.42824      17.80214  
1 1 1 10 13 28 o 86.31049 7.678845  5.160805       0.8739367     5.619955       1.023226      3.922632       1.680292      89.63419 8.675228  69.48999 18.00272  20.14420       19.98393  
1 1 1 10 13 29 o 36.45216 11.58821  0.9623263      0.6328818     0.6953996E-01  0.8397934     2.135875       0.9628292     28.35768 12.22615  52.62724 13.62435  -24.26956      18.30579  
1 1 1 10 13 30 o 18.96380 9.295501  -1.421990      0.7971193     -2.698659      1.610525      -1.007775      0.9173626     26.46877 13.02192  22.75972 10.85919  3.709044       16.95561  
1 1 1 10 13 31 o 23.55099 9.935326  0.1166593      0.5335892     0.2972159      0.5926070     -0.6567876     1.226522      26.55080 10.76132  28.59150 13.29887  -2.040701      17.10748  
1 1 1 10 14 0  o 666.6865 65.58934  319.3011       56.88154      319.3011       56.88154      319.3011       56.88154      666.6865 65.58934  666.6865 65.58934  0.000000       0.000000  
1 1 1 10 14 1  f 402.8519 15.35278  108.8997       8.226414      112.6244       11.74093      105.3078       11.52976      408.2753 21.65871  394.6627 22.01124  13.61255       30.88032  
1 1 1 10 14 2  o 297.3678 9.217351  59.09429       3.647950      57.49351       4.296234      63.23063       6.906046      293.1172 11.01912  306.5287 16.97398  -13.41153      20.23703  
1 1 1 10 14 3  o 388.4953 15.84577  101.3469       8.185781      109.2525       14.84803      97.89487       9.811506      400.1527 28.02358  381.0710 19.38588  19.08176       34.07541  
1 1 1 10 14 4  o 245.1136 6.641131  40.10315       2.167118      45.13245       2.791292      32.47139       3.438459      259.9312 8.068624  220.0692 11.76829  39.86208       14.26868  
1 1 1 10 14 5  o 699.6790 12.42700  327.4763       11.58614      330.7281       18.39520      325.3380       14.91674      700.7537 19.71958  696.4553 16.07338  4.298462       25.44043  
1 1 1 10 14 6  o 305.6654 6.034638  62.31069       2.457938      66.55376       3.598055      58.59801       3.365670      315.6288 8.562864  296.1514 8.537638  19.47742       12.09189  
1 1 1 10 14 7  o 434.8879 8.661073  126.2783       5.019062      122.4190       6.666548      131.3281       7.625828      427.6540 11.70965  442.7289 12.94023  -15.07483      17.45180  
1 1 1 10 14 8  o 139.3611 10.18400  13.04895       1.878126      13.87502       2.254599      11.17612       3.394756      143.5166 11.89624  127.1109 20.75831  16.40572       23.92547  
1 1 1 10 14 9  o 212.2323 7.531527  30.10379       2.126566      29.73021       2.516012      31.03822       3.979133      210.7708 8.978938  214.6998 13.98470  -3.929077      16.61906  
1 1 1 10 14 10 o 107.1898 3.727349  7.668181       0.5315763     7.605416       0.5552156     8.358524       1.841351      106.7404 3.910152  110.9759 12.67913  -4.235489      13.26837  
1 1 1 10 14 11 o 186.4062 5.964325  23.20756       1.479571      23.38014       1.641653      22.46074       3.414966      187.0477 6.596841  182.3345 14.16650  4.713226       15.62716  
1 1 1 10 14 12 o 455.5042 7.916381  138.6352       4.804991      138.8307       5.805516      138.2099       8.561532      455.5257 9.564327  453.1541 14.19607  2.371643       17.11738  
1 1 1 10 14 13 o 220.2137 5.458731  32.36006       1.601805      31.12696       1.933202      35.06078       2.860997      215.7856 6.731513  228.6775 9.409122  -12.89185      11.56913  
1 1 1 10 14 14 o 65.23458 13.34150  2.967705       1.120575      2.420876       1.291825      4.629793       2.252188      58.87181 16.03620  80.81046 20.79493  -21.93864      26.26003  
1 1 1 10 14 15 o 233.7557 1.508465  36.41124       0.4698628     36.33043       0.4747457     40.27917       3.284478      233.4958 1.525838  244.8259 10.08944  -11.33008      10.20417  
1 1 1 10 14 16 o 176.1240 7.588175  20.79688       1.776680      21.17584       1.831158      14.71065       7.338398      177.7003 7.751938  138.4889 38.41973  39.21146       39.19398  
1 1 1 10 14 17 o 94.17795 3.828379  5.926719       0.4794369     5.914734       0.4800161     10.88400       9.762279      94.08190 3.836970  122.4921 45.24349  -28.41018      45.40590  
1 1 1 10 14 18 o 58.76292 5.249131  2.325184       0.4066979     2.254681       0.4137092     4.352508       2.218470      57.83588 5.431721  77.79916 20.94018  -19.96327      21.63319  
1 1 1 10 14 19 o 278.1433 7.903209  51.94238       2.926207      51.00265       3.110098      59.19143       8.638000      275.4530 8.483421  289.2561 22.58982  -13.80304      24.13024  
1 1 1 10 14 20 o 94.88908 4.204992  6.023953       0.5303652     6.030725       0.5391691     5.821643       2.946894      94.93610 4.273017  88.74487 24.23978  6.191223       24.61352  
1 1 1 10 14 21 o 84.20345 4.269473  4.748532       0.4774830     4.765247       0.4796134     2.879527       5.071558      84.35070 4.281062  77.22746 31.41484  7.123238       31.70520  
1 1 1 10 14 22 o 41.96024 18.91993  -0.8737841     2.236693      -3.509663      3.399747      1.137779       2.969961      44.60776 21.17558  57.55598 23.79453  -12.94822      31.85255  
1 1 1 10 14 23 o 140.9966 5.874405  13.36631       1.101269      14.74364       1.279846      9.437865       2.161470      147.9454 6.507985  115.7307 14.32141  32.21470       15.73075  
1 1 1 10 14 24 o 52.45234 6.210778  1.876931       0.4256817     1.892672       0.4292996     0.9548151      3.285753      52.66946 6.237801  57.17853 24.40830  -4.509068      25.19276  
1 1 1 10 14 25 o 101.1050 4.214532  6.862998       0.5665552     6.110152       0.6452852     9.395823       1.183589      95.21502 5.104617  117.3845 7.607858  -22.16948      9.161693  
1 1 1 10 14 26 o 94.05533 6.344439  6.020268       0.7904996     -0.1202749     2.842368      6.535035       0.8229669     47.75982 21.44909  98.01343 6.335135  -50.25360      22.36510  
1 1 1 10 14 27 o 59.41425 7.837033  2.464800       0.6053474     0.8421898      2.855889      2.541132       0.6194223     50.46176 22.13866  60.32079 7.895667  -9.859032      23.50451  
1 1 1 10 14 28 o 79.85620 9.202633  4.516540       0.9613643     4.036976       2.021238      4.656748       1.092901      68.05434 20.55982  80.43957 10.44240  -12.38523      23.05971  
1 1 1 10 14 29 o 64.42770 6.552624  2.874432       0.5547313     3.948084       1.929962      2.777742       0.5791716     66.63068 20.08163  63.15786 6.999218  3.472828       21.26643  
1 1 1 10 14 30 f 27.92045 12.88034  -0.5281680     1.115639      3.304092       1.885473      -2.592710      1.383900      59.78635 20.06580  23.89260 11.81381  35.89375       23.28524  
1 1 1 10 14 31 o 30.69515 12.83526  0.3542202      0.8783697     -0.3599433E-01 1.741773      0.4873024      1.017184      36.51899 16.55873  33.28054 13.85632  3.238441       21.59142  
1 1 1 10 15 0  o 478.9448 48.72235  162.2975       30.29675      162.2975       30.29675      162.2975       30.29675      478.9448 48.72235  478.9448 48.72235  0.000000       0.000000  
1 1 1 10 15 1  o 204.8498 11.38715  28.14540       3.096078      23.83916       4.442557      32.21199       4.317165      187.4725 18.00478  218.7058 14.90278  -31.23325      23.37231  
1 1 1 10 15 2  o 226.8405 9.250286  34.42316       2.790212      34.59070       3.049470      33.56166       6.915143      227.3051 10.09313  221.4591 23.80673  5.845963       25.85791  
1 1 1 10 15 3  o 675.0101 11.40096  304.7112       10.25475      278.6288       15.05559      327.2838       14.00603      643.5914 17.57198  698.5992 15.04574  -55.00781      23.13328  
1 1 1 10 15 4  o 487.8578 10.57169  159.0982       6.872442      161.8478       9.529853      156.1188       9.920092      491.1137 14.57846  482.1212 15.46137  8.992554       21.25054  
1 1 1 10 15 5  o 188.2882 9.217544  23.73866       2.305632      23.95100       2.957187      23.40946       3.682003      188.8307 11.81172  186.2157 14.96454  2.615097       19.06448  
1 1 1 10 15 6  f 388.4499 8.437089  100.7687       4.367180      102.1293       7.582112      100.0932       5.342375      389.8878 14.61999  386.7777 10.37509  3.110138       17.92725  
1 1 1 10 15 7  o 600.2736 9.452518  240.8207       7.560843      249.4776       13.76676      237.0817       9.047486      608.6314 16.99140  595.1733 11.40804  13.45807       20.46585  
1 1 1 10 15 8  o 154.5776 9.171441  16.02577       1.880620      17.23499       3.772411      15.62586       2.169416      158.8628 18.14571  152.4395 10.74893  6.423340       21.09044  
1 1 1 10 15 9  o 682.9750 15.31123  313.7769       13.93440      307.1465       30.37594      315.5441       15.68174      662.1421 34.54696  683.8213 17.22360  -21.67920      38.60239  
1 1 1 10 15 10 o 92.39909 20.51827  6.017824       2.460486      3.269738       2.982499      11.87318       4.353535      72.50050 25.21402  129.3226 26.16316  -56.82205      36.33535  
1 1 1 10 15 11 o 583.5295 9.937037  228.0109       7.726686      221.3131       10.10864      237.4234       11.98336      573.7864 13.22114  593.2864 15.17041  -19.50000      20.12312  
1 1 1 10 15 12 o 61.31107 16.41724  2.630737       1.367935      4.708648       2.012209      0.8452716      1.865243      81.65578 18.87164  48.35849 19.26688  33.29729       26.96946  
1 1 1 10 15 13 o 197.4325 6.751957  26.07711       1.773709      24.91650       2.473439      27.30574       2.544893      192.5660 9.670306  201.6382 9.498293  -9.072205      13.55479  
1 1 1 10 15 14 o 277.8377 6.965907  51.64350       2.576913      52.44543       3.086653      49.79893       4.681321      279.7494 8.289425  271.4473 12.97985  8.302094       15.40100  
1 1 1 10 15 15 o 76.03750 3.502441  3.864102       0.3539192     3.771830       0.3585874     7.338969       2.200530      75.11600 3.592941  102.5778 16.67094  -27.46175      17.05372  
1 1 1 10 15 16 o 108.5604 11.83008  8.042536       1.683673      9.137036       1.809187      0.9654143      4.600487      115.7755 11.89624  69.21318 29.18439  46.56236       31.51586  
1 1 1 10 15 17 o 160.0231 7.343288  17.19017       1.561663      16.75762       1.588260      29.78206       8.569343      157.9557 7.567945  198.4973 33.59533  -40.54156      34.43719  
1 1 1 10 15 18 o 146.5344 8.369720  14.46473       1.627474      14.59167       1.877084      14.08036       3.266254      146.9166 9.641533  141.9357 17.64989  4.980850       20.11163  
1 1 1 10 15 19 o 170.4380 9.333894  19.62428       2.111747      19.80045       2.250063      18.32209       6.117415      171.0536 9.914114  154.8567 30.73074  16.19690       32.29037  
1 1 1 10 15 20 o 191.6646 12.77598  25.16288       3.244314      29.72210       4.822445      21.39329       4.384995      205.8531 17.75403  173.6400 19.27600  32.21317       26.20629  
1 1 1 10 15 21 o 84.76422 29.20796  5.372757       3.998278      7.754967       5.440899      2.576098       5.895227      98.52293 34.06668  78.29314 33.02624  20.22979       47.44756  
1 1 1 10 15 22 o 115.6714 21.57673  10.02806       3.203413      12.06185       3.705713      4.014300       6.372232      126.3101 22.85839  82.82526 34.59773  43.48486       41.46696  
1 1 1 10 15 23 o 164.6965 19.75125  20.11489       4.248269      22.93245       6.486808      17.99883       5.621577      165.2395 30.58697  146.7829 29.76123  18.45663       42.67662  
1 1 1 10 15 24 o 167.2062 15.83799  20.29108       3.486727      23.84050       4.457013      14.69263       5.597568      178.1806 19.06812  125.2949 33.05489  52.88567       38.16043  
1 1 1 10 15 25 o 83.06463 10.38406  4.863209       1.124323      2.597599       2.416289      5.489301       1.270209      59.47612 22.40086  87.99973 11.07717  -28.52361      24.99004  
1 1 1 10 15 26 o 37.21723 13.87746  0.8533323      0.9224924     3.443804       3.906153      0.7003188      0.9493463     65.22617 27.15478  35.84981 13.90619  29.37637       30.50843  
1 1 1 10 15 27 o 67.92803 9.669311  3.296434       0.8505357     6.333726       2.767889      2.979732       0.8937795     82.57463 23.83458  63.97191 10.87376  18.60272       26.19782  
1 1 1 10 15 28 o 48.12387 11.28290  1.732147       0.7108845     2.335020       2.384727      1.673349       0.7447443     54.22104 21.72385  47.07698 11.87511  7.144058       24.75771  
1 1 1 10 15 29 o 79.40136 10.42399  4.609869       1.076287      4.309171       1.911443      4.749466       1.302372      69.02277 19.77080  78.91026 12.82595  -9.887482      23.56671  
1 1 1 10 15 30 o 50.72916 12.09596  1.994290       0.8061008     1.615453       1.270383      2.249631       1.042962      44.99914 16.36964  52.56244 14.44619  -7.563293      21.83248  
1 1 1 10 16 0  o 42.34116 25.09702  1.342125       2.452527      1.342125       2.452527      1.342125       2.452527      42.34116 25.09702  42.34116 25.09702  0.000000       0.000000  
1 1 1 10 16 1  o 487.2469 16.56884  159.8609       10.74193      158.0995       12.26099      165.6774       22.28070      483.7299 19.05899  487.6275 34.51297  -3.897583      39.42576  
1 1 1 10 16 2  o 381.9294 7.059187  97.35785       3.592620      92.39417       4.576276      105.3308       5.799894      371.8342 9.236115  396.6170 10.98484  -24.78278      14.35174  
1 1 1 10 16 3  o 516.4531 12.68233  178.7462       8.727773      163.0200       14.74751      187.2231       10.82749      489.6057 22.66620  527.6067 15.41737  -38.00101      27.41262  
1 1 1 10 16 4  o 223.9888 4.331019  33.45039       1.292677      31.98688       1.425465      40.22590       3.067117      219.0132 4.884418  245.1301 9.407342  -26.11694      10.59979  
1 1 1 10 16 5  o 291.9651 5.929846  56.87285       2.307002      53.55539       2.843694      63.26005       3.945799      283.1012 7.544927  307.4256 9.644037  -24.32440      12.24473  
1 1 1 10 16 6  o 95.55602 1.118486  6.083902       0.1424171     6.098824       0.1429944     4.246887       1.586601      95.67313 1.121645  78.06502 15.79539  17.60811       15.83517  
1 1 1 10 16 7  o 141.6080 8.121135  13.44350       1.525994      12.24601       2.235343      14.48864       2.088315      134.5171 12.61807  146.6983 10.75791  -12.18118      16.58157  
1 1 1 10 16 8  o 357.3201 8.519223  85.36536       4.056309      82.11193       4.620068      96.30927       8.473508      350.0899 9.913633  377.2387 16.89964  -27.14880      19.59280  
1 1 1 10 16 9  f 160.8744 14.72293  17.58229       3.121175      22.32581       5.608144      15.45373       3.756747      178.8421 24.14949  149.6669 19.28477  29.17516       30.90470  
1 1 1 10 16 10 o 289.6437 9.678690  56.26129       3.730300      55.83073       5.675733      56.58871       4.949421      287.2620 14.87828  289.7696 12.85019  -2.507629      19.65936  
1 1 1 10 16 11 o 267.9195 7.873858  48.05587       2.807980      49.93894       4.022372      46.26588       3.921708      272.4814 11.10151  262.2189 11.24991  10.26254       15.80519  
1 1 1 10 16 12 o 197.4333 7.759621  26.12056       2.037454      21.10688       2.761614      32.10938       3.018249      176.7429 11.79341  218.4583 10.39828  -41.71535      15.72287  
1 1 1 10 16 13 o 82.57706 10.97928  4.663965       1.178203      4.582326       1.318654      4.987126       2.623564      81.52394 12.53990  83.46455 22.90127  -1.940605      26.10971  
1 1 1 10 16 14 o 223.5037 5.142967  33.35851       1.531694      32.69812       1.735200      35.68892       3.259608      221.1234 5.894253  230.0744 10.66119  -8.950989      12.18209  
1 1 1 10 16 15 o 231.3555 6.240415  35.82067       1.922074      34.66330       2.215102      39.34762       3.866848      227.3943 7.319928  241.0481 12.07718  -13.65381      14.12231  
1 1 1 10 16 16 o 290.1211 9.075489  56.61852       3.504196      56.44901       4.632679      56.84521       5.357277      288.6326 12.07183  288.8350 13.96075  -0.2024231     18.45621  
1 1 1 10 16 17 o 335.7288 8.995790  75.85355       4.020776      77.76461       5.386882      73.44958       6.041774      338.6465 11.95637  328.1274 13.84924  10.51901       18.29635  
1 1 1 10 16 18 o 59.56608 8.463647  2.432291       0.6528985     2.645240       0.6783189     -0.2501840     2.407485      62.17794 8.401783  46.82568 20.43998  15.35226       22.09938  
1 1 1 10 16 19 o 172.2662 12.36324  20.32442       2.819087      17.84154       3.474144      25.11093       4.823697      159.6124 16.57565  187.9522 19.54525  -28.33975      25.62750  
1 1 1 10 16 20 o 64.02538 19.41045  2.960512       1.799356      2.124233       1.981393      6.894634       4.297532      57.40495 20.50015  93.60329 30.24183  -36.19835      36.53525  
1 1 1 10 16 21 o 74.52028 28.08845  3.839455       3.800664      2.885984       5.687947      4.608562       5.108521      76.78056 32.41704  81.56322 32.07755  -4.782661      45.60519  
1 1 1 10 16 22 o 80.00616 19.46025  4.856782       2.054465      3.325634       2.359052      9.664274       4.180115      66.78744 22.44503  107.2193 28.69357  -40.43190      36.42939  
1 1 1 10 16 23 o 54.82685 21.16035  1.867431       2.189909      2.590536       2.758167      0.6341245      3.602099      61.80553 23.77544  56.67156 24.86315  5.133972       34.40128  
1 1 1 10 16 24 o 40.76403 19.08862  -1.640721      2.596680      -1.454793      3.338629      -1.925406      4.131217      47.00675 21.89030  50.73179 23.85765  -3.725037      32.37859  
1 1 1 10 16 25 o 89.34230 11.61660  5.746504       1.350245      6.839484       2.497587      5.295138       1.605013      90.52711 21.09680  83.76888 14.92616  6.758240       25.84309  
1 1 1 10 16 26 o 71.29504 13.41885  3.824888       1.228050      5.141527       3.584508      3.649797       1.307157      71.55137 27.20754  68.84868 14.69571  2.702690       30.92271  
1 1 1 10 16 27 o 25.52515 12.04855  -0.9586218     1.071452      1.882996       3.196722      -1.318251      1.137233      54.35447 23.64230  24.94647 11.95332  29.40800       26.49227  
1 1 1 10 16 28 o 55.73249 10.08504  2.280274       0.7213973     4.246232       2.103616      2.018259       0.7679666     67.45901 21.08500  51.71086 11.44784  15.74816       23.99229  
1 1 1 10 16 29 o 37.01995 13.96589  0.9321752      0.9400581     4.431458       2.188775      0.1406907      1.040957      67.17770 21.57131  31.00655 13.48898  36.17116       25.44158  
1 1 1 10 17 0  o 75.62932 25.62461  4.970540       2.311474      4.970540       2.311474      4.970540       2.311474      75.62932 25.62461  75.62932 25.62461  0.000000       0.000000  
1 1 1 10 17 1  o 128.0780 5.597395  10.96562       0.9529802     10.87973       0.9663860     13.99698       5.741277      127.5666 5.699517  139.2444 31.66125  -11.67774      32.17016  
1 1 1 10 17 2  o 442.5119 7.484667  130.8018       4.413376      129.2954       6.384731      132.1802       6.107414      439.3210 10.90654  444.3228 10.31538  -5.001770      15.01199  
1 1 1 10 17 3  o 501.3137 10.07693  168.2433       6.731491      166.2259       11.40300      169.3224       8.339676      495.7197 17.28919  502.2860 12.46019  -6.566254      21.31132  
1 1 1 10 17 4  o 206.0590 10.32718  28.50709       2.826573      32.02883       4.558991      26.30802       3.602556      217.3698 15.84858  197.3296 13.78751  20.04012       21.00650  
1 1 1 10 17 5  o 159.9352 13.09131  17.30429       2.765585      9.772087       6.177001      19.19270       3.092899      116.7351 36.07405  168.3326 13.91285  -51.59748      38.66399  
1 1 1 10 17 6  o 680.4515 10.69395  310.4013       9.696366      311.1903       13.29232      309.5038       14.17573      679.4656 14.68114  677.0530 15.71265  2.412537       21.50403  
1 1 1 10 17 7  o 265.5900 4.818986  47.05960       1.705458      46.37216       1.922907      49.59383       3.692029      263.5918 5.474605  271.8258 10.21113  -8.233948      11.58613  
1 1 1 10 17 8  o 397.0331 7.884995  105.4300       4.171590      107.4080       5.014936      100.9871       7.516029      400.4174 9.398941  386.5112 14.61963  13.90619       17.38027  
1 1 1 10 17 9  o 189.4313 9.501116  24.11116       2.390624      29.39739       3.854365      20.80615       3.047657      208.2563 13.97014  175.2343 13.14776  33.02196       19.18406  
1 1 1 10 17 10 o 139.4258 10.67299  13.13227       1.967835      15.62547       3.451595      11.93161       2.395246      150.5399 17.53444  132.2326 13.79642  18.30730       22.31138  
1 1 1 10 17 11 o 360.9203 9.882938  87.51580       4.748560      82.28522       7.590175      90.87966       6.086896      347.4140 16.44239  366.9007 12.46824  -19.48669      20.63515  
1 1 1 10 17 12 o 122.3922 9.510771  10.11681       1.538946      10.16687       1.633777      9.722755       4.583785      122.5934 10.09045  114.4303 29.77901  8.163017       31.44212  
1 1 1 10 17 13 o 201.8963 9.468778  27.44427       2.540296      28.68797       2.785323      21.29391       6.193947      206.2679 10.16507  170.7801 28.20152  35.48784       29.97757  
1 1 1 10 17 14 o 118.7518 5.335125  9.441575       0.8420693     9.417781       0.8888620     9.649881       2.629986      118.5676 5.642125  117.4327 17.32691  1.134834       18.22239  
1 1 1 10 17 15 o 82.25329 12.11541  4.673194       1.288168      4.532193       1.455875      5.181616       2.764557      80.50335 14.08448  84.31837 23.65146  -3.815025      27.52752  
1 1 1 10 17 16 o 56.89506 15.51572  2.292417       1.208512      2.305035       1.341102      2.237904       2.787535      57.21917 16.61303  63.40214 24.01986  -6.182976      29.20525  
1 1 1 10 17 17 o 146.1884 7.273183  14.37698       1.412359      14.60938       1.545654      13.20120       3.476559      147.2402 7.906936  135.9740 19.76601  11.26620       21.28885  
1 1 1 10 17 18 o 101.4809 6.935325  6.945477       0.9321938     7.375898       0.9860930     3.327965       2.858749      104.5586 7.120057  69.98232 24.66006  34.57627       25.66737  
1 1 1 10 17 19 o 65.11828 19.51523  3.085871       1.826427      2.228746       1.976092      8.109983       4.784258      58.10454 20.50021  99.87269 31.87383  -41.76815      37.89723  
1 1 1 10 17 20 o 93.36767 17.00550  6.343102       2.037802      4.611333       2.563855      9.313876       3.358020      77.56171 23.09260  109.8773 23.63704  -32.31557      33.04509  
1 1 1 10 17 21 o 59.78819 21.43897  2.484009       2.169354      4.475298       2.623358      -1.822790      3.858048      75.52882 23.53678  51.29839 23.76611  24.23043       33.44859  
1 1 1 10 17 22 o 57.85181 21.97679  2.234507       2.337324      1.727831       2.805176      3.385003       4.227052      57.03288 23.30206  70.12257 28.62177  -13.08969      36.90788  
1 1 1 10 17 23 o 37.95801 16.28062  0.2217648      1.474547      0.4138729      1.533789      -2.121954      5.357294      39.78365 16.81707  56.38133 26.71110  -16.59768      31.56417  
1 1 1 10 17 24 o 74.22468 24.12188  4.920296       2.731814      5.615051       3.292411      3.385034       4.894285      77.20583 26.50836  66.84883 29.16264  10.35700       39.41006  
1 1 1 10 17 25 o 69.70041 24.81402  4.561275       2.900833      7.408090       4.803649      2.927228       3.639350      79.69664 31.17636  61.14437 25.87840  18.55227       40.51737  
1 1 1 10 17 26 o 49.66547 21.17198  1.389498       2.466165      -2.455132      3.310184      6.185653       3.697188      41.80353 20.12430  75.21664 27.83200  -33.41311      34.34541  
1 1 1 10 17 27 o 36.48867 14.85250  0.6805885      1.134491      2.783908       3.009280      0.3321237      1.224868      56.57388 23.71382  34.67425 14.85460  21.89963       27.98222  
1 1 1 10 17 28 o 95.18686 12.42368  6.868114       1.538229      4.813358       3.918585      7.242416       1.672476      63.38890 26.84172  96.95895 13.29460  -33.57005      29.95370  
1 1 1 10 18 0  o 105.2558 23.32151  8.469457       2.859730      8.469457       2.859730      8.469457       2.859730      105.2558 23.32151  105.2558 23.32151  0.000000       0.000000  
1 1 1 10 18 1  o 189.7897 2.742846  24.00940       0.6936617     24.22091       0.7209396     21.37202       2.545799      190.6209 2.838278  178.1760 10.77296  12.44492       11.14058  
1 1 1 10 18 2  o 279.4888 10.15442  52.43289       3.775465      59.17440       6.046936      48.12590       4.833296      295.5442 15.40784  266.9456 13.63288  28.59854       20.57321  
1 1 1 10 18 3  o 266.0984 2.766024  47.19886       0.9807805     42.52205       2.937375      47.78569       1.040495      251.8888 8.764745  267.7406 2.916435  -15.85179      9.237226  
1 1 1 10 18 4  o 388.4995 9.311104  101.1105       4.820201      97.49530       6.632013      105.1588       7.017932      380.2573 13.10823  394.8466 13.35774  -14.58932      18.71510  
1 1 1 10 18 5  o 154.1004 9.087666  15.96150       1.857792      15.06860       3.572841      16.29239       2.174941      147.6525 18.56902  155.4586 10.56199  -7.806183      21.36268  
1 1 1 10 18 6  o 165.7392 9.187591  18.46311       2.021147      19.76516       2.380466      15.10009       3.825722      171.2813 10.48003  147.3098 20.00643  23.97150       22.58513  
1 1 1 10 18 7  o 239.9354 7.568149  38.55201       2.416651      38.57843       2.997085      38.50290       4.085905      239.6873 9.402079  238.6328 12.89738  1.054413       15.96062  
1 1 1 10 18 8  o 170.1311 9.629340  19.48229       2.174088      20.05303       3.910930      19.22704       2.615449      170.6862 17.44009  168.5994 11.71456  2.086746       21.00923  
1 1 1 10 18 9  o 84.14819 13.21088  4.895013       1.432581      5.994416       2.348313      4.243335       1.807981      91.74347 19.79117  77.31215 17.90277  14.43132       26.68707  
1 1 1 10 18 10 o 204.0365 8.157151  27.94323       2.213317      27.95573       3.158323      27.93117       3.102626      203.2910 11.70862  203.2547 11.50248  0.3636169E-01  16.41338  
1 1 1 10 18 11 o 451.0150 10.04809  136.8159       6.038761      136.1039       9.306058      137.3338       7.936672      446.5877 15.66240  450.1212 13.24671  -3.533478      20.51307  
1 1 1 10 18 12 o 160.6564 9.772564  17.42435       2.082193      16.71474       2.247001      21.73630       5.538991      157.1106 10.79876  174.0101 24.57117  -16.89952      26.83944  
1 1 1 10 18 13 o 205.5289 9.730643  28.49453       2.657376      27.87548       2.884064      31.97451       6.838044      203.0185 10.69871  211.0028 24.79288  -7.984268      27.00276  
1 1 1 10 18 14 o 105.8283 10.43178  7.627851       1.451964      7.913674       1.645523      6.622803       3.085666      107.5236 11.67190  94.68706 24.32739  12.83650       26.98250  
1 1 1 10 18 15 o 161.1628 9.397953  17.56264       2.009477      17.60270       2.333535      17.44772       3.952667      160.9288 10.94713  157.0396 19.29395  3.889145       22.18325  
1 1 1 10 18 16 o 254.8097 4.892156  43.41307       1.661077      44.08718       1.770469      38.45814       4.799976      256.7260 5.175412  235.6987 15.36678  21.02733       16.21489  
1 1 1 10 18 17 o 192.6355 8.481263  25.07727       2.171724      26.63405       2.428308      18.85649       4.854143      198.2859 9.215693  159.5695 23.53482  38.71645       25.27482  
1 1 1 10 18 18 o 50.53542 14.06752  1.823681       0.9820144     1.637230       1.051229      3.101329       2.751824      48.34308 14.87167  67.26502 24.14305  -18.92194      28.35584  
1 1 1 10 18 19 o 55.34985 16.27201  2.220152       1.279599      1.499377       1.516534      4.001549       2.384145      49.05265 17.87918  72.53292 22.41107  -23.48027      28.66917  
1 1 1 10 18 20 o 108.7019 13.14633  8.365521       1.865573      6.982019       2.048224      15.10126       4.519392      97.65910 16.31462  136.8282 25.73166  -39.16908      30.46777  
1 1 1 10 18 21 o 37.66569 17.04231  -0.6164902     1.833221      0.1224251      2.266655      -2.013923      3.117120      45.21572 19.78306  44.42496 20.83855  0.7907639      28.73351  
1 1 1 10 18 22 o 58.66630 19.70749  2.664298       1.818707      2.841568       1.928910      1.244552       5.458842      60.26585 20.29610  64.10343 29.16372  -3.837582      35.53104  
1 1 1 10 18 23 o 42.20231 18.19608  0.4318532      1.860340      -0.3824336     2.036704      4.532162       4.570329      39.74159 17.97420  70.37164 29.34085  -30.63004      34.40868  
1 1 1 10 18 24 f 37.99759 18.00919  -1.721907      2.440189      -3.009501      3.328317      -0.2253738     3.588217      41.33961 19.97011  49.89105 23.04568  -8.551437      30.49441  
1 1 1 10 18 25 f 48.15847 19.43060  1.536150       1.922158      -0.4013088E-01 2.208513      6.459785       3.903248      41.61908 18.78012  75.98372 28.50233  -34.36464      34.13321  
1 1 1 10 18 26 o 49.15462 19.31907  1.841962       1.851900      0.5287533      2.124110      6.003150       3.781105      42.85905 18.93656  71.47620 27.74523  -28.61715      33.59153  
1 1 1 10 18 27 o 44.91605 20.66974  0.2385252      2.848021      -0.3281804     3.230145      2.217616       6.036375      44.97469 21.13324  57.19711 27.44155  -12.22242      34.63599  
1 1 1 10 19 0  o 258.2990 9.039793  44.74863       3.102740      44.74863       3.102740      44.74863       3.102740      258.2990 9.039793  258.2990 9.039793  0.000000       0.000000  
1 1 1 10 19 1  o 146.5948 0.9875006 14.31898       0.1928987     14.30862       0.1931550     18.21437       3.746132      146.5417 0.9891703 162.6100 17.56723  -16.06828      17.59506  
1 1 1 10 19 2  o 249.0755 9.871202  41.69994       3.269743      40.31147       4.511561      43.23616       4.745536      243.8217 13.94427  252.4698 14.16272  -8.648132      19.87525  
1 1 1 10 19 3  o 378.9753 10.55169  96.58094       5.323330      98.28008       5.944731      89.70432       11.95928      381.8954 11.69571  357.5065 25.26704  24.38885       27.84265  
1 1 1 10 19 4  o 248.1040 6.466953  41.17479       2.136173      42.17601       2.383443      37.08660       4.816209      250.9974 7.133502  233.2199 15.58714  17.77748       17.14194  
1 1 1 10 19 5  o 137.2702 14.06204  12.88261       2.535846      17.41307       4.131430      10.14407       3.212101      157.9562 20.08200  119.7228 20.89403  38.23340       28.98012  
1 1 1 10 19 6  o 320.1324 9.227023  68.83120       3.931981      67.43157       4.551074      72.95150       7.808567      316.3873 10.81085  325.9602 18.04812  -9.572876      21.03827  
1 1 1 10 19 7  o 119.9442 12.03715  9.801998       1.897895      9.936107       2.567785      9.640521       2.817640      119.6249 16.55181  117.1743 18.67206  2.450584       24.95212  
1 1 1 10 19 8  o 274.1328 4.989984  50.18501       1.822777      48.44603       2.201492      53.97607       3.250509      269.1813 6.137600  283.5203 8.613856  -14.33899      10.57680  
1 1 1 10 19 9  o 339.4674 5.045452  76.97050       2.282294      77.21207       2.699237      76.36469       4.274578      339.8320 5.960782  336.9202 9.530797  2.911774       11.24131  
1 1 1 10 19 10 o 161.6462 6.203355  17.50379       1.333702      17.04038       1.607725      18.52644       2.388350      159.2724 7.597164  165.3940 10.89762  -6.121552      13.28439  
1 1 1 10 19 11 o 300.8286 6.564410  60.58159       2.631409      58.89188       3.426417      63.01100       4.108510      295.9509 8.697980  305.6531 10.10134  -9.702179      13.33012  
1 1 1 10 19 12 o 123.3947 9.234398  10.30301       1.507362      10.19696       1.596737      11.17158       4.569563      122.6239 9.854945  121.5293 28.68238  1.094635       30.32819  
1 1 1 10 19 13 o 86.25923 16.56499  5.290647       1.834819      5.546462       2.158251      4.623807       3.484577      87.64772 19.02635  80.76030 27.27927  6.887421       33.25900  
1 1 1 10 19 14 o 119.7288 12.69088  9.875887       1.993921      10.68825       2.580613      8.672485       3.140887      123.4381 16.07034  108.4758 22.46903  14.96230       27.62450  
1 1 1 10 19 15 o 257.6949 12.92361  45.57433       4.423587      46.48751       5.021402      42.40958       9.347932      259.2361 14.59532  233.5322 30.78901  25.70389       34.07325  
1 1 1 10 19 16 o 45.11253 11.58218  1.442677       0.6997651     1.322244       0.7156436     4.066658       3.340442      43.29176 11.99317  75.33782 26.64704  -32.04606      29.22158  
1 1 1 10 19 17 o 23.95928 10.41609  -0.8353422E-01 0.6198238     -0.2602273     0.6480851     1.810883       2.122072      23.00613 10.29391  55.31465 20.95717  -32.30852      23.34882  
1 1 1 10 19 18 o 58.80673 8.557999  2.394427       0.6509523     2.211234       0.6586618     10.08282       4.267036      56.33556 9.083000  109.5283 28.84351  -53.19274      30.23985  
1 1 1 10 19 19 o 177.6068 5.900708  21.26797       1.394550      21.77735       1.467750      16.53988       4.471703      179.6356 6.140802  144.0063 24.15803  35.62926       24.92628  
1 1 1 10 19 20 o 43.63872 16.57966  1.127487       1.330382      0.9523129      1.560327      1.593922       2.546109      43.98954 17.58991  54.43332 22.21515  -10.44377      28.33581  
1 1 1 10 19 21 o 35.49497 15.92855  -0.3534673     1.564173      -0.2389470E-01 1.716716      -1.964619      3.795693      38.81878 17.09289  48.10322 22.69733  -9.284439      28.41365  
1 1 1 10 19 22 o 47.57957 20.68184  0.7020192      2.442910      0.6225975      2.901419      0.8954440      4.527904      49.91093 22.08831  57.87438 26.41875  -7.963455      34.43608  
1 1 1 10 19 23 o 33.39547 16.05178  -2.197543      2.087153      0.3169351      2.567400      -7.097741      3.584070      46.06252 20.55787  36.02579 18.00727  10.03672       27.32924  
1 1 1 10 19 24 o 57.64065 23.68052  2.713289       2.917217      2.117495       3.768406      3.604264       4.608317      56.91972 25.18240  63.21234 27.91243  -6.292618      37.59331  
1 1 1 10 19 25 o 72.09999 25.41892  5.537156       3.037683      8.474414       4.821415      3.603744       3.911702      78.24563 31.04069  60.72576 26.28454  17.51987       40.67434  
1 1 1 10 19 26 o 33.90446 15.43807  -0.2881487     1.533831      -0.1684525     2.182930      -0.4048726     2.155656      39.71630 18.21016  38.62121 17.84788  1.095085       25.49817  
1 1 1 10 20 0  o 128.4155 5.781192  11.07023       0.9846775     11.07023       0.9846775     11.07023       0.9846775     128.4155 5.781192  128.4155 5.781192  0.000000       0.000000  
1 1 1 10 20 1  o 270.4685 2.818063  48.77445       1.015643      49.05992       1.043190      43.58241       4.448897      271.2541 2.886115  253.4150 13.22059  17.83902       13.53195  
1 1 1 10 20 2  o 31.97849 11.08661  0.6208915      0.5764092     0.5343642      0.5887178     2.625526       2.833663      30.85847 11.15520  66.62602 24.41519  -35.76755      26.84288  
1 1 1 10 20 3  o 105.9408 15.57374  7.798059       2.132953      9.540250       3.288001      6.532208       2.802692      115.3070 22.20499  94.99627 22.49129  20.31077       31.60569  
1 1 1 10 20 4  o 79.00695 19.58209  4.475114       2.051106      1.405028       3.910276      5.640475       2.409142      66.56844 27.38959  88.52226 20.78178  -21.95382      34.38128  
1 1 1 10 20 5  o 217.2154 8.214778  31.68801       2.373431      26.63854       6.604358      32.43686       2.543342      192.0251 26.51776  219.6635 8.706317  -27.63835      27.91042  
1 1 1 10 20 6  o 71.60998 9.477397  3.505828       0.8821677     3.319061       0.9690099     4.409945       2.132014      69.37237 10.83680  78.29480 20.27617  -8.922432      22.99042  
1 1 1 10 20 7  o 197.6270 8.957951  26.29354       2.352870      25.60067       2.994633      27.41123       3.803458      194.3157 11.61850  200.1989 14.35274  -5.883148      18.46593  
1 1 1 10 20 8  o 255.1898 7.669230  43.70789       2.604927      43.93677       3.542228      43.43834       3.844107      255.0635 10.44418  253.2777 11.41940  1.785873       15.47526  
1 1 1 10 20 9  o 199.9593 8.170481  26.89071       2.172436      27.06622       2.725077      26.58467       3.598458      200.0770 10.25556  197.1297 13.78596  2.947281       17.18223  
1 1 1 10 20 10 o 207.6595 4.309759  28.79752       1.192555      29.18102       1.278628      26.23331       3.306245      209.0050 4.591072  196.0664 12.72360  12.93861       13.52657  
1 1 1 10 20 11 f 99.98388 3.750120  6.682485       0.4987448     6.628246       0.5027153     10.07544       3.976094      99.57269 3.795809  115.6578 26.38470  -16.08514      26.65634  
1 1 1 10 20 12 o 77.56176 4.002196  4.028339       0.4122384     3.844194       0.4298230     6.141723       1.456126      75.73586 4.276443  94.33447 11.84434  -18.59861      12.59271  
1 1 1 10 20 13 o 232.8698 8.631066  36.63024       2.673616      37.61935       3.048241      33.33178       5.566496      235.5631 9.732060  216.1385 19.53831  19.42461       21.82793  
1 1 1 10 20 14 o 122.6324 5.771524  10.10499       0.9404791     10.18983       0.9530005     6.939879       5.820832      123.1377 5.824535  94.16716 34.90782  28.97056       35.39041  
1 1 1 10 20 15 f 58.78426 5.883755  2.342303       0.4546940     2.438596       0.4599411     -1.806012      3.018831      60.00172 5.825853  45.61335 21.09394  14.38837       21.88367  
1 1 1 10 20 16 o 230.1910 5.005516  35.52631       1.535361      35.82919       1.551206      20.92676       10.76962      231.1613 5.035944  133.3830 47.77540  97.77834       48.04008  
1 1 1 10 20 17 o 65.95490 5.584624  2.945031       0.4862021     2.936484       0.4870499     5.393641       8.243782      65.85495 5.603401  86.02901 37.68173  -20.17406      38.09607  
1 1 1 10 20 18 o 129.7606 5.105681  11.33596       0.8810929     11.47401       0.8938673     6.609093       5.230345      130.5381 5.148905  84.83916 32.71304  45.69896       33.11577  
1 1 1 10 20 19 o 103.9662 4.562304  7.276032       0.6305088     7.140876       0.6371049     13.70206       4.393039      102.9726 4.655224  124.6718 27.20967  -21.69927      27.60502  
1 1 1 10 20 20 o 95.38412 4.711789  6.139619       0.5970204     6.362067       0.6193718     3.223339       2.242600      97.07684 4.803003  62.78659 21.86220  34.29026       22.38358  
1 1 1 10 20 21 o 58.47705 6.193468  2.349067       0.4752789     2.381117       0.4812514     1.081798       3.026149      58.86856 6.229404  52.17384 22.84214  6.694729       23.67633  
1 1 1 10 20 22 o 59.67337 7.385787  2.481535       0.5747629     2.538436       0.5839534     0.7163873      3.252424      60.35170 7.417116  51.07541 22.94066  9.276295       24.10990  
1 1 1 10 20 23 o 55.45295 5.773444  2.114462       0.4203726     2.129012       0.4214918     -0.6144856     5.772288      55.64697 5.767802  55.29853 26.60906  0.3484383      27.22701  
1 1 1 10 20 24 o 85.76004 5.417381  5.024839       0.6159179     5.250583       0.6245627     -2.960959      3.714733      87.69066 5.370781  42.13670 20.52657  45.55396       21.21757  
1 1 1 10 20 25 o 68.20251 6.664399  3.235613       0.5979486     3.114164       0.6071015     7.172519       3.456539      66.78963 6.921703  77.98605 27.14259  -11.19643      28.01125  
1 1 1 10 21 0  o 149.2443 15.27619  15.47967       2.958918      15.47967       2.958918      15.47967       2.958918      149.2443 15.27619  149.2443 15.27619  0.000000       0.000000  
1 1 1 10 21 1  o 175.5959 7.276690  20.69685       1.698947      21.29397       1.948227      18.80113       3.471337      177.9308 8.239404  164.9935 15.98925  12.93729       17.98733  
1 1 1 10 21 2  o 246.8447 6.524972  40.81496       2.144346      42.27219       2.377232      34.45156       4.967645      251.0901 7.112236  223.3762 16.81277  27.71388       18.25523  
1 1 1 10 21 3  o 96.89449 9.341172  6.372949       1.191142      5.793213       1.303192      9.315950       2.936220      92.03657 10.83337  114.2590 20.01421  -22.22241      22.75809  
1 1 1 10 21 4  o 153.7001 8.898205  15.93408       1.814636      15.93384       2.090863      15.93480       3.652948      153.3850 10.28937  150.6961 18.58479  2.688904       21.24301  
1 1 1 10 21 5  o 87.12802 1.762742  5.059634       0.2046540     5.031149       0.2063637     6.757299       1.593148      86.88206 1.782501  99.10074 12.33033  -12.21867      12.45851  
1 1 1 10 21 6  o 202.5727 7.477489  27.56567       2.014950      27.61879       2.382838      27.43239       3.774710      202.4364 8.854916  199.9503 14.26095  2.486053       16.78643  
1 1 1 10 21 7  o 27.20850 13.12311  -2.149488      1.423593      -8.697742      2.870206      -0.1298901E-01 1.639463      30.54577 15.38358  39.91135 17.14348  -9.365574      23.03374  
1 1 1 10 21 8  o 263.5956 7.105572  46.64973       2.493529      47.32570       3.079376      45.36240       4.249564      264.9853 8.732953  257.9245 12.40088  7.060760       15.16728  
1 1 1 10 21 9  o 67.51752 5.287877  3.068299       0.4719491     3.060673       0.4800409     3.288786       2.581271      67.41998 5.388191  69.01981 23.47724  -1.599838      24.08761  
1 1 1 10 21 10 o 94.66727 7.602424  6.064528       0.9509588     5.895408       1.000481      7.647101       3.060499      93.22466 8.135283  101.0456 23.21824  -7.820976      24.60222  
1 1 1 10 21 11 o 176.4971 8.931705  21.10169       2.093782      20.86277       2.226802      22.92417       6.150126      175.2798 9.570331  172.7845 27.64336  2.495300       29.25315  
1 1 1 10 21 12 o 169.3836 5.430597  19.24710       1.224139      19.72127       1.277087      13.88191       4.295859      171.4228 5.598366  134.8629 24.81901  36.55994       25.44258  
1 1 1 10 21 13 o 69.67176 9.428184  3.354178       0.8528606     3.319659       1.043118      3.423782       1.481234      68.63455 11.83279  68.36634 16.45832  0.2682114      20.27045  
1 1 1 10 21 14 o 103.8739 9.933867  7.430492       1.358255      7.266328       1.405977      9.726349       5.257902      102.5393 10.43521  104.4807 33.42184  -1.941383      35.01304  
1 1 1 10 21 15 o 92.28392 9.494431  5.878115       1.150892      6.069103       1.164845      -1.951002      7.457988      93.80077 9.447993  68.46078 32.15110  25.33998       33.51057  
1 1 1 10 21 16 o 49.70711 8.488825  1.729311       0.5420910     1.747091       0.5444522     -0.3072670     5.826998      49.97030 8.479417  64.22429 29.55892  -14.25399      30.75110  
1 1 1 10 21 17 o 43.16870 10.49328  1.343421       0.5976411     1.394064       0.6010920     -3.029193      5.585410      43.99185 10.41618  56.13226 26.78561  -12.14041      28.73962  
1 1 1 10 21 18 o 68.60027 8.073157  3.266550       0.7238643     3.521278       0.7416223     -1.862248      3.327762      71.30141 7.940242  45.33143 21.34730  25.96998       22.77619  
1 1 1 10 21 19 o 79.36033 11.50643  4.547835       1.181346      5.774714       1.249533      -5.781984      3.625709      90.06213 10.61565  38.74857 19.15257  51.31356       21.89778  
1 1 1 10 21 20 o 72.31446 18.54137  4.284044       1.794946      4.900672       2.133100      2.788379       3.322130      75.85322 20.58356  60.31087 25.07012  15.54235       32.43753  
1 1 1 10 21 21 o 32.58893 15.47617  -1.544407      1.819418      0.5305125      2.095421      -7.901193      3.667665      43.66758 19.06520  35.32909 17.73841  8.338493       26.04099  
1 1 1 10 21 22 o 33.22803 16.02607  -2.199605      2.122789      -3.411572      2.831077      -0.6430998     3.208349      36.17126 17.68538  45.36750 21.23582  -9.196247      27.63572  
1 1 1 10 21 23 o 58.90276 22.46793  3.259654       2.449231      6.854039       3.921914      0.9616148      3.135917      74.59092 28.43633  49.27275 22.29230  25.31817       36.13269  
1 1 1 10 22 0  o 89.95692 1.431718  5.396397       0.1715210     5.396397       0.1715210     5.396397       0.1715210     89.95692 1.431718  89.95692 1.431718  0.000000       0.000000  
1 1 1 10 22 1  o 26.81898 8.081369  0.4874313      0.3125722     0.7481042E-01  0.3616088     1.706854       0.6216423     20.08357 8.302786  49.45013 9.780669  -29.36656      12.82957  
1 1 1 10 22 2  o 135.1326 4.810113  12.22148       0.8647602     12.10623       0.8954241     13.81826       3.332970      134.4679 5.006053  139.7176 18.34497  -5.249680      19.01574  
1 1 1 10 22 3  o 189.1366 6.018432  23.98193       1.514884      24.13089       1.603841      22.74978       4.612758      189.6565 6.355270  178.9814 19.66453  10.67503       20.66599  
1 1 1 10 22 4  o 179.4768 8.116663  21.71383       1.936128      20.86995       2.232618      24.27320       3.888129      175.5457 9.580766  186.8744 15.76089  -11.32877      18.44442  
1 1 1 10 22 5  o 33.01057 10.36439  0.7312350      0.5077031     0.6756593      0.5175601     2.148743       2.613852      32.14540 10.50305  61.31374 23.25243  -29.16834      25.51450  
1 1 1 10 22 6  o 151.7973 7.671079  15.53760       1.546621      15.52310       2.377451      15.54824       2.036437      150.4577 11.95660  151.1717 10.16859  -0.7139282     15.69587  
1 1 1 10 22 7  o 119.5238 15.10159  10.02788       2.351604      17.80575       4.257550      6.613328       2.820953      156.6114 20.92464  93.80328 22.79528  62.80816       30.94293  
1 1 1 10 22 8  o 82.33155 10.50093  4.677555       1.125857      5.483871       1.314998      2.463729       2.178934      89.00674 11.34486  60.87463 21.52225  28.13210       24.32927  
1 1 1 10 22 9  o 114.5985 8.788849  8.934722       1.331857      8.552505       1.411147      12.05205       4.030026      111.8952 9.555631  125.2826 25.01676  -13.38734      26.77963  
1 1 1 10 22 10 o 66.74986 12.40428  3.157228       1.062702      3.112785       1.091024      3.980078       4.694520      66.14133 12.84218  77.71626 30.69302  -11.57493      33.27136  
1 1 1 10 22 11 o 118.1548 8.647189  9.516821       1.352017      7.703839       1.517431      16.49892       2.977867      105.4972 10.95354  152.7676 14.81427  -47.27036      18.42397  
1 1 1 10 22 12 o 85.27511 9.869750  5.032185       1.100826      5.211119       1.162091      3.468128       3.435733      86.66911 10.26124  70.14385 26.64525  16.52526       28.55280  
1 1 1 10 22 13 o 45.51667 13.80740  1.479318       0.9102921     1.089629       0.9675574     4.482125       2.685848      40.97720 14.35382  75.00092 23.87579  -34.02373      27.85831  
1 1 1 10 22 14 o 58.73960 11.88874  2.485533       0.8985761     2.401789       1.049860      2.714926       1.737587      57.11688 13.92255  59.93183 19.21737  -2.814949      23.73067  
1 1 1 10 22 15 o 88.07923 9.643040  5.411186       1.113301      5.481908       1.126128      2.359661       7.397226      88.63900 9.692101  72.72934 33.41146  15.90966       34.78883  
1 1 1 10 22 16 o 53.65466 9.034222  2.034599       0.6229866     1.989229       0.6584042     2.422591       1.925398      52.82025 9.712243  56.63492 20.21026  -3.814671      22.42281  
1 1 1 10 22 17 o 72.71165 5.695165  3.599128       0.5474027     3.523675       0.5495052     13.40256       6.263575      71.91727 5.782807  103.5010 36.49940  -31.58369      36.95467  
1 1 1 10 22 18 o 95.84351 2.962331  6.154611       0.3778750     6.250247       0.3795149     -4.839943      4.069179      96.58783 2.952181  42.85676 21.00611  53.73107       21.21254  
1 1 1 10 22 19 o 61.68993 10.53584  2.758463       0.8350047     2.877071       0.8576984     0.6056653      3.654098      63.00425 10.59164  52.56742 23.89402  10.43682       26.13632  
1 1 1 10 22 20 o 46.16360 14.32945  1.637234       0.9733995     1.618973       1.013280      1.855615       3.504117      45.94080 14.66945  55.30609 24.38393  -9.365295      28.45644  
1 1 1 10 22 21 f 42.34055 12.99161  1.364122       0.8028793     1.607516       0.8388089     -1.295798      2.772950      45.67055 13.10194  40.68378 19.25738  4.986771       23.29179  
1 1 1 10 22 22 o 114.8492 10.46969  9.576940       1.584671      10.48953       1.768480      5.858734       3.569673      119.4978 11.23816  70.75882 27.09145  48.73900       29.32989  
1 1 1 10 23 0  o 223.4052 1.284012  33.26139       0.3822114     33.26139       0.3822114     33.26139       0.3822114     223.4052 1.284012  223.4052 1.284012  0.000000       0.000000  
1 1 1 10 23 1  f 65.55135 4.676362  2.889165       0.4057902     2.390379       0.4840469     4.068631       0.7443427     59.36513 6.210833  77.42304 7.301090  -18.05791      9.585425  
1 1 1 10 23 2  o 82.90269 13.54485  4.848902       1.444672      3.387299       1.643780      9.809538       3.028293      68.00413 17.89927  115.4665 20.42930  -47.46236      27.16137  
1 1 1 10 23 3  o 22.82988 10.94347  -1.313134      0.9552876     -1.297014      0.9868549     -1.553069      3.807397      23.45113 11.20932  52.96177 24.19510  -29.51064      26.66556  
1 1 1 10 23 4  o 222.3607 8.745825  33.50316       2.586334      33.17680       2.828826      35.16565       6.384636      220.8801 9.634341  218.2316 22.26726  2.648453       24.26214  
1 1 1 10 23 5  o 66.22637 17.09910  3.215533       1.519319      2.775534       2.606025      3.442090       1.869999      64.41348 23.44358  68.16940 19.56446  -3.755920      30.53473  
1 1 1 10 23 6  o 144.8186 8.459702  14.24067       1.625390      14.41540       2.459526      14.10521       2.165704      143.9183 12.96395  143.0154 11.46014  0.9028473      17.30314  
1 1 1 10 23 7  o 93.82460 12.01401  6.152389       1.467608      4.414013       2.045910      7.995138       2.106434      76.48419 19.89034  105.7031 15.40803  -29.21893      25.16014  
1 1 1 10 23 8  o 165.8300 10.34698  18.88654       2.274997      18.97701       3.515641      18.82136       2.983999      162.6163 16.45034  163.6601 13.81184  -1.043823      21.47977  
1 1 1 10 23 9  o 79.78316 14.95096  4.620870       1.531088      4.097174       1.695679      6.932421       3.562509      74.05161 17.46909  91.39993 27.22302  -17.34832      32.34597  
1 1 1 10 23 10 o 227.2329 9.235222  35.33476       2.790527      35.64843       3.278560      34.51010       5.315978      227.0966 10.86578  216.0531 18.64732  11.04355       21.58211  
1 1 1 10 23 11 o 38.53685 15.26527  0.6863521      1.164439      0.7878830      1.231308      -0.1729950     3.582216      40.07312 15.75197  53.65962 24.09059  -13.58649      28.78334  
1 1 1 10 23 12 o 98.52338 11.90762  6.883377       1.531608      5.606054       1.888236      9.340200       2.618743      86.12962 17.05602  110.8094 18.37912  -24.67983      25.07389  
1 1 1 10 23 13 o 73.28325 21.22476  4.378573       2.191477      4.072661       2.517435      5.335740       4.453008      70.12978 23.17708  76.89334 30.03523  -6.763557      37.93800  
1 1 1 10 23 14 o 81.70857 16.86752  5.143581       1.775616      4.262068       1.887616      11.91758       5.232649      72.84362 19.18471  105.6026 33.28969  -32.75900      38.42209  
1 1 1 10 23 15 f 45.82615 13.55148  1.561919       0.8853285     2.513692       1.030396      -1.122427      1.730442      57.83380 13.60041  33.68301 15.71032  24.15079       20.77944  
1 1 1 10 23 16 o 43.47520 13.48614  1.397414       0.8623577     1.344267       0.8830357     2.492517       4.008346      42.81474 13.69670  61.19667 26.54735  -18.38194      29.87242  
1 1 1 10 23 17 o 155.0402 4.890426  16.24769       1.009069      15.99006       1.036358      20.94760       4.426405      153.7244 5.066253  157.2152 21.70791  -3.490799      22.29126  
1 1 1 10 23 18 o 56.81079 4.258038  2.186219       0.3199945     2.161532       0.3207625     7.323439       4.627190      56.47949 4.294244  78.07977 30.58234  -21.60028      30.88236  
1 1 1 10 23 19 o 110.2662 6.599768  8.367785       0.9652789     8.295644       1.006492      9.194954       3.408142      109.6120 6.926359  95.21252 26.09280  14.39952       26.99645  
1 1 1 10 23 20 o 93.89875 6.465495  6.079576       0.8040367     6.382986       0.8320164     1.794671       3.126712      96.19088 6.529902  52.58776 23.11497  43.60312       24.01960  
1 1 1 10 24 0  o 56.64084 2.334378  2.149867       0.1755054     2.149867       0.1755054     2.149867       0.1755054     56.64084 2.334378  56.64084 2.334378  0.000000       0.000000  
1 1 1 10 24 1  o 205.4434 5.234895  28.34099       1.431923      27.55303       1.950560      29.26195       2.108772      201.8407 7.264168  207.8564 7.626575  -6.015701      10.53246  
1 1 1 10 24 2  o 44.18859 11.81913  1.396096       0.7094733     1.489651       1.039034      1.314374       0.9711012     46.21605 14.86458  43.80788 14.39115  2.408165       20.68963  
1 1 1 10 24 3  o 93.03329 8.157026  5.913322       1.000994      3.794019       1.242969      9.824163       1.688492      72.73654 13.31483  119.1318 10.75208  -46.39528      17.11408  
1 1 1 10 24 4  o 109.9117 7.348651  8.205934       1.070096      8.561261       1.564163      7.893304       1.467177      111.1162 10.69606  106.7530 10.44765  4.363213       14.95189  
1 1 1 10 24 5  o 21.41088 9.960889  -0.5876065     0.6886170     -0.9343084     0.7023692     8.006817       3.497001      19.70964 9.430593  98.28671 26.21824  -78.57707      27.86274  
1 1 1 10 24 6  o 149.1901 11.58984  15.52220       2.285985      15.93754       2.956041      14.90427       3.605612      148.9249 15.10469  140.4524 19.81524  8.472488       24.91577  
1 1 1 10 24 7  o 142.2696 10.86899  14.07793       2.044912      13.88853       2.840878      14.28158       2.945861      138.2428 15.69958  139.9160 16.09326  -1.673233      22.48266  
1 1 1 10 24 8  o 90.25474 17.35775  6.143484       2.011755      4.074064       2.568889      9.425287       3.235022      71.09484 23.40905  107.8526 23.19900  -36.75779      32.95720  
1 1 1 10 24 9  o 117.9891 17.49143  10.48397       2.666896      6.549078       3.564957      15.48456       4.018823      85.66467 27.53193  138.9814 22.46658  -53.31670      35.53526  
1 1 1 10 24 10 o 45.58963 18.60929  0.9681635      1.787041      -0.4593854E-02 2.024084      4.406864       3.805603      42.04140 18.53410  72.16087 27.88286  -30.11946      33.48084  
1 1 1 10 24 11 o 56.46113 16.83491  2.451624       1.361825      1.676482       1.465466      7.357557       3.686770      48.89128 17.60972  88.43237 27.95155  -39.54108      33.03621  
1 1 1 10 24 12 o 67.21109 19.52299  3.673675       1.851686      2.791852       2.471055      4.802968       2.796374      59.96652 22.63842  73.66021 24.43051  -13.69369      33.30688  
1 1 1 10 24 13 o 58.51870 19.23921  2.741670       1.735458      1.479274       2.189595      4.874669       2.846173      50.39619 20.58842  73.42233 24.65351  -23.02613      32.11975  
1 1 1 10 24 14 o 94.47952 19.19800  7.250922       2.334428      6.026379       2.919868      9.420311       3.886378      80.65994 24.78012  97.19265 28.29863  -16.53271      37.61472  
1 1 1 10 24 15 o 136.7428 8.824723  13.05583       1.599388      12.22059       1.772269      16.72132       3.712689      131.2702 10.21216  142.4078 20.12534  -11.13760      22.56807  
1 1 1 10 24 16 o 50.62373 13.53641  1.967207       0.9307858     0.9520612      1.139111      4.006776       1.614622      39.41700 15.24835  70.08385 17.37609  -30.66685      23.11798  
1 1 1 10 24 17 o 20.84977 10.02034  -1.052866      0.8127555     -1.164130      0.8529631     0.4453502E-01  2.678770      21.06001 10.15770  44.71871 20.37760  -23.65870      22.76896  
1 1 1 10 24 18 o 35.35452 13.53192  0.7692257      0.8904133     1.069853       1.015006      -0.2347656     1.854894      39.37885 14.58072  37.49329 17.03502  1.885555       22.42297  
1 1 1 10 25 0  o 113.9505 6.241975  8.789404       0.9412440     8.789404       0.9412440     8.789404       0.9412440     113.9505 6.241975  113.9505 6.241975  0.000000       0.000000  
1 1 1 10 25 1  o 75.45478 4.498369  3.834634       0.4502352     6.794057       1.292934      3.426245       0.4802970     98.75902 9.960814  71.19662 5.096346  27.56239       11.18886  
1 1 1 10 25 2  o 46.21854 11.38822  1.547586       0.6967496     2.314978       1.215951      1.172450       0.8501614     55.56368 15.72080  41.03678 13.46440  14.52690       20.69864  
1 1 1 10 25 3  o 83.29053 11.37498  4.922259       1.229512      5.829783       2.086964      4.439826       1.521615      86.79101 18.60441  77.19968 15.33237  9.591331       24.10821  
1 1 1 10 25 4  o 108.7596 12.26381  8.425778       1.746369      11.81921       2.077929      0.2637607      3.222626      129.0161 12.23300  52.10626 23.15743  76.90987       26.18993  
1 1 1 10 25 5  o 54.92347 11.98114  2.198111       0.8521277     1.839571       1.340091      2.441486       1.104087      50.28003 16.91695  57.11212 14.48777  -6.832088      22.27282  
1 1 1 10 25 6  o 39.68145 10.40069  1.136110       0.5565226     1.054577       0.8088596     1.209403       0.7668993     39.12849 13.14274  41.06342 12.71448  -1.934933      18.28633  
1 1 1 10 25 7  o 153.0676 9.271935  16.25015       1.882286      18.70553       4.175893      15.62407       2.108649      152.7382 21.07908  149.1270 10.68220  3.611206       23.63127  
1 1 1 10 25 8  f 73.06720 10.06346  3.780866       0.9538180     1.250556       3.731681      3.957729       0.9865900     57.13179 25.17707  74.73707 10.17028  -17.60528      27.15363  
1 1 1 10 25 9  o 229.2279 9.660283  36.62926       2.944125      41.84724       5.919285      34.91410       3.393672      230.1651 19.48279  221.7271 11.52580  8.438080       22.63677  
1 1 1 10 25 10 o 152.7115 11.58777  16.65361       2.340407      13.91750       4.241340      17.85147       2.806341      123.4486 26.57111  156.1826 13.62061  -32.73392      29.85875  
1 1 1 10 25 11 o 67.73051 12.28806  3.375584       1.068194      3.500913       1.433211      3.218961       1.602180      66.85403 16.24919  63.13519 18.10610  3.718842       24.32831  
1 1 1 10 25 12 o 103.1234 12.63651  7.790458       1.700187      8.697952       3.134913      7.412309       2.023648      98.05729 24.15334  97.98165 16.05502  0.7563782E-01  29.00255  
1 1 1 10 25 13 o 63.97521 17.38787  3.327159       1.520746      4.813715       2.346429      2.250477       1.996920      73.27237 22.15548  53.80241 20.34213  19.46996       30.07769  
1 1 1 10 25 14 o 49.78669 19.78848  1.753896       1.963027      3.453273       9.596163      1.679678       2.005435      66.66182 32.58621  49.45663 19.88473  17.20519       38.17412  
1 1 1 10 25 15 o 41.86415 16.28737  1.139132       1.305287      4.326186       2.577681      0.4008511E-01  1.513710      67.05253 23.43267  35.97135 15.93505  31.08118       28.33754  
1 1 1 10 25 16 o 42.60355 15.99658  1.284689       1.230109      0.6219583      1.370254      4.036455       2.792149      38.13703 15.99486  63.95690 24.08197  -25.81987      28.90981  
1 1 1 10 26 0  o 76.25037 32.49910  6.493164       3.359227      6.493164       3.359227      6.493164       3.359227      76.25037 32.49910  76.25037 32.49910  0.000000       0.000000  
1 1 1 10 26 1  o 58.56921 3.855839  2.311188       0.2992536     4.149726       1.342418      2.215046       0.3069782     74.62702 14.01400  57.30015 4.046509  17.32687       14.58652  
1 1 1 10 26 2  o 38.90002 17.70812  -0.5814352     2.016409      0.6145366      2.209132      -6.552660      4.936201      46.04145 19.83981  45.75055 22.56363  0.2909012      30.04556  
1 1 1 10 26 3  o 40.93086 18.26517  -0.1329268     2.025977      -1.457764      2.640111      1.764724       3.159723      41.11599 19.25155  56.51253 24.02344  -15.39654      30.78551  
1 1 1 10 26 4  o 87.47615 15.17238  5.774159       1.704465      5.707252       2.041250      5.928244       3.097706      84.53848 18.62412  80.23460 25.65205  4.303879       31.69993  
1 1 1 10 26 5  o 50.82854 19.17996  1.814755       1.773263      1.264938       2.265943      2.683523       2.848341      49.63654 20.67477  59.76917 23.81030  -10.13264      31.53374  
1 1 1 10 26 6  o 110.4690 9.821900  8.584118       1.430746      12.27918       2.668936      7.094037       1.694853      127.0331 16.13013  98.24382 13.28680  28.78928       20.89785  
1 1 1 10 26 7  o 45.82251 9.571753  1.514330       0.5655677     2.361951       1.057851      1.175076       0.6692468     55.64809 14.21610  40.07989 11.76380  15.56820       18.45222  
1 1 1 10 26 8  o 118.2546 12.00957  10.12009       1.866207      14.08737       4.449597      9.273259       2.055754      120.5191 28.20889  111.4934 14.15588  9.025673       31.56153  
1 1 1 10 26 9  o 107.3725 18.53512  9.288258       2.556108      11.44181       4.499662      8.262199       3.105907      102.9444 30.57849  94.80455 24.43271  8.139816       39.14079  
1 1 1 10 26 10 o 55.93851 22.12099  2.443923       2.441389      3.836199       3.024548      -0.1595205     4.135918      64.57291 24.88218  52.10243 24.29699  12.47048       34.77739  
1 1 1 10 26 11 o 81.62086 9.564055  4.744897       1.020494      5.648522       1.590022      4.111948       1.330740      85.92282 14.39619  73.22655 14.15013  12.69627       20.18605  
1 1 1 10 26 12 f 86.59135 9.156749  5.319176       1.040562      5.670371       1.890260      5.166479       1.246414      83.19450 17.60128  83.95035 11.43938  -0.7558441     20.99201  
1 1 1 10 26 13 o 60.85093 25.59987  3.439064       3.526944      3.399055       4.631700      3.494281       5.441226      61.49267 27.51641  62.39496 28.66085  -0.9022903     39.73156  
1 1 1 10 27 0  o 75.68790 7.523393  3.985949       0.7403005     3.985949       0.7403005     3.985949       0.7403005     75.68790 7.523393  75.68790 7.523393  0.000000       0.000000  
1 1 1 10 27 1  o 14.24029 6.894345  -0.6370590     0.4022104     -0.7040539E-01 0.9752649     -0.7531890     0.4415054     29.41814 12.92084  14.59354 7.101799  14.82460       14.74394  
1 1 1 10 27 2  o 83.17371 18.72037  5.659979       2.024565      4.344546       2.623665      7.596158       3.183075      69.04303 23.66493  89.41495 25.48155  -20.37192      34.77554  
1 1 1 10 27 3  o 58.67343 20.83551  2.860676       2.044014      1.646170       2.830646      4.183954       2.954686      53.26052 22.69287  67.20112 24.87811  -13.94059      33.67323  
1 1 1 10 27 4  o 37.50361 17.43979  -0.9732486     2.107178      -2.271296      2.771358      0.8055134      3.244190      39.02228 18.68775  51.41265 23.01572  -12.39037      29.64718  
1 1 1 10 27 5  o 142.8666 14.01493  15.28232       2.633762      18.75625       3.796101      12.05799       3.657186      151.4629 19.24241  114.4411 24.70695  37.02177       31.31619  
1 1 1 10 27 6  f 59.39938 22.14478  3.030776       2.348812      -0.5532904     3.509247      5.939469       3.161366      47.99669 22.38180  76.85978 25.98329  -28.86309      34.29397  
1 1 1 10 27 7  o 72.24421 22.71727  4.833062       2.438218      6.538347       3.072577      1.933096       4.006829      81.00890 25.50572  57.08960 25.56612  23.91929       36.11327  
1 1 1 10 27 8  o 100.3952 2.502893  6.742607       0.3348334     5.604245       1.575930      6.796424       0.3426569     85.47582 14.34393  100.7547 2.554293  -15.27892      14.56959  
1 1 1 10 27 9  o 88.17971 10.26934  5.600513       1.184105      5.711598       5.876964      5.595812       1.208897      68.68881 30.84578  87.98422 10.51945  -19.29541      32.59020  
1 1 1 10 27 10 o 71.25021 21.04502  4.591779       2.136186      1.959939       6.282775      4.935803       2.271516      60.25980 28.65750  73.26189 21.71734  -13.00209      35.95685  
1 1 1 10 28 0  o 64.80133 8.667798  3.006263       0.7109647     3.006263       0.7109647     3.006263       0.7109647     64.80133 8.667798  64.80133 8.667798  0.000000       0.000000  
1 1 1 10 28 1  o 38.63283 16.71611  0.3810396      1.581022      1.729130       2.138502      -1.244055      2.347953      50.05610 20.38548  38.15566 17.95670  11.90044       27.16636  
1 1 1 10 28 2  o 76.93073 9.690454  4.238167       0.9713926     5.977611       2.183860      3.809130       1.084595      83.23505 19.95002  71.74509 11.75140  11.48997       23.15380  
1 1 1 10 28 3  o 41.23943 18.50796  0.7478136E-01  2.112267      0.6065010      3.950902      -0.1380253     2.499467      52.41166 24.20017  43.04668 19.64186  9.364983       31.16811  
1 1 1 10 28 4  o 47.95193 21.72130  0.4622095      2.988235      -2.430654      6.577809      1.214494       3.354351      54.45426 26.69407  52.14388 23.36860  2.310375       35.47766  
1 1 1 11 0  1  o 535.9926 14.23250  192.2528       10.14895      192.2528       10.14895      192.2528       10.14895      535.9926 14.23250  535.9926 14.23250  0.000000       0.000000  
1 1 1 11 0  2  o 792.5207 27.70370  423.6786       29.17531      423.6786       29.17531      423.6786       29.17531      792.5207 27.70370  792.5207 27.70370  0.000000       0.000000  
1 1 1 11 0  3  o 34.52915 23.89142  -3.042699      3.754127      -3.042699      3.754127      -3.042699      3.754127      34.52915 23.89142  34.52915 23.89142  0.000000       0.000000  
1 1 1 11 0  4  o 148.6329 14.00844  15.14073       2.714470      15.14073       2.714470      15.14073       2.714470      148.6329 14.00844  148.6329 14.00844  0.000000       0.000000  
1 1 1 11 0  5  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 11 0  6  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 11 0  7  o 317.9708 15.04281  68.01369       6.341037      68.01369       6.341037      68.01369       6.341037      317.9708 15.04281  317.9708 15.04281  0.000000       0.000000  
1 1 1 11 0  8  o 55.41611 4.859445  2.093486       0.3522111     2.093486       0.3522111     2.093486       0.3522111     55.41611 4.859445  55.41611 4.859445  0.000000       0.000000  
1 1 1 11 0  9  o 545.0815 16.45848  199.2304       11.92963      199.2304       11.92963      199.2304       11.92963      545.0815 16.45848  545.0815 16.45848  0.000000       0.000000  
1 1 1 11 0  10 o 53.00928 6.394227  1.953385       0.4342357     1.953385       0.4342357     1.953385       0.4342357     53.00928 6.394227  53.00928 6.394227  0.000000       0.000000  
1 1 1 11 0  11 o 1355.789 32.62263  1244.348       58.85945      1244.348       58.85945      1244.348       58.85945      1355.789 32.62263  1355.789 32.62263  0.000000       0.000000  
1 1 1 11 0  12 o 281.5266 7.419360  52.95343       2.778927      52.95343       2.778927      52.95343       2.778927      281.5266 7.419360  281.5266 7.419360  0.000000       0.000000  
1 1 1 11 0  13 o 763.6663 15.28203  390.1627       15.53694      390.1627       15.53694      390.1627       15.53694      763.6663 15.28203  763.6663 15.28203  0.000000       0.000000  
1 1 1 11 0  14 o 81.58587 26.30622  5.652944       2.524944      5.652944       2.524944      5.652944       2.524944      81.58587 26.30622  81.58587 26.30622  0.000000       0.000000  
1 1 1 11 0  15 o 339.9167 10.87356  77.32944       4.913707      77.32944       4.913707      77.32944       4.913707      339.9167 10.87356  339.9167 10.87356  0.000000       0.000000  
1 1 1 11 0  16 o 320.8890 10.31314  68.90884       4.399478      68.90884       4.399478      68.90884       4.399478      320.8890 10.31314  320.8890 10.31314  0.000000       0.000000  
1 1 1 11 0  17 o 860.5052 33.38699  503.0267       38.15174      503.0267       38.15174      503.0267       38.15174      860.5052 33.38699  860.5052 33.38699  0.000000       0.000000  
1 1 1 11 0  18 o 33.42133 19.57369  0.8777421      1.460908      0.8777421      1.460908      0.8777421      1.460908      33.42133 19.57369  33.42133 19.57369  0.000000       0.000000  
1 1 1 11 0  19 o 159.4989 8.889570  17.13140       1.875831      17.13140       1.875831      17.13140       1.875831      159.4989 8.889570  159.4989 8.889570  0.000000       0.000000  
1 1 1 11 0  20 o 197.9605 7.979014  26.27383       2.096968      26.27383       2.096968      26.27383       2.096968      197.9605 7.979014  197.9605 7.979014  0.000000       0.000000  
1 1 1 11 0  21 o 42.30078 27.08568  0.2656569      3.435354      0.2656569      3.435354      0.2656569      3.435354      42.30078 27.08568  42.30078 27.08568  0.000000       0.000000  
1 1 1 11 0  22 o 91.87918 29.66984  7.270157       3.208243      7.270157       3.208243      7.270157       3.208243      91.87918 29.66984  91.87918 29.66984  0.000000       0.000000  
1 1 1 11 0  23 o 122.2432 20.98651  10.94623       3.116431      10.94623       3.116431      10.94623       3.116431      122.2432 20.98651  122.2432 20.98651  0.000000       0.000000  
1 1 1 11 0  24 o 290.2608 15.72521  57.31446       6.041107      57.31446       6.041107      57.31446       6.041107      290.2608 15.72521  290.2608 15.72521  0.000000       0.000000  
1 1 1 11 0  25 o 258.5975 16.79050  45.83682       5.729069      45.83682       5.729069      45.83682       5.729069      258.5975 16.79050  258.5975 16.79050  0.000000       0.000000  
1 1 1 11 0  26 o 218.9586 19.99105  33.57290       5.715116      33.57290       5.715116      33.57290       5.715116      218.9586 19.99105  218.9586 19.99105  0.000000       0.000000  
1 1 1 11 0  27 o 41.29116 26.59484  0.3367826      3.374214      0.3367826      3.374214      0.3367826      3.374214      41.29116 26.59484  41.29116 26.59484  0.000000       0.000000  
1 1 1 11 0  28 o 161.2663 26.36416  19.74982       5.211012      19.74982       5.211012      19.74982       5.211012      161.2663 26.36416  161.2663 26.36416  0.000000       0.000000  
1 1 1 11 0  29 o 48.06576 29.37179  1.958058       3.571806      1.958058       3.571806      1.958058       3.571806      48.06576 29.37179  48.06576 29.37179  0.000000       0.000000  
1 1 1 11 0  30 o 29.24222 20.12278  -1.445769      2.576174      -1.445769      2.576174      -1.445769      2.576174      29.24222 20.12278  29.24222 20.12278  0.000000       0.000000  
1 1 1 11 0  31 o 31.29650 21.52169  -1.356246      2.935023      -1.356246      2.935023      -1.356246      2.935023      31.29650 21.52169  31.29650 21.52169  0.000000       0.000000  
1 1 1 11 0  32 o 77.42712 21.50699  5.233488       1.919352      5.233488       1.919352      5.233488       1.919352      77.42712 21.50699  77.42712 21.50699  0.000000       0.000000  
1 1 1 11 0  33 o 20.54403 14.48854  -1.555947      1.579775      -1.555947      1.579775      -1.555947      1.579775      20.54403 14.48854  20.54403 14.48854  0.000000       0.000000  
1 1 1 11 0  34 o 24.30415 17.23943  -2.256030      2.347006      -2.256030      2.347006      -2.256030      2.347006      24.30415 17.23943  24.30415 17.23943  0.000000       0.000000  
1 1 1 11 0  35 o 30.84287 21.69159  -1.783328      3.464890      -1.783328      3.464890      -1.783328      3.464890      30.84287 21.69159  30.84287 21.69159  0.000000       0.000000  
1 1 1 11 1  0  o 20.34785 13.12766  -0.1364576E-01 0.8266680     -0.1364576E-01 0.8266680     -0.1364576E-01 0.8266680     20.34785 13.12766  20.34785 13.12766  0.000000       0.000000  
1 1 1 11 1  1  o 322.2528 2.978381  69.20303       1.278941      70.63333       1.414868      62.81365       2.990408      325.5594 3.261461  306.8595 7.313368  18.69989       8.007651  
1 1 1 11 1  2  o 243.8128 8.187956  39.71156       2.656372      37.74734       3.193611      44.12166       4.785311      237.5296 10.11313  256.3720 14.06152  -18.84236      17.32056  
1 1 1 11 1  3  f 230.5021 8.017069  35.49572       2.458682      34.23026       3.368155      36.93927       3.597353      226.0523 11.21678  234.8131 11.53235  -8.760803      16.08761  
1 1 1 11 1  4  o 320.7402 5.454641  68.59077       2.331273      65.19189       2.698863      78.58105       4.627028      312.6458 6.478204  342.8504 10.13915  -30.20456      12.03202  
1 1 1 11 1  5  o 307.3134 10.44153  63.16910       4.269607      59.28988       5.913069      67.39481       6.171490      297.0927 14.98483  316.8500 14.65686  -19.75726      20.96113  
1 1 1 11 1  6  o 344.7590 13.44514  79.68315       6.164827      71.64147       10.17849      84.34230       7.747536      324.7231 23.68611  354.1725 16.46133  -29.44931      28.84453  
1 1 1 11 1  7  o 333.9621 11.12441  74.63451       4.943573      79.09460       9.063920      72.74596       5.898069      342.1786 19.96551  329.3685 13.46701  12.81015       24.08281  
1 1 1 11 1  8  o 897.4030 22.15135  543.7625       26.48873      520.2177       41.14570      560.4274       34.61622      868.0150 35.64913  906.5707 28.69139  -38.55573      45.76086  
1 1 1 11 1  9  o 352.1063 9.260011  82.85367       4.340919      81.05653       4.648738      95.09155       12.13103      348.1721 10.03045  373.9604 24.47894  -25.78836      26.45427  
1 1 1 11 1  10 o 435.9160 12.10733  127.2049       7.025928      120.4678       10.48172      132.7017       9.467789      422.8294 18.64935  444.4631 16.01215  -21.63367      24.58022  
1 1 1 11 1  11 o 213.2787 4.894064  30.32621       1.390883      32.02670       1.811525      27.88411       2.170902      219.0458 6.212618  204.2460 7.991941  14.79980       10.12263  
1 1 1 11 1  12 o 292.9959 4.992508  57.23301       1.949189      57.03656       2.272158      57.78046       3.793028      292.4583 5.830436  293.9728 9.696163  -1.514496      11.31413  
1 1 1 11 1  13 o 274.1736 3.348348  50.09767       1.223291      49.52362       1.400727      51.94271       2.511189      272.5858 3.856353  279.0560 6.753274  -6.470276      7.776772  
1 1 1 11 1  14 o 141.4024 7.390305  13.37575       1.387658      12.65112       1.526644      16.82070       3.328653      137.4258 8.376518  157.5905 16.07622  -20.16464      18.12763  
1 1 1 11 1  15 f 267.0893 3.359052  47.54196       1.195492      47.10901       2.899850      47.63061       1.312190      265.5612 8.204626  267.3307 3.683616  -1.769501      8.993605  
1 1 1 11 1  16 o 430.6336 11.75222  124.0799       6.737443      127.4459       10.40127      121.6466       8.843517      435.2161 17.97394  425.6964 15.61666  9.519684       23.81056  
1 1 1 11 1  17 o 174.4964 5.172403  20.31960       1.201359      20.42769       1.904156      20.24813       1.548436      174.7485 8.200279  174.0948 6.687168  0.6536713      10.58125  
1 1 1 11 1  18 o 468.6114 7.567418  146.5697       4.725351      151.1539       7.366632      143.3648       6.159522      475.3062 11.63113  463.1544 9.980392  12.15170       15.32617  
1 1 1 11 1  19 o 229.9648 6.119243  35.30837       1.873469      36.21016       2.340770      33.70112       3.124980      232.7581 7.557122  224.2045 10.48902  8.553665       12.92786  
1 1 1 11 1  20 o 42.44572 16.08431  0.8696252      1.250100      -0.7588450     2.224532      1.621264       1.511310      43.38055 19.26198  51.63682 17.94908  -8.256264      26.32856  
1 1 1 11 1  21 o 71.94485 16.72050  3.640673       1.572380      3.906682       3.421940      3.569476       1.770343      78.15865 27.01701  71.19257 18.49648  6.966080       32.74199  
1 1 1 11 1  22 o 53.85649 19.63072  1.644746       1.828245      0.6006550      2.097192      4.950364       3.731602      48.90773 20.08394  85.23642 28.21995  -36.32869      34.63712  
1 1 1 11 1  23 o 42.96581 18.40411  -0.1227636E-01 1.879676      -1.853269      4.575850      0.3614369      2.061650      59.85691 27.01896  47.01510 19.66211  12.84181       33.41590  
1 1 1 11 1  24 o 30.88464 14.34587  -1.210842      1.419706      -0.9737185E-01 2.281260      -1.914689      1.813737      46.60823 20.12304  33.41620 15.74353  13.19203       25.54986  
1 1 1 11 1  25 o 301.7364 8.616048  61.23735       3.460704      56.04131       4.207518      72.10399       6.084669      287.7851 10.99217  324.9185 14.08712  -37.13348      17.86826  
1 1 1 11 1  26 o 166.9780 13.87047  19.18765       3.058361      15.29840       4.303673      23.15561       4.347005      144.9289 23.05647  181.5438 18.21530  -36.61494      29.38364  
1 1 1 11 1  27 o 286.6800 12.96583  56.41415       4.940215      50.20723       7.259313      61.76849       6.742336      264.4190 20.76954  296.8098 17.12006  -32.39087      26.91599  
1 1 1 11 1  28 o 43.92819 19.85136  -0.8954020     2.478309      1.828771       3.548917      -3.488373      3.462400      63.56161 26.11659  44.74263 21.27693  18.81898       33.68656  
1 1 1 11 1  29 o 57.33366 22.05052  2.019782       2.372120      4.181963       2.977972      -1.733730      3.923679      73.34238 25.20975  51.89016 24.01480  21.45221       34.81726  
1 1 1 11 1  30 o 36.17742 17.38986  -2.848943      2.450367      -5.709825      3.300790      0.6631958      3.657243      37.48617 18.48076  56.28671 24.85957  -18.80054      30.97639  
1 1 1 11 1  31 o 48.91355 16.07237  1.789215       1.211220      1.964664       1.373817      1.176838       2.566627      51.02364 17.12819  50.89016 21.64321  0.1334877      27.60079  
1 1 1 11 1  32 o 28.59996 13.74469  -1.755994      1.528969      -2.715126      1.796471      0.7645843      2.912267      28.83670 14.09685  49.32835 21.96295  -20.49166      26.09775  
1 1 1 11 1  33 o 50.61587 16.54974  2.076702       1.284921      0.8264741      1.872033      3.190363       1.766832      42.95562 18.38246  60.32854 19.38174  -17.37292      26.71267  
1 1 1 11 1  34 o 70.09470 7.786480  3.476163       0.7150198     0.5191902      2.558521      3.726672       0.7446916     44.17207 20.04477  72.58134 7.823193  -28.40927      21.51732  
1 1 1 11 1  35 o 22.84560 10.38087  -0.2603705     0.6890192     6.555640       1.657953      -1.683325      0.7575347     90.35249 14.24185  17.17054 8.533388  73.18196       16.60268  
1 1 1 11 2  0  o 240.9130 12.36652  39.04171       3.945911      39.04171       3.945911      39.04171       3.945911      240.9130 12.36652  240.9130 12.36652  0.000000       0.000000  
1 1 1 11 2  1  o 142.9990 4.600193  13.64495       0.8754213     14.17927       0.9353520     9.871653       2.485626      145.7641 4.822246  120.3480 15.88739  25.41611       16.60311  
1 1 1 11 2  2  o 294.7675 7.849067  58.01506       3.080240      56.23640       3.450146      65.00108       6.837647      290.1171 8.935291  310.9095 16.56416  -20.79245      18.82049  
1 1 1 11 2  3  o 470.1879 12.60742  147.9641       7.891859      151.9811       15.06036      146.4435       9.265910      473.7689 23.93340  467.3448 14.89815  6.424103       28.19153  
1 1 1 11 2  4  o 347.5675 5.006005  80.53642       2.318483      81.67834       2.458547      71.36239       6.968511      350.0110 5.271368  325.8368 16.09953  24.17422       16.94055  
1 1 1 11 2  5  o 364.6606 17.43286  89.49226       8.446399      89.49226       8.446399      0.000000       0.000000      364.6606 17.43286  ?        ?         0.000000       17.43286  
1 1 1 11 2  6  o 140.7865 5.066133  13.23181       0.9488611     9.789893       2.691570      13.72027       1.013957      119.5235 17.41103  143.3509 5.317394  -23.82745      18.20491  
1 1 1 11 2  7  o 469.8321 10.63384  147.5167       6.657429      137.3954       13.17048      150.9903       7.715736      450.6893 21.99706  474.9503 12.20156  -24.26096      25.15450  
1 1 1 11 2  8  o 246.9109 10.69300  40.82153       3.509802      44.49471       4.603029      35.71971       5.424815      257.4376 13.46513  229.8672 17.85046  27.57043       22.35953  
1 1 1 11 2  9  o 134.7133 3.649736  12.10434       0.6545536     12.46984       1.027245      11.85450       0.8492932     136.6307 5.654466  133.2612 4.790575  3.369522       7.410977  
1 1 1 11 2  10 o 98.92204 1.866938  6.520348       0.2460915     6.509315       0.2474237     7.536597       2.374665      98.83825 1.878636  104.5127 17.68129  -5.674484      17.78081  
1 1 1 11 2  11 o 366.8805 6.266571  89.77315       3.063572      90.81107       4.221978      88.61891       4.452280      368.8260 8.590550  364.1814 9.182008  4.644562       12.57405  
1 1 1 11 2  12 o 236.2845 1.340778  37.19923       0.4221490     37.20282       0.4260844     37.00772       3.113222      236.2958 1.353213  235.1737 9.957073  1.122101       10.04861  
1 1 1 11 2  13 o 941.0278 14.48638  593.0879       18.16502      617.4542       26.54543      571.6300       24.91084      957.5143 20.80516  921.5415 20.28617  35.97284       29.05827  
1 1 1 11 2  14 o 246.4763 4.321009  40.49416       1.419168      41.08278       2.345408      40.15417       1.782512      248.0635 7.102796  245.4063 5.450964  2.657272       8.953363  
1 1 1 11 2  15 o 449.3414 6.894935  134.6804       4.128385      126.5779       7.004886      138.9925       5.110196      434.9209 12.09872  456.3486 8.403638  -21.42770      14.73093  
1 1 1 11 2  16 o 79.39560 2.461196  4.204561       0.2600707     4.155831       1.103737      4.207425       0.2676055     78.11385 10.90030  79.42010 2.531899  -1.306252      11.19049  
1 1 1 11 2  17 f 342.0114 8.707822  78.14764       3.965247      80.13870       5.551668      76.07410       5.665475      345.9116 12.06285  336.9272 12.64147  8.984375       17.47339  
1 1 1 11 2  18 o 155.9954 4.399391  16.23601       0.9135745     17.22560       1.536284      15.69461       1.136324      160.4992 7.201661  153.3039 5.571838  7.195267       9.105454  
1 1 1 11 2  19 o 492.4085 8.015190  161.9400       5.259118      156.9700       8.260655      165.3273       6.819787      483.7078 12.82748  497.1384 10.29485  -13.43060      16.44774  
1 1 1 11 2  20 o 66.91534 18.13564  3.129127       1.657128      0.9899995      2.916724      4.148740       2.013700      58.53524 23.81912  76.77631 19.61417  -18.24107      30.85557  
1 1 1 11 2  21 o 179.9483 9.555904  21.74911       2.283143      24.32510       6.175085      21.34120       2.457272      186.0314 25.58766  178.1159 10.39848  7.915558       27.61986  
1 1 1 11 2  22 o 61.01434 20.25439  2.442342       1.921957      2.130159       2.826229      2.710920       2.621427      63.88378 24.18973  66.48689 23.59705  -2.603104      33.79295  
1 1 1 11 2  23 o 50.88627 19.80445  1.163268       1.930413      0.6690878      3.803787      1.334699       2.240360      62.95772 26.54150  54.57420 21.30788  8.383526       34.03641  
1 1 1 11 2  24 o 111.4471 13.54982  8.546869       1.970922      11.52051       2.928592      6.085032       2.664674      128.4076 17.57651  91.57065 22.09393  36.83694       28.23252  
1 1 1 11 2  25 o 194.2959 9.389544  25.47286       2.423784      22.09994       2.812779      35.20042       4.776772      180.2817 11.77316  225.9406 15.96885  -45.65891      19.83965  
1 1 1 11 2  26 o 135.8429 14.51711  12.78610       2.587103      13.65893       3.688886      11.94125       3.629274      137.8590 20.72154  128.1311 22.05178  9.727859       30.25992  
1 1 1 11 2  27 o 202.3181 12.63069  28.11839       3.388156      32.10516       6.130084      26.36477       4.065589      209.8913 22.25668  194.2169 15.84716  15.67439       27.32201  
1 1 1 11 2  28 o 166.4692 15.73531  19.61252       3.449038      21.99840       5.842642      18.33638       4.273012      167.5129 27.10000  157.5430 20.86720  9.969879       34.20306  
1 1 1 11 2  29 o 56.51029 22.08568  1.873385       2.408854      1.945308       3.012571      1.745876       4.011201      60.00040 24.28345  63.85009 27.10212  -3.849686      36.38971  
1 1 1 11 2  30 f 74.38229 21.03846  4.454543       2.178038      3.214436       3.783768      5.069067       2.663574      67.07037 27.18932  77.90790 23.61553  -10.83753      36.01323  
1 1 1 11 2  31 o 39.52354 15.76983  0.7985542      1.251391      2.038521       1.529204      -1.715097      2.177274      51.95554 18.05531  36.12371 17.08854  15.83184       24.85986  
1 1 1 11 2  32 o 101.5528 14.65772  7.875875       1.926161      14.35030       2.861942      2.514840       2.604261      135.7197 16.14084  56.35230 22.65895  79.36737       27.82005  
1 1 1 11 2  33 o 55.67447 10.58953  2.288807       0.7569089     0.2362477      2.974640      2.430904       0.7826706     46.46169 21.28597  57.39955 10.62405  -10.93786      23.78998  
1 1 1 11 2  34 o 24.33975 11.09858  -0.3269377     0.7963084     3.040646       1.487441      -1.679855      0.9427925     58.87783 17.60347  20.36393 10.00754  38.51391       20.24928  
1 1 1 11 2  35 o 41.43173 13.41556  1.361212       0.8454223     1.535357       3.183654      1.348000       0.8769060     48.73091 22.20945  41.25148 13.68077  7.479435       26.08492  
1 1 1 11 3  0  o 492.1256 20.52956  163.0091       13.40921      163.0091       13.40921      163.0091       13.40921      492.1256 20.52956  492.1256 20.52956  0.000000       0.000000  
1 1 1 11 3  1  o 604.7451 11.81914  244.4814       9.524269      254.1603       14.60035      237.3118       12.56610      615.0333 17.83405  594.8051 15.86866  20.22827       23.87191  
1 1 1 11 3  2  o 456.1862 12.91306  139.3267       7.841656      152.2702       9.772954      115.9304       13.13931      476.4396 15.41404  413.5891 23.94366  62.85049       28.47615  
1 1 1 11 3  3  o 202.7881 6.620824  27.45767       1.786674      29.27465       3.630153      26.87682       2.052480      208.7624 13.11594  200.5530 7.694538  8.209427       15.20637  
1 1 1 11 3  4  o 429.0425 9.042018  122.9015       5.169389      128.6718       7.073151      116.2856       7.573734      438.4672 12.11767  416.5534 13.66325  21.91382       18.26259  
1 1 1 11 3  5  o 322.8225 10.64909  69.71404       4.574623      73.72003       9.760649      68.58636       5.178615      329.7727 22.34408  320.0012 12.16691  9.771484       25.44193  
1 1 1 11 3  6  o 173.2998 2.402249  20.01271       0.5547401     13.17805       4.887530      20.10191       0.5583482     136.9003 27.74376  173.6855 2.412505  -36.78513      27.84846  
1 1 1 11 3  7  o 224.1790 12.03357  33.71057       3.581528      30.56655       4.781044      37.73103       5.406525      212.6962 17.01068  236.4031 17.28234  -23.70688      24.24958  
1 1 1 11 3  8  o 26.50902 11.06100  0.8622061E-01  0.6502325     -1.939761      2.531506      0.2293261      0.6728053     42.23758 19.45534  28.44728 11.48930  13.79029       22.59456  
1 1 1 11 3  9  o 321.0658 8.252465  68.85244       3.527696      64.54226       4.189217      79.35974       6.540796      310.6467 10.13384  343.8796 14.30541  -33.23291      17.53110  
1 1 1 11 3  10 o 514.6365 7.803005  176.7493       5.351012      180.3515       6.650032      170.1330       9.012438      519.6349 9.603994  503.9250 13.43354  15.70987       16.51353  
1 1 1 11 3  11 o 315.4786 4.542352  66.34650       1.909520      65.70409       2.021455      71.66996       5.819102      313.9365 4.832243  326.9437 13.38532  -13.00726      14.23086  
1 1 1 11 3  12 o 505.9026 11.24206  171.0681       7.578553      169.2607       10.27171      173.2275       11.22731      502.2958 15.36458  507.8594 16.61282  -5.563629      22.62866  
1 1 1 11 3  13 o 476.9696 10.29520  151.9714       6.543332      152.6121       8.252620      150.8867       10.73771      477.4316 12.98406  473.8907 17.03205  3.540894       21.41673  
1 1 1 11 3  14 o 553.1603 9.826957  204.3457       7.243418      204.3760       9.718249      204.3080       10.86487      552.6808 13.19593  552.0977 14.78176  0.5831299      19.81497  
1 1 1 11 3  15 o 303.6215 5.689537  61.46876       2.301881      55.41689       4.832183      63.24518       2.618012      287.5632 12.64151  307.9460 6.380044  -20.38272      14.16026  
1 1 1 11 3  16 f 454.7551 7.206926  137.9685       4.367180      140.3817       5.999762      135.2491       6.369017      458.4523 9.821240  449.8983 10.62391  8.554016       14.46804  
1 1 1 11 3  17 o 274.4531 4.124565  50.21006       1.508411      50.67181       3.210597      50.07927       1.708743      275.3392 8.761884  274.0764 4.678770  1.262848       9.932849  
1 1 1 11 3  18 o 615.8022 11.88642  253.8239       9.753621      262.0637       11.80351      236.0849       17.31876      625.1112 14.17034  590.1868 22.06067  34.92438       26.21968  
1 1 1 11 3  19 o 348.0796 6.613041  80.86330       3.067280      73.95500       5.253142      84.43693       3.778230      332.0302 11.89242  355.5485 7.974732  -23.51831      14.31873  
1 1 1 11 3  20 o 487.7034 8.946739  159.0896       5.814255      165.4246       9.232940      154.9265       7.484741      495.7405 13.99093  480.6223 11.68690  15.11816       18.22991  
1 1 1 11 3  21 o 88.00156 17.35278  5.428072       1.962507      -3.312380      5.022537      7.003004       2.131999      59.73509 27.47456  100.4548 16.49966  -40.71975      32.04824  
1 1 1 11 3  22 o 112.8914 15.34032  8.787016       2.247994      8.850404       3.846059      8.754124       2.770517      110.3560 26.49104  111.6320 19.32452  -1.276077      32.79043  
1 1 1 11 3  23 o 173.8654 8.672289  20.32340       2.002845      23.62008       6.880437      20.01819       2.093505      179.5419 29.80375  172.4653 9.142248  7.076630       31.17442  
1 1 1 11 3  24 o 164.8104 8.572913  18.28508       1.876251      16.40648       4.379613      18.70737       2.076448      151.6386 22.34358  166.5372 9.395095  -14.89859      24.23847  
1 1 1 11 3  25 o 109.0766 16.54348  8.354569       2.329187      5.622935       2.924911      13.08922       3.850748      87.36253 24.26278  134.7203 22.22486  -47.35777      32.90330  
1 1 1 11 3  26 o 145.5627 12.47031  14.52945       2.395523      19.12241       3.287026      9.326765       3.498408      166.1422 15.00908  111.9109 24.16788  54.23132       28.44923  
1 1 1 11 3  27 o 73.52743 23.02931  3.978190       2.508130      4.944942       4.009834      3.356864       3.214610      82.27442 29.18605  70.99300 26.00637  11.28143       39.09164  
1 1 1 11 3  28 o 162.1978 14.67102  18.51416       3.136622      17.70100       4.808836      19.11629       4.138061      151.6622 24.64014  161.5729 19.62179  -9.910721      31.49843  
1 1 1 11 3  29 f 41.99346 18.29960  0.1497027E-01  1.922687      -0.6861806     2.688221      0.7492773      2.751047      45.81551 20.69237  52.37406 22.34508  -6.558548      30.45450  
1 1 1 11 3  30 o 67.58369 16.46585  3.482005       1.469006      4.612075       1.727189      0.5267678      2.793080      77.63620 17.15336  50.44440 22.01791  27.19180       27.91104  
1 1 1 11 3  31 o 22.67318 9.892612  -0.6189816E-01 0.5633759     2.215571       1.850380      -0.2945873     0.5914562     54.04802 19.74169  21.22704 9.634556  32.82098       21.96723  
1 1 1 11 3  32 f 16.44946 8.060801  -1.108784      0.5981457     1.039381       0.9265727     -2.643589      0.7831991     38.87578 14.00245  15.23181 7.713911  23.64397       15.98665  
1 1 1 11 3  33 o 39.98459 16.21377  0.9137922      1.345976      2.815696       3.138422      0.4851321      1.489957      56.94677 24.06327  38.09439 16.35275  18.85239       29.09387  
1 1 1 11 3  34 o 19.60594 9.213083  -0.5416278     0.6140229     5.837234       1.778283      -1.405094      0.6542625     83.48100 16.57080  16.26687 8.057514  67.21413       18.42593  
1 1 1 11 4  0  o 192.3383 9.156788  24.84050       2.334663      24.84050       2.334663      24.84050       2.334663      192.3383 9.156788  192.3383 9.156788  0.000000       0.000000  
1 1 1 11 4  1  o 353.2406 10.00909  83.41176       4.706530      80.06428       6.068367      88.46513       7.455959      345.6472 13.19970  362.9733 15.45076  -17.32614      20.32137  
1 1 1 11 4  2  o 375.3678 6.165589  93.96783       3.083934      91.07948       4.950355      95.79974       3.942420      369.1185 10.07403  378.8980 7.808490  -9.779510      12.74593  
1 1 1 11 4  3  o 383.7867 8.726946  98.32797       4.462987      100.0839       5.886236      95.95345       6.844932      386.7592 11.43406  378.3534 13.59893  8.405731       17.76707  
1 1 1 11 4  4  o 181.3180 7.316496  21.97024       1.764106      19.45751       3.201547      23.06578       2.113982      169.8516 14.27749  185.6898 8.566659  -15.83827      16.65036  
1 1 1 11 4  5  o 310.1399 7.874300  64.23135       3.251560      67.18294       6.001371      63.00489       3.868577      316.3812 14.27203  307.0066 9.467807  9.374634       17.12689  
1 1 1 11 4  6  o 196.0763 1.191580  25.61595       0.3113306     32.95782       5.837740      25.59501       0.3117743     220.3324 20.10476  195.9961 1.193766  24.33630       20.14017  
1 1 1 11 4  7  o 400.8753 15.34852  107.9146       8.183638      112.1038       9.931836      99.05579       14.44294      407.9210 18.31848  380.3009 28.71275  27.62003       34.05861  
1 1 1 11 4  8  o 401.9236 16.62591  108.6214       8.885129      114.7635       12.39552      102.1305       12.74261      411.5525 22.69081  387.5307 24.80648  24.02185       33.61895  
1 1 1 11 4  9  o 403.7931 11.10681  109.0761       5.970476      109.6158       9.525357      108.7269       7.662496      403.5213 17.75850  402.6075 14.30559  0.9138489      22.80382  
1 1 1 11 4  10 o 210.2317 3.566426  29.45687       0.9990908     29.70510       1.067479      27.70362       2.836926      211.1110 3.794680  203.3474 10.50535  7.763611       11.16969  
1 1 1 11 4  11 o 631.9905 9.972249  266.7907       8.398026      263.0856       10.13618      274.9019       14.99754      627.2047 12.12807  639.5672 17.61465  -12.36255      21.38612  
1 1 1 11 4  12 o 367.2521 11.36448  90.23677       5.554747      88.20154       7.038373      93.59790       9.044984      362.5912 14.59722  372.8229 18.26229  -10.23172      23.37926  
1 1 1 11 4  13 o 211.9775 5.196043  29.95781       1.467696      30.05709       1.579811      29.33191       3.966779      212.2440 5.590806  208.8112 14.34355  3.432739       15.39463  
1 1 1 11 4  14 o 135.3548 7.099123  12.25494       1.275942      13.69400       1.843310      10.93113       1.767957      142.8709 9.740619  127.4897 10.49993  15.38123       14.32230  
1 1 1 11 4  15 o 346.2897 6.049207  79.96833       2.791332      79.96062       3.357510      79.98560       5.022914      346.2025 7.278026  345.8018 10.91438  0.4007263      13.11844  
1 1 1 11 4  16 o 292.3688 4.863752  56.98734       1.894855      54.40921       2.822337      59.10310       2.556763      285.4635 7.425978  297.6761 6.445744  -12.21255      9.833247  
1 1 1 11 4  17 o 153.7009 1.914726  15.74140       0.3921539     13.32966       3.140486      15.77960       0.3952475     139.8056 17.22125  153.8871 1.927495  -14.08156      17.32878  
1 1 1 11 4  18 o 245.8330 9.772035  40.46078       3.194717      41.25080       4.024062      39.11399       5.254093      247.8892 12.22008  240.6179 16.48650  7.271301       20.52158  
1 1 1 11 4  19 o 122.0723 7.382369  9.987086       1.195231      13.26229       2.501397      9.018056       1.360606      139.9059 13.58850  115.8138 8.884385  24.09205       16.23514  
1 1 1 11 4  20 o 172.8145 5.861574  19.95584       1.347842      20.06073       3.913233      19.94172       1.435690      171.3543 17.37834  172.7191 6.248319  -1.364777      18.46749  
1 1 1 11 4  21 f 121.1019 5.486172  9.809812       0.8830079     8.103263       2.929618      9.980337       0.9260746     106.9939 21.29750  122.1326 5.706151  -15.13862      22.04867  
1 1 1 11 4  22 o 174.7154 8.529323  20.49915       1.979725      28.07735       4.543684      18.72337       2.199481      202.3878 17.00520  166.7163 9.945971  35.67154       19.70023  
1 1 1 11 4  23 o 231.9973 13.21845  36.54778       4.069453      41.77081       6.598742      33.34221       5.169547      244.9964 20.39774  219.8705 17.79659  25.12592       27.07003  
1 1 1 11 4  24 o 236.1290 8.466041  37.48456       2.659499      43.75613       5.943821      35.91468       2.973786      251.3853 17.86035  230.8033 9.690845  20.58197       20.32006  
1 1 1 11 4  25 o 217.5582 7.700312  31.80793       2.228805      28.70357       3.841078      33.38371       2.736627      204.5498 14.18003  222.4695 9.251678  -17.91968      16.93124  
1 1 1 11 4  26 o 105.9024 15.83644  7.900152       2.166272      9.257696       2.876866      6.122455       3.292087      113.2473 19.78382  90.06615 25.99277  23.18117       32.66533  
1 1 1 11 4  27 o 219.0078 12.00977  32.90298       3.491422      34.64969       6.913709      32.30504       4.045120      215.4107 24.52242  215.8109 14.14441  -0.4001770     28.30924  
1 1 1 11 4  28 o 26.68732 13.26800  -4.307464      1.838190      -4.449511      4.706297      -4.281893      1.996799      51.37807 24.53637  28.57082 14.13851  22.80726       28.31838  
1 1 1 11 4  29 o 141.9447 6.031390  13.60063       1.138202      12.46958       2.121803      14.05759       1.348670      133.3237 12.07406  143.9737 7.051345  -10.64999      13.98229  
1 1 1 11 4  30 o 29.72539 12.02717  0.3228161      0.7387666     -2.830867      1.818400      0.9462597      0.8084980     29.42824 14.34145  37.75637 13.12796  -8.328127      19.44275  
1 1 1 11 4  31 o 73.07215 9.998030  3.803359       0.9480062     5.813172       1.438845      2.261610       1.260210      89.16423 12.44906  53.84805 16.22689  35.31618       20.45217  
1 1 1 11 4  32 o 32.47695 12.05816  0.6519049      0.6950501     -3.425940      1.208183      2.669067       0.8497435     19.92283 10.02676  60.24907 10.98912  -40.32624      14.87605  
1 1 1 11 4  33 o 31.37620 12.12791  0.5603085      0.7201629     3.310689       1.548512      -0.1987377     0.8134904     62.20932 17.78744  25.67811 11.50794  36.53121       21.18550  
1 1 1 11 4  34 o 17.26912 8.790034  -4.040950      1.110610      -4.685105      2.347980      -3.855292      1.260540      29.07023 14.53724  19.51057 9.870090  9.559660       17.57129  
1 1 1 11 5  0  o 438.0518 25.10898  130.1320       14.54535      130.1320       14.54535      130.1320       14.54535      438.0518 25.10898  438.0518 25.10898  0.000000       0.000000  
1 1 1 11 5  1  o 865.6768 20.02419  504.4889       23.09852      488.6713       40.60096      512.0585       28.08686      841.4513 36.29580  869.7337 24.25871  -28.28241      43.65627  
1 1 1 11 5  2  o 557.9921 6.630392  207.6804       4.929930      187.5634       13.91316      210.5688       5.271985      527.5319 19.82792  561.8179 7.042147  -34.28595      21.04135  
1 1 1 11 5  3  o 534.8565 2.854016  190.6385       2.034076      258.7551       17.17770      189.6698       2.048489      619.3416 20.84397  533.4948 2.881575  85.84680       21.04221  
1 1 1 11 5  4  o 241.4334 6.212092  38.90174       1.996861      37.80595       3.866024      39.30046       2.332025      237.4235 12.26143  242.5970 7.222010  -5.173477      14.23025  
1 1 1 11 5  5  o 478.7152 6.323188  152.8504       4.033544      151.1273       4.899237      156.4756       7.106240      475.8828 7.726005  483.8272 11.02240  -7.944458      13.46048  
1 1 1 11 5  6  o 210.4627 7.132521  29.58632       1.997394      32.71729       4.127585      28.62895       2.282434      220.5570 14.11849  206.9323 8.294250  13.62468       16.37456  
1 1 1 11 5  7  o 62.11424 5.516435  2.592904       0.4518427     0.9372022      0.8453060     3.255216       0.5346311     39.17960 13.43242  69.62481 5.815649  -30.44521      14.63734  
1 1 1 11 5  8  o 224.1201 7.634312  33.55720       2.276616      35.35421       5.110057      33.11219       2.542928      228.8752 16.87399  222.5466 8.591247  6.328598       18.93518  
1 1 1 11 5  9  o 479.0398 28.43542  156.6940       18.06951      167.9447       25.99408      146.1739       25.13583      490.2303 40.14373  456.2580 41.80795  33.97226       57.96054  
1 1 1 11 5  10 o 347.0926 6.562534  80.35562       3.035222      80.02649       3.322335      82.01676       7.463846      346.3420 7.198877  349.3321 16.07744  -2.990051      17.61555  
1 1 1 11 5  11 o 292.4856 6.098441  57.05054       2.376823      55.34418       2.627091      64.74808       5.579745      288.0432 6.844534  310.7356 13.50793  -22.69232      15.14304  
1 1 1 11 5  12 o 276.8305 4.484529  51.08408       1.654262      51.19409       1.717338      49.66841       6.160428      277.1232 4.650602  271.5341 17.11305  5.589111       17.73372  
1 1 1 11 5  13 o 464.5907 8.887626  144.0830       5.502117      148.7588       6.399438      130.8283       10.77447      471.9293 10.17634  440.9590 18.37710  30.97025       21.00656  
1 1 1 11 5  14 o 492.4527 8.793678  161.8796       5.770436      153.4861       7.259019      176.2895       9.511233      479.2128 11.36779  512.9886 13.92700  -33.77582      17.97743  
1 1 1 11 5  15 o 197.8365 5.121065  26.11171       1.348885      26.28047       1.539697      25.55463       2.797467      198.4362 5.829237  195.2615 10.79364  3.174698       12.26714  
1 1 1 11 5  16 o 306.7838 7.738693  62.84906       3.161016      57.52530       5.125666      66.11649       4.015542      292.8476 13.16884  314.4728 9.593911  -21.62521      16.29299  
1 1 1 11 5  17 o 330.2790 5.984268  72.76000       2.633695      77.75492       6.347505      71.72126       2.894620      340.2873 14.02866  327.8714 6.625436  12.41589       15.51450  
1 1 1 11 5  18 o 169.6653 1.847034  19.18158       0.4175816     16.33475       2.281871      19.28021       0.4247544     155.8399 11.06039  170.1006 1.873952  -14.26073      11.21802  
1 1 1 11 5  19 o 321.4640 5.664286  68.94969       2.426337      68.79388       4.559492      69.01125       2.865809      320.3351 10.69665  321.5163 6.689147  -1.181213      12.61598  
1 1 1 11 5  20 o 268.1030 7.346679  48.06887       2.622145      45.40883       5.382096      48.89677       3.002599      258.8567 15.67686  270.2581 8.347686  -11.40140      17.76085  
1 1 1 11 5  21 o 208.3662 7.092934  29.05822       1.966496      31.61229       4.449503      28.43825       2.192217      215.5240 15.59880  206.0012 8.001416  9.522751       17.53127  
1 1 1 11 5  22 o 202.2497 10.34176  27.55962       2.777868      26.77223       4.280632      28.13244       3.651052      197.6770 16.39837  203.5478 13.53797  -5.870773      21.26460  
1 1 1 11 5  23 o 137.2487 9.487956  12.71858       1.724540      10.71123       3.271834      13.49081       2.029321      122.7845 20.73507  141.0869 10.87815  -18.30236      23.41532  
1 1 1 11 5  24 o 187.0387 10.46510  23.66690       2.597844      27.03395       4.661963      22.15049       3.128615      197.1603 17.94130  180.1432 13.12351  17.01711       22.22873  
1 1 1 11 5  25 o 86.97299 13.67726  5.277375       1.532829      7.687428       3.747724      4.793224       1.679751      100.8368 27.24966  82.19075 15.91239  18.64606       31.55547  
1 1 1 11 5  26 o 92.48671 13.83948  5.986466       1.653234      4.025606       3.025663      6.821073       1.973959      75.17747 25.41948  98.25616 15.59718  -23.07868      29.82318  
1 1 1 11 5  27 o 78.44164 16.01000  4.443908       1.616743      2.013678       3.427191      5.139531       1.833588      64.19102 25.92898  84.16676 16.93597  -19.97575      30.96997  
1 1 1 11 5  28 o 214.8751 11.23119  31.83188       3.204609      25.68813       3.793855      47.13163       5.986961      190.4070 15.07582  255.4672 17.69662  -65.06021      23.24759  
1 1 1 11 5  29 o 54.27946 18.13302  2.139270       1.539953      2.374097       1.737716      1.280147       3.323777      56.91978 19.26388  57.62799 24.57312  -0.7082100     31.22396  
1 1 1 11 5  30 o 111.9227 10.29551  8.794110       1.518270      11.60989       2.772177      7.587603       1.814622      123.4421 17.32988  101.9401 13.70575  21.50197       22.09462  
1 1 1 11 5  31 o 90.46096 10.35332  5.838426       1.225543      6.240566       1.729597      5.432937       1.736785      90.61111 14.83796  83.45990 16.20124  7.151207       21.96919  
1 1 1 11 5  32 o 35.89999 14.91796  0.5244443      1.175750      4.671452       2.725936      -0.4233823     1.303205      69.14706 24.10160  31.25268 14.23044  37.89437       27.98915  
1 1 1 11 5  33 o 37.21656 17.15684  -0.4533504     1.974503      -0.2938189     2.795119      -0.6122555     2.789627      43.24356 20.10112  42.22524 19.77681  1.018326       28.19889  
1 1 1 11 5  34 o 39.61029 17.81136  0.3145802      1.966851      2.431772       2.388147      -4.149453      3.467726      51.86788 21.37950  37.37541 18.51978  14.49247       28.28543  
1 1 1 11 6  0  o 695.5875 23.66096  325.8565       21.87339      325.8565       21.87339      325.8565       21.87339      695.5875 23.66096  695.5875 23.66096  0.000000       0.000000  
1 1 1 11 6  1  o 747.0697 2.965497  371.9349       2.952107      337.5336       19.97858      372.7028       2.984873      707.2514 21.22310  747.8387 2.995328  -40.58728      21.43343  
1 1 1 11 6  2  o 468.2787 9.883498  146.4810       6.167208      149.5785       9.069314      143.8167       8.411306      472.2946 14.42771  463.2590 13.64078  9.035645       19.85522  
1 1 1 11 6  3  o 497.2450 2.805220  164.7693       1.858707      187.7718       18.38747      164.5318       1.868276      525.3654 26.34969  496.8859 2.821701  28.47952       26.50035  
1 1 1 11 6  4  o 261.6353 5.867809  45.65012       2.045718      0.000000       0.000000      45.65012       2.045718      ?        ?         261.6353 5.867809  0.000000       5.867809  
1 1 1 11 6  5  o 322.3338 5.900484  69.28889       2.534352      72.23942       3.610702      66.42371       3.558107      328.8752 8.245741  315.3282 8.475720  13.54697       11.82498  
1 1 1 11 6  6  o 110.4230 8.735087  8.191059       1.274825      8.105800       1.821178      8.272974       1.785112      109.3335 12.73880  110.5301 12.32998  -1.196617      17.72866  
1 1 1 11 6  7  o 508.4233 11.94886  172.8814       8.095159      173.8642       13.33687      172.3082       10.18617      507.8271 19.74663  506.7844 15.10077  1.042725       24.85885  
1 1 1 11 6  8  f 446.9018 16.70341  134.2310       9.929464      139.7666       12.45377      124.5718       16.45107      455.0191 20.59324  426.7215 29.10609  28.29758       35.65454  
1 1 1 11 6  9  o 289.7513 10.18612  56.15434       3.926736      61.48935       8.183009      54.55833       4.475716      301.4970 20.49013  285.4088 11.79392  16.08823       23.64195  
1 1 1 11 6  10 o 95.03910 5.127929  6.039401       0.6470033     5.794545       0.6627113     11.02166       2.989388      93.07056 5.366411  126.8348 18.20910  -33.76429      18.98340  
1 1 1 11 6  11 o 565.7181 11.26595  213.8911       8.492615      217.5111       10.74052      207.8520       13.87244      569.9768 14.14147  555.8418 18.75646  14.13501       23.49012  
1 1 1 11 6  12 o 243.3780 13.10953  39.74122       4.235807      41.30697       4.605049      31.13545       10.79612      248.0217 13.99057  208.9611 40.23264  39.06053       42.59579  
1 1 1 11 6  13 o 381.7764 8.305320  97.27168       4.225120      98.00082       4.384582      87.79104       15.81046      383.1826 8.587146  356.6870 33.66286  26.49567       34.74086  
1 1 1 11 6  14 o 394.1265 7.802428  103.6495       4.097689      104.2400       4.722936      101.8515       8.240917      395.1523 8.969620  389.4522 15.91342  5.700104       18.26721  
1 1 1 11 6  15 o 338.4182 9.026683  76.52261       4.066936      73.80192       4.812002      83.32494       7.608788      332.1264 10.88770  352.0500 16.26345  -19.92358      19.57145  
1 1 1 11 6  16 o 494.6748 9.311537  163.4500       6.137828      172.7221       9.084390      155.6621       8.325564      507.6409 13.44151  481.9999 12.97443  25.64099       18.68181  
1 1 1 11 6  17 o 342.2054 8.014688  78.19129       3.654660      73.49593       5.914986      81.09061       4.648013      330.8550 13.44460  348.1360 10.02993  -17.28104      16.77369  
1 1 1 11 6  18 o 327.3526 6.638415  71.52310       2.895701      73.34928       4.866466      70.52209       3.602952      330.8035 11.05556  324.7822 8.332044  6.021301       13.84371  
1 1 1 11 6  19 o 201.4274 1.831396  27.03661       0.4915574     27.29253       2.979643      27.02945       0.4983861     201.4778 11.14187  201.4002 1.857088  0.7756042E-01  11.29557  
1 1 1 11 6  20 o 135.9439 1.856837  12.31553       0.3363622     12.77816       4.084886      12.31238       0.3375084     134.4520 23.66405  135.9264 1.863405  -1.474426      23.73730  
1 1 1 11 6  21 o 164.4971 6.723911  18.11772       1.470745      16.79094       3.509949      18.40029       1.619805      156.2141 17.14325  165.6974 7.354567  -9.483337      18.65424  
1 1 1 11 6  22 o 55.16349 18.06449  2.016262       1.530627      7.616089       3.271227      0.4466035      1.731912      102.3986 24.33484  44.10608 18.19605  58.29252       30.38554  
1 1 1 11 6  23 o 158.3238 5.870527  16.78252       1.236357      24.53275       5.711910      16.40156       1.266379      185.4149 23.65674  156.4856 6.084774  28.92935       24.42675  
1 1 1 11 6  24 o 187.2701 6.070209  23.49164       1.512765      25.10799       5.378688      23.35280       1.576398      187.8391 21.89933  186.6687 6.346772  1.170349       22.80049  
1 1 1 11 6  25 o 223.6947 9.257486  33.78829       2.753485      36.54177       5.334340      32.78817       3.214887      228.7504 17.63637  219.7473 11.01426  9.003098       20.79316  
1 1 1 11 6  26 o 18.19076 8.627212  -0.6759747     0.5617426     -0.1123618     2.595229      -0.7036787     0.5753831     48.78807 21.26055  18.33879 8.707247  30.44929       22.97449  
1 1 1 11 6  27 o 130.3038 7.807546  11.49897       1.349425      9.859479       3.187793      11.85689       1.489457      114.6353 21.66243  132.1254 8.505135  -17.49010      23.27226  
1 1 1 11 6  28 o 120.5346 10.69017  10.05413       1.699210      8.935575       2.190722      11.74331       2.692131      111.5325 15.13033  127.4346 16.22099  -15.90211      22.18214  
1 1 1 11 6  29 o 22.14447 10.30825  -0.6193082     0.7391901     -2.279942      1.794160      -0.2797993     0.8112406     30.90545 14.86204  25.74814 11.51917  5.157309       18.80350  
1 1 1 11 6  30 o 155.8795 8.777636  16.82079       1.815858      17.23504       2.435463      16.30224       2.724860      155.4379 11.84774  149.3821 13.84660  6.055862       18.22354  
1 1 1 11 6  31 o 35.91077 15.32476  0.3228189      1.294509      0.6049661      1.450253      -0.7832139     2.871376      39.29471 16.46610  43.91185 20.39871  -4.617134      26.21526  
1 1 1 11 6  32 o 33.67764 16.17589  -1.994164      2.110938      -2.301047      2.456558      -1.127904      4.127284      35.81094 17.26386  48.42696 23.08555  -12.61602      28.82678  
1 1 1 11 6  33 o 33.30059 16.02596  -1.872442      2.095389      -2.289876      2.851387      -1.382352      3.089580      37.91247 18.35546  41.50610 19.83780  -3.593632      27.02705  
1 1 1 11 6  34 o 32.63578 15.42545  -1.000804      1.767058      -0.5020726     2.192120      -1.926166      2.985980      37.73940 17.62867  38.72042 18.75548  -0.9810257     25.73981  
1 1 1 11 7  0  o 127.3305 21.42657  11.73323       3.326363      11.73323       3.326363      11.73323       3.326363      127.3305 21.42657  127.3305 21.42657  0.000000       0.000000  
1 1 1 11 7  1  o 455.9040 16.88227  139.7267       10.23828      138.1919       12.16661      143.4503       18.95110      452.5126 20.22854  457.0535 31.30576  -4.540924      37.27257  
1 1 1 11 7  2  o 731.7950 7.322017  357.3116       7.139926      362.4758       18.73710      356.4344       7.722587      733.7361 19.18057  730.8053 7.930264  2.930847       20.75533  
1 1 1 11 7  3  f 532.6830 12.02706  189.7839       8.536934      0.000000       0.000000      189.7839       8.536934      ?        ?         532.6830 12.02706  0.000000       12.02706  
1 1 1 11 7  4  o 212.3996 1.027174  30.05822       0.2907176     54.19605       9.294436      30.03458       0.2908599     281.8198 25.00959  212.3161 1.028081  69.50369       25.03071  
1 1 1 11 7  5  o 423.4736 7.106120  119.6404       4.009890      126.8072       5.489848      111.4439       5.871003      435.7481 9.454777  408.2108 10.80280  27.53732       14.35595  
1 1 1 11 7  6  o 319.7082 6.428574  68.17505       2.738683      69.83065       4.158093      66.90656       3.639646      323.2011 9.665765  316.4635 8.639098  6.737579       12.96384  
1 1 1 11 7  7  o 408.9388 11.73962  111.9100       6.390521      111.9100       6.390521      0.000000       0.000000      408.9388 11.73962  ?        ?         0.000000       11.73962  
1 1 1 11 7  8  o 228.7321 9.428548  34.99509       2.867565      30.44839       3.764365      41.28129       4.426264      212.8854 13.33705  247.9902 13.44487  -35.10478      18.93783  
1 1 1 11 7  9  o 328.5052 9.538374  72.12298       4.170902      62.63936       5.483601      85.14083       6.424633      305.6348 13.49777  356.4082 13.55249  -50.77344      19.12746  
1 1 1 11 7  10 o 493.1639 12.67088  162.7811       8.319777      173.7679       10.66134      145.6704       13.30484      508.9244 15.74010  464.4848 21.55513  44.43964       26.69034  
1 1 1 11 7  11 o 259.7325 8.754698  45.07976       3.025659      44.08245       3.560997      47.66901       5.737793      256.6796 10.43308  266.1570 16.25585  -9.477356      19.31585  
1 1 1 11 7  12 o 100.2984 3.186404  6.710806       0.4253210     6.639345       0.4290395     10.77987       3.237495      99.76058 3.231754  125.0693 20.10748  -25.30871      20.36553  
1 1 1 11 7  13 o 138.0092 1.649016  12.69078       0.3032540     12.74001       0.3038981     1.114064       4.660253      138.2766 1.649323  72.25483 29.83244  66.02180       29.87799  
1 1 1 11 7  14 o 253.6877 6.747534  42.95912       2.278936      42.38367       2.559788      45.15830       5.004172      251.9153 7.634442  259.2398 14.54461  -7.324448      16.42652  
1 1 1 11 7  15 f 179.4314 7.915851  21.52984       1.887988      21.81120       2.334066      20.99734       3.211036      180.4326 9.744038  176.5314 13.75913  3.901184       16.86001  
1 1 1 11 7  16 o 155.9342 7.519359  16.26687       1.557807      15.30048       2.491109      16.88748       1.996301      150.6568 12.52191  158.7004 9.483307  -8.043610      15.70769  
1 1 1 11 7  17 o 175.3083 8.492455  20.57891       1.977950      21.60845       3.209302      19.94830       2.511691      178.9763 13.55763  172.3004 10.99713  6.675980       17.45698  
1 1 1 11 7  18 o 230.3330 6.784554  35.45049       2.080067      37.74884       3.398015      34.07314       2.630506      237.1730 10.78012  225.5879 8.767536  11.58508       13.89535  
1 1 1 11 7  19 o 21.44448 10.17727  -0.9687448     0.7843390     -0.4645031     1.942514      -1.066967      0.8573340     41.49701 18.23034  22.37385 10.62469  19.12316       21.10046  
1 1 1 11 7  20 o 61.49512 6.739923  2.557130       0.5432547     6.227929       2.209484      2.320936       0.5604599     94.13479 18.27347  58.46195 7.356995  35.67284       19.69886  
1 1 1 11 7  21 o 133.2033 1.924278  11.82497       0.3415515     5.391693       3.914027      11.87433       0.3428594     88.07827 28.88954  133.4810 1.927628  -45.40269      28.95378  
1 1 1 11 7  22 o 55.84216 15.10252  2.192733       1.150635      -1.117069      3.869941      2.513704       1.205137      56.63005 25.25922  59.65520 15.13806  -3.025154      29.44808  
1 1 1 11 7  23 o 196.6694 6.550520  25.91871       1.714271      30.20089       5.510475      25.45988       1.803776      207.5115 20.18313  194.8470 6.958460  12.66444       21.34898  
1 1 1 11 7  24 o 88.46384 5.012507  5.246988       0.5884556     0.7447087      5.122839      5.307189       0.5923768     70.44055 30.28128  88.97100 5.016943  -18.53045      30.69406  
1 1 1 11 7  25 o 25.49686 10.73577  0.6007718E-01  0.6211339     -0.5632142E-01 2.613060      0.6704792E-01  0.6394623     49.43663 21.44021  25.91652 10.90161  23.52011       24.05260  
1 1 1 11 7  26 o 75.79156 11.49042  4.000883       1.124117      1.060295       4.406632      4.205559       1.162580      65.85221 28.19259  77.71889 11.57886  -11.86668      30.47774  
1 1 1 11 7  27 o 139.2165 8.181351  13.15777       1.511021      14.76362       2.338135      12.00614       1.980044      145.9180 12.13478  131.8124 11.38462  14.10559       16.63918  
1 1 1 11 7  28 o 24.42734 11.96078  -2.385811      1.309065      -3.043570      1.494695      -0.2201093     2.712179      25.16114 12.41051  47.78349 21.23986  -22.62235      24.59985  
1 1 1 11 7  29 o 97.84639 10.75212  6.735538       1.378812      5.988737       1.724444      8.059221       2.295825      90.08855 14.88434  103.1553 17.31510  -13.06679      22.83323  
1 1 1 11 7  30 o 37.89748 15.07054  0.7300346      1.139123      1.046255       1.360570      -0.1123146E-01 2.083113      42.37074 16.58703  41.75375 18.58372  0.6169891      24.90952  
1 1 1 11 7  31 o 53.57076 21.74684  2.101996       2.424454      4.228038       3.541075      0.2259441      3.326379      65.89010 26.44692  49.31949 22.56293  16.57061       34.76385  
1 1 1 11 7  32 o 26.72381 13.27924  -3.655425      1.831823      -2.880905      2.062507      -6.548435      3.986155      30.76543 15.05349  38.20039 19.07838  -7.434963      24.30210  
1 1 1 11 7  33 o 38.21851 17.88262  -0.6694974     2.271485      -0.6694974     2.271485      0.000000       0.000000      38.21851 17.88262  ?        ?         0.000000       17.88262  
1 1 1 11 7  34 o 35.45854 17.67403  -4.832957      3.348770      -4.815859      5.907614      -4.841052      4.064947      45.40014 22.75512  39.06890 19.47341  6.331230       29.95011  
1 1 1 11 8  0  o 338.8351 19.70909  77.65131       8.829237      77.65131       8.829237      77.65131       8.829237      338.8351 19.70909  338.8351 19.70909  0.000000       0.000000  
1 1 1 11 8  1  o 685.3471 23.04768  317.6646       21.01808      305.8367       24.38787      351.8132       41.43896      670.4179 27.35697  707.5356 44.17323  -37.11774      51.95842  
1 1 1 11 8  2  o 152.1102 6.109906  15.45557       1.235896      14.76161       3.495361      15.55473       1.321243      147.1155 18.21942  152.5713 6.513838  -5.455856      19.34883  
1 1 1 11 8  3  o 155.5188 1.210667  16.11483       0.2508887     22.98541       2.412590      16.03972       0.2522564     185.2481 9.808597  155.1559 1.220114  30.09221       9.884192  
1 1 1 11 8  4  o 481.7016 15.46137  155.7223       9.911437      0.000000       0.000000      155.7223       9.911437      ?        ?         481.7016 15.46137  0.000000       15.46137  
1 1 1 11 8  5  o 458.9908 11.82110  140.9617       7.223935      151.8236       15.58505      137.9895       8.152615      472.9948 24.81419  453.8296 13.49626  19.16519       28.24700  
1 1 1 11 8  6  o 266.0153 6.574305  47.19899       2.330397      45.40998       3.968277      48.14075       2.879164      260.3846 11.46513  268.4621 8.057528  -8.077484      14.01332  
1 1 1 11 8  7  o 440.5614 6.774745  129.4647       3.977159      125.7668       4.678167      139.1051       7.553450      434.1189 8.087112  455.8861 12.44578  -21.76718      14.84247  
1 1 1 11 8  8  o 101.7940 11.87635  7.020685       1.580708      7.091117       3.164274      6.997264       1.824696      100.4838 23.96902  101.3138 13.88055  -0.8300323     27.69808  
1 1 1 11 8  9  o 670.4156 12.64031  300.6068       11.29211      309.0847       16.77341      293.5795       15.27104      678.0497 18.58215  661.1931 17.34770  16.85657       25.42123  
1 1 1 11 8  10 o 296.0033 8.806683  58.53535       3.469758      57.32719       4.104020      61.56324       6.497077      292.7573 10.53749  302.6132 16.17099  -9.855927      19.30128  
1 1 1 11 8  11 o 445.5952 11.78164  132.8181       6.989376      128.0630       8.281797      144.5874       13.02941      437.1381 14.23679  462.9138 21.17889  -25.77576      25.51924  
1 1 1 11 8  12 o 397.3023 8.556430  105.3543       4.529885      104.2805       5.327522      108.1567       8.606536      395.0037 10.12999  401.3318 16.12637  -6.328064      19.04407  
1 1 1 11 8  13 o 628.6633 12.60945  264.3736       10.56301      268.7967       12.72190      254.5562       18.95342      633.3578 15.07403  613.5347 23.22522  19.82318       27.68822  
1 1 1 11 8  14 o 463.0080 10.07967  143.2271       6.218823      142.2112       6.808368      148.3426       15.27804      461.2303 11.07775  467.3856 24.61800  -6.155365      26.99561  
1 1 1 11 8  15 o 193.1365 7.308978  24.92868       1.877631      24.72827       2.230970      25.41538       3.476653      192.2319 8.732335  194.3080 13.51173  -2.076172      16.08790  
1 1 1 11 8  16 o 251.8127 8.050631  42.38695       2.697880      44.83027       3.783837      39.86042       3.847723      258.6127 11.00533  243.7035 11.88448  14.90923       16.19747  
1 1 1 11 8  17 o 463.0067 9.336141  143.3504       5.760076      146.4017       7.829218      139.7499       8.504580      467.0482 12.59156  455.9084 14.01580  11.13986       18.84118  
1 1 1 11 8  18 o 163.2974 10.97896  17.95433       2.375103      17.68115       2.770043      18.71271       4.615352      161.7107 12.96356  164.3517 21.59657  -2.640961      25.18861  
1 1 1 11 8  19 o 186.9261 7.026124  23.38282       1.746971      29.00574       2.933574      20.29301       2.174612      207.6685 10.63658  173.8008 9.425068  33.86772       14.21157  
1 1 1 11 8  20 o 202.7895 4.331148  27.43649       1.170367      20.54924       3.177046      28.51788       1.258900      173.8871 13.82516  206.7312 4.569951  -32.84418      14.56089  
1 1 1 11 8  21 o 151.8729 2.917178  15.37879       0.5903598     19.64376       9.516091      15.36231       0.5914991     156.3180 43.89270  151.7912 2.924381  4.526779       43.99001  
1 1 1 11 8  22 o 87.78668 6.463446  5.183755       0.7507762     0.7865242      3.947399      5.348792       0.7647355     64.06962 27.02556  89.17844 6.479639  -25.10882      27.79149  
1 1 1 11 8  23 o 85.51233 6.792489  4.928237       0.7676275     6.297946       4.479864      4.886805       0.7791511     92.95673 30.92480  85.13017 6.928394  7.826561       31.69142  
1 1 1 11 8  24 o 88.89999 7.076304  5.333690       0.8313531     2.072233       4.281913      5.461450       0.8474798     70.56001 28.80441  89.95657 7.128292  -19.39656      29.67333  
1 1 1 11 8  25 o 125.1355 6.362092  10.52754       1.057369      7.512347       3.958905      10.75915       1.097228      98.32149 28.54241  126.4774 6.532580  -28.15587      29.28043  
1 1 1 11 8  26 o 69.05392 9.345465  3.288483       0.8378773     3.827783       1.818898      3.143219       0.9440007     71.94547 18.77643  67.07460 10.93849  4.870872       21.73027  
1 1 1 11 8  27 o 69.60076 17.24088  3.602606       1.590641      5.057865       1.936483      0.5841438      2.788922      82.31207 18.14474  52.37877 22.42651  29.93330       28.84753  
1 1 1 11 8  28 o 64.26080 13.96979  3.028666       1.162018      3.635932       1.391415      1.628785       2.112579      69.99263 15.34282  52.73246 20.66127  17.26017       25.73500  
1 1 1 11 8  29 o 70.70106 14.98948  3.763134       1.368288      1.858574       1.711035      7.141601       2.278880      51.47232 18.95364  95.56246 18.56539  -44.09014      26.53138  
1 1 1 11 8  30 o 121.9056 13.09115  10.92221       2.093268      9.015110       2.707092      13.75822       3.301181      104.3145 20.20532  129.9315 19.68264  -25.61696      28.20747  
1 1 1 11 8  31 o 41.83106 18.99552  -0.1290967     2.302534      -0.1574114     5.231546      -0.1222942     2.564250      54.82674 26.09546  43.61403 19.89845  11.21271       32.81647  
1 1 1 11 8  32 o 36.99607 16.42725  0.1281155      1.617989      1.414010       2.032888      -2.094257      2.672509      46.79800 19.54447  37.53464 18.07256  9.263367       26.61962  
1 1 1 11 8  33 o 65.67518 23.52522  4.671770       2.611362      7.389275       4.687160      3.448606       3.144610      69.42589 29.37522  57.29509 24.14214  12.13079       38.02296  
1 1 1 11 9  0  o 526.7509 34.17274  189.8943       23.75136      189.8943       23.75136      189.8943       23.75136      526.7509 34.17274  526.7509 34.17274  0.000000       0.000000  
1 1 1 11 9  1  o 199.4949 23.00277  27.21321       6.003011      27.21321       6.003011      0.000000       0.000000      199.4949 23.00277  ?        ?         0.000000       23.00277  
1 1 1 11 9  2  o 433.2340 7.117239  125.2119       4.108730      115.5999       9.289482      127.5496       4.581201      414.7176 16.84497  437.1977 7.863718  -22.48013      18.59008  
1 1 1 11 9  3  o 402.5431 7.465508  108.1126       4.004471      100.0993       8.379930      110.4840       4.558650      385.9786 16.32999  406.8575 8.408537  -20.87881      18.36769  
1 1 1 11 9  4  o 503.1264 12.03859  169.2618       8.070982      197.9678       22.02343      164.8084       8.674476      537.9534 30.85262  496.1231 13.13295  41.83023       33.53145  
1 1 1 11 9  5  o 592.6652 10.34066  234.6405       8.166414      239.4568       13.05797      231.5467       10.46564      597.3051 16.42171  588.2305 13.35196  9.074585       21.16477  
1 1 1 11 9  6  o 118.5187 5.649461  9.387215       0.8896422     9.545503       0.9154572     6.698744       3.772824      119.5086 5.765654  98.03565 27.67599  21.47293       28.27018  
1 1 1 11 9  7  o 780.8837 12.31874  407.7485       12.81818      393.7485       17.60535      423.5426       18.69935      766.0294 17.24748  794.3447 17.66623  -28.31537      24.68950  
1 1 1 11 9  8  o 289.7973 7.566263  56.06807       2.919292      54.73138       5.039228      56.74326       3.581493      285.7133 13.27237  291.3938 9.235470  -5.680542      16.16940  
1 1 1 11 9  9  o 493.0117 10.75520  162.3817       7.065604      160.2521       8.270751      168.1339       13.59294      489.3449 12.69472  499.4901 20.46603  -10.14517      24.08349  
1 1 1 11 9  10 o 224.9357 8.197277  33.80834       2.452871      33.67902       2.620675      34.72219       6.966745      224.4566 8.779012  225.6438 23.51501  -1.187195      25.10033  
1 1 1 11 9  11 o 393.9151 10.49094  103.7301       5.501787      106.1831       6.932201      99.55531       9.043549      398.1812 13.08299  384.7086 17.68876  13.47260       22.00129  
1 1 1 11 9  12 f 369.3808 10.90409  91.25726       5.361194      94.72108       6.360009      82.75330       9.965304      376.0745 12.70968  349.7612 21.48555  26.31329       24.96327  
1 1 1 11 9  13 o 153.5920 2.841403  15.72085       0.5815340     15.86369       0.5882055     9.531272       3.872115      154.2880 2.861037  116.3712 25.66162  37.91676       25.82062  
1 1 1 11 9  14 o 633.1716 9.142174  267.7790       7.713375      270.2725       9.524689      263.0277       13.14783      635.7043 11.24403  625.7844 15.77983  9.919983       19.37605  
1 1 1 11 9  15 o 277.4905 8.815720  51.49181       3.255578      53.72850       4.228247      48.23516       5.102041      283.1397 11.22919  267.7397 14.35317  15.40002       18.22384  
1 1 1 11 9  16 o 340.1720 7.080200  77.25348       3.209354      73.97934       3.990925      83.24606       5.399234      332.5562 9.014378  352.3498 11.51511  -19.79358      14.62385  
1 1 1 11 9  17 o 158.5925 8.782171  16.87081       1.848669      17.99046       2.463887      15.42857       2.796392      163.4241 11.38560  150.8183 14.07720  12.60585       18.10523  
1 1 1 11 9  18 o 103.6995 7.774298  7.229644       1.066445      6.686907       1.385948      8.017420       1.669757      99.30106 10.63985  108.6523 11.71806  -9.351265      15.82781  
1 1 1 11 9  19 o 139.6373 5.466387  13.03772       1.015162      11.44031       2.250491      13.44579       1.137461      129.6123 13.21507  141.7542 6.035621  -12.14191      14.52813  
1 1 1 11 9  20 o 91.85391 5.011876  5.649384       0.6111149     10.83625       3.625890      5.497736       0.6199841     123.1856 22.93295  90.59557 5.157006  32.59000       23.50564  
1 1 1 11 9  21 o 56.95141 7.460971  2.208884       0.5526017     11.64974       5.401902      2.109042       0.5555160     123.9282 32.36546  55.58642 7.706954  68.34177       33.27041  
1 1 1 11 9  22 o 26.42696 11.45382  -0.9720445E-01 0.7447811     5.748336       3.680574      -0.3467837     0.7605144     88.88298 27.90581  24.74638 11.10578  64.13660       30.03453  
1 1 1 11 9  23 o 54.15786 7.348034  2.002503       0.5166150     0.7110867      4.582637      2.019126       0.5199293     67.20350 28.76013  54.38334 7.363744  12.82016       29.68787  
1 1 1 11 9  24 o 107.8571 2.011163  7.755311       0.2890478     8.707635       3.554435      7.748971       0.2900083     107.5029 25.24616  107.8128 2.018676  -0.3099213     25.32674  
1 1 1 11 9  25 o 33.02801 13.19256  0.4015087      0.8767443     -1.779768      1.620059      1.304948       1.042618      31.07273 14.71143  44.47692 14.92131  -13.40420      20.95403  
1 1 1 11 9  26 o 114.4769 5.951540  8.825150       0.9047468     3.733182       1.984675      10.16093       1.016514      70.55849 20.12516  122.7957 6.232749  -52.23717      21.06820  
1 1 1 11 9  27 o 23.54799 10.90779  -0.6324374     0.8121907     -1.865938      1.201008      0.4070587      1.102523      24.53391 11.88641  35.61321 14.58632  -11.07930      18.81615  
1 1 1 11 9  28 o 28.96289 13.53223  -1.046950      1.292957      -1.558567      1.394815      2.077180       3.446738      28.25694 13.45632  60.86858 25.43701  -32.61164      28.77697  
1 1 1 11 9  29 f 26.54764 12.59674  -1.235452      1.200463      -3.833950      1.519250      3.083679       1.958692      23.30698 11.66092  61.57132 20.44728  -38.26434      23.53865  
1 1 1 11 9  30 o 48.15182 19.44386  1.475832       1.926529      3.262643       2.608179      -0.6696202     2.857970      61.19698 23.22278  44.12047 20.44569  17.07651       30.94065  
1 1 1 11 9  31 o 33.96799 15.73205  -0.7286521     1.688503      0.1777670      3.501729      -1.003248      1.927370      49.07991 22.70459  35.19378 16.46900  13.88613       28.04865  
1 1 1 11 9  32 o 49.08965 20.55500  1.770912       2.257340      1.590655       3.987595      1.855918       2.738350      52.84147 24.36774  50.80035 21.99014  2.041119       32.82306  
1 1 1 11 9  33 o 35.32731 16.77155  -1.128122      2.133573      0.8722959      2.627479      -5.000594      3.655720      45.19970 20.43167  37.07190 18.47630  8.127800       27.54681  
1 1 1 11 10 0  o 1165.578 32.84837  919.1405       50.92697      919.1405       50.92697      919.1405       50.92697      1165.578 32.84837  1165.578 32.84837  0.000000       0.000000  
1 1 1 11 10 1  o 275.6824 13.13318  50.96220       4.810627      69.90143       7.516458      37.82191       6.260867      322.2332 17.57179  236.2796 20.07531  85.95357       26.67931  
1 1 1 11 10 2  o 638.9755 8.437940  272.4938       7.184460      260.5577       16.31185      275.3666       8.002473      622.1534 19.70063  642.2094 9.351345  -20.05597      21.80739  
1 1 1 11 10 3  o 413.5292 9.978390  114.2068       5.498448      118.3063       10.91814      112.8138       6.364439      419.0141 19.60888  410.6596 11.64242  8.354492       22.80469  
1 1 1 11 10 4  o 365.5764 7.742947  89.17014       3.771881      92.46464       7.363913      87.99836       4.391733      371.2572 14.91575  362.9558 9.087625  8.301453       17.46610  
1 1 1 11 10 5  o 277.8132 8.114122  51.54583       3.000560      50.16428       4.288747      52.87049       4.199525      273.6939 11.78721  281.0569 11.23592  -7.362915      16.28448  
1 1 1 11 10 6  o 279.0721 5.454289  51.92526       2.028280      51.10195       2.382903      54.09047       3.864327      276.8119 6.460230  284.4010 10.21351  -7.589111      12.08513  
1 1 1 11 10 7  o 303.3590 4.914372  61.34814       1.986545      62.24043       2.289791      58.63273       3.994487      305.5306 5.624289  296.1264 10.13798  9.404205       11.59359  
1 1 1 11 10 8  o 199.8694 8.930103  26.71817       2.372347      24.83868       3.719974      28.00654       3.079937      192.0515 14.64661  204.4053 11.35234  -12.35376      18.53102  
1 1 1 11 10 9  o 183.5813 8.532941  22.54124       2.081666      23.57818       2.562071      20.52706       3.570791      187.6053 10.28817  174.3521 15.53208  13.25325       18.63041  
1 1 1 11 10 10 o 250.2268 7.341131  41.80733       2.445122      42.00336       2.711840      40.95525       5.653807      250.7522 8.126804  246.4384 17.32750  4.313766       19.13863  
1 1 1 11 10 11 o 504.6076 9.386810  170.0297       6.311685      176.0860       8.551168      162.7811       9.355042      513.0705 12.50763  492.8102 14.26099  20.26031       18.96883  
1 1 1 11 10 12 f 112.9729 8.843351  8.573411       1.320663      8.917233       1.352387      1.501647       6.133356      115.2260 8.876365  82.58152 34.17231  32.64445       35.30632  
1 1 1 11 10 13 o 157.9302 9.473287  16.72235       1.984442      16.90322       2.172003      15.80871       4.881657      158.6922 10.32754  150.6800 25.20233  8.012177       27.23629  
1 1 1 11 10 14 o 159.1986 1.857188  16.88781       0.3939749     16.90423       0.3990266     16.25159       2.483781      159.2757 1.880091  155.3269 12.09561  3.948776       12.24086  
1 1 1 11 10 15 o 456.1776 8.884554  139.0835       5.400614      137.3152       8.152182      140.4666       7.209622      452.1321 13.54644  457.7357 11.83010  -5.603577      17.98491  
1 1 1 11 10 16 o 469.8844 8.284937  147.5806       5.187448      145.9025       6.679875      150.1303       8.233778      466.6928 10.74147  472.6105 13.08701  -5.917755      16.93071  
1 1 1 11 10 17 o 151.2278 6.780978  15.30714       1.362986      15.98496       3.207109      15.15773       1.505731      153.0065 15.96465  150.4053 7.536968  2.601196       17.65434  
1 1 1 11 10 18 f 232.4823 7.818052  36.19635       2.418487      35.69940       2.916639      37.29005       4.326862      230.5937 9.512511  234.6839 13.89842  -4.090164      16.84203  
1 1 1 11 10 19 o 237.0171 7.715996  37.64029       2.433695      37.25017       4.185215      37.83961       2.991459      234.4453 13.45334  237.3057 9.479296  -2.860458      16.45750  
1 1 1 11 10 20 o 267.1259 8.480191  47.89667       3.014703      49.78424       4.533909      46.40074       4.036225      271.1485 12.58282  262.0753 11.58645  9.073181       17.10477  
1 1 1 11 10 21 o 206.9555 11.68771  29.03019       3.210046      33.47833       5.482354      26.70962       3.959814      219.3756 18.93979  197.3282 15.17605  22.04738       24.26990  
1 1 1 11 10 22 f 74.55330 22.52543  3.984085       2.426105      2.813303       3.906185      4.719359       3.095562      72.51394 28.18581  81.00510 25.61363  -8.491158      38.08540  
1 1 1 11 10 23 o 129.8839 3.811878  11.27165       0.6590188     9.801187       6.392525      11.28745       0.6625490     110.8553 36.94279  129.9733 3.829697  -19.11797      37.14077  
1 1 1 11 10 24 o 150.4521 7.611201  15.26329       1.520939      12.42481       2.634259      16.68267       1.862792      133.3244 15.09289  156.9603 8.943386  -23.63591      17.54364  
1 1 1 11 10 25 o 46.91632 5.192552  1.492360       0.3191952     2.726946       2.063679      1.462101       0.3230832     62.25422 20.99323  46.41225 5.320111  15.84196       21.65685  
1 1 1 11 10 26 o 191.2324 7.945649  24.80715       2.020306      16.25017       3.542189      28.93291       2.459594      149.0393 18.21401  206.0466 8.979838  -57.00732      20.30733  
1 1 1 11 10 27 o 51.11512 11.98353  1.891727       0.8019500     5.443489       1.605950      0.7118304      0.9256186     86.50322 14.44117  36.31595 13.82187  50.18727       19.98978  
1 1 1 11 10 28 o 70.18189 13.73098  3.642434       1.238096      1.993243       2.789711      4.046942       1.381616      56.90661 23.24258  73.62918 14.59787  -16.72257      27.44659  
1 1 1 11 10 29 o 22.65113 10.90720  -1.310292      0.9739085     -0.3290989     2.821427      -1.443017      1.037690      45.59610 20.82935  23.14290 11.17259  22.45320       23.63659  
1 1 1 11 10 30 o 84.40619 7.137472  4.930985       0.7952543     3.830657       2.858786      5.023274       0.8279335     63.94730 24.30203  85.09145 7.374640  -21.14414      25.39634  
1 1 1 11 10 31 o 39.18205 17.40982  0.2068852      1.820465      0.7327732E-01  2.986099      0.2859167      2.296615      45.84822 21.12266  42.82407 19.25239  3.024147       28.58009  
1 1 1 11 10 32 o 63.49122 18.74162  3.644078       1.694595      1.663210       2.633630      5.043653       2.213732      49.08041 21.40213  71.84711 21.47405  -22.76670      30.31808  
1 1 1 11 11 0  o 313.9298 7.768027  65.82763       3.245008      65.82763       3.245008      65.82763       3.245008      313.9298 7.768027  313.9298 7.768027  0.000000       0.000000  
1 1 1 11 11 1  o 555.6949 22.83451  208.5671       16.87235      235.0752       23.30678      179.3782       24.45696      587.2224 29.88384  509.9958 36.22416  77.22650       46.95992  
1 1 1 11 11 2  o 528.9687 10.41066  186.8916       7.338072      157.1679       11.26967      208.7695       9.668557      483.6693 17.51487  558.6848 12.98737  -75.01547      21.80465  
1 1 1 11 11 3  o 345.0429 10.31477  79.58656       4.737162      76.93960       8.666018      80.71457       5.657191      337.8311 19.33140  347.2460 12.24533  -9.414948      22.88342  
1 1 1 11 11 4  o 392.4732 9.358223  102.8345       4.894145      101.9046       6.760109      103.8588       7.094745      390.1124 13.02266  393.7599 13.54187  -3.647522      18.78754  
1 1 1 11 11 5  o 238.1179 8.438902  37.88651       2.673402      41.22957       5.115227      36.63019       3.135751      247.5851 15.58388  233.9853 10.08090  13.59978       18.56023  
1 1 1 11 11 6  f 604.1067 8.888374  243.5941       7.154998      226.1466       10.57610      258.3188       9.715924      581.3472 13.65264  621.6757 11.72861  -40.32849      17.99875  
1 1 1 11 11 7  o 727.4734 17.65568  355.1688       17.11493      353.9299       35.05399      355.5566       19.61132      716.7048 36.82837  726.7600 20.27061  -10.05518      42.03839  
1 1 1 11 11 8  o 147.3871 14.43756  14.68269       2.799149      15.67925       5.561754      14.34464       3.239304      149.4910 28.96674  145.2483 17.06155  4.242783       33.61798  
1 1 1 11 11 9  o 319.5386 8.283002  68.18974       3.523857      69.92506       4.487475      65.39842       5.691354      323.3596 10.42824  312.2769 13.71078  11.08273       17.22596  
1 1 1 11 11 10 o 225.9805 6.217675  34.08399       1.870508      34.30553       2.003928      32.58454       5.213457      226.6862 6.641284  219.5089 17.98125  7.177322       19.16852  
1 1 1 11 11 11 o 299.1167 8.418325  59.77713       3.352029      57.17476       4.149817      64.66287       5.686029      292.2783 10.67305  310.4016 13.78147  -18.12335      17.43110  
1 1 1 11 11 12 o 717.8953 10.39573  344.5238       9.944655      329.8192       14.69023      356.9630       13.51135      700.9003 15.72892  729.7825 13.89414  -28.88226      20.98680  
1 1 1 11 11 13 o 267.6492 6.927685  47.84080       2.468666      46.79505       2.988044      50.08953       4.381693      264.5491 8.487302  273.2281 12.06467  -8.678986      14.75095  
1 1 1 11 11 14 o 276.3415 6.093181  50.95490       2.243694      50.59852       2.796126      51.59927       3.759875      275.1512 7.633641  277.5269 10.18432  -2.375671      12.72764  
1 1 1 11 11 15 o 277.4770 6.728285  51.40779       2.487739      53.05441       3.577118      49.86537       3.462089      281.4199 9.552897  272.8233 9.537878  8.596558       13.49922  
1 1 1 11 11 16 o 285.4089 6.810718  54.41331       2.590204      55.36756       3.475508      53.22110       3.884768      287.4693 9.084455  281.5971 10.37065  5.872223       13.78687  
1 1 1 11 11 17 f 404.6789 14.03307  110.6397       7.555775      109.3897       10.29196      112.1011       11.12789      399.8936 19.37197  404.0685 20.73668  -4.174927      28.37752  
1 1 1 11 11 18 o 95.50507 11.76476  6.230091       1.465603      6.171386       2.010659      6.296642       2.140810      93.94552 16.67218  94.68797 17.61533  -0.7424469     24.25410  
1 1 1 11 11 19 o 321.9431 11.26534  69.90514       4.825331      70.63139       5.787823      68.24976       8.738191      322.7677 13.48682  313.4188 21.04493  9.348969       24.99567  
1 1 1 11 11 20 o 69.53960 21.81504  3.371603       2.249707      3.918228       2.752120      2.270698       3.905694      75.01063 24.19800  70.35850 27.92948  4.652130       36.95401  
1 1 1 11 11 21 o 207.0950 11.54528  29.09347       3.173401      28.51159       6.712956      29.26092       3.601192      198.0614 26.06773  207.1601 13.11297  -9.098785      29.18007  
1 1 1 11 11 22 o 223.0353 15.99510  34.40177       4.722164      39.84703       8.018572      31.51066       5.842791      233.2543 26.25388  210.5908 21.10541  22.66342       33.68538  
1 1 1 11 11 23 o 87.59673 6.406507  5.171571       0.7426242     7.066850       1.861080      4.812649       0.8098954     100.5133 14.29810  84.34152 7.277440  16.17181       16.04359  
1 1 1 11 11 24 o 73.44330 7.017339  3.659407       0.6784086     9.150863       2.163680      3.060683       0.7144348     114.1117 14.56073  66.87424 8.187952  47.23750       16.70501  
1 1 1 11 11 25 o 53.22354 9.541283  1.983015       0.6518235     2.977241       1.388287      1.701864       0.7382557     63.67382 16.29602  48.83255 11.53116  14.84127       19.96316  
1 1 1 11 11 26 o 100.5005 3.516913  6.762860       0.4702550     6.323346       1.938894      6.790330       0.4847280     92.70792 16.28925  100.6901 3.618635  -7.982140      16.68634  
1 1 1 11 11 27 o 61.08989 13.73747  2.757826       1.091064      0.3353158      3.553274      3.010010       1.146449      54.32097 24.21817  63.82437 13.87667  -9.503399      27.91203  
1 1 1 11 11 28 o 48.86789 14.42417  1.798504       1.003793      -1.925085      2.536844      2.489717       1.092997      38.75925 18.36789  57.25821 14.35424  -18.49896      23.31145  
1 1 1 11 11 29 o 21.34971 10.23570  -1.056304      0.8365034     -2.335441      2.901735      -0.9403689     0.8735898     39.75917 19.06232  22.54928 10.71288  17.20989       21.86637  
1 1 1 11 11 30 o 47.10654 15.81829  1.728770       1.171715      8.050082       3.977398      1.128039       1.226127      82.99614 29.10016  41.29735 15.86089  41.69879       33.14193  
1 1 1 11 11 31 o 50.46539 13.90548  2.025462       0.9649483     -2.421698      2.983664      2.544945       1.019751      38.57718 18.70081  56.78972 13.64607  -18.21254      23.15027  
1 1 1 11 11 32 o 34.82203 15.42559  0.1673862      1.418392      1.071029       1.940250      -0.8698403     2.078721      43.32199 18.62978  35.84908 16.87882  7.472919       25.13888  
1 1 1 11 12 0  o 258.0766 17.83893  45.16675       6.066204      45.16675       6.066204      45.16675       6.066204      258.0766 17.83893  258.0766 17.83893  0.000000       0.000000  
1 1 1 11 12 1  o 410.2351 8.990941  112.3352       4.914865      113.1182       5.181798      105.3174       15.51321      411.6227 9.447300  392.5084 29.88520  19.11423       31.34289  
1 1 1 11 12 2  o 201.6061 10.36374  27.21820       2.774813      27.04919       3.133986      27.83135       5.969376      200.8305 11.76249  201.9941 22.56261  -1.163559      25.44459  
1 1 1 11 12 3  o 374.3719 8.651880  93.54041       4.316058      99.12411       7.864683      91.13403       5.162993      384.3654 15.38658  369.2261 10.50455  15.13928       18.63041  
1 1 1 11 12 4  o 201.6322 6.948374  27.14959       1.864091      29.39287       2.153567      20.44717       3.722483      209.7522 7.718260  173.9084 16.25165  35.84384       17.99132  
1 1 1 11 12 5  o 202.6028 3.482107  27.35639       0.9400719     27.20221       0.9976870     28.57680       2.806968      202.0272 3.706046  206.5963 10.22807  -4.569077      10.87880  
1 1 1 11 12 6  o 254.5914 7.204647  43.27306       2.441704      45.31649       4.201321      42.23083       3.000453      260.0575 12.15757  251.3618 8.972451  8.695679       15.10997  
1 1 1 11 12 7  o 244.6909 7.442899  39.98307       2.423976      39.22815       2.838217      42.01793       4.659763      242.2559 8.806859  250.1293 14.03692  -7.873383      16.57093  
1 1 1 11 12 8  f 206.6640 10.68075  28.61540       2.931327      29.10958       5.620445      28.43074       3.435595      206.8907 20.66324  205.7709 12.59008  1.119843       24.19668  
1 1 1 11 12 9  o 306.0207 8.556999  62.56890       3.485934      61.39211       4.241963      65.01648       6.117673      302.9093 10.52546  311.1008 14.79990  -8.191498      18.16101  
1 1 1 11 12 10 o 240.4013 7.587817  38.60933       2.427633      42.29821       4.579334      37.16739       2.863053      250.8878 13.75032  235.7202 9.132324  15.16760       16.50669  
1 1 1 11 12 11 o 332.8767 9.199203  74.08821       4.076529      74.24895       4.994348      73.76736       7.056122      332.9430 11.27359  330.9627 16.04759  1.980316       19.61171  
1 1 1 11 12 12 o 132.3021 7.057520  11.71664       1.239704      11.21138       1.711162      12.27480       1.798511      129.0960 10.02583  135.1102 10.06191  -6.014191      14.20420  
1 1 1 11 12 13 o 448.1320 8.184157  134.1767       4.887125      131.4376       7.109370      136.6308       6.729167      442.6443 12.06446  451.6621 11.18083  -9.017883      16.44878  
1 1 1 11 12 14 o 185.9038 8.873893  23.16679       2.191897      26.32651       3.236163      20.48865       2.979359      197.6682 12.34795  174.1835 12.92855  23.48465       17.87790  
1 1 1 11 12 15 o 142.8660 7.242846  13.67391       1.374334      12.52293       1.590932      17.05871       2.728260      136.5205 8.792152  158.7357 13.01258  -22.21515      15.70443  
1 1 1 11 12 16 o 218.9892 8.978201  32.17337       2.614349      34.83509       3.394859      28.29459       4.098148      227.4473 11.23605  204.0010 15.18476  23.44629       18.88983  
1 1 1 11 12 17 o 71.94027 3.342592  3.458493       0.3195510     3.562648       0.7411519     3.434710       0.3541602     72.54840 7.788455  71.66618 3.721365  0.8822174      8.631836  
1 1 1 11 12 18 o 176.0557 10.10943  20.90027       2.361676      21.71822       2.707622      18.29885       4.828702      179.1930 11.39858  160.6019 23.23812  18.59105       25.88316  
1 1 1 11 12 19 o 72.84980 15.31314  3.746783       1.439230      3.429382       1.723134      4.479078       2.617326      69.35670 18.35977  79.04716 23.28086  -9.690460      29.64927  
1 1 1 11 12 20 o 165.2533 13.00567  18.64356       2.840825      20.68386       3.577510      15.16117       4.673835      173.2019 15.67018  144.1487 25.25247  29.05322       29.71938  
1 1 1 11 12 21 o 241.6277 9.273613  39.37610       2.980315      37.70791       4.596310      40.58630       3.914836      234.2610 14.79999  244.3022 12.06307  -10.04118      19.09339  
1 1 1 11 12 22 o 62.89714 17.44946  2.839841       1.513736      2.831767       1.616028      2.897625       4.323366      62.89523 18.22934  73.96312 29.37700  -11.06789      34.57336  
1 1 1 11 12 23 o 117.2181 7.797838  9.293616       1.211061      6.986454       2.444238      10.04431       1.394232      97.68968 19.46061  121.6738 8.655852  -23.98411      21.29881  
1 1 1 11 12 24 o 70.01739 7.668199  3.346858       0.7037511     6.067385       1.488240      2.563311       0.7986918     93.15669 12.28847  60.54191 10.26676  32.61478       16.01290  
1 1 1 11 12 25 o 47.16755 12.49159  1.601791       0.7974362     1.727105       1.547700      1.556501       0.9304472     50.93987 18.12610  46.65792 13.91625  4.281940       22.85209  
1 1 1 11 12 26 o 79.56755 6.247257  4.301622       0.6570590     3.614064       5.115198      4.313158       0.6625477     72.48737 30.67967  79.66363 6.292487  -7.176262      31.31833  
1 1 1 11 12 27 o 115.4184 5.952950  9.039720       0.9124535     10.08278       3.583691      8.967413       0.9435501     106.8494 25.52155  114.8712 6.187079  -8.021797      26.26080  
1 1 1 11 12 28 o 102.1404 3.488754  7.005618       0.4741365     5.084800       2.767978      7.063682       0.4812493     74.08282 24.29437  102.5545 3.526865  -28.47166      24.54904  
1 1 1 11 12 29 o 51.78367 16.51600  2.139098       1.284726      0.3717227      2.954973      2.551039       1.426613      47.78286 21.62682  55.87785 17.34794  -8.094990      27.72491  
1 1 1 11 12 30 o 32.40923 13.01696  0.5179918      0.8584310     -0.7566039     2.404974      0.7040934      0.9189656     39.61912 18.49287  34.85123 13.63529  4.767883       22.97624  
1 1 1 11 12 31 o 46.34679 16.52616  1.743021       1.287176      2.522330       2.570347      1.482170       1.487077      53.21301 22.07989  44.46211 17.35987  8.750896       28.08713  
1 1 1 11 13 0  o 56.07684 18.05834  2.661807       1.190995      2.661807       1.190995      2.661807       1.190995      56.07684 18.05834  56.07684 18.05834  0.000000       0.000000  
1 1 1 11 13 1  o 334.0237 12.49317  74.71760       5.550821      73.17663       6.177771      81.17458       12.64590      330.3296 14.06716  344.8210 27.75648  -14.49149      31.11763  
1 1 1 11 13 2  o 409.1218 8.108798  111.6968       4.420615      116.8714       5.528935      102.5266       7.360202      418.3262 9.918657  391.0805 14.14706  27.24570       17.27770  
1 1 1 11 13 3  o 445.9402 10.96692  132.8853       6.516808      135.1072       7.899873      128.1527       11.52925      449.1631 13.21341  436.0201 19.89605  13.14301       23.88404  
1 1 1 11 13 4  o 301.5036 9.763433  60.77343       3.917379      59.66300       5.033493      62.47915       6.238470      298.3813 12.68869  304.9438 15.40257  -6.562500      19.95601  
1 1 1 11 13 5  o 415.2815 6.950947  115.0451       3.846450      125.1582       6.176102      108.6370       4.916317      432.7809 10.70959  403.3668 9.146738  29.41412       14.08397  
1 1 1 11 13 6  o 264.5133 6.103545  46.66285       2.151311      42.80710       3.541321      48.91805       2.708339      252.8833 10.53230  270.6564 7.516782  -17.77306      12.93953  
1 1 1 11 13 7  o 214.1245 4.918767  30.56841       1.403447      31.63562       1.893276      29.26670       2.090964      217.6756 6.534654  209.2867 7.509933  8.388962       9.954939  
1 1 1 11 13 8  o 343.6594 10.43082  79.01469       4.771085      78.62698       9.159245      79.15907       5.589268      340.8628 20.25674  343.7076 12.22318  -2.844788      23.65886  
1 1 1 11 13 9  o 305.0226 7.797818  62.15124       3.166812      65.25981       4.209333      58.09716       4.807049      312.2843 10.12895  294.3189 12.28408  17.96533       15.92150  
1 1 1 11 13 10 o 367.6773 10.01207  90.45885       4.900720      87.10486       6.367915      95.33102       7.674987      360.1983 13.29007  376.3788 15.33520  -16.18042      20.29272  
1 1 1 11 13 11 o 236.0284 10.13010  37.33661       3.178624      37.25259       4.967512      37.39487       4.136287      234.7406 15.97619  235.7270 13.22123  -0.9864197     20.73739  
1 1 1 11 13 12 o 177.6234 7.153741  21.10311       1.689731      20.45697       2.269745      21.90641       2.530792      174.5765 9.796329  180.5682 10.56435  -5.991699      14.40741  
1 1 1 11 13 13 o 286.9912 7.483948  55.07172       2.859579      56.25776       3.884556      53.66869       4.224967      289.6503 10.07990  282.6769 11.23896  6.973389       15.09697  
1 1 1 11 13 14 o 282.9874 8.052475  53.60314       3.033390      49.85506       5.097614      55.65792       3.774372      271.5901 14.13437  288.0372 9.848314  -16.44705      17.22701  
1 1 1 11 13 15 o 61.29877 4.126459  2.517686       0.3350927     2.559781       0.3388544     0.6532340      2.255137      61.81043 4.137965  50.73069 20.82886  11.07974       21.23591  
1 1 1 11 13 16 o 167.7950 7.218177  18.86773       1.610138      18.74944       1.888505      19.18264       3.081219      167.0788 8.510520  167.8976 13.89660  -0.8187714     16.29553  
1 1 1 11 13 17 o 232.7197 8.302724  36.34518       2.570578      37.44825       2.679435      23.59130       9.110962      236.1827 8.527764  173.5691 40.18628  62.61362       41.08114  
1 1 1 11 13 18 o 157.8236 12.78861  16.96778       2.666461      17.69107       2.787644      9.187093       9.143026      161.0872 13.09979  114.5364 43.47631  46.55079       45.40698  
1 1 1 11 13 19 o 125.8186 12.19524  10.81451       2.018992      10.72866       2.467998      10.98820       3.510553      124.4775 15.19372  123.5433 22.13783  0.9342651      26.85019  
1 1 1 11 13 20 f 76.10757 14.14461  4.072759       1.381684      3.835039       1.448337      6.478624       4.607574      73.53358 15.28074  93.76665 31.36627  -20.23307      34.89046  
1 1 1 11 13 21 o 127.1098 12.28228  11.09377       2.054443      12.97956       2.424456      6.290996       3.869136      137.1970 13.43359  91.26357 28.60580  45.93341       31.60305  
1 1 1 11 13 22 o 104.3178 10.14936  7.445218       1.393003      8.246661       1.450430      -2.078624      4.999960      109.8719 10.01691  60.01011 27.53164  49.86180       29.29727  
1 1 1 11 13 23 o 125.8024 9.695059  10.81508       1.612694      6.884140       2.429613      13.91101       2.156178      96.35777 19.59067  142.0883 11.48597  -45.73054      22.70951  
1 1 1 11 13 24 o 39.66968 14.23343  0.9696010      0.9563422     1.684347       1.334050      0.2139644      1.371680      49.62149 16.87783  37.48880 15.87791  12.13269       23.17259  
1 1 1 11 13 25 o 97.14973 9.270426  6.521110       1.185558      9.342280       3.442914      6.141588       1.262787      106.4922 24.73666  93.88094 10.26128  12.61127       26.78052  
1 1 1 11 13 26 o 55.81053 15.13329  2.353301       1.153539      6.165477       4.304469      2.058339       1.197335      80.45462 29.98146  52.31225 15.82839  28.14237       33.90319  
1 1 1 11 13 27 o 26.74554 11.08837  0.1912814      0.6474780     -1.526921      2.638487      0.3013816      0.6679007     40.55383 19.06971  28.24835 11.43353  12.30548       22.23464  
1 1 1 11 13 28 o 35.59495 13.30932  0.7905847      0.8496795     3.530472       1.357659      -0.9735351     1.089402      67.00124 15.51290  25.81353 12.17383  41.18770       19.71933  
1 1 1 11 13 29 o 52.31737 10.00288  2.001876       0.6719322     1.032266       1.161351      2.489783       0.8238229     39.97676 15.41474  57.96893 11.06868  -17.99216      18.97709  
1 1 1 11 13 30 o 67.67883 14.97651  3.694065       1.314851      1.999900       2.397009      4.423231       1.572552      50.70610 21.20305  72.84215 16.57551  -22.13605      26.91313  
1 1 1 11 13 31 o 41.07555 12.85837  1.313337       0.7820213     1.540262       1.033781      1.009761       1.195694      43.89224 14.85826  39.08487 15.47309  4.807377       21.45191  
1 1 1 11 14 0  o 71.63528 0.7113162 3.420022       0.6788389E-01 3.420022       0.6788389E-01 3.420022       0.6788389E-01 71.63528 0.7113162 71.63528 0.7113162 0.000000       0.000000  
1 1 1 11 14 1  o 300.3456 9.716529  60.31889       3.883595      56.40285       5.097475      65.73656       5.995663      289.9685 13.22745  312.8975 14.41885  -22.92896      19.56703  
1 1 1 11 14 2  o 99.01254 2.340212  6.532652       0.3087586     6.590967       0.3144440     4.963671       1.631038      99.45328 2.372743  84.81990 14.97840  14.63338       15.16517  
1 1 1 11 14 3  o 333.8839 7.704778  74.39809       3.427907      73.38576       3.540636      89.54096       13.69375      331.5818 8.013404  361.3711 28.67265  -29.78925      29.77139  
1 1 1 11 14 4  f 349.1762 7.510303  81.36613       3.494424      81.29459       3.689138      81.99065       10.90015      348.9897 7.933024  347.2119 23.70153  1.777740       24.99391  
1 1 1 11 14 5  o 365.9260 8.376803  89.40189       4.084558      86.63564       6.191360      91.53365       5.435117      359.4649 12.94690  369.8127 11.04181  -10.34772      17.01599  
1 1 1 11 14 6  o 117.4819 4.822267  9.217994       0.7533061     8.943566       0.7884727     12.09022       2.550833      115.6983 5.127033  133.4805 14.57809  -17.78220      15.45339  
1 1 1 11 14 7  o 193.8006 6.980377  25.09767       1.799689      26.82827       3.016744      24.14145       2.242427      199.9079 11.37182  189.8918 8.886787  10.01610       14.43237  
1 1 1 11 14 8  o 379.1535 11.98746  96.38224       6.048810      92.76696       7.975219      101.2785       9.281153      371.0146 16.17046  387.1620 18.03978  -16.14746      24.22638  
1 1 1 11 14 9  o 58.51346 21.13671  1.948655       2.113132      5.347435       3.281413      -0.4594415     2.762081      87.74113 26.12542  50.32383 21.93151  37.41730       34.11053  
1 1 1 11 14 10 o 280.4530 14.03220  52.99097       5.227302      57.16140       6.480845      45.22656       8.842917      290.6205 16.80693  255.3982 26.36228  35.22229       31.26408  
1 1 1 11 14 11 o 359.3173 10.21360  86.53442       4.885282      90.12806       7.273671      83.58108       6.593905      365.4731 14.96734  352.1841 14.07912  13.28900       20.54855  
1 1 1 11 14 12 o 190.9524 7.763874  24.41551       1.971381      22.87032       2.362571      27.95756       3.577009      184.5467 9.640809  203.4269 13.26828  -18.88014      16.40099  
1 1 1 11 14 13 o 139.6185 5.283041  13.02899       0.9811064     12.53180       1.714924      13.27089       1.196202      136.4353 9.492077  140.8077 6.392029  -4.372360      11.44367  
1 1 1 11 14 14 o 199.5808 7.908806  26.69700       2.099145      24.47882       2.807879      29.50748       3.160604      190.5368 11.10742  209.1940 11.38115  -18.65718      15.90300  
1 1 1 11 14 15 o 137.6910 3.010465  12.64060       0.5523478     12.82692       0.5632235     7.955114       2.824342      138.7009 3.047390  105.7907 20.77703  32.91013       20.99932  
1 1 1 11 14 16 o 260.7723 3.080030  45.34570       1.070262      45.39651       1.102824      44.52319       4.437127      260.9117 3.172043  256.2435 13.03783  4.668213       13.41815  
1 1 1 11 14 17 o 202.9405 9.849567  27.76943       2.655586      27.03569       2.748004      38.13096       10.32666      200.1137 10.34052  223.5070 35.88766  -23.39337      37.34770  
1 1 1 11 14 18 o 48.46459 12.26962  1.651865       0.7930015     1.635990       0.7980149     2.903410       7.085731      48.23804 12.36018  87.27635 36.47210  -39.03831      38.50958  
1 1 1 11 14 19 o 220.2198 8.588924  32.65578       2.515563      32.85876       2.914138      32.06224       4.983131      220.5104 9.943202  214.6517 17.57562  5.858704       20.19331  
1 1 1 11 14 20 o 116.9792 10.95076  9.350629       1.687130      9.225028       1.714532      13.18610       9.474525      116.1123 11.22103  123.5708 44.73989  -7.458427      46.12558  
1 1 1 11 14 21 o 120.2074 13.22874  10.02330       2.083976      9.156699       2.204955      17.27675       6.379137      114.2560 14.83235  145.4256 33.59519  -31.16967      36.72378  
1 1 1 11 14 22 o 103.4130 14.25500  7.546299       1.912137      7.523615       2.007019      7.769337       6.293361      102.9237 15.08131  96.98492 36.23021  5.938805       39.24378  
1 1 1 11 14 23 o 80.21042 10.52585  4.476335       1.097901      4.404466       1.136127      5.490790       4.268461      79.38998 11.03770  82.81511 30.02334  -3.425133      31.98799  
1 1 1 11 14 24 o 42.17283 12.83422  1.261958       0.7856368     1.437971       1.023555      1.009567       1.225679      45.28385 14.76869  42.05280 15.92849  3.231052       21.72167  
1 1 1 11 14 25 o 124.5724 8.502421  10.68338       1.402900      11.54897       2.001780      9.847877       1.966686      127.6231 11.90847  117.2346 12.79697  10.38844       17.48068  
1 1 1 11 14 26 o 36.63895 11.16343  0.9616740      0.5941620     0.6073119      0.7077171     1.807887       1.093644      32.39064 12.13941  48.95138 15.18775  -16.56074      19.44308  
1 1 1 11 14 27 o 18.95702 8.475152  -0.1541316     0.4383356     0.1234426E-02  0.5184242     -0.5437108     0.8209282     22.31736 9.613867  23.80351 11.00514  -1.486155      14.61299  
1 1 1 11 14 28 o 16.36579 7.899731  -0.7615408     0.5183397     -0.8191957     0.9257923     -0.7352151     0.6255846     23.92319 11.26390  18.86941 8.993125  5.053778       14.41359  
1 1 1 11 14 29 o 26.09096 9.978376  0.3717999      0.4839104     2.974656       0.8946699     -0.7045671     0.5753312     63.27151 11.01135  17.89643 8.555481  45.37508       13.94439  
1 1 1 11 14 30 o 19.44920 9.662826  -2.100924      0.9683463     1.608397       2.469345      -2.774999      1.052662      48.35433 20.90669  18.96321 9.518741  29.39112       22.97164  
1 1 1 11 15 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 11 15 1  o 344.9171 16.07452  80.11520       7.367667      85.75885       8.885790      67.69963       13.17952      356.2024 18.78729  311.9498 32.16668  44.25259       37.25127  
1 1 1 11 15 2  o 416.6094 11.84424  116.2788       6.568542      122.5079       9.289510      110.0503       9.289131      426.5720 16.37322  404.0236 17.29421  22.54837       23.81537  
1 1 1 11 15 3  o 346.1864 11.15253  80.27422       5.137949      79.35477       5.506517      86.46105       14.28386      344.0466 12.02971  353.3384 30.64017  -9.291840      32.91707  
1 1 1 11 15 4  o 431.3999 6.557218  124.1873       3.769408      124.5189       4.440765      123.3324       7.129810      431.8467 7.717110  428.8614 12.48965  2.985321       14.68146  
1 1 1 11 15 5  o 551.8441 10.72860  203.7776       7.889201      204.1861       12.12408      203.4775       10.38968      550.5200 16.54609  550.3729 14.17860  0.1470947      21.79004  
1 1 1 11 15 6  o 87.27332 3.655941  5.086246       0.4242201     5.232989       0.4387163     2.975160       1.664017      88.52158 3.727642  65.46775 18.34435  23.05383       18.71926  
1 1 1 11 15 7  o 124.8424 7.598544  10.44796       1.258069      9.509884       1.562097      12.17961       2.122356      118.8088 9.958562  134.2694 11.98824  -15.46053      15.58496  
1 1 1 11 15 8  o 402.1655 7.891133  108.0713       4.228806      108.6024       5.556313      107.3401       6.519329      402.5994 10.36577  399.8052 12.25163  2.794189       16.04841  
1 1 1 11 15 9  o 330.5875 10.82814  73.32613       4.763514      69.88903       5.800498      80.44554       8.348185      322.1006 13.54474  344.1056 18.27202  -22.00494      22.74481  
1 1 1 11 15 10 o 240.1886 8.527918  38.64104       2.725080      40.85159       3.409494      34.73121       4.534378      246.6596 10.39665  226.3916 15.11749  20.26797       18.34744  
1 1 1 11 15 11 o 176.1191 6.271396  20.74224       1.469436      24.24339       2.204627      17.94349       1.971116      190.1109 8.725985  163.4442 9.086188  26.66664       12.59768  
1 1 1 11 15 12 o 97.18130 2.617090  6.299788       0.3385941     6.376288       0.3426511     3.126409       2.206885      97.76933 2.632518  67.90381 21.64540  29.86552       21.80490  
1 1 1 11 15 13 o 50.33627 3.291245  1.696709       0.2195463     1.724762       0.2210988     -0.2798620     1.855893      50.75277 3.286966  41.29542 17.98742  9.457352       18.28528  
1 1 1 11 15 14 o 38.44756 11.59302  1.004021       0.6430880     0.8809495      0.6945820     1.742936       1.701928      36.94997 12.17259  53.67055 19.01681  -16.72058      22.57900  
1 1 1 11 15 15 o 103.5502 2.919703  7.155416       0.4024661     7.242834       0.4138343     5.629532       1.728963      104.1776 2.984188  89.85899 14.96555  14.31864       15.26018  
1 1 1 11 15 16 o 263.6782 3.712428  46.38812       1.304385      45.97110       1.369301      50.47607       4.287193      262.4695 3.915134  273.0508 11.81094  -10.58133      12.44293  
1 1 1 11 15 17 o 126.3457 4.499453  10.67338       0.7563101     10.69094       0.7591906     8.372659       8.690350      126.4484 4.512954  109.5638 42.18801  16.88461       42.42870  
1 1 1 11 15 18 o 89.69630 3.702456  5.378746       0.4415738     5.356433       0.4421699     13.63752       8.506825      89.50867 3.715316  127.6543 42.61815  -38.14565      42.77979  
1 1 1 11 15 19 o 74.18484 4.535954  3.691298       0.4462481     3.690939       0.4506128     3.709553       3.213976      74.17626 4.581308  73.90742 26.13806  0.2688446      26.53652  
1 1 1 11 15 20 o 16.10408 7.777706  -0.7953033     0.5041512     -0.7777765     0.5056383     -3.761790      6.578240      16.23909 7.829545  65.23544 30.49400  -48.99635      31.48310  
1 1 1 11 15 21 o 82.55693 4.577670  4.574732       0.5016120     4.575692       0.5041046     4.478367       5.050384      82.56261 4.600280  81.20252 31.90696  1.360085       32.23689  
1 1 1 11 15 22 f 161.2003 15.82407  18.55810       3.355298      19.57419       5.257666      17.85995       4.358133      157.3156 25.98779  153.6202 21.91032  3.695389       33.99158  
1 1 1 11 15 23 o 153.7093 7.552166  16.06061       1.542104      15.92297       1.635390      17.16489       4.632169      152.8380 8.058491  146.1712 24.65851  6.666809       25.94189  
1 1 1 11 15 24 o 40.55163 6.204261  1.136363       0.3246094     1.155217       0.3253084     -3.236521      4.954240      40.90366 6.159334  52.62414 25.14321  -11.72049      25.88664  
1 1 1 11 15 25 o 38.45722 7.165562  1.039852       0.3536924     1.254575       0.3660798     -1.972845      1.371240      42.45913 6.691701  26.21473 12.70078  16.24440       14.35579  
1 1 1 11 15 26 o 97.03722 12.04782  6.863134       1.524385      7.812975       4.124567      6.712865       1.640542      84.66821 29.63754  95.09126 13.31126  -10.42305      32.48959  
1 1 1 11 15 27 f 45.35757 15.60396  1.551666       1.140990      -0.5482300     2.103812      2.426703       1.358068      38.73708 17.80390  54.72559 16.91535  -15.98852      24.55826  
1 1 1 11 15 28 o 24.97383 11.63672  -0.6538036     0.9456555     -3.800520      2.812518      -0.2527204     1.004115      34.94015 17.19329  28.17213 12.69213  6.768021       21.37052  
1 1 1 11 15 29 o 38.00854 11.68462  1.091226       0.6490780     0.2311243      2.664393      1.145490       0.6692403     43.80569 20.09749  38.84025 11.85046  4.965439       23.33115  
1 1 1 11 16 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 11 16 1  o 128.5791 22.90982  11.57690       3.781291      9.598116       4.421806      16.96173       7.294343      115.7794 28.78415  152.4471 36.41016  -36.66773      46.41365  
1 1 1 11 16 2  o 201.4210 11.32332  27.26470       3.026912      27.41339       3.347610      26.59829       7.087008      201.7806 12.51191  194.7088 28.12961  7.071747       30.78673  
1 1 1 11 16 3  o 309.5562 5.275620  63.92362       2.176138      65.75888       2.534645      58.77749       4.244320      313.9063 6.059596  296.0597 10.77657  17.84659       12.36338  
1 1 1 11 16 4  o 293.9610 4.401099  57.62521       1.723949      56.91740       1.865554      61.76378       4.511029      292.1258 4.792525  303.3916 11.17742  -11.26584      12.16154  
1 1 1 11 16 5  o 196.4593 2.450896  25.72259       0.6416098     25.67165       0.6655284     26.39332       2.414955      196.2625 2.544813  198.4226 9.158350  -2.160187      9.505338  
1 1 1 11 16 6  o 70.35917 7.809193  3.348886       0.7198341     3.412064       0.7714755     2.923807       2.001112      70.95659 8.317019  65.73898 20.56748  5.217613       22.18545  
1 1 1 11 16 7  f 538.4858 6.773185  193.6786       4.860050      188.3808       5.897010      204.8968       8.581136      530.7272 8.338482  552.5052 11.65561  -21.77802      14.33121  
1 1 1 11 16 8  o 146.6148 8.484413  14.42999       1.650494      13.43321       2.241291      15.61096       2.439601      140.8910 12.05397  151.9400 12.15080  -11.04906      17.11549  
1 1 1 11 16 9  o 349.0471 9.294330  81.67643       4.319057      89.08034       8.311658      78.93766       5.055157      361.8352 17.28867  342.6939 11.08476  19.14130       20.53704  
1 1 1 11 16 10 o 140.9187 17.93829  13.72365       3.292152      9.371050       5.757923      15.83765       4.012761      113.1985 34.80196  150.7647 20.50519  -37.56622      40.39355  
1 1 1 11 16 11 o 174.8287 13.18933  20.74135       3.049960      10.84924       10.35444      21.68116       3.191556      124.9217 46.51047  178.6897 13.50379  -53.76804      48.43114  
1 1 1 11 16 12 f 67.45923 10.44189  3.128911       0.9083310     2.977609       0.9436013     5.040073       3.353637      65.62861 11.19108  84.59381 26.64841  -18.96520      28.90290  
1 1 1 11 16 13 o 268.9774 7.270402  48.46737       2.603451      44.45058       3.437870      53.86821       3.986398      256.9357 10.06078  282.7249 10.60017  -25.78915      14.61448  
1 1 1 11 16 14 o 89.55881 8.184639  5.422922       0.9659603     5.424125       1.073100      5.417782       2.217736      89.40943 9.135312  86.93433 19.61268  2.475098       21.63588  
1 1 1 11 16 15 o 198.7510 5.755028  26.43345       1.522554      26.21576       1.666375      27.53381       3.746377      197.8401 6.329131  200.7078 14.09759  -2.867691      15.45315  
1 1 1 11 16 16 o 183.6660 3.338716  22.50448       0.8171123     22.52665       0.8474888     22.21170       3.079580      183.7475 3.461299  180.4012 12.89593  3.346283       13.35236  
1 1 1 11 16 17 o 141.6683 10.18556  13.62133       1.909953      14.95226       2.324080      10.85240       3.352197      147.9858 11.88563  122.5501 21.30053  25.43575       24.39223  
1 1 1 11 16 18 o 131.4732 6.437331  11.61607       1.124331      11.57836       1.125876      25.33041       21.47137      131.2557 6.457047  146.0120 62.36405  -14.75638      62.69743  
1 1 1 11 16 19 o 149.2282 8.997860  15.10464       1.780907      15.45014       1.938509      13.23532       4.509118      150.7153 9.704003  131.0703 26.72459  19.64497       28.43188  
1 1 1 11 16 20 o 22.97374 11.23134  -2.091305      1.140802      -2.135214      1.165855      -1.102450      5.532667      23.22352 11.35357  64.43098 29.33122  -41.20745      31.45193  
1 1 1 11 16 21 o 52.75260 21.73339  1.112267       2.466242      0.3907225      3.296568      2.029439       3.716688      55.04228 23.97419  64.31522 26.60636  -9.272942      35.81424  
1 1 1 11 16 22 o 82.55070 33.57107  5.686147       5.789773      5.375245       7.970191      6.033514       8.424648      84.12914 36.94436  86.24233 37.92395  -2.113190      52.94442  
1 1 1 11 16 23 o 77.67734 25.53123  5.201212       3.056287      2.909714       4.151395      7.912995       4.516082      66.43363 27.85009  90.34396 31.04514  -23.91032      41.70645  
1 1 1 11 16 24 o 66.87852 26.52251  3.749420       3.518891      2.796632       4.713369      4.949224       5.289182      65.14832 28.51530  73.14930 31.08819  -8.000984      42.18528  
1 1 1 11 16 25 o 67.43380 26.46217  4.230818       3.469896      -0.2698150     6.128216      6.354617       4.209727      59.16859 28.18493  77.02877 29.43796  -17.86018      40.75517  
1 1 1 11 16 26 o 41.68835 19.22091  -0.5587215     2.479357      -2.306521      2.757241      6.824694       5.667057      38.53353 18.50273  73.61608 31.74966  -35.08255      36.74768  
1 1 1 11 16 27 o 20.41801 10.05543  -1.834736      0.9684957     3.069861       3.286901      -2.301040      1.013490      58.54271 24.67587  19.72492 9.814041  38.81779       26.55586  
1 1 1 11 16 28 o 62.99461 15.25331  3.235801       1.266587      -0.1241264     2.211241      4.876462       1.545186      40.04259 18.34786  77.58872 15.48825  -37.54613      24.01104  
1 1 1 11 17 0  o 349.9260 38.74960  87.69063       17.50292      87.69063       17.50292      87.69063       17.50292      349.9260 38.74960  349.9260 38.74960  0.000000       0.000000  
1 1 1 11 17 1  o 177.0192 22.39967  21.76353       5.165564      20.07892       6.207729      25.55592       9.314058      167.7509 28.80870  185.3746 38.94660  -17.62369      48.44356  
1 1 1 11 17 2  o 101.9115 5.197549  6.948156       0.7034913     6.413697       0.7972835     8.827255       1.494962      97.81897 6.147777  114.3688 9.907166  -16.54984      11.65964  
1 1 1 11 17 3  o 119.0629 1.042807  9.445474       0.1654451     9.452423       0.1661473     8.628454       1.801436      119.1067 1.046848  112.6815 12.19149  6.425240       12.23635  
1 1 1 11 17 4  o 375.2245 8.076880  94.16682       4.038391      94.85088       6.131724      93.64279       5.366719      375.4472 12.27281  373.4627 10.79553  1.984528       16.34520  
1 1 1 11 17 5  o 328.7650 6.849425  72.22242       3.000635      74.16585       3.811043      69.05257       4.867188      332.7721 8.601768  320.4486 11.41670  12.32349       14.29446  
1 1 1 11 17 6  o 105.6369 1.282408  7.435692       0.1805159     7.448540       0.1812957     5.951791       1.948403      105.7281 1.286837  92.39946 16.42667  13.32867       16.47699  
1 1 1 11 17 7  o 312.5475 6.234523  65.25665       2.596527      68.02007       4.118746      63.43404       3.344933      318.3500 9.720659  307.7548 8.163808  10.59518       12.69405  
1 1 1 11 17 8  o 106.2565 13.70912  7.744867       1.895871      10.02359       2.837155      5.906426       2.548367      119.9377 18.33353  90.91886 21.39372  29.01881       28.17462  
1 1 1 11 17 9  o 130.6594 13.85136  11.66655       2.374919      13.32625       3.586711      10.37077       3.169192      137.9780 20.09821  121.3488 20.31684  16.62926       28.57817  
1 1 1 11 17 10 o 121.2712 20.25236  10.37594       3.157373      13.51626       4.984170      8.271055       4.080564      135.7344 28.46736  106.0344 28.33793  29.70008       40.16751  
1 1 1 11 17 11 o 228.4268 12.75672  35.37844       3.867507      47.66063       11.16082      33.70234       4.122963      253.1179 33.94520  222.5467 13.97373  30.57112       36.70888  
1 1 1 11 17 12 o 274.5101 6.400821  50.40577       2.341356      50.75788       2.791385      49.57010       4.300239      275.1367 7.621074  270.6454 11.95339  4.491302       14.17619  
1 1 1 11 17 13 o 250.9493 7.983423  42.27791       2.666218      44.43649       3.590142      39.62330       3.981333      256.5732 10.52324  241.6382 12.40640  14.93509       16.26829  
1 1 1 11 17 14 o 113.3360 7.711363  8.654460       1.157652      8.880600       1.241671      7.151086       3.201488      114.7358 8.175016  98.47940 24.49758  16.25639       25.82561  
1 1 1 11 17 15 o 230.0555 6.326639  35.46414       1.937611      35.88233       2.230659      34.17882       3.910685      231.2034 7.249404  223.7274 13.17611  7.476089       15.03874  
1 1 1 11 17 16 o 20.56946 9.582360  -0.5862768     0.6406727     -0.7593342     0.6515529     4.466037       3.520462      19.73831 9.340533  79.59734 27.40802  -59.85903      28.95592  
1 1 1 11 17 17 o 21.85807 9.847816  -0.2975057     0.6045516     -0.4603771     0.6168053     3.679909       3.048079      20.88615 9.614295  72.84584 25.47956  -51.95969      27.23311  
1 1 1 11 17 18 o 31.84059 10.78855  0.6448889      0.5450352     0.6131865      0.5502572     2.291458       3.965613      31.39753 10.83476  68.37382 27.79184  -36.97629      29.82915  
1 1 1 11 17 19 o 155.3352 5.686092  16.21485       1.174962      16.16324       1.260383      16.55731       3.246869      154.9839 6.114985  152.4648 16.23085  2.519135       17.34455  
1 1 1 11 17 20 o 105.3010 16.14843  8.049073       2.193698      8.203884       2.363705      7.087525       5.890849      105.6634 17.39248  90.39998 34.75369  15.26337       38.86280  
1 1 1 11 17 21 o 114.8653 14.17679  9.478955       2.123905      10.31013       2.380609      6.236419       4.702004      119.1374 15.35217  83.98207 31.32759  35.15537       34.88706  
1 1 1 11 17 22 o 44.75823 22.15453  -7.864908      4.914093      -3.126291      8.068345      -10.65929      6.195860      64.63829 31.19244  48.07123 23.97337  16.56706       39.34070  
1 1 1 11 17 23 o 56.70707 24.75526  1.446773       3.531919      7.313797       5.341398      -3.111493      4.708101      81.83719 32.60447  50.15025 24.10596  31.68694       40.54810  
1 1 1 11 17 24 o 55.48378 21.82389  2.302383       2.364880      4.060771       2.771589      -2.405043      4.534854      67.03267 24.20783  49.52641 23.76755  17.50626       33.92514  
1 1 1 11 17 25 o 54.74637 19.65292  2.439763       1.823515      1.558843       5.204082      2.563061       1.946952      59.18230 27.48195  55.80497 20.27032  3.377335       34.14884  
1 1 1 11 17 26 o 58.43148 23.65265  3.066766       2.858664      2.498632       4.032454      3.640747       4.053146      57.57375 25.72503  61.53872 26.69551  -3.964966      37.07327  
1 1 1 11 17 27 o 27.26360 13.66477  -4.815101      2.130229      -3.408774      2.703293      -7.119049      3.460080      34.59602 16.99050  33.90148 17.04955  0.6945381      24.06999  
1 1 1 11 18 0  o 307.2081 18.12473  64.23538       7.359887      64.23538       7.359887      64.23538       7.359887      307.2081 18.12473  307.2081 18.12473  0.000000       0.000000  
1 1 1 11 18 1  o 317.7747 20.49672  69.49844       8.632855      76.27909       15.22301      66.28411       10.48117      322.7096 36.01412  307.4572 25.82134  15.25235       44.31432  
1 1 1 11 18 2  o 481.0335 10.28347  155.3124       6.591566      167.4843       12.98809      151.0898       7.649964      494.2879 19.75913  473.6162 12.13157  20.67169       23.18616  
1 1 1 11 18 3  o 409.7153 8.657279  112.4422       4.726472      109.4220       5.551859      120.3953       9.009184      403.5902 10.33193  420.9220 16.09204  -17.33179      19.12335  
1 1 1 11 18 4  o 179.8846 3.491065  21.57849       0.8368070     15.45746       1.572498      23.99667       0.9883751     151.7791 7.801250  189.6746 3.910561  -37.89551      8.726510  
1 1 1 11 18 5  o 197.7807 8.056422  26.23423       2.118798      25.10766       4.282799      26.59931       2.438061      191.3288 16.97461  198.9532 9.221527  -7.624496      19.31771  
1 1 1 11 18 6  o 41.45120 13.82947  1.099871       0.8957799     0.2779429      0.9782671     5.366355       2.228822      33.60623 13.74923  86.77546 19.72418  -53.16923      24.04339  
1 1 1 11 18 7  o 149.1796 9.653093  15.00392       1.908585      15.35281       2.592664      14.59119       2.819929      150.1826 13.08600  145.9757 14.69704  4.206970       19.67858  
1 1 1 11 18 8  o 53.10207 8.868114  1.941770       0.6053899     2.019075       0.6400351     1.285151       1.865343      54.11271 9.205626  51.19578 19.58818  2.916935       21.64348  
1 1 1 11 18 9  o 185.5725 10.77651  23.26798       2.653339      21.92242       3.360907      25.49405       4.322894      179.1889 14.19157  192.3326 17.04366  -13.14369      22.17852  
1 1 1 11 18 10 o 217.8717 8.669112  31.90995       2.511777      28.39358       6.060404      32.63925       2.759985      200.0931 23.15675  220.1730 9.429228  -20.07990      25.00291  
1 1 1 11 18 11 o 127.3529 12.27045  11.07253       2.056550      9.004463       8.217245      11.21072       2.124151      111.7564 41.46679  128.0665 12.61076  -16.31014      43.34196  
1 1 1 11 18 12 o 134.1209 7.304570  12.09188       1.300536      11.33426       1.453284      15.13829       2.914187      129.6397 8.458966  148.1876 14.96289  -18.54788      17.18843  
1 1 1 11 18 13 o 227.6032 8.620522  34.87685       2.609755      35.20948       2.865233      33.25717       6.322531      228.4543 9.432403  216.0159 22.28449  12.43839       24.19853  
1 1 1 11 18 14 f 187.5924 9.800581  23.81404       2.441359      23.38193       2.636026      26.41970       6.473155      185.6023 10.70382  189.0885 26.41026  -3.486145      28.49690  
1 1 1 11 18 15 o 127.2734 5.858852  10.87194       0.9909623     12.11545       1.066435      3.007766       2.681862      134.3508 5.971829  67.30293 23.86940  67.04788       24.60510  
1 1 1 11 18 16 o 230.4417 5.027483  35.53873       1.543779      35.64525       1.616665      34.43663       5.200092      230.7387 5.258066  220.6267 17.84007  10.11195       18.59880  
1 1 1 11 18 17 o 28.74835 12.02722  0.1292040      0.7718375     0.2041309      0.7831349     -2.411694      4.560489      29.64664 12.23379  55.63798 25.79832  -25.99133      28.55204  
1 1 1 11 18 18 o 19.70049 9.785049  -2.356478      0.9903920     -2.217139      1.054768      -3.394580      2.878984      21.16384 10.43631  39.66544 19.00944  -18.50160      21.68584  
1 1 1 11 18 19 o 143.6829 7.095595  13.98691       1.354322      14.31441       1.467775      12.11072       3.513081      145.1781 7.613869  125.3577 21.82359  19.82048       23.11363  
1 1 1 11 18 20 o 42.59960 18.27275  0.3026678      1.857726      -1.597389      2.227315      4.645910       3.367483      37.92101 17.73186  74.97002 26.73064  -37.04902      32.07719  
1 1 1 11 18 21 o 46.99015 19.87174  0.7803580      2.143082      1.497538       2.873009      -0.1192645     3.217757      55.00472 23.12060  50.33138 22.69390  4.673340       32.39715  
1 1 1 11 18 22 o 41.98466 18.49007  0.1344999      2.009640      -0.4308217     2.351399      1.666373       3.870703      42.29907 19.20331  58.57635 25.73380  -16.27728      32.10911  
1 1 1 11 18 23 o 31.36316 15.21729  -2.600902      1.987138      -2.685746      2.709475      -2.502147      2.923149      37.70210 18.16429  39.80176 19.09586  -2.099663      26.35514  
1 1 1 11 18 24 f 39.69113 17.91424  -0.1682372     2.010885      -0.8750321     3.482454      0.1853128      2.462998      46.93327 22.01856  44.46640 19.96851  2.466869       29.72471  
1 1 1 11 18 25 o 58.04863 27.15204  1.901125       5.229278      0.4180198      7.974400      3.020044       6.926462      59.62205 29.26092  62.17856 29.71402  -2.556511      41.70281  
1 1 1 11 18 26 o 78.33501 17.41158  5.169821       1.770358      8.158118       3.581731      4.203737       2.036519      83.47026 27.64790  67.10027 20.70949  16.37000       34.54402  
1 1 1 11 19 0  o 81.64316 32.08006  6.281452       3.345070      6.281452       3.345070      6.281452       3.345070      81.64316 32.08006  81.64316 32.08006  0.000000       0.000000  
1 1 1 11 19 1  o 243.7155 7.086056  39.77733       2.298794      38.91944       3.890461      40.23752       2.849415      239.8654 12.21213  244.7956 8.749387  -4.930145      15.02291  
1 1 1 11 19 2  o 346.2510 7.134077  80.22931       3.291564      80.89903       3.714927      77.78313       7.099801      347.4917 8.022917  337.6988 15.82166  9.792908       17.73957  
1 1 1 11 19 3  f 116.9600 5.678709  9.161412       0.8823901     9.593317       0.9944856     7.563008       1.913143      119.6266 6.260536  104.7510 14.06095  14.87555       15.39171  
1 1 1 11 19 4  o 145.2779 4.893175  14.10802       0.9458964     14.12398       0.9683766     13.77608       4.415565      145.3489 5.007350  138.2066 24.89176  7.142365       25.39041  
1 1 1 11 19 5  o 55.18929 14.15873  2.144725       1.046266      0.7995107      1.562563      3.238003       1.408664      44.78167 17.70091  67.61315 15.90335  -22.83148      23.79577  
1 1 1 11 19 6  o 214.2113 9.787412  30.91481       2.786344      31.34693       5.900234      30.79078       3.161026      211.4785 21.22434  213.4284 11.15352  -1.949875      23.97652  
1 1 1 11 19 7  o 64.22248 10.66585  2.850589       0.8807544     3.134276       0.9135438     -0.8898434     3.317187      67.44620 10.50695  52.82026 23.48357  14.62594       25.72691  
1 1 1 11 19 8  o 92.39893 2.920851  5.698936       0.3591733     5.664618       0.3632866     7.188766       2.393616      92.11747 2.963461  100.6614 18.52757  -8.543900      18.76307  
1 1 1 11 19 9  o 69.63059 4.932826  3.254981       0.4547249     3.328543       0.4629442     1.238325       2.423916      70.41335 4.965861  55.10647 21.96086  15.30688       22.51530  
1 1 1 11 19 10 o 201.3948 11.59996  27.53236       3.099822      29.12558       9.051827      27.32070       3.299315      192.6399 36.60056  200.3469 12.41962  -7.706985      38.65033  
1 1 1 11 19 11 o 225.8942 7.640301  34.28531       2.296485      34.63005       3.963006      34.11102       2.817821      225.1454 13.26838  224.8279 9.426580  0.3175049      16.27606  
1 1 1 11 19 12 o 60.66394 13.63314  2.609309       1.075130      2.679585       1.157400      2.167033       2.903524      61.36700 14.40272  63.35317 24.38788  -1.986164      28.32326  
1 1 1 11 19 13 o 112.0597 8.715875  8.512942       1.291242      8.413655       1.334296      9.977380       5.124382      111.3204 9.073690  111.7041 32.48643  -0.3837433     33.72981  
1 1 1 11 19 14 o 140.6779 11.67147  13.58168       2.168212      14.04162       2.321705      10.44417       6.063815      142.8211 12.31979  111.6032 35.91095  31.21786       37.96542  
1 1 1 11 19 15 o 60.61544 10.99995  2.578681       0.8557677     2.888788       0.8842793     -1.998946      3.397457      64.32218 10.69227  48.43134 22.39027  15.89084       24.81227  
1 1 1 11 19 16 o 112.2683 5.887558  8.486994       0.8776987     8.545310       0.8965954     7.147096       4.297709      112.6326 5.995515  93.07943 30.25593  19.55314       30.84425  
1 1 1 11 19 17 o 167.0659 4.352601  18.70286       0.9681444     18.75373       0.9881639     17.48540       4.834190      167.2744 4.437207  148.6548 25.31068  18.61963       25.69668  
1 1 1 11 19 18 o 34.60792 14.27244  0.3509536      1.065025      0.5468667      1.119860      -1.503853      3.445730      36.91599 14.85344  48.75832 22.54402  -11.84232      26.99736  
1 1 1 11 19 19 o 36.31371 15.22153  0.3311865      1.239880      0.1030701      1.264396      6.043125       6.326981      34.99086 15.04298  81.59283 34.30447  -46.60197      37.45782  
1 1 1 11 19 20 o 37.91269 16.94389  -0.2731568     1.750420      -0.2901919     1.843663      -0.1174083     5.574699      38.76197 17.35161  60.80946 28.30739  -22.04749      33.20221  
1 1 1 11 19 21 o 27.30755 13.37244  -2.724476      1.637576      -1.660321      2.019186      -4.769465      2.799106      34.70888 16.43030  34.28172 16.92308  0.4271622      23.58697  
1 1 1 11 19 22 o 64.86800 22.00921  3.667940       2.268395      3.134244       2.680647      5.013947       4.257126      61.00381 23.44620  70.58509 28.75622  -9.581276      37.10316  
1 1 1 11 19 23 o 47.08953 20.28829  0.9860319      2.309443      1.691981       2.756449      -0.6766815     4.230310      52.49636 22.38121  50.80422 23.96867  1.692139       32.79353  
1 1 1 11 19 24 o 58.69575 22.68281  3.133688       2.518734      4.564651       2.852222      -1.934593      5.367839      67.14538 24.51255  51.02534 24.81549  16.12004       34.88084  
1 1 1 11 19 25 o 62.10509 27.26097  4.304902       4.335404      2.551514       6.388349      5.801872       5.902775      58.84031 28.23000  65.23896 29.92448  -6.398655      41.13888  
1 1 1 11 20 0  o 127.6400 11.14463  11.16670       1.860837      11.16670       1.860837      11.16670       1.860837      127.6400 11.14463  127.6400 11.14463  0.000000       0.000000  
1 1 1 11 20 1  o 166.9808 6.604935  18.68814       1.466733      18.82659       1.684522      18.25414       2.982412      167.4438 7.569347  163.3942 13.82772  4.049667       15.76391  
1 1 1 11 20 2  o 342.6413 10.99698  79.26749       5.014456      79.13853       7.005543      79.40299       7.180725      340.1622 15.49617  340.5177 15.86906  -0.3554382     22.18013  
1 1 1 11 20 3  o 43.17380 7.736447  1.286948       0.4287292     1.254414       0.4417961     1.812654       1.775937      42.55463 8.086701  54.53955 19.41566  -11.98492      21.03242  
1 1 1 11 20 4  o 202.6960 8.788383  27.64877       2.368069      28.31836       3.564296      27.11964       3.168454      203.8854 13.19019  199.9019 11.94933  3.983490       17.79797  
1 1 1 11 20 5  o 279.1280 6.124973  52.12311       2.278143      53.18742       3.915169      51.57829       2.801188      280.6684 10.48692  277.2603 7.589090  3.408081       12.94487  
1 1 1 11 20 6  f 291.0197 8.610389  56.95035       3.335345      55.71849       5.045525      57.90648       4.445102      286.0511 13.27317  292.4364 11.42914  -6.385284      17.51578  
1 1 1 11 20 7  o 84.73647 16.50514  5.093234       1.796612      5.058466       2.222630      5.158774       3.051656      83.54826 20.19090  84.04455 25.23433  -0.4962921     32.31785  
1 1 1 11 20 8  o 139.5641 10.58431  13.23262       1.953708      12.98197       3.313265      13.36623       2.419005      135.4680 18.86578  139.5458 13.16466  -4.077774      23.00491  
1 1 1 11 20 9  o 217.0048 5.916852  31.54572       1.709338      30.92006       1.883121      34.47388       4.073869      214.7005 6.590012  224.2705 13.69738  -9.570053      15.20022  
1 1 1 11 20 10 o 173.6170 5.488026  20.19124       1.268049      20.95356       1.465700      17.92267       2.528437      176.7308 6.233613  161.9719 11.79576  14.75896       13.34159  
1 1 1 11 20 11 o 75.57873 13.79652  4.033375       1.338268      3.985666       1.670652      4.118810       2.235646      74.20953 17.22695  74.82571 21.36544  -0.6161880     27.44540  
1 1 1 11 20 12 o 184.1822 6.817077  22.81936       1.670203      22.23825       2.144119      23.71613       2.663538      181.2079 8.906990  186.4588 10.76597  -5.250916      13.97285  
1 1 1 11 20 13 o 47.19333 15.29506  1.523507       1.098753      1.754560       1.111661      -8.252446      7.230958      49.93715 15.28039  60.18802 29.16174  -10.25087      32.92260  
1 1 1 11 20 14 o 141.4388 20.95421  14.86805       3.829949      10.39869       6.527180      17.21485       4.729769      107.0216 37.29552  149.6275 24.57457  -42.60593      44.66392  
1 1 1 11 20 15 o 67.56193 7.842343  3.129227       0.6929252     3.289455       0.7122501     0.2961111      2.994987      69.28883 7.852569  52.56889 22.87467  16.71995       24.18498  
1 1 1 11 20 16 o 65.54670 10.52171  3.023827       0.8879029     2.935967       0.9003206     6.143102       5.364499      64.45721 10.86835  84.79498 33.01066  -20.33777      34.75377  
1 1 1 11 20 17 o 68.41444 7.487948  3.214915       0.6714913     3.127769       0.6816244     6.080730       3.908822      67.40466 7.728569  82.95937 28.86439  -15.55471      29.88116  
1 1 1 11 20 18 o 53.58479 7.007873  1.982225       0.4884023     1.941285       0.4892341     13.99155       8.379143      52.99376 7.107188  101.7904 40.74189  -48.79660      41.35714  
1 1 1 11 20 19 o 39.86381 12.03833  1.149271       0.6930646     0.8048424      0.7039871     11.99137       3.949772      34.97895 12.24432  115.5058 26.25895  -80.52689      28.97336  
1 1 1 11 20 20 o 80.12393 7.272362  4.428812       0.7679970     4.491868       0.7921378     3.441323       3.134755      80.62637 7.457588  63.80531 25.11743  16.82107       26.20116  
1 1 1 11 20 21 o 55.21005 18.08457  2.451033       1.533987      1.225062       1.748262      6.552887       3.197839      45.72905 18.50200  81.70637 26.05695  -35.97731      31.95761  
1 1 1 11 20 22 o 38.31583 16.94302  0.1185575      1.703760      0.4436180      1.998545      -0.7460215     3.259373      42.30118 18.54025  45.81186 21.43091  -3.510681      28.33769  
1 1 1 11 20 23 o 43.32313 19.81123  -0.2655937E-01 2.560901      1.407833       3.098198      -3.120357      4.550101      51.18070 22.72831  45.98315 22.46946  5.197548       31.96017  
1 1 1 11 20 24 o 26.44495 13.20343  -4.079167      1.902925      -4.167810      2.843762      -4.007290      2.560723      34.24547 16.93322  32.41553 16.03565  1.829937       23.32115  
1 1 1 11 21 0  o 27.36918 18.61592  -1.083380      2.067418      -1.083380      2.067418      -1.083380      2.067418      27.36918 18.61592  27.36918 18.61592  0.000000       0.000000  
1 1 1 11 21 1  o 38.56493 9.230816  1.041193       0.4680368     1.098129       0.4745048     -1.004697      2.844372      39.61108 9.170894  47.86502 21.47967  -8.253948      23.35555  
1 1 1 11 21 2  o 136.3005 1.444376  12.38091       0.2623319     12.36760       0.2630881     14.68681       3.462467      136.2270 1.449320  144.4033 18.41252  -8.176300      18.46948  
1 1 1 11 21 3  o 72.10240 7.060076  3.518578       0.6696325     3.277287       0.6845133     8.887947       3.229038      69.48784 7.511918  110.1527 22.75256  -40.66486      23.96055  
1 1 1 11 21 4  o 268.1209 9.499810  48.52693       3.388694      50.28429       6.322872      47.81874       4.013829      268.6590 17.76164  265.4089 11.37571  3.250092       21.09224  
1 1 1 11 21 5  o 50.79596 15.13334  1.800334       1.100798      1.686192       1.622055      1.897785       1.498772      52.18365 18.55768  53.43818 17.88957  -1.254524      25.77643  
1 1 1 11 21 6  o 145.5712 13.78187  14.62353       2.641524      13.41495       4.424672      15.29281       3.292677      133.9160 25.73041  147.5811 17.05701  -13.66507      30.87063  
1 1 1 11 21 7  o 80.44344 11.41765  4.479130       1.189546      5.353621       1.345631      1.351997       2.544612      87.98265 11.77292  56.06840 22.44835  31.91425       25.34818  
1 1 1 11 21 8  o 73.86360 11.56865  3.797433       1.101291      4.933558       1.363594      1.666201       1.867616      84.12541 12.54735  53.34253 19.77325  30.78288       23.41832  
1 1 1 11 21 9  o 264.3836 7.443427  47.06402       2.619682      50.02319       3.611239      43.77704       3.806007      271.4384 10.00126  253.2425 11.30723  18.19582       15.09565  
1 1 1 11 21 10 o 67.55273 11.05470  3.186993       0.9607048     3.281033       0.9997193     2.052196       3.472803      68.48370 11.35249  64.70334 26.11342  3.780357       28.47437  
1 1 1 11 21 11 o 91.83444 0.8713083 5.619857       0.1066230     5.623775       0.1067017     2.967463       2.776329      91.86644 0.8716480 66.26203 24.18513  25.60441       24.20083  
1 1 1 11 21 12 f 173.7691 9.381660  20.59454       2.164275      22.21711       2.418639      14.07478       4.848250      180.1686 10.11500  131.5511 28.48437  48.61749       30.22701  
1 1 1 11 21 13 o 158.6898 9.424181  17.23227       1.983837      20.91132       3.288987      15.12827       2.487232      171.8906 14.49434  147.0027 12.82578  24.88795       19.35423  
1 1 1 11 21 14 o 58.23654 21.41822  2.316087       2.183844      6.903330       3.703316      -0.1295745     2.704040      89.92305 27.95586  48.09337 21.30186  41.82968       35.14682  
1 1 1 11 21 15 o 53.32546 12.35355  2.067080       0.8605676     2.092496       0.8668250     0.3256902      7.175023      53.65041 12.37705  69.74489 32.34626  -16.09448      34.63339  
1 1 1 11 21 16 o 43.98085 13.38134  1.400493       0.8541134     1.357122       0.8616150     3.858693       6.486739      43.41608 13.48238  74.22875 32.92948  -30.81267      35.58265  
1 1 1 11 21 17 o 38.01173 12.46664  1.009726       0.7288625     1.052295       0.7335528     -2.287301      6.455740      38.63258 12.49543  59.35204 28.44987  -20.71946      31.07300  
1 1 1 11 21 18 o 31.47144 11.84845  0.5627438      0.6758416     0.2515611      0.6941089     6.242457       2.965399      28.13815 11.55454  82.67484 24.88688  -54.53669      27.43837  
1 1 1 11 21 19 o 82.18587 7.594486  4.677236       0.8223015     4.845052       0.8438125     1.511085       3.665176      83.63270 7.656614  56.20744 24.85270  27.42525       26.00539  
1 1 1 11 21 20 o 55.15482 12.89197  2.302830       0.9303998     2.892228       0.9667846     -5.088410      3.423609      62.39601 12.06429  37.80643 18.67289  24.58958       22.23115  
1 1 1 11 21 21 o 23.23765 11.43997  -2.285263      1.249864      -2.504951      1.359605      -1.086842      3.175509      24.08226 11.87037  44.09968 20.79365  -20.01742      23.94330  
1 1 1 11 21 22 o 40.97302 17.43855  0.7373684      1.668413      1.430860       1.756396      -5.668991      5.338356      45.93718 18.55979  45.34662 22.55569  0.5905609      29.21002  
1 1 1 11 22 0  o 10.55071 7.679650  -1.379043      0.6212206     -1.379043      0.6212206     -1.379043      0.6212206     10.55071 7.679650  10.55071 7.679650  0.000000       0.000000  
1 1 1 11 22 1  o 301.0139 5.840666  60.70931       2.342731      59.75602       2.549780      65.87421       5.935021      298.4701 6.411039  308.8493 14.46138  -10.37918      15.81875  
1 1 1 11 22 2  o 68.02625 6.837492  3.137809       0.6113963     3.062834       0.6137356     12.91690       7.009293      67.17982 6.956518  122.3746 38.52241  -55.19473      39.14548  
1 1 1 11 22 3  o 234.9520 7.904948  37.21325       2.471341      38.19784       2.621299      29.33901       7.412987      237.9085 8.281249  194.6147 29.50982  43.29378       30.64977  
1 1 1 11 22 4  o 75.60891 22.72733  4.243241       2.474381      9.420465       5.036876      2.596389       2.840796      107.4683 32.45326  64.87785 24.32004  42.59048       40.55463  
1 1 1 11 22 5  o 186.0764 10.89166  23.64878       2.688782      24.07421       3.539914      23.06861       4.133819      186.0733 14.38865  180.3992 17.41278  5.674133       22.58845  
1 1 1 11 22 6  o 79.61464 14.08084  4.500466       1.439170      2.492885       1.789680      8.174562       2.421107      59.56340 19.53505  106.4064 17.69680  -46.84296      26.35896  
1 1 1 11 22 7  o 120.6998 8.832682  9.912843       1.410768      10.55837       1.470511      2.449128       5.000202      124.5623 8.918496  73.06162 30.59247  51.50064       31.86595  
1 1 1 11 22 8  o 163.8709 7.991813  18.18483       1.739839      18.09029       2.246805      18.32643       2.749674      162.5286 10.42942  162.4883 12.80283  0.4037476E-01  16.51318  
1 1 1 11 22 9  o 113.5274 10.49278  8.882081       1.569367      9.024163       1.756890      8.321064       3.491108      113.9729 11.73586  102.1465 25.67995  11.82642       28.23456  
1 1 1 11 22 10 o 82.60854 20.89770  5.244376       2.301679      8.602040       3.042467      0.7511930      3.519527      105.4547 22.34675  57.84472 24.98463  47.60994       33.52028  
1 1 1 11 22 11 o 134.1675 13.66967  12.74736       2.409775      13.75449       2.996457      10.90346       4.054490      137.4943 16.69678  114.7078 26.98080  22.78647       31.72926  
1 1 1 11 22 12 o 43.89380 2.060595  1.288221       0.1201864     1.298936       0.1202664     -6.759301      3.295900      44.07692 2.053311  36.05828 17.89967  8.018642       18.01705  
1 1 1 11 22 13 o 50.98180 17.52807  1.847401       1.439660      2.975693       1.647285      -1.801242      2.962264      62.23541 18.50544  43.71200 20.44279  18.52341       27.57461  
1 1 1 11 22 14 o 56.95359 16.38993  2.466502       1.310691      3.365788       1.669420      1.021399       2.116246      65.59454 18.37203  48.28183 20.03435  17.31271       27.18284  
1 1 1 11 22 15 o 100.6982 10.19302  7.131353       1.348908      7.474228       1.377454      -0.8850330     6.660375      103.1304 10.15504  62.46131 29.64732  40.66908       31.33829  
1 1 1 11 22 16 o 102.1571 9.251125  7.297149       1.245684      7.313506       1.262283      6.687436       7.706637      102.2096 9.372349  77.54105 35.02700  24.66856       36.25922  
1 1 1 11 22 17 o 53.12089 13.71448  2.141319       0.9774178     2.127671       0.9818500     3.642789       10.29835      52.92804 13.78646  71.68398 34.74821  -18.75595      37.38321  
1 1 1 11 22 18 o 41.70934 15.49712  1.165386       1.148423      1.240178       1.180880      -0.1393580     4.932195      42.62177 15.73687  55.42977 26.06731  -12.80800      30.44920  
1 1 1 11 22 19 o 94.03205 10.12161  6.329958       1.248284      6.582474       1.314685      4.017906       3.978111      95.67032 10.48418  64.55013 27.17390  31.12019       29.12626  
1 1 1 11 22 20 o 23.09857 11.25510  -1.722957      1.118797      -2.429687      1.193484      3.399428       3.213111      22.01031 10.89890  60.31006 24.82279  -38.29975      27.11009  
1 1 1 11 22 21 o 53.88840 20.39505  2.494893       2.008497      2.187087       2.209140      3.962220       4.823342      52.06274 20.89177  61.75199 27.81925  -9.689247      34.79047  
1 1 1 11 23 0  o 16.58032 10.34824  0.1151046      0.4664112     0.1151046      0.4664112     0.1151046      0.4664112     16.58032 10.34824  16.58032 10.34824  0.000000       0.000000  
1 1 1 11 23 1  o 178.8923 2.804320  21.35979       0.6684864     21.31319       0.6720732     25.69130       6.479068      178.6949 2.822480  180.1558 27.88967  -1.460922      28.03212  
1 1 1 11 23 2  o 173.4829 7.853880  20.37510       1.810868      19.95382       1.866155      27.17077       7.495070      171.5588 8.186834  180.3724 32.37360  -8.813583      33.39272  
1 1 1 11 23 3  o 87.84234 8.464899  5.273215       0.9785742     4.948835       1.000721      12.35936       4.677258      84.93924 8.977285  122.6648 29.06371  -37.72560      30.41860  
1 1 1 11 23 4  o 57.10362 16.19314  2.378028       1.288635      1.765364       1.336807      10.42238       4.843987      50.60466 16.89449  110.2140 31.44262  -59.60936      35.69400  
1 1 1 11 23 5  o 136.6340 10.78558  12.87653       1.947790      14.16704       2.256862      9.109011       3.856133      142.8055 11.97009  105.5010 27.24194  37.30450       29.75578  
1 1 1 11 23 6  o 38.66370 13.62262  0.9425433      0.8723675     1.273221       1.056995      0.2360748      1.544959      43.79925 15.02035  39.57773 16.81046  4.221523       22.54335  
1 1 1 11 23 7  o 56.85964 12.71952  2.333529       0.9395593     3.185424       1.030984      -1.840795      2.282190      66.89323 12.00758  38.04636 17.84145  28.84686       21.50580  
1 1 1 11 23 8  o 53.69667 16.83616  2.100540       1.340161      2.681702       1.588682      0.6665315      2.495537      59.90673 18.25451  50.11947 21.32933  9.787262       28.07432  
1 1 1 11 23 9  o 103.7674 13.36863  7.692607       1.805604      8.832943       2.689766      6.757245       2.436062      107.5506 19.48571  93.33635 20.17591  14.21423       28.04925  
1 1 1 11 23 10 o 34.23537 15.19815  -0.2661546     1.384182      -1.179851      1.578675      2.771736       2.878577      32.22728 15.02277  62.77430 24.25170  -30.54702      28.52768  
1 1 1 11 23 11 f 73.22303 18.64747  4.195712       1.824099      4.104700       2.009175      4.622563       4.351174      71.69501 20.18156  74.13383 29.46273  -2.438820      35.71202  
1 1 1 11 23 12 o 89.79861 3.212340  5.402947       0.3837642     5.448176       0.3859938     1.521857       3.575620      90.17333 3.217550  58.13193 25.14593  32.04140       25.35095  
1 1 1 11 23 13 o 26.38994 9.185210  0.4396071      0.3958397     0.4797408      0.3978751     -3.452888      3.918377      27.14780 9.217537  45.28182 21.82307  -18.13402      23.68986  
1 1 1 11 23 14 o 94.68546 3.855635  6.027096       0.4854487     6.024460       0.4937713     6.103325       2.655209      94.64973 3.923519  83.53708 23.08543  11.11265       23.41647  
1 1 1 11 23 15 o 32.66424 15.41447  -1.408353      1.751669      -1.445792      2.734527      -1.382300      2.281129      41.45839 19.46945  37.96191 17.81314  3.496475       26.38877  
1 1 1 11 23 16 o 79.30650 3.900806  4.236633       0.4109625     4.253880       0.4114100     -3.678074      8.813176      79.46899 3.896997  60.25857 29.79836  19.21042       30.05210  
1 1 1 11 23 17 o 75.32630 4.006213  3.828466       0.4006724     3.878173       0.4089014     2.630650       2.007273      75.80151 4.063096  56.30121 20.56209  19.50031       20.95968  
1 1 1 11 23 18 o 117.7470 4.789847  9.395459       0.7499588     9.518103       0.7558785     1.657224       6.004127      118.5114 4.796411  59.34860 28.16378  59.16284       28.56929  
1 1 1 11 23 19 o 70.25632 4.441540  3.348105       0.4136794     3.315955       0.4147434     9.590048       5.778940      69.90730 4.475801  78.40735 32.86360  -8.500046      33.16698  
1 1 1 11 24 0  o 320.5144 11.48625  70.10696       4.891370      70.10696       4.891370      70.10696       4.891370      320.5144 11.48625  320.5144 11.48625  0.000000       0.000000  
1 1 1 11 24 1  o 104.8178 2.197333  7.331108       0.3069053     7.340515       0.3071505     1.447717       7.681321      104.8850 2.197680  74.80767 34.24726  30.07731       34.31771  
1 1 1 11 24 2  o 156.6662 6.173824  16.57536       1.286329      16.72833       1.323050      13.93375       5.497969      157.3369 6.323503  122.4882 32.96363  34.84872       33.56468  
1 1 1 11 24 3  o 226.8342 7.691632  34.97705       2.321517      35.78413       2.576930      31.50043       5.348407      228.9631 8.460794  204.0987 19.91896  24.86436       21.64140  
1 1 1 11 24 4  o 76.59398 8.170766  4.037946       0.8210707     4.236337       0.8358247     -1.433175      4.389267      78.49084 8.107966  54.62346 25.32150  23.86738       26.58792  
1 1 1 11 24 5  o 104.0744 15.05296  7.903862       2.026999      8.093128       2.279623      7.189090       4.430079      104.1360 17.01520  88.32078 30.72883  15.81520       35.12518  
1 1 1 11 24 6  o 44.84689 17.24886  1.161908       1.451553      2.097405       2.350004      0.5848069      1.845753      56.58561 21.89840  43.96391 18.50881  12.62170       28.67256  
1 1 1 11 24 7  o 31.50690 14.75636  -1.249938      1.552916      -3.872660      2.605974      0.1942341      1.933763      35.07867 17.11130  42.39732 18.41528  -7.318642      25.13800  
1 1 1 11 24 8  o 173.5608 6.446675  20.43761       1.488352      20.72459       1.716841      19.56956       2.985903      174.2758 7.409890  164.7128 13.72899  9.563080       15.60101  
1 1 1 11 24 9  o 54.41489 3.997813  1.996929       0.2878535     2.000481       0.2898817     1.745727       2.437700      54.45937 4.023015  53.93814 21.83890  0.5212364      22.20635  
1 1 1 11 24 10 o 61.84623 5.576839  2.604897       0.4546625     2.624691       0.4561947     -0.3271258     5.552192      62.08332 5.573701  59.69485 27.94014  2.388474       28.49065  
1 1 1 11 24 11 o 79.29391 5.565681  4.272050       0.5843387     4.228786       0.5919132     5.930089       3.664316      78.86044 5.670674  78.30911 27.88788  0.5513229      28.45858  
1 1 1 11 24 12 o 19.52847 9.125965  -0.5194364     0.5884968     -0.4356368     0.5956297     -3.955546      3.814071      20.25984 9.369370  43.11201 20.95574  -22.85218      22.95491  
1 1 1 11 24 13 f 48.81851 9.918832  1.724699       0.6232027     1.849115       0.6408937     -0.4360435     2.670849      50.61192 9.857563  44.18932 20.21666  6.422600       22.49188  
1 1 1 11 24 14 o 25.52859 11.19023  -0.7338499E-01 0.7282331     -0.6710358E-01 0.7338110     -0.4818595     5.917495      25.67547 11.24439  57.65344 27.52773  -31.97797      29.73570  
1 1 1 11 24 15 o 123.2131 0.7029167 10.11793       0.1154075     10.12066       0.1154306     3.269940       5.778676      123.2297 0.7029621 63.80804 29.39223  59.42167       29.40064  
1 1 1 11 24 16 o 45.77243 10.29227  1.546162       0.6124703     1.534494       0.6384594     1.680800       2.168734      45.44634 10.71811  49.69550 20.41728  -4.249157      23.05956  
1 1 1 11 24 17 o 37.44573 10.68054  1.039320       0.5589804     0.9686936      0.5679395     3.225069       3.159514      36.25965 10.88599  59.25519 24.52379  -22.99554      26.83134  
1 1 1 11 25 0  o 134.2684 5.605898  12.15282       0.9989960     12.15282       0.9989960     12.15282       0.9989960     134.2684 5.605898  134.2684 5.605898  0.000000       0.000000  
1 1 1 11 25 1  o 118.9996 1.643279  9.445599       0.2605736     9.419335       0.2629670     10.86876       1.935764      118.8326 1.660703  123.6145 11.89876  -4.781883      12.01410  
1 1 1 11 25 2  o 107.6044 5.291960  7.824674       0.7564597     8.891662       0.8520533     3.853876       1.643713      114.6295 5.595138  70.29015 17.59248  44.33935       18.46080  
1 1 1 11 25 3  o 90.42603 11.53562  5.836476       1.358373      6.192773       1.392018      -1.268173      6.215991      93.22572 11.44550  60.79006 28.79166  32.43566       30.98321  
1 1 1 11 25 4  f 57.95933 1.293618  2.239815       0.9990863E-01 2.239657       0.9993026E-01 2.605289       4.802924      57.95727 1.293944  65.60392 28.74797  -7.646648      28.77708  
1 1 1 11 25 5  f 72.74816 2.806893  3.543887       0.2715850     3.563811       0.2728567     1.421451       2.816230      72.95198 2.812148  53.77138 22.76155  19.18060       22.93461  
1 1 1 11 25 6  o 109.8173 4.957508  8.143173       0.7235796     8.525514       0.7576831     4.180459       2.439263      112.3353 5.074821  69.98482 22.79725  42.35050       23.35527  
1 1 1 11 25 7  o 32.67653 10.61835  0.7358801      0.5293569     0.7168266      0.5387512     1.267974       2.847052      32.42598 10.72217  52.83961 22.64217  -20.41363      25.05260  
1 1 1 11 25 8  o 124.7969 9.257018  10.86954       1.528428      8.372443       1.930521      15.06379       2.501981      106.4348 13.94710  143.8118 13.20341  -37.37695      19.20551  
1 1 1 11 25 9  o 101.1403 9.223697  7.165288       1.229426      7.542584       1.497771      6.386037       2.152498      102.6837 11.12382  89.08128 18.72886  13.60238       21.78324  
1 1 1 11 25 10 o 127.2817 9.226837  11.34041       1.554296      12.49767       1.755448      7.141059       3.343971      133.1192 9.968714  85.77016 26.54855  47.34909       28.35843  
1 1 1 11 25 11 o 115.8829 10.35387  9.554095       1.581981      9.044261       1.650173      15.34312       5.560552      112.1373 11.19284  113.8917 34.03218  -1.754448      35.82554  
1 1 1 11 25 12 o 169.9328 7.439113  19.92028       1.680422      21.18109       1.811857      12.16382       4.493986      174.9488 7.791666  105.4080 30.35350  69.54082       31.33760  
1 1 1 11 25 13 o 45.76764 14.33183  1.607368       0.9714360     1.322618       1.001126      6.195654       4.018670      42.39293 14.61503  73.98608 28.63533  -31.59315      32.14936  
1 1 1 11 25 14 o 64.32955 10.55285  3.023398       0.8732556     3.218977       0.8935324     -1.139747      4.122484      66.48170 10.42919  48.48965 23.10331  17.99205       25.34820  
1 1 1 11 25 15 o 60.36248 13.51754  2.820553       1.060179      2.868546       1.086158      1.853100       4.876606      60.75334 13.73982  57.25571 26.59276  3.497627       29.93255  
1 1 1 11 26 0  o 36.19925 10.97754  1.102996       0.4619842     1.102996       0.4619842     1.102996       0.4619842     36.19925 10.97754  36.19925 10.97754  0.000000       0.000000  
1 1 1 11 26 1  o 29.50268 4.610469  0.5996960      0.1753232     0.5892349      0.1755094     5.522929       3.807487      29.22811 4.662942  75.13735 28.15767  -45.90924      28.54115  
1 1 1 11 26 2  o 46.65017 3.949248  1.471652       0.2431897     1.472411       0.2436142     1.254366       4.121264      46.66123 3.955306  57.64072 25.86182  -10.97949      26.16254  
1 1 1 11 26 3  o 108.8048 6.653728  8.095562       0.9600741     7.188963       1.109165      10.80428       1.917212      101.8052 8.246763  122.4992 11.89485  -20.69395      14.47399  
1 1 1 11 26 4  f 39.59204 9.927293  1.139225       0.5227118     0.9346538      0.6487976     1.517632       0.8824001     36.35398 11.75083  45.09687 13.57581  -8.742886      17.95507  
1 1 1 11 26 5  o 55.17336 9.593385  2.179879       0.6797094     2.535211       0.7888579     1.155715       1.339264      59.28329 10.36311  42.99341 16.55985  16.28988       19.53517  
1 1 1 11 26 6  o 29.03955 10.95061  0.4721997      0.5778170     0.7107563E-02  0.7312456     1.245330       0.9428014     26.30889 11.37599  41.66659 14.18836  -15.35770      18.18579  
1 1 1 11 26 7  o ?        ?         -1.136896      0.2062275     -1.137871      0.2068548     -0.9768581     2.650036      ?        ?         41.93537 19.51989  0.000000       19.51989  
1 1 1 11 26 8  o 37.77943 16.70427  0.5250635E-01  1.655710      2.601651       2.119280      -3.940799      2.652512      56.46416 21.03799  34.18444 16.79674  22.27972       26.92077  
1 1 1 11 26 9  o 33.43653 14.56302  0.9752075E-01  1.216298      1.031304       1.599618      -1.182290      1.872690      43.17286 17.61259  34.34357 16.12305  8.829288       23.87795  
1 1 1 11 26 10 o 45.90922 17.99860  1.427898       1.603967      1.336038       1.821596      1.744903       3.383945      46.30422 18.83051  54.45023 23.98612  -8.146011      30.49463  
1 1 1 11 26 11 o 57.23894 17.60986  2.721232       1.473933      2.098676       1.763691      4.162918       2.683915      51.43309 19.18642  65.73724 23.81066  -14.30416      30.57885  
1 1 1 11 26 12 o 33.38633 13.41625  0.5459971      0.9123976     0.7691572      1.000465      -0.5567738     2.224008      36.35096 14.22560  39.33858 18.16136  -2.987617      23.06952  
1 1 1 11 27 0  o 25.60937 9.510702  0.5967006      0.3014381     0.5967006      0.3014381     0.5967006      0.3014381     25.60937 9.510702  25.60937 9.510702  0.000000       0.000000  
1 1 1 11 27 1  o 109.3488 5.720546  8.146691       0.8306383     7.861829       0.9061841     9.644626       2.077999      107.1283 6.376883  113.0937 14.09403  -5.965446      15.46953  
1 1 1 11 27 2  o 22.77273 9.355628  0.1519997      0.4553301     0.1264824      0.4673978     0.6271022      2.016801      22.68598 9.414557  43.55323 18.86243  -20.86725      21.08139  
1 1 1 11 27 3  o 102.1517 9.661309  7.408462       1.299463      9.651544       1.753248      4.674220       1.935705      115.2216 11.57588  74.17142 19.37613  41.05016       22.57068  
1 1 1 11 27 4  o 47.85283 14.58153  1.771314       1.013684      2.453217       1.691055      1.388863       1.266439      54.68102 18.98767  44.16734 16.29886  10.51367       25.02368  
1 1 1 11 27 5  o 27.80664 13.51789  -2.208045      1.588464      -1.670714      1.730562      -5.082782      4.002811      31.08910 14.85571  41.02053 20.24736  -9.931433      25.11270  
1 1 1 11 27 6  o 103.5574 14.22905  8.171279       1.911642      10.35225       2.500084      5.101185       2.966232      113.8519 16.99932  71.34234 25.12106  42.50961       30.33224  
1 1 1 11 27 7  o 65.61996 10.00763  3.113194       0.8474160     2.697217       1.172563      3.568011       1.226082      58.36219 14.99742  67.99654 13.99861  -9.634350      20.51545  
1 1 1 11 27 8  o 119.4154 11.48506  10.40821       1.805029      15.65361       4.029680      9.091570       2.018897      129.6845 24.20909  109.1107 14.22419  20.57383       28.07860  
1 1 1 12 0  0  f 500.3280 41.03236  171.8820       26.91855      171.8820       26.91855      171.8820       26.91855      500.3280 41.03236  500.3280 41.03236  0.000000       0.000000  
1 1 1 12 0  1  o 345.2866 19.54962  80.58256       8.928336      80.58256       8.928336      80.58256       8.928336      345.2866 19.54962  345.2866 19.54962  0.000000       0.000000  
1 1 1 12 0  2  o 333.7897 9.270752  74.48621       4.116265      74.48621       4.116265      74.48621       4.116265      333.7897 9.270752  333.7897 9.270752  0.000000       0.000000  
1 1 1 12 0  3  o 199.9337 14.13054  27.09801       3.720592      27.09801       3.720592      27.09801       3.720592      199.9337 14.13054  199.9337 14.13054  0.000000       0.000000  
1 1 1 12 0  4  o 138.0288 10.95257  12.95138       1.984426      12.95138       1.984426      12.95138       1.984426      138.0288 10.95257  138.0288 10.95257  0.000000       0.000000  
1 1 1 12 0  5  o 421.4508 14.49750  119.0951       8.119805      119.0951       8.119805      119.0951       8.119805      421.4508 14.49750  421.4508 14.49750  0.000000       0.000000  
1 1 1 12 0  6  o 193.6331 19.25587  25.83243       4.847295      25.83243       4.847295      25.83243       4.847295      193.6331 19.25587  193.6331 19.25587  0.000000       0.000000  
1 1 1 12 0  7  o 853.0053 37.90623  496.8869       42.89177      496.8869       42.89177      496.8869       42.89177      853.0053 37.90623  853.0053 37.90623  0.000000       0.000000  
1 1 1 12 0  8  o 460.6300 18.62034  142.7060       11.38660      142.7060       11.38660      142.7060       11.38660      460.6300 18.62034  460.6300 18.62034  0.000000       0.000000  
1 1 1 12 0  9  o 363.8164 9.882615  88.49514       4.783025      88.49514       4.783025      88.49514       4.783025      363.8164 9.882615  363.8164 9.882615  0.000000       0.000000  
1 1 1 12 0  10 o 419.6707 30.82330  120.6108       17.01864      120.6108       17.01864      120.6108       17.01864      419.6707 30.82330  419.6707 30.82330  0.000000       0.000000  
1 1 1 12 0  11 o 17.34566 12.01921  -0.8120575     0.9588399     -0.8120575     0.9588399     -0.8120575     0.9588399     17.34566 12.01921  17.34566 12.01921  0.000000       0.000000  
1 1 1 12 0  12 o 569.5547 13.56731  216.9782       10.28361      216.9782       10.28361      216.9782       10.28361      569.5547 13.56731  569.5547 13.56731  0.000000       0.000000  
1 1 1 12 0  13 o 122.1581 5.933966  10.01669       0.9607001     10.01669       0.9607001     10.01669       0.9607001     122.1581 5.933966  122.1581 5.933966  0.000000       0.000000  
1 1 1 12 0  14 f 437.1650 9.934334  127.6808       5.780308      127.6808       5.780308      127.6808       5.780308      437.1650 9.934334  437.1650 9.934334  0.000000       0.000000  
1 1 1 12 0  15 o 785.5449 17.59186  413.3712       18.39350      413.3712       18.39350      413.3712       18.39350      785.5449 17.59186  785.5449 17.59186  0.000000       0.000000  
1 1 1 12 0  16 f 649.4290 14.20545  282.1956       12.27979      282.1956       12.27979      282.1956       12.27979      649.4290 14.20545  649.4290 14.20545  0.000000       0.000000  
1 1 1 12 0  17 o 87.32953 6.535241  5.169420       0.7504733     5.169420       0.7504733     5.169420       0.7504733     87.32953 6.535241  87.32953 6.535241  0.000000       0.000000  
1 1 1 12 0  18 o 126.9963 5.678890  10.81631       0.9566234     10.81631       0.9566234     10.81631       0.9566234     126.9963 5.678890  126.9963 5.678890  0.000000       0.000000  
1 1 1 12 0  19 o 159.2341 5.460970  16.96437       1.155629      16.96437       1.155629      16.96437       1.155629      159.2341 5.460970  159.2341 5.460970  0.000000       0.000000  
1 1 1 12 0  20 o 247.9195 8.682648  41.18866       2.860390      41.18866       2.860390      41.18866       2.860390      247.9195 8.682648  247.9195 8.682648  0.000000       0.000000  
1 1 1 12 0  21 o 115.6946 15.55899  9.457132       2.276857      9.457132       2.276857      9.457132       2.276857      115.6946 15.55899  115.6946 15.55899  0.000000       0.000000  
1 1 1 12 0  22 o 225.5170 9.420487  34.18468       2.819652      34.18468       2.819652      34.18468       2.819652      225.5170 9.420487  225.5170 9.420487  0.000000       0.000000  
1 1 1 12 0  23 f 263.7911 14.02003  47.19600       4.896142      47.19600       4.896142      47.19600       4.896142      263.7911 14.02003  263.7911 14.02003  0.000000       0.000000  
1 1 1 12 0  24 o 87.04738 41.05142  8.013301       5.371915      8.013301       5.371915      8.013301       5.371915      87.04738 41.05142  87.04738 41.05142  0.000000       0.000000  
1 1 1 12 0  25 o 144.4558 16.33743  14.65777       3.041266      14.65777       3.041266      14.65777       3.041266      144.4558 16.33743  144.4558 16.33743  0.000000       0.000000  
1 1 1 12 0  26 o 24.37629 17.09479  -2.129969      2.106050      -2.129969      2.106050      -2.129969      2.106050      24.37629 17.09479  24.37629 17.09479  0.000000       0.000000  
1 1 1 12 0  27 o 51.06352 31.44748  1.965433       4.168059      1.965433       4.168059      1.965433       4.168059      51.06352 31.44748  51.06352 31.44748  0.000000       0.000000  
1 1 1 12 0  28 o 59.55933 32.25554  3.963324       3.583423      3.963324       3.583423      3.963324       3.583423      59.55933 32.25554  59.55933 32.25554  0.000000       0.000000  
1 1 1 12 0  29 f 45.94667 28.66649  1.636932       3.575942      1.636932       3.575942      1.636932       3.575942      45.94667 28.66649  45.94667 28.66649  0.000000       0.000000  
1 1 1 12 0  30 f 31.73575 21.63256  -1.032354      2.823563      -1.032354      2.823563      -1.032354      2.823563      31.73575 21.63256  31.73575 21.63256  0.000000       0.000000  
1 1 1 12 0  31 o 43.48277 27.00761  1.860535       3.138144      1.860535       3.138144      1.860535       3.138144      43.48277 27.00761  43.48277 27.00761  0.000000       0.000000  
1 1 1 12 0  32 o 46.02772 31.34254  0.8816829      5.895230      0.8816829      5.895230      0.8816829      5.895230      46.02772 31.34254  46.02772 31.34254  0.000000       0.000000  
1 1 1 12 0  33 o 78.99126 33.66523  7.810220       3.604655      7.810220       3.604655      7.810220       3.604655      78.99126 33.66523  78.99126 33.66523  0.000000       0.000000  
1 1 1 12 0  34 o 32.63045 19.91735  1.059563       1.638366      1.059563       1.638366      1.059563       1.638366      32.63045 19.91735  32.63045 19.91735  0.000000       0.000000  
1 1 1 12 1  0  o 333.9798 19.16523  75.39691       8.464400      75.39691       8.464400      75.39691       8.464400      333.9798 19.16523  333.9798 19.16523  0.000000       0.000000  
1 1 1 12 1  1  o 332.7811 10.27672  74.05613       4.551618      71.45362       5.371398      80.68414       8.572010      326.6050 12.36448  345.9429 18.66448  -19.33792      22.38846  
1 1 1 12 1  2  o 418.4116 16.25882  117.6191       9.047711      122.0950       10.71770      106.5187       16.87837      425.6834 18.94220  393.2303 32.50142  32.45303       37.61847  
1 1 1 12 1  3  o 412.3425 14.14697  114.0110       7.761601      111.9401       8.536131      123.8939       18.64790      408.2692 15.72002  423.8909 33.28102  -15.62167      36.80687  
1 1 1 12 1  4  o 458.0581 12.54117  140.4835       7.647567      142.3237       9.024346      135.7946       14.40503      460.6242 14.72155  447.3342 24.25696  13.29007       28.37471  
1 1 1 12 1  5  o 264.1362 11.75083  46.74848       4.125548      46.40922       4.582318      48.20023       9.478999      262.9907 13.11730  265.0152 27.22913  -2.024475      30.22398  
1 1 1 12 1  6  o 429.2587 26.43171  125.5215       15.04550      125.5215       15.04550      0.000000       0.000000      429.2587 26.43171  ?        ?         0.000000       26.43171  
1 1 1 12 1  7  o 679.7271 24.17767  313.0203       21.86403      303.2504       40.62328      317.0045       25.94189      654.2816 46.90594  681.7892 28.61836  -27.50769      54.94705  
1 1 1 12 1  8  o 236.3168 4.858642  37.23106       1.529971      39.99644       4.154753      36.79723       1.645610      244.1488 12.81565  234.9234 5.256869  9.225372       13.85191  
1 1 1 12 1  9  o 365.1656 8.245423  89.00092       4.012142      77.87764       12.26127      90.33475       4.245887      337.5171 27.50068  367.8579 8.661932  -30.34085      28.83256  
1 1 1 12 1  10 o 131.5410 1.959150  11.52943       0.3434017     11.48044       0.3531001     12.38479       1.475329      131.2608 2.018781  135.9802 8.179983  -4.719406      8.425414  
1 1 1 12 1  11 o 496.9214 13.03851  165.3241       8.626087      170.6928       10.55925      154.5531       14.95644      504.3753 15.73030  477.8065 23.56375  26.56885       28.33183  
1 1 1 12 1  12 o 293.8255 6.196715  57.57393       2.426188      54.69502       3.311453      60.91026       3.564838      286.1251 8.695477  301.9425 8.869783  -15.81744      12.42113  
1 1 1 12 1  13 o 432.8874 7.545286  125.0224       4.352354      123.3165       5.185925      129.0869       8.004680      429.7944 9.055073  438.9677 13.70156  -9.173218      16.42337  
1 1 1 12 1  14 o 346.4075 6.633811  80.03567       3.062132      77.61995       3.601233      86.34132       5.818263      341.0616 7.924006  359.1354 12.17559  -18.07376      14.52704  
1 1 1 12 1  15 o 456.8089 7.509759  139.2323       4.571241      137.8135       6.553800      140.5764       6.379159      454.1218 10.83047  458.7004 10.43664  -4.578583      15.04070  
1 1 1 12 1  16 o 350.4408 5.953620  81.90408       2.780157      75.05235       4.808744      85.34415       3.407333      334.9097 10.78941  357.6458 7.149703  -22.73608      12.94332  
1 1 1 12 1  17 o 308.2469 6.303692  63.38627       2.589210      64.59968       3.109920      60.64510       4.674277      311.1008 7.501957  300.8179 11.68325  10.28293       13.88444  
1 1 1 12 1  18 o 101.6145 6.213890  6.915236       0.8373577     10.99197       3.083690      6.590703       0.8700489     126.2524 18.91114  99.15620 6.622887  27.09620       20.03732  
1 1 1 12 1  19 o 458.7486 8.342546  140.6666       5.099726      140.3109       6.980126      141.0739       7.468858      457.3755 11.46197  458.4048 12.23827  -1.029358      16.76759  
1 1 1 12 1  20 o 214.9073 5.176639  30.81856       1.482424      28.62754       2.443468      32.09474       1.864826      206.6293 8.895282  219.1309 6.393310  -12.50168      10.95447  
1 1 1 12 1  21 o 131.9213 10.64058  11.76034       1.854625      12.69800       2.798530      11.02604       2.476558      136.0305 15.72844  126.8290 14.94032  9.201492       21.69325  
1 1 1 12 1  22 o 107.2309 12.64839  7.865333       1.772558      7.091547       2.933802      8.310183       2.224473      99.22543 22.68444  109.5314 15.68849  -10.30593      27.58102  
1 1 1 12 1  23 o 126.0731 11.19712  10.80190       1.861512      10.39310       3.848484      10.92675       2.126873      119.3194 25.00630  126.4294 12.80086  -7.110062      28.09229  
1 1 1 12 1  24 o 183.6827 9.617378  22.77713       2.345757      26.91269       5.147694      21.69330       2.635273      195.6641 20.02586  178.8538 11.11231  16.81035       22.90237  
1 1 1 12 1  25 o 180.5791 11.98622  22.23151       2.867861      26.49506       4.013067      17.78155       4.099861      195.7594 15.51109  158.2295 19.88294  37.52992       25.21756  
1 1 1 12 1  26 o 186.3882 11.54731  23.72588       2.853875      20.73112       4.737627      25.43149       3.575363      169.1862 21.49954  191.8750 14.08198  -22.68874      25.70082  
1 1 1 12 1  27 o 140.1193 14.39137  13.75440       2.648885      16.93946       3.798421      10.73902       3.695862      153.0031 19.04159  118.4821 24.22751  34.52097       30.81484  
1 1 1 12 1  28 o 191.7217 13.27755  25.72870       3.371100      26.15994       4.220885      24.96909       5.602000      190.6396 16.78691  179.5934 24.00976  11.04620       29.29623  
1 1 1 12 1  29 o 70.58631 24.29782  3.984865       2.766737      0.5578398      3.796495      7.866374       4.040401      57.17490 25.28660  93.53980 29.21920  -36.36490      38.64161  
1 1 1 12 1  30 o 65.91168 23.33780  3.600466       2.562840      1.686650       3.975171      4.961790       3.352636      59.84159 26.19004  74.20943 26.64705  -14.36783      37.36286  
1 1 1 12 1  31 o 38.36424 18.12686  -1.589146      2.436303      -1.245267      2.971825      -2.293912      4.254441      43.36998 20.34477  48.14662 23.08313  -4.776638      30.76915  
1 1 1 12 1  32 o 44.65754 21.37986  -1.849599      3.621219      -2.074605      5.430878      -1.669480      4.859056      51.65028 25.08292  50.41563 24.29840  1.234653       34.92228  
1 1 1 12 1  33 o 35.47071 16.99214  -1.735155      2.295147      -3.124974      3.077257      0.7225669E-02  3.445531      37.75376 18.45467  47.08956 22.03050  -9.335800      28.73878  
1 1 1 12 1  34 f 41.06482 17.41436  0.9494975      1.653476      0.7009259      2.015422      1.461258       2.891837      41.67292 18.42756  48.32514 21.67435  -6.652222      28.44912  
1 1 1 12 2  0  o 162.1797 6.142393  17.60801       1.323088      17.60801       1.323088      17.60801       1.323088      162.1797 6.142393  162.1797 6.142393  0.000000       0.000000  
1 1 1 12 2  1  o 347.7173 3.825913  80.58649       1.772699      80.89288       1.847420      77.02715       6.296756      348.3722 3.979685  338.8689 13.97477  9.503296       14.53038  
1 1 1 12 2  2  o 191.9003 10.20025  24.67152       2.598944      24.33010       3.544484      25.06853       3.822124      190.0857 14.09388  192.8327 14.99250  -2.746964      20.57699  
1 1 1 12 2  3  o 257.4591 9.481012  44.32803       3.247088      47.57265       6.218379      43.11166       3.807392      265.5413 17.67465  253.6983 11.29083  11.84297       20.97322  
1 1 1 12 2  4  o 441.3409 3.711190  129.8232       2.182533      151.9326       8.069545      128.0782       2.267026      476.3325 12.72490  438.3572 3.881100  37.97531       13.30361  
1 1 1 12 2  5  o 462.4595 13.38538  143.2975       8.239878      143.6592       14.30281      143.1178       10.08087      460.4034 23.39024  461.5163 16.41836  -1.112915      28.57737  
1 1 1 12 2  6  o 443.5271 16.79847  132.2431       9.910090      128.2199       11.65609      142.7363       18.82444      435.8724 20.12303  455.9572 31.17054  -20.08478      37.10174  
1 1 1 12 2  7  o 334.2585 11.11908  74.76674       4.945610      72.82945       10.46784      75.32343       5.611381      327.2396 24.17662  335.2975 12.58163  -8.057953      27.25447  
1 1 1 12 2  8  f 511.8691 12.26045  175.2626       8.362549      188.2511       18.57103      171.9590       9.365846      526.0148 26.58120  506.5501 13.88868  19.46469       29.99092  
1 1 1 12 2  9  o 513.2824 18.33364  177.2764       12.51931      166.6944       14.29015      212.2114       25.96471      496.7420 21.64092  554.4794 35.32553  -57.73743      41.42732  
1 1 1 12 2  10 o 86.19733 3.238966  4.958585       0.3713646     4.683384       0.4358268     5.687992       0.7095348     83.73374 3.916923  92.17577 5.806248  -8.442024      7.003913  
1 1 1 12 2  11 f 477.0338 9.427724  151.9455       5.992796      147.7750       6.576168      172.3725       14.55391      470.3193 10.49317  505.2919 21.66577  -34.97256      24.07306  
1 1 1 12 2  12 o 708.4392 14.17740  336.0063       13.38359      343.7697       26.24196      333.2770       15.55923      711.2338 27.74241  704.9363 16.56398  6.297485       32.31110  
1 1 1 12 2  13 o 624.9045 11.09192  260.9470       9.236217      254.8836       12.01952      269.6902       14.43321      616.9317 14.62098  633.7759 17.10609  -16.84424      22.50315  
1 1 1 12 2  14 o 323.7914 6.168714  69.91627       2.661542      68.19697       3.004617      76.18156       5.735663      319.7398 7.052108  337.2318 12.78701  -17.49200      14.60274  
1 1 1 12 2  15 o 209.8176 6.663290  29.39430       1.860601      27.06890       2.805546      31.22004       2.485926      201.0043 10.51115  216.0870 8.650967  -15.08269      13.61335  
1 1 1 12 2  16 o 530.5162 7.816588  187.8444       5.525727      178.9666       9.224031      192.8138       6.901069      516.7834 13.40620  537.2438 9.639874  -20.46045      16.51222  
1 1 1 12 2  17 o 361.2583 6.037495  87.05555       2.906351      85.21468       5.061675      87.96098       3.549856      356.8117 10.65783  363.0289 7.338310  -6.217133      12.93986  
1 1 1 12 2  18 o 319.8887 7.244705  68.31778       3.088113      66.20419       3.982430      71.50537       4.890678      314.5257 9.513011  326.6021 11.25449  -12.07645      14.73638  
1 1 1 12 2  19 o 120.9271 5.990215  9.783409       0.9622450     11.97234       1.647822      8.650757       1.185338      133.4530 9.325015  113.5086 7.885853  19.94447       12.21239  
1 1 1 12 2  20 o 174.4586 4.498475  20.31565       1.044885      23.45587       1.793918      18.70329       1.285444      187.2087 7.204678  167.2846 5.775313  19.92406       9.233722  
1 1 1 12 2  21 o 135.5025 8.603644  12.34617       1.545449      10.48623       2.240317      14.03487       2.134697      123.8850 13.80547  144.0734 11.20743  -20.18842      17.78194  
1 1 1 12 2  22 o 281.6403 9.964179  53.35703       3.733576      50.50565       6.826207      54.57412       4.459774      270.5964 19.05325  284.2968 11.79810  -13.70044      22.41030  
1 1 1 12 2  23 o 100.8163 11.81555  6.956075       1.557216      7.684981       3.461978      6.771194       1.743555      102.2000 25.50446  99.03454 13.56859  3.165474       28.88917  
1 1 1 12 2  24 o 267.9291 10.07236  48.45570       3.589638      38.07372       7.436724      51.60938       4.098738      230.0672 24.64131  276.1176 11.16294  -46.05048      27.05190  
1 1 1 12 2  25 o 40.15615 16.48317  0.4313588      1.411847      0.6153529      3.110760      0.3836258      1.584433      56.74817 23.96704  41.76115 17.33249  14.98702       29.57760  
1 1 1 12 2  26 o 52.27776 19.87825  1.483157       1.913379      1.129079       2.950764      1.740052       2.513404      57.56863 23.75060  58.02514 22.59366  -0.4565163     32.78056  
1 1 1 12 2  27 o 46.37860 19.25585  0.6108486      1.956580      -0.2917505E-01 2.647010      1.381707       2.904992      49.15040 21.44412  57.82256 23.67914  -8.672153      31.94608  
1 1 1 12 2  28 f 76.99642 22.39173  4.620436       2.434556      3.395025       3.099570      6.593959       3.933522      68.82921 25.48077  88.72708 28.95288  -19.89787      38.56863  
1 1 1 12 2  29 o 67.89342 23.82345  3.624740       2.666083      1.743292       3.666020      5.736859       3.884257      60.90474 25.88309  81.00813 28.72653  -20.10339      38.66714  
1 1 1 12 2  30 o 50.96172 21.99201  0.9308214      2.722111      -1.107982      4.647872      1.995255       3.358348      54.43509 25.50581  58.62977 24.83874  -4.194687      35.60210  
1 1 1 12 2  31 o 63.86504 23.21985  3.620126       2.555600      2.705880       3.730922      4.428256       3.507725      60.27480 25.87555  67.89842 26.61748  -7.623619      37.12189  
1 1 1 12 2  32 f 42.39516 19.38512  -0.1925339     2.451190      -0.7602666     6.015934      -0.7951955E-01 2.684095      55.24984 26.72832  44.26762 20.25785  10.98222       33.53779  
1 1 1 12 2  33 o 34.47013 15.39102  -0.7073100E-02 1.440730      -0.2809699     1.716211      0.6466499      2.651393      35.65725 16.27232  45.59264 20.57478  -9.935390      26.23185  
1 1 1 12 2  34 o 33.41487 15.56384  -0.6201156     1.689024      -0.6508754     1.969748      -0.5346797     3.282760      35.65251 16.67241  43.56237 20.71623  -7.909859      26.59194  
1 1 1 12 3  0  o 262.7810 14.46982  46.55048       5.031398      46.55048       5.031398      46.55048       5.031398      262.7810 14.46982  262.7810 14.46982  0.000000       0.000000  
1 1 1 12 3  1  o 493.5338 11.04720  162.8090       7.265117      164.9793       12.62984      161.7357       8.881682      494.8466 19.19012  491.3156 13.57932  3.531097       23.50869  
1 1 1 12 3  2  o 69.94476 16.72114  3.414879       1.537279      3.673432       1.705785      2.296771       3.547249      72.52145 17.78875  70.31205 26.98455  2.209404       32.32036  
1 1 1 12 3  3  o 381.6907 8.624019  97.25946       4.386264      93.89529       6.067430      100.9423       6.348329      374.4660 12.17577  388.2608 12.28597  -13.79480      17.29724  
1 1 1 12 3  4  o 546.8712 9.549755  199.7457       6.959064      194.0628       8.349237      212.6780       12.59504      538.7172 11.63088  562.6067 16.81934  -23.88953      20.44915  
1 1 1 12 3  5  o 277.2100 8.610620  51.34988       3.176800      51.27082       4.567005      51.42399       4.421857      276.5573 12.42462  277.0266 12.00722  -0.4692993     17.27844  
1 1 1 12 3  6  o 292.7773 9.741883  57.31809       3.795322      62.01236       7.348364      55.61029       4.432254      303.2011 18.27286  288.1627 11.56636  15.03842       21.62587  
1 1 1 12 3  7  o 170.3488 2.289307  19.33669       0.5196569     20.25697       2.880314      19.30573       0.5283266     173.5598 12.53876  170.2120 2.329372  3.347855       12.75330  
1 1 1 12 3  8  o 420.1303 16.86254  118.6619       9.421004      119.2393       11.41324      117.4271       16.68964      420.2750 20.44119  413.7810 30.48333  6.493988       36.70253  
1 1 1 12 3  9  o 446.1201 14.30165  133.4249       8.490825      128.8474       13.20132      136.6546       11.08875      436.3205 22.78481  450.5602 18.50896  -14.23969      29.35523  
1 1 1 12 3  10 o 195.3680 7.230690  25.49811       1.879130      24.16789       2.132925      30.11112       3.971985      190.1022 8.441102  211.5939 14.16906  -21.49173      16.49286  
1 1 1 12 3  11 o 215.7459 1.573550  31.01380       0.4523731     30.94691       0.4631563     32.40035       2.108701      215.5128 1.612801  220.2670 7.194077  -4.754181      7.372643  
1 1 1 12 3  12 o 205.1077 4.193123  28.04078       1.146023      27.92537       1.204031      29.15269       3.737209      204.6805 4.414561  208.2892 13.53837  -3.608704      14.23994  
1 1 1 12 3  13 o 260.9202 3.451087  45.37153       1.199878      45.21467       1.234144      48.07918       5.127512      260.4665 3.555826  267.5789 14.43417  -7.112366      14.86571  
1 1 1 12 3  14 f 183.0728 7.637810  22.40112       1.859136      21.11821       2.287238      24.89918       3.191646      177.5656 9.703600  192.5436 12.50744  -14.97806      15.83022  
1 1 1 12 3  15 o 332.4734 6.845756  73.73825       3.032856      74.28413       3.696626      72.61417       5.304661      333.6040 8.315738  329.2777 12.11050  4.326233       14.69067  
1 1 1 12 3  16 o 118.0171 4.465830  9.298408       0.7010300     9.184519       0.7219944     11.17451       2.930372      117.2823 4.628942  127.7428 17.68941  -10.46051      18.28503  
1 1 1 12 3  17 o 506.4229 8.688189  171.3109       5.862949      166.8416       8.834587      174.8284       7.837583      498.7397 13.30537  511.1015 11.50804  -12.36172      17.59170  
1 1 1 12 3  18 o 258.4942 3.092148  44.53625       1.065086      36.63735       2.631599      46.08361       1.164745      234.0079 8.453368  262.9384 3.324325  -28.93047      9.083532  
1 1 1 12 3  19 o 285.4596 6.698880  54.41277       2.548122      57.61157       3.120343      48.00953       4.414769      293.4854 7.986313  267.1286 12.43677  26.35672       14.78021  
1 1 1 12 3  20 o 216.9718 8.407137  31.54656       2.426064      32.40075       2.972371      29.84184       4.199066      219.6016 10.18541  209.6617 15.13184  9.939926       18.24048  
1 1 1 12 3  21 o 147.9430 7.757439  14.68640       1.523934      14.29423       2.403976      14.94987       1.970443      145.1157 12.55543  148.9251 9.987121  -3.809464      16.04311  
1 1 1 12 3  22 o 79.08389 6.802515  4.214270       0.7098957     4.513396       5.128860      4.208428       0.7167950     86.86113 32.65322  79.01902 6.875930  7.842110       33.36931  
1 1 1 12 3  23 o 130.9695 13.52170  11.75907       2.325913      9.324050       5.187949      12.37164       2.602076      110.7998 32.81447  134.0030 14.81978  -23.20320      36.00577  
1 1 1 12 3  24 o 82.84390 14.00525  4.797852       1.491008      6.245313       2.646624      4.124873       1.804636      92.52354 21.82305  75.77625 18.11801  16.74728       28.36384  
1 1 1 12 3  25 o 147.6084 11.90241  14.89057       2.321262      10.69725       5.311021      15.88076       2.580815      116.2410 32.84398  152.1575 12.84885  -35.91655      35.26783  
1 1 1 12 3  26 o 59.59461 19.58400  2.462837       1.798297      4.135682       3.023538      1.547156       2.236969      75.63184 25.41020  54.90895 21.33335  20.72290       33.17816  
1 1 1 12 3  27 f 46.29954 17.86993  1.107990       1.561844      2.952724       3.063705      0.4602271      1.815466      67.21214 25.24336  44.08398 18.44460  23.12816       31.26389  
1 1 1 12 3  28 o 130.3712 20.04954  12.77002       3.371644      8.690452       4.418516      18.45669       5.216729      99.89983 30.44361  150.8832 26.93512  -50.98339      40.64866  
1 1 1 12 3  29 o 51.05581 21.41444  1.041896       2.456385      2.411069       3.642307      -0.1003459     3.326798      63.38568 26.29088  51.80600 23.24050  11.57968       35.09033  
1 1 1 12 3  30 o 67.73029 24.37815  3.940491       2.807910      3.887750       4.781147      3.968259       3.469219      69.05957 29.46060  68.00674 26.52602  1.052834       39.64286  
1 1 1 12 3  31 o 38.77727 18.20704  -1.287928      2.389522      1.085413       3.674707      -3.026695      3.145308      54.00147 24.30875  39.88013 19.30096  14.12134       31.03937  
1 1 1 12 3  32 o 62.28339 24.01622  3.703425       2.819053      3.058064       4.517405      4.115045       3.607739      60.33377 27.07270  63.83105 26.29070  -3.497284      37.73767  
1 1 1 12 3  33 o 15.91858 7.861865  -1.254093      0.6065926     -2.932702      2.278598      -1.126057      0.6293014     32.18432 15.76340  16.91139 8.283187  15.27294       17.80719  
1 1 1 12 3  34 o 40.07381 13.44480  1.247438       0.8464858     -0.1207627     1.387019      2.059482       1.068557      32.82769 14.84144  49.77515 14.92924  -16.94746      21.05114  
1 1 1 12 4  0  o 285.7596 11.08418  54.74003       4.206191      54.74003       4.206191      54.74003       4.206191      285.7596 11.08418  285.7596 11.08418  0.000000       0.000000  
1 1 1 12 4  1  o 480.5496 9.661125  154.2439       6.186420      157.0066       8.647939      151.3483       8.853522      484.0885 13.41941  475.1617 13.99829  8.926788       19.39156  
1 1 1 12 4  2  o 484.4264 6.906076  156.5505       4.457924      161.2158       8.228361      154.6122       5.303749      490.7032 12.59447  481.2847 8.270036  9.418549       15.06699  
1 1 1 12 4  3  o 23.75875 11.39729  -1.508969      1.040510      -0.8203328     2.195377      -1.708476      1.181661      42.93056 19.09448  25.33265 12.15058  17.59791       22.63263  
1 1 1 12 4  4  o 240.1443 7.971194  38.53006       2.547223      35.70825       6.103404      39.12521       2.803002      229.4082 20.17111  241.9291 8.709053  -12.52086      21.97091  
1 1 1 12 4  5  o 469.1270 6.944796  146.8183       4.341336      151.4740       5.165606      135.6208       8.011052      476.3934 8.137331  449.9073 13.37752  26.48611       15.65804  
1 1 1 12 4  6  o 309.5241 7.087737  63.91594       2.923315      61.94409       7.241880      64.29980       3.195209      303.0958 18.01195  310.4135 7.724764  -7.317627      19.59853  
1 1 1 12 4  7  o 259.3590 12.64479  45.11084       4.356880      41.03402       5.267094      53.94521       7.753500      246.8182 16.10268  282.2188 20.76296  -35.40062      26.27540  
1 1 1 12 4  8  o 316.6830 11.92612  67.15483       5.023668      61.32145       10.94841      68.71055       5.654010      299.2339 27.77490  320.1438 13.28258  -20.90994      30.78753  
1 1 1 12 4  9  o 102.0515 10.81728  7.036359       1.448620      6.447533       1.637145      9.160410       3.109396      97.32653 12.94422  114.8689 21.09122  -17.54233      24.74656  
1 1 1 12 4  10 o 634.6488 16.13890  270.2375       13.63730      265.1383       16.41723      281.5880       24.49381      627.5729 19.65613  643.0758 28.65582  -15.50293      34.74938  
1 1 1 12 4  11 o 423.0869 6.837654  119.3961       3.854874      124.4505       4.467897      104.6746       7.625018      431.8794 7.763672  395.1089 14.50737  36.77054       16.45413  
1 1 1 12 4  12 o 449.2437 7.813218  134.6604       4.677195      130.5067       5.160182      153.7851       11.07242      442.1783 8.757782  478.4013 17.39806  -36.22299      19.47796  
1 1 1 12 4  13 o 546.4850 15.81153  200.3397       11.50188      202.2867       20.17490      199.4021       13.99988      545.2612 27.85963  544.2880 19.33359  0.9732056      33.91086  
1 1 1 12 4  14 o 338.3457 8.008908  76.39469       3.610833      79.37224       4.543956      71.29290       5.947930      344.5884 9.906287  326.0621 13.72030  18.52631       16.92280  
1 1 1 12 4  15 o 336.4944 7.209087  75.54644       3.232449      75.84412       3.724424      74.63766       6.507466      337.0797 8.291879  333.4055 14.68359  3.674255       16.86307  
1 1 1 12 4  16 o 113.0048 5.878109  8.540181       0.8820890     10.30650       1.396461      7.367557       1.137819      123.9479 8.506622  104.7288 8.219110  19.21910       11.82863  
1 1 1 12 4  17 o 129.7653 4.187663  11.23789       0.7231604     9.745420       1.418437      11.76207       0.8406148     120.4457 8.900704  132.7288 4.760606  -12.28313      10.09385  
1 1 1 12 4  18 o 161.4681 2.905736  17.37697       0.6251963     15.29906       1.646718      17.72694       0.6757964     151.0950 8.209751  163.0816 3.109835  -11.98662      8.779015  
1 1 1 12 4  19 o 219.4691 8.803417  32.27294       2.569307      31.41986       2.920139      35.19704       5.406368      216.3418 10.15790  227.2470 18.00088  -10.90526      20.66917  
1 1 1 12 4  20 o 233.6852 7.830338  36.56642       2.434845      36.95445       2.925911      35.69254       4.390860      234.6699 9.375734  229.5003 14.43102  5.169632       17.20926  
1 1 1 12 4  21 o 121.8904 12.67205  10.12353       2.028204      10.02396       2.242386      10.57135       4.755401      120.9464 14.18286  119.7074 29.90178  1.239044       33.09486  
1 1 1 12 4  22 o 328.8118 8.643943  72.57029       3.784043      74.02650       11.83276      72.40440       3.993767      321.2317 27.92064  328.2930 9.138403  -7.061310      29.37810  
1 1 1 12 4  23 o 136.4255 6.604599  12.48653       1.197080      10.56196       4.945321      12.60632       1.233772      117.8554 31.05864  137.0550 6.776655  -19.19964      31.78934  
1 1 1 12 4  24 o 283.4431 8.943312  54.10053       3.373603      57.16184       5.067638      51.66402       4.521007      289.5874 13.16710  275.6622 12.33919  13.92526       18.04517  
1 1 1 12 4  25 o 139.2841 11.55178  13.25756       2.124728      24.09509       12.16206      12.91638       2.157914      157.9562 50.86073  137.3614 11.90700  20.59482       52.23591  
1 1 1 12 4  26 o 37.62907 17.61822  -1.940237      2.210785      -1.063995      3.408551      -2.576535      2.904610      51.78507 23.35250  42.65731 20.04298  9.127758       30.77435  
1 1 1 12 4  27 o 59.62857 19.41374  2.543506       1.769054      2.385547       2.693991      2.663259       2.345663      62.02368 23.58643  62.42804 22.30387  -0.4043579     32.46202  
1 1 1 12 4  28 o 35.75479 16.45485  -1.052681      1.805314      -3.798939      2.814359      0.8674248      2.353268      37.73500 18.26146  50.23912 21.00830  -12.50411      27.83577  
1 1 1 12 4  29 o 31.99183 15.12272  -1.595397      1.699234      -1.210634      2.370340      -2.002178      2.437215      40.39355 18.68406  38.40553 18.14151  1.988022       26.04244  
1 1 1 12 4  30 o 51.81420 20.67915  1.724791       2.152368      3.377285       4.571803      1.254226       2.439651      66.34315 28.56413  50.53946 21.27829  15.80369       35.61846  
1 1 1 12 4  31 o 73.23748 5.299991  3.652532       0.5137289     5.315725       1.782570      3.501880       0.5364913     81.49827 16.96673  71.59170 5.670028  9.906570       17.88908  
1 1 1 12 4  32 o 31.17060 12.72040  0.4096019      0.8347271     -3.028132      5.282557      0.4976368      0.8453475     49.12267 24.04739  32.15524 12.91654  16.96743       27.29677  
1 1 1 12 4  33 o 15.27865 7.678244  -1.963420      0.6951527     -3.692308      0.7945516     3.678745       1.435362      ?        ?         66.21252 16.36376  0.000000       16.36376  
1 1 1 12 4  34 o 29.76824 11.50119  0.5206019      0.6474423     3.244893       1.365398      -0.2696193     0.7353715     61.35046 16.39049  23.60823 10.72621  37.74224       19.58826  
1 1 1 12 5  0  o 328.6819 14.58795  72.60354       6.360432      72.60354       6.360432      72.60354       6.360432      328.6819 14.58795  328.6819 14.58795  0.000000       0.000000  
1 1 1 12 5  1  o 317.7379 6.398859  67.33701       2.709225      66.62650       2.771154      82.70272       12.88707      316.0473 6.580139  347.6460 28.05728  -31.59872      28.81856  
1 1 1 12 5  2  o 277.4879 9.115217  51.47025       3.365850      49.75362       4.995764      52.89721       4.554801      272.2329 13.81689  280.9526 12.19547  -8.719727      18.42921  
1 1 1 12 5  3  o 482.6034 12.22867  155.8880       7.857660      160.8462       9.486771      145.0538       14.02350      489.7600 14.55270  462.8882 22.80583  26.87186       27.05341  
1 1 1 12 5  4  o 577.3953 14.20298  223.2995       10.92763      202.9615       20.40859      231.4740       12.93867      545.5882 28.16743  587.0858 16.55574  -41.49762      32.67257  
1 1 1 12 5  5  o 252.3027 7.273126  42.50590       2.442660      43.09353       3.617725      42.01355       3.311445      253.7147 10.72500  250.5951 9.936496  3.119659       14.62052  
1 1 1 12 5  6  o 416.8284 6.942023  115.9054       3.855821      129.8881       9.783120      113.3339       4.195421      439.6193 16.73095  412.1240 7.639662  27.49527       18.39263  
1 1 1 12 5  7  o 406.6554 13.38253  110.7992       7.241799      107.0840       9.307548      116.4983       11.52796      398.9648 17.55057  415.3437 20.89627  -16.37891      27.28876  
1 1 1 12 5  8  o 58.55309 11.84023  2.374503       0.8920235     2.374503       0.8920235     0.000000       0.000000      58.55309 11.84023  ?        ?         0.000000       11.84023  
1 1 1 12 5  9  o 432.9182 10.57536  125.2109       6.100626      122.2568       8.303068      128.6767       8.993396      427.0053 14.61411  437.9269 15.43577  -10.92157      21.25641  
1 1 1 12 5  10 o 460.0713 8.690706  141.2808       5.327871      142.8237       6.573013      138.3253       9.097436      462.3637 10.66860  454.1644 15.05334  8.199341       18.45053  
1 1 1 12 5  11 o 559.1840 10.95418  208.9226       8.162216      207.7464       9.698997      211.7774       15.11031      557.2748 13.06122  560.7179 20.25675  -3.443054      24.10252  
1 1 1 12 5  12 o 306.6497 6.090888  62.70661       2.488838      62.78714       2.761283      62.35787       5.746246      306.8154 6.753986  304.8750 14.18342  1.940460       15.70941  
1 1 1 12 5  13 o 875.5908 21.17398  516.3962       24.70456      455.9448       49.02965      536.9664       28.60054      805.6761 45.85874  891.1180 24.10820  -85.44189      51.80954  
1 1 1 12 5  14 o 539.1583 10.90149  194.2742       7.832053      178.8348       9.360931      230.3037       14.29989      516.6706 13.60849  585.0955 18.36413  -68.42493      22.85678  
1 1 1 12 5  15 o 324.5756 7.265987  70.29572       3.142563      70.74655       3.640032      68.97621       6.227421      325.4245 8.401265  320.4536 14.62230  4.970978       16.86395  
1 1 1 12 5  16 o 312.5666 6.813504  65.19022       2.837831      66.37514       3.342180      62.12868       5.372249      315.2078 7.963562  304.2136 13.28472  10.99420       15.48877  
1 1 1 12 5  17 o 64.35339 8.112866  2.809699       0.6802669     3.134170       1.178225      2.647450       0.8331648     67.15450 13.63295  62.07106 10.44363  5.083443       17.17343  
1 1 1 12 5  18 o 109.3222 4.571413  7.984288       0.6644663     8.702580       2.586099      7.933517       0.6875487     112.1298 17.91045  108.9619 4.746773  3.167915       18.52879  
1 1 1 12 5  19 o 25.72060 10.58811  0.1333610      0.5847383     -1.767848      1.404396      0.5320702      0.6431359     28.49283 13.54987  31.61463 11.62384  -3.121796      17.85253  
1 1 1 12 5  20 f 153.6285 2.049810  15.72935       0.4196225     19.01933       2.306628      15.61675       0.4267434     168.0347 10.35186  153.0766 2.092109  14.95804       10.56115  
1 1 1 12 5  21 o 168.1369 11.74966  19.13371       2.615892      20.97981       3.023477      13.63773       5.216772      175.8005 12.99858  136.0617 29.61603  39.73872       32.34304  
1 1 1 12 5  22 o 79.14532 7.842224  4.238283       0.8161982     6.065401       3.727422      4.146263       0.8364989     91.42239 27.98141  78.22558 8.144066  13.19682       29.14249  
1 1 1 12 5  23 o 194.1257 6.799199  25.26647       1.756076      21.27701       5.617926      25.69849       1.848715      171.2696 25.38346  195.7249 7.100198  -24.45532      26.35779  
1 1 1 12 5  24 o 198.5393 7.200166  26.46905       1.901703      27.34402       4.587126      26.28745       2.089748      198.0679 17.56198  197.6876 7.949275  0.3802338      19.27729  
1 1 1 12 5  25 o 162.3181 10.85053  17.94141       2.333404      21.39265       4.930067      16.94510       2.648883      171.9138 22.02672  157.0754 12.76549  14.83832       25.45848  
1 1 1 12 5  26 o 70.71557 18.32690  3.670564       1.740927      6.525377       3.515177      2.742752       2.003956      91.46550 26.99112  62.43461 20.68045  29.03089       34.00296  
1 1 1 12 5  27 o 119.5327 14.19207  10.09756       2.216439      13.29294       3.757738      8.392776       2.744730      132.5287 22.05327  105.8250 20.20091  26.70366       29.90692  
1 1 1 12 5  28 o 58.42744 18.34017  2.540011       1.589846      4.563717       3.577969      2.042151       1.774665      75.44862 27.46818  54.39660 19.40398  21.05202       33.63057  
1 1 1 12 5  29 o 93.56949 15.96439  6.555771       1.919126      8.623466       4.154647      5.994908       2.163810      95.30446 29.60745  87.36583 19.11904  7.938629       35.24399  
1 1 1 12 5  30 o 65.21486 7.766653  2.959030       0.6616770     2.755156       1.606187      3.000700       0.7261567     58.58472 18.44039  65.39827 8.536346  -6.813549      20.32036  
1 1 1 12 5  31 o 45.77130 15.28405  1.592180       1.094087      1.087242       3.975045      1.633567       1.138042      54.43412 24.81184  46.30225 15.58962  8.131874       29.30296  
1 1 1 12 5  32 o 87.12950 11.25979  5.584040       1.276744      7.498909       2.710363      5.037962       1.447390      89.22110 22.73528  80.75906 13.95447  8.462036       26.67621  
1 1 1 12 5  33 o 84.86250 10.76666  5.329134       1.190138      2.081578       1.640015      8.941969       1.729790      49.53730 18.49706  108.7880 12.13933  -59.25068      22.12475  
1 1 1 12 6  0  o 832.1445 35.11210  471.2151       38.77597      471.2151       38.77597      471.2151       38.77597      832.1445 35.11210  832.1445 35.11210  0.000000       0.000000  
1 1 1 12 6  1  o 317.4197 10.11794  67.37717       4.274099      64.07922       7.322232      69.08161       5.263939      308.3265 17.89906  321.1301 12.32433  -12.80362      21.73167  
1 1 1 12 6  2  o 46.38826 17.27198  1.100812       1.427973      1.384411       1.792393      0.6080501      2.362650      51.94202 19.34866  51.94718 21.32299  -0.5161285E-02 28.79307  
1 1 1 12 6  3  o 256.2888 7.210566  43.85654       2.460031      43.15265       3.092737      45.06903       4.059082      254.0551 9.150642  259.3524 11.77602  -5.297302      14.91338  
1 1 1 12 6  4  o 67.25520 19.13598  3.117967       1.796549      3.909139       5.295321      3.015053       1.909823      87.64716 33.12840  66.58592 19.95596  21.06124       38.67468  
1 1 1 12 6  5  o 462.4959 11.96305  143.1330       7.366457      143.7550       11.30501      142.6741       9.711179      462.1436 18.39454  461.0061 15.83203  1.137482       24.26958  
1 1 1 12 6  6  f 292.2559 8.367604  57.05428       3.255297      55.48988       4.679825      58.52085       4.531144      287.7946 12.23108  295.6538 11.52347  -7.859222      16.80446  
1 1 1 12 6  7  o 359.2642 9.375306  86.23952       4.484372      103.0245       8.207944      79.09747       5.354090      391.7217 15.75688  343.7776 11.70492  47.94418       19.62867  
1 1 1 12 6  8  o 627.5668 19.06784  264.9578       15.92689      264.9578       15.92689      0.000000       0.000000      627.5668 19.06784  ?        ?         0.000000       19.06784  
1 1 1 12 6  9  o 185.5213 7.658201  23.00257       1.889119      22.26577       1.984834      30.09403       6.157652      182.4800 8.183554  210.1392 22.33206  -27.65924      23.78427  
1 1 1 12 6  10 o 606.1055 10.82035  245.4359       8.739030      249.0645       11.49304      240.4625       13.45535      609.9752 14.14000  598.5173 16.88804  11.45782       22.02601  
1 1 1 12 6  11 o 621.8182 12.56026  258.5784       10.40724      259.1460       11.49523      255.9989       24.50721      622.2471 13.86377  612.6209 30.11352  9.626221       33.15159  
1 1 1 12 6  12 o 30.23813 10.25642  0.5639799      0.4926048     0.6135499      0.4982717     -1.578187      3.275542      31.13058 10.31217  51.07755 22.97512  -19.94697      25.18327  
1 1 1 12 6  13 o 201.2176 7.304240  27.04758       1.955209      28.53238       2.073841      15.17213       5.864976      206.6561 7.543679  146.5106 31.00976  60.14543       31.91414  
1 1 1 12 6  14 o 567.4016 13.84705  215.6221       10.46939      225.7465       13.17420      198.2697       17.24729      579.5386 17.07821  540.7720 23.99473  38.76660       29.45186  
1 1 1 12 6  15 o 569.4888 11.59381  216.9676       8.798017      212.2916       10.75364      226.4337       15.30051      562.5253 14.35804  579.1656 19.85510  -16.64038      24.50262  
1 1 1 12 6  16 o 191.5029 7.984110  24.53128       2.032926      24.94739       2.070046      13.23998       10.78322      193.1156 8.062052  139.3539 47.96870  53.76163       48.64147  
1 1 1 12 6  17 o 327.6430 6.873029  71.66455       3.000700      71.43139       3.733003      72.09031       5.044391      326.8180 8.579352  327.8218 11.56587  -1.003784      14.40051  
1 1 1 12 6  18 f 137.9540 6.207428  12.73014       1.138166      9.168004       2.842518      13.41029       1.242083      114.7572 19.27113  141.5628 6.602766  -26.80557      20.37088  
1 1 1 12 6  19 o 394.6208 7.949817  104.1542       4.180330      115.5672       6.470587      95.97798       5.476695      414.5829 11.72452  378.0274 10.88364  36.55551       15.99744  
1 1 1 12 6  20 o 249.2598 5.559329  41.48830       1.846495      45.68535       3.633637      40.02717       2.143950      260.6104 10.48489  244.6331 6.582955  15.97728       12.38015  
1 1 1 12 6  21 o 240.5460 10.35972  38.97773       3.312840      37.67987       4.070683      41.52332       5.700934      235.7561 13.00821  245.8432 17.51738  -10.08711      21.81907  
1 1 1 12 6  22 o 72.55964 5.904409  3.543163       0.5659505     -0.3704058E-01 3.099138      3.666677       0.5756300     54.32127 23.45383  73.82207 5.900812  -19.50081      24.18474  
1 1 1 12 6  23 o 123.4445 6.513114  10.23044       1.067565      7.108256       3.516053      10.54750       1.120461      97.71084 26.38931  125.3154 6.734677  -27.60459      27.23511  
1 1 1 12 6  24 f 104.8702 7.313715  7.414793       1.015625      9.462293       4.317038      7.294830       1.044954      111.0825 28.89545  103.9661 7.595184  7.116394       29.87698  
1 1 1 12 6  25 o 124.4964 7.245779  10.44834       1.196836      5.483008       4.226426      10.88122       1.247917      86.21949 30.01321  127.0252 7.404729  -40.80573      30.91315  
1 1 1 12 6  26 o 208.2023 6.550783  29.16083       1.815146      29.04642       4.081942      29.18902       2.026531      203.6194 15.15301  208.0552 7.321139  -4.435791      16.82892  
1 1 1 12 6  27 o 68.86137 22.52167  3.578928       2.379476      -0.2084121     4.302539      5.247695       2.855983      59.11467 26.48138  81.40131 24.40532  -22.28664      36.01226  
1 1 1 12 6  28 o 67.06019 7.805170  3.095773       0.6844423     -1.832993      3.737780      3.266773       0.6962143     49.55984 23.10685  68.93548 7.711220  -19.37564      24.35959  
1 1 1 12 6  29 o 179.5188 8.430616  22.17886       2.011073      12.03681       4.932255      24.20121       2.202471      109.1173 31.91075  187.2366 8.852738  -78.11929      33.11596  
1 1 1 12 6  30 o 15.62422 7.363266  -0.4160193     0.3972675     2.796378       1.744202      -0.5917860     0.4079910     58.49351 19.29035  14.68094 7.066844  43.81258       20.54404  
1 1 1 12 6  31 o 31.10863 13.34238  0.1629065      0.9902737     2.579790       3.452403      -0.5376940E-01 1.033711      57.86765 24.86733  30.09935 13.25823  27.76829       28.18093  
1 1 1 12 6  32 o 58.74976 13.94285  2.719322       1.075039      6.095873       1.741341      0.6398230      1.366554      87.36774 15.52640  38.00553 15.95862  49.36221       22.26537  
1 1 1 12 6  33 o 33.25292 15.78071  -1.186137      1.885386      -2.568843      2.876884      -0.1452001     2.496144      36.99127 18.02979  41.17337 19.08958  -4.182102      26.25805  
1 1 1 12 7  0  o 815.4116 24.05119  447.4208       26.08138      447.4208       26.08138      447.4208       26.08138      815.4116 24.05119  815.4116 24.05119  0.000000       0.000000  
1 1 1 12 7  1  o 430.2968 15.85936  124.3209       9.077864      119.7491       10.17855      142.0958       20.07011      421.7937 18.15224  454.2580 33.39019  -32.46426      38.00538  
1 1 1 12 7  2  o 436.0132 6.579326  126.8010       3.822562      137.1913       7.310194      122.8907       4.484529      452.7661 12.12754  429.1382 7.842350  23.62796       14.44229  
1 1 1 12 7  3  o 534.8760 11.14386  191.2098       7.942592      207.5794       14.28583      183.8859       9.555599      555.2311 19.33845  523.9375 13.69865  31.29364       23.69870  
1 1 1 12 7  4  o 322.7195 6.638784  69.46579       2.854876      0.000000       0.000000      69.46579       2.854876      ?        ?         322.7195 6.638784  0.000000       6.638784  
1 1 1 12 7  5  o 108.4523 5.445380  7.861902       0.7844201     9.026810       5.555231      7.838202       0.7923591     113.9677 34.00661  108.2841 5.509516  5.683601       34.45002  
1 1 1 12 7  6  o 200.4081 5.262367  26.79579       1.404087      28.66717       2.874150      26.20918       1.609174      206.8909 10.45937  198.1537 6.101618  8.737198       12.10901  
1 1 1 12 7  7  o 147.0695 11.35311  14.54058       2.207691      14.20058       3.013098      14.93467       3.243963      144.7026 15.88755  148.3055 16.70544  -3.602844      23.05398  
1 1 1 12 7  8  o 727.3575 15.03855  354.3708       14.57563      357.2830       17.88591      348.6133       25.14904      729.1420 18.42355  717.0168 26.36689  12.12512       32.16582  
1 1 1 12 7  9  o 106.7023 10.40708  7.676538       1.460923      7.491185       2.549124      7.767194       1.782745      103.9947 19.09888  107.0208 12.75159  -3.026146      22.96454  
1 1 1 12 7  10 o 415.2227 8.369807  115.0593       4.630949      114.1162       5.183194      118.7914       10.31040      413.4275 9.408589  420.1721 18.46019  -6.744568      20.71956  
1 1 1 12 7  11 o 205.4977 7.653016  28.21383       2.091962      28.55032       2.517569      27.46323       3.760124      206.5975 9.167812  202.0714 14.05200  4.526169       16.77818  
1 1 1 12 7  12 o 475.4196 10.59079  151.0081       6.709323      143.5013       8.247136      165.7001       11.53761      462.8793 13.38500  496.5315 17.46514  -33.65222      22.00430  
1 1 1 12 7  13 o 118.2710 16.98776  9.577795       2.600511      8.653277       2.808189      15.14388       6.890387      111.8198 19.55853  145.5198 35.78720  -33.69997      40.78308  
1 1 1 12 7  14 o 37.04880 11.83300  0.8972549      0.6592807     0.8429554      0.6613267     9.631744       8.387581      36.25744 11.87410  121.9339 42.29037  -85.67641      43.92572  
1 1 1 12 7  15 f 412.7434 7.826817  113.7346       4.304660      113.9721       5.118046      113.1605       7.958052      413.0003 9.299943  410.4132 14.57478  2.587097       17.28910  
1 1 1 12 7  16 o 453.5157 8.906760  137.4600       5.382519      132.7745       6.242084      151.0455       10.62886      445.4473 10.51622  473.2102 16.88324  -27.76294      19.89057  
1 1 1 12 7  17 o 349.0404 7.568942  81.38680       3.520339      81.88531       4.261847      80.31622       6.245590      349.7744 9.151866  345.4539 13.59435  4.320435       16.38790  
1 1 1 12 7  18 o 226.5337 8.957063  34.39828       2.698454      41.95484       4.500383      30.15645       3.371820      249.2843 13.59969  211.5587 12.01013  37.72563       18.14373  
1 1 1 12 7  19 o 160.0188 7.017778  17.14910       1.492748      17.35926       2.483560      17.03024       1.867780      160.2649 11.71037  159.2205 8.838133  1.044434       14.67124  
1 1 1 12 7  20 o 296.3224 9.313022  58.95944       3.672730      58.32227       4.372109      60.48701       6.769631      294.2150 11.17230  297.4137 17.15446  -3.198669      20.47183  
1 1 1 12 7  21 o 212.2049 11.74214  30.47472       3.307347      32.80029       3.979857      25.28400       5.945898      219.5826 13.66958  188.4583 24.23764  31.12427       27.82662  
1 1 1 12 7  22 o 124.3994 2.343017  10.31658       0.3883894     12.53686       4.043550      10.29590       0.3901935     131.4851 23.96131  124.2743 2.356271  7.210838       24.07689  
1 1 1 12 7  23 o 146.7251 16.64813  14.99603       3.197476      11.85941       4.718312      17.65982       4.348162      125.0579 28.89476  157.3385 21.28485  -32.28053      35.88805  
1 1 1 12 7  24 o 149.9346 7.495792  15.13519       1.492841      5.609285       5.583542      15.86856       1.549240      90.42706 34.05348  153.5113 7.597245  -63.08427      34.89066  
1 1 1 12 7  25 o 138.3342 9.144191  12.99088       1.676122      16.05366       5.711925      12.70230       1.753308      141.6840 31.10837  136.6260 9.693506  5.058029       32.58365  
1 1 1 12 7  26 o 166.7133 6.007722  18.68968       1.332425      22.72220       5.101139      18.39441       1.380345      174.1875 22.50268  165.3195 6.277397  8.867981       23.36185  
1 1 1 12 7  27 o 108.1774 6.060651  7.902081       0.8701401     12.45625       4.742726      7.743445       0.8851652     120.4739 29.72818  107.0416 6.232768  13.43234       30.37453  
1 1 1 12 7  28 o 118.5870 9.825565  9.760183       1.538706      8.850259       2.969116      10.09429       1.799157      105.0956 21.91250  119.7952 11.40842  -14.69962      24.70444  
1 1 1 12 7  29 o 10.68591 5.424505  -1.483918      0.4027809     0.1771969      1.630085      -1.591931      0.4156700     38.90621 16.90318  ?        ?         0.000000       16.90318  
1 1 1 12 7  30 f 106.4118 11.38053  8.184565       1.588683      9.628684       5.036162      8.024977       1.674165      88.29945 32.51672  104.7483 12.22389  -16.44881      34.73846  
1 1 1 12 7  31 o 86.67104 11.83794  5.546531       1.331480      7.386794       1.562466      0.6659267      2.544529      100.0844 11.95170  46.36230 20.59255  53.72211       23.80959  
1 1 1 12 7  32 o 18.37130 9.259648  -3.058183      1.051382      -3.273284      1.138205      -1.807444      2.744626      19.13138 9.641692  38.48764 18.47538  -19.35626      20.83991  
1 1 1 12 7  33 o 46.68754 17.38927  1.801670       1.447669      2.942245       1.566600      -4.866161      3.787813      57.03493 18.24315  38.00821 18.92096  19.02673       26.28337  
1 1 1 12 8  0  o 256.3246 17.24243  44.52175       5.827173      44.52175       5.827173      44.52175       5.827173      256.3246 17.24243  256.3246 17.24243  0.000000       0.000000  
1 1 1 12 8  1  o 415.4199 16.18848  115.8850       8.944061      117.7522       10.40880      110.6159       17.48568      418.2087 18.72566  400.9217 33.02278  17.28705       37.96254  
1 1 1 12 8  2  o 260.0238 7.806598  45.15472       2.701820      42.51065       4.224775      46.98442       3.514443      251.7947 12.63202  265.0489 9.968543  -13.25420      16.09161  
1 1 1 12 8  3  o 364.2253 6.482431  88.47611       3.146165      86.03211       5.664876      89.56618       3.783286      358.5356 11.87365  366.3822 7.749279  -7.846558      14.17867  
1 1 1 12 8  4  o 341.0335 6.437745  77.56584       2.925529      76.11926       7.704142      77.80959       3.162407      336.3736 17.24570  341.5409 6.948668  -5.167297      18.59296  
1 1 1 12 8  5  o 404.0230 9.891603  109.0100       5.325327      92.55024       15.02055      111.3763       5.695280      367.3222 30.97617  408.1934 10.47936  -40.87115      32.70076  
1 1 1 12 8  6  o 180.5536 11.23808  21.86809       2.690378      18.94742       4.507532      23.48434       3.353150      166.5463 20.76047  186.8545 13.55941  -20.30823      24.79627  
1 1 1 12 8  7  o 210.5923 4.681360  29.56315       1.313676      22.86694       3.231786      30.88857       1.437822      184.4148 13.23954  215.2533 5.012814  -30.83849      14.15676  
1 1 1 12 8  8  o 514.4151 10.24967  176.7376       7.025824      174.4356       7.855062      185.9462       15.71059      510.8879 11.53853  524.7429 22.52084  -13.85495      25.30466  
1 1 1 12 8  9  o 543.5446 8.740633  197.1923       6.330698      203.0318       8.627984      190.3818       9.317655      551.1373 11.74833  533.4814 13.10732  17.65588       17.60184  
1 1 1 12 8  10 o 403.6856 9.611784  108.8136       5.170360      107.5485       6.250509      111.5552       9.201205      400.9499 11.71163  407.4464 16.98455  -6.496521      20.63098  
1 1 1 12 8  11 o 475.5172 15.79547  151.7404       9.994682      151.7404       9.994682      0.000000       0.000000      475.5172 15.79547  ?        ?         0.000000       15.79547  
1 1 1 12 8  12 o 434.7184 11.61291  126.4440       6.720991      119.6608       7.236175      169.0570       18.13687      422.6846 12.86248  498.1279 27.43012  -75.44330      30.29613  
1 1 1 12 8  13 o 195.7013 11.23172  25.69296       2.916658      26.61780       3.764834      24.30469       4.612661      198.7881 14.30861  189.1851 18.53506  9.602951       23.41548  
1 1 1 12 8  14 f 92.15090 2.125802  5.658562       0.2610333     5.660789       0.2614589     4.976202       4.576492      92.16901 2.128850  89.48819 31.22632  2.680824       31.29881  
1 1 1 12 8  15 o 233.3420 8.777482  36.43252       2.724341      35.70515       2.943303      40.78271       7.197985      230.9019 9.586931  244.1670 22.37171  -13.26509      24.33932  
1 1 1 12 8  16 o 71.23216 6.425271  3.414130       0.6033261     3.496410       0.6245255     2.263524       2.335435      72.07584 6.574916  62.19115 22.25109  9.884682       23.20217  
1 1 1 12 8  17 o 254.7313 7.423919  43.39392       2.517245      44.50343       3.415248      42.07425       3.724690      257.5877 9.968833  250.2279 11.19909  7.359756       14.99324  
1 1 1 12 8  18 o 467.4706 12.08931  147.0271       7.524274      138.3065       8.938344      168.2352       13.93917      452.2643 14.85185  495.1699 21.17449  -42.90558      25.86381  
1 1 1 12 8  19 o 150.6104 9.252715  15.26440       1.847976      20.45572       2.610462      10.04939       2.616413      174.0457 11.31728  120.5012 16.74646  53.54457       20.21200  
1 1 1 12 8  20 o 163.5930 10.14606  18.05649       2.200863      19.20836       2.953094      16.61736       3.300840      168.0148 13.29874  155.4009 16.17685  12.61385       20.94151  
1 1 1 12 8  21 o 180.0554 10.24263  21.89533       2.447351      21.79957       3.517167      21.98522       3.407587      178.3189 14.93924  179.2634 14.38600  -0.9444580     20.73977  
1 1 1 12 8  22 o 94.26073 5.263722  5.956758       0.6585198     3.766098       4.561608      6.003383       0.6654907     80.13668 30.63918  94.62612 5.299024  -14.48944      31.09404  
1 1 1 12 8  23 o 96.04519 7.805759  6.234869       0.9903927     -2.905664      3.229162      7.183966       1.040541      45.16995 21.19493  103.1722 7.622562  -58.00224      22.52395  
1 1 1 12 8  24 o 200.2838 1.849533  26.74039       0.4936073     26.53855       5.753113      26.74189       0.4954342     190.7401 23.10587  200.2890 1.856330  -9.548996      23.18032  
1 1 1 12 8  25 o 95.83343 5.877419  6.182777       0.7469356     1.137969       5.295733      6.285174       0.7544780     70.27586 30.49988  96.62489 5.887764  -26.34904      31.06297  
1 1 1 12 8  26 o 41.71911 9.498958  1.230884       0.5161870     -0.5282050E-01 4.118042      1.251376       0.5202906     58.80977 26.15473  42.06795 9.506194  16.74182       27.82872  
1 1 1 12 8  27 o 162.8591 6.832064  17.96211       1.479352      22.65445       6.327232      17.69077       1.521525      161.2631 30.56290  161.5231 7.086454  -0.2600250     31.37370  
1 1 1 12 8  28 o 32.77195 12.62890  0.5535533      0.7791707     2.534875       1.615716      -0.4685342E-01 0.8894271     57.51086 18.53974  28.68893 12.47480  28.82193       22.34598  
1 1 1 12 8  29 o 62.58267 10.75968  2.828902       0.8649392     5.868681       2.178740      2.260201       0.9423816     84.48639 19.71464  54.88215 13.07353  29.60424       23.65553  
1 1 1 12 8  30 o 37.91297 17.90124  -1.451975      2.368435      -1.558525      4.005058      -1.394675      2.937022      47.86822 22.79730  42.27327 19.95230  5.594948       30.29540  
1 1 1 12 8  31 o 31.51277 14.38387  -0.4312855     1.341857      -0.7624422     1.583082      0.4138124      2.528950      32.64402 15.15822  44.91284 20.19615  -12.26882      25.25186  
1 1 1 12 8  32 o 30.25866 13.92735  -0.4889546     1.293926      1.285734       1.568994      -4.261997      2.287736      43.38267 17.53670  29.48127 14.68076  13.90139       22.87052  
1 1 1 12 9  0  o 608.4231 40.77728  254.6786       32.71354      254.6786       32.71354      254.6786       32.71354      608.4231 40.77728  608.4231 40.77728  0.000000       0.000000  
1 1 1 12 9  1  o 421.1880 15.40525  119.0110       8.631494      118.0243       14.18909      119.5906       10.87511      416.9093 25.66551  421.3649 19.42098  -4.455627      32.18529  
1 1 1 12 9  2  o 296.4575 6.196542  58.60840       2.447853      61.44441       6.423059      58.12651       2.647667      302.3594 15.99902  295.2123 6.730624  7.147125       17.35713  
1 1 1 12 9  3  o 491.3796 7.149363  161.0636       4.681208      154.9808       7.434152      165.0602       6.025909      481.5434 11.58571  497.2550 9.094313  -15.71167      14.72872  
1 1 1 12 9  4  o 284.0100 7.726377  53.85588       2.921322      0.000000       0.000000      53.85588       2.921322      ?        ?         284.0100 7.726377  0.000000       7.726377  
1 1 1 12 9  5  o 165.9456 8.771222  18.43107       1.932655      18.72300       3.606283      18.31345       2.289134      166.3143 16.48947  165.2560 10.44888  1.058273       19.52131  
1 1 1 12 9  6  o 85.43169 8.393040  4.917368       0.9431380     7.484838       1.440172      2.989449       1.247976      105.3526 10.39404  65.54205 14.65735  39.81055       17.96869  
1 1 1 12 9  7  o 514.4545 14.43934  177.3247       9.888674      179.2092       17.00167      176.3613       12.15641      514.3755 24.87868  512.3032 17.83477  2.072327       30.61091  
1 1 1 12 9  8  o 229.3472 4.168652  35.05956       1.273980      34.05893       1.453045      38.38539       2.649058      226.0350 4.824250  239.6915 8.306577  -13.65646      9.605864  
1 1 1 12 9  9  o 504.1779 13.18260  170.1800       8.848827      180.9618       12.93422      160.6933       12.13248      518.6516 18.74588  488.7252 18.66424  29.92633       26.45302  
1 1 1 12 9  10 o 421.7703 10.25323  118.8311       5.762487      128.6172       7.431897      104.0783       9.125015      438.3004 12.73841  393.3717 17.45177  44.92874       21.60628  
1 1 1 12 9  11 o 248.8601 7.264863  41.35500       2.406528      41.76269       2.547047      37.96304       7.346871      250.0541 7.653161  235.8249 23.70073  14.22920       24.90573  
1 1 1 12 9  12 o 148.7414 10.53568  14.86094       2.074665      13.68345       2.995997      15.94580       2.875735      141.8855 16.13251  153.6126 14.21012  -11.72717      21.49850  
1 1 1 12 9  13 o 139.1809 11.39785  13.04580       2.095360      13.78948       2.198395      5.665378       6.925538      143.0880 11.63019  101.5444 37.99161  41.54355       39.73190  
1 1 1 12 9  14 o 355.9127 14.33787  85.17049       6.785969      88.35001       9.306580      81.56093       9.916004      361.1567 19.40972  346.2829 21.59731  14.87381       29.03758  
1 1 1 12 9  15 o 107.2632 6.761042  7.710890       0.9614409     7.553788       0.9847103     10.91765       4.448880      106.1376 7.001618  123.6923 27.68395  -17.55470      28.55563  
1 1 1 12 9  16 o 189.5468 6.030333  24.00555       1.521172      23.19752       1.664342      28.10529       3.748914      186.2618 6.716714  203.9373 13.87812  -17.67551      15.41806  
1 1 1 12 9  17 o 271.1489 7.684719  49.19669       2.773774      50.07679       3.573075      47.86192       4.400266      273.1924 9.831249  266.5140 12.42460  6.678345       15.84374  
1 1 1 12 9  18 o 114.7657 13.81226  9.015441       2.069863      8.927217       2.359161      9.310434       4.313920      113.6816 16.01722  112.8872 28.63820  0.7944412      32.81307  
1 1 1 12 9  19 o 343.1952 13.30768  79.72319       6.074256      77.73931       7.205403      84.59616       11.29272      337.6881 16.05888  347.1307 24.57242  -9.442596      29.35458  
1 1 1 12 9  20 o 256.9717 9.118721  44.39759       3.117481      45.99706       4.036606      42.03356       4.907450      260.8281 11.64353  248.1519 14.90982  12.67618       18.91757  
1 1 1 12 9  21 o 76.23431 4.154370  3.890756       0.4204215     0.1821203      2.373428      4.010893       0.4271767     48.83402 20.79225  77.40554 4.156788  -28.57152      21.20370  
1 1 1 12 9  22 o 45.86518 8.634036  1.459579       0.5083224     1.243271       5.078795      1.461767       0.5108877     71.98569 30.52336  45.89392 8.671738  26.09177       31.73128  
1 1 1 12 9  23 o 37.28598 11.38202  0.9477220      0.6172747     -1.714495      2.511574      1.118868       0.6368070     41.84401 19.31154  40.08927 11.38840  1.754742       22.41944  
1 1 1 12 9  24 o 205.2216 4.403519  28.15520       1.204194      23.24052       5.948303      28.36523       1.229655      175.2614 26.27944  205.9734 4.480213  -30.71199      26.65861  
1 1 1 12 9  25 o 20.16034 9.091701  -0.2566793     0.5167093     19.34445       8.600504      -0.3276854     0.5176443     140.6211 42.39466  19.58215 8.936530  121.0390       43.32631  
1 1 1 12 9  26 o 115.0193 2.142722  8.825485       0.3284053     8.285298       4.306264      8.828646       0.3293644     97.78835 30.10275  115.0395 2.148603  -17.25115      30.17934  
1 1 1 12 9  27 o 126.8166 8.198066  11.01337       1.377932      12.70668       2.607241      10.35710       1.623136      132.2213 15.06661  122.1308 10.06290  10.09057       18.11807  
1 1 1 12 9  28 o 149.6994 6.740508  15.26835       1.341130      8.351753       2.368574      18.53225       1.627080      103.8882 17.74671  164.5637 7.439192  -60.67548      19.24285  
1 1 1 12 9  29 o 16.52923 8.295535  -2.230297      0.7977729     -2.803387      0.9978327     -1.214958      1.328164      18.35335 9.220139  28.20493 13.34377  -9.851585      16.21934  
1 1 1 12 9  30 o 56.14164 13.05318  2.408403       0.9579498     4.430285       1.696017      1.461184       1.160853      73.35014 17.58130  44.38898 15.70777  28.96115       23.57618  
1 1 1 12 9  31 o 65.86800 17.85715  3.716928       1.606339      4.465169       1.824120      1.132613       3.390042      71.43961 18.88027  50.64714 23.01856  20.79246       29.77110  
1 1 1 12 9  32 o 34.11844 16.38585  -1.686678      2.164768      -1.685930      3.463341      -1.687157      2.773270      42.16457 20.36925  38.42612 18.47835  3.738449       27.50192  
1 1 1 12 10 0  o 97.30033 11.82567  6.591362       1.472968      6.591362       1.472968      6.591362       1.472968      97.30033 11.82567  97.30033 11.82567  0.000000       0.000000  
1 1 1 12 10 1  o 713.7407 20.59488  342.9724       19.56676      330.2946       39.54549      347.0824       22.51611      688.3007 43.33665  716.8441 23.60411  -28.54346      49.34793  
1 1 1 12 10 2  o 457.4680 7.757807  139.6245       4.729043      148.4706       9.612663      136.7999       5.431824      470.5505 15.35132  452.7093 9.004359  17.84128       17.79723  
1 1 1 12 10 3  f 414.3456 8.847329  114.5900       4.884819      111.2204       6.941546      117.8956       6.875285      407.6118 12.79600  419.7504 12.30538  -12.13864      17.75275  
1 1 1 12 10 4  o 515.3714 10.68371  177.4266       7.336959      176.5611       15.63133      177.6711       8.309137      511.1954 23.00647  515.5370 12.09546  -4.341644      25.99226  
1 1 1 12 10 5  o 411.3448 9.744263  112.9808       5.341073      114.2760       11.07919      112.5886       6.096235      411.7228 20.25653  410.3405 11.15956  1.382324       23.12710  
1 1 1 12 10 6  o 184.0264 6.356104  22.61134       1.556296      22.10900       2.218438      23.09813       2.183839      181.7555 9.189624  185.8167 8.845267  -4.061218      12.75492  
1 1 1 12 10 7  o 481.5642 19.72001  156.1806       12.62743      0.000000       0.000000      156.1806       12.62743      ?        ?         481.5642 19.72001  0.000000       19.72001  
1 1 1 12 10 8  o 299.2712 4.622260  59.70329       1.843287      60.61382       1.937634      51.03057       5.979995      301.5378 4.822325  275.3849 16.37010  26.15295       17.06561  
1 1 1 12 10 9  o 399.5137 8.272520  106.5274       4.403956      112.1435       5.499114      96.48405       7.353811      409.7382 10.07193  379.2469 14.57896  30.49130       17.71976  
1 1 1 12 10 10 o 229.0435 6.376999  35.01814       1.944397      37.47851       2.253152      27.84085       3.848315      236.9041 7.145640  203.3630 14.29221  33.54115       15.97897  
1 1 1 12 10 11 o 83.77139 13.52995  4.818458       1.458855      4.687199       1.787765      5.080062       2.523879      82.05103 16.91376  85.13435 22.06787  -3.083328      27.80406  
1 1 1 12 10 12 o 532.3795 11.58537  189.6676       8.218734      168.4151       11.29147      213.6135       11.98565      500.1350 16.96755  563.6563 15.97394  -63.52124      23.30375  
1 1 1 12 10 13 o 181.4993 14.53954  22.25857       3.487020      20.30751       4.275236      26.13602       6.026954      172.4501 18.91474  194.6905 23.72070  -22.24036      30.33873  
1 1 1 12 10 14 o 199.4590 4.329535  26.52765       1.150716      26.95565       1.179515      18.08240       5.239503      201.0588 4.402573  160.7793 25.29034  40.27954       25.67068  
1 1 1 12 10 15 o 664.6219 9.146735  295.5340       8.100546      290.7408       9.791836      305.9276       14.41901      658.5403 11.15856  673.2845 16.07175  -14.74426      19.56565  
1 1 1 12 10 16 o 93.17176 5.376451  5.812755       0.6646687     6.142502       0.6910887     1.745732       2.427068      95.78133 5.437092  59.00958 22.39983  36.77175       23.05026  
1 1 1 12 10 17 o 62.04926 8.341179  2.622969       0.6722115     2.359768       0.7125753     4.750742       2.026047      58.60847 9.445217  81.86604 18.94778  -23.25758      21.17145  
1 1 1 12 10 18 o 155.6753 14.71327  16.55968       3.015915      19.36380       3.567541      9.536450       5.645976      168.0440 16.12991  113.3623 34.38642  54.68168       37.98158  
1 1 1 12 10 19 o 100.9403 14.09967  7.036715       1.844803      6.167250       1.958834      13.85905       5.487037      93.83763 16.25411  136.0601 30.96326  -42.22243      34.97027  
1 1 1 12 10 20 o 111.9879 5.984760  8.410468       0.8898383     5.548698       2.292782      8.917963       0.9655201     87.81145 20.03830  115.2857 6.309152  -27.47425      21.00806  
1 1 1 12 10 21 o 281.9567 9.786359  53.62194       3.671286      53.40811       5.054947      53.86064       5.340802      279.8127 13.59809  280.6394 14.32928  -0.8266296     19.75440  
1 1 1 12 10 22 o 186.2452 7.519510  23.32376       1.862320      29.50360       6.152009      22.70032       1.954001      202.1619 23.26069  183.6231 8.005135  18.53879       24.59964  
1 1 1 12 10 23 o 178.4518 7.068677  21.42067       1.677539      20.45550       5.404292      21.52359       1.764710      165.5825 25.29472  178.7936 7.423244  -13.21111      26.36147  
1 1 1 12 10 24 o 36.00637 13.55820  0.6820996      0.8850520     2.280550       4.309831      0.6117229      0.9043256     69.66665 28.71891  35.47075 13.62184  34.19590       31.78569  
1 1 1 12 10 25 o 212.0011 5.234894  30.15030       1.478834      22.99731       6.629968      30.52481       1.517055      165.5603 31.19661  213.2178 5.343754  -47.65750      31.65098  
1 1 1 12 10 26 o 83.10702 6.473346  4.689867       0.7112189     5.970199       1.972703      4.498584       0.7624989     89.40909 17.18210  81.22451 7.116793  8.184578       18.59767  
1 1 1 12 10 27 o 90.22334 2.751065  5.445111       0.3303585     9.402040       2.140464      5.348554       0.3343650     113.3983 14.49643  89.41137 2.809920  23.98689       14.76625  
1 1 1 12 10 28 o 74.34975 10.70205  3.961469       1.029776      2.268354       1.450132      5.683807       1.462593      53.97565 17.57716  88.05469 12.84314  -34.07903      21.76931  
1 1 1 12 10 29 o 30.49446 13.43485  -0.6792934E-01 1.061912      -3.315592      4.695446      0.1071340      1.090157      47.80873 23.24158  32.06519 13.87751  15.74354       27.06947  
1 1 1 12 10 30 o 69.78533 13.82118  3.757492       1.239760      1.973004       1.925190      5.021817       1.620489      50.62271 19.75600  79.31455 15.88701  -28.69184      25.35146  
1 1 1 12 10 31 o 48.71159 17.39757  1.956255       1.427072      -4.511291      5.378676      2.446013       1.480119      45.90460 22.80088  53.31892 17.77650  -7.414326      28.91166  
1 1 1 12 10 32 o 33.01691 13.81370  0.4570589      1.018233      -0.1215325     3.302834      0.5178255      1.070368      44.91506 21.18676  34.00109 14.18960  10.91397       25.49948  
1 1 1 12 11 0  o 514.3452 19.53428  177.7861       13.34439      177.7861       13.34439      177.7861       13.34439      514.3452 19.53428  514.3452 19.53428  0.000000       0.000000  
1 1 1 12 11 1  o 381.7921 7.781730  97.25224       3.958919      96.57677       11.99014      97.33488       4.194136      377.5237 23.95812  381.9221 8.241272  -4.398438      25.33595  
1 1 1 12 11 2  o 181.6487 6.574414  22.03464       1.588715      29.03805       3.910986      20.65059       1.738626      207.8072 14.20932  175.7849 7.439333  32.02228       16.03897  
1 1 1 12 11 3  f 349.9721 13.12648  82.04314       6.110617      77.03629       9.123387      86.11650       8.229076      337.8234 20.36168  357.8698 17.30781  -20.04639      26.72374  
1 1 1 12 11 4  o 206.3843 5.304783  28.41641       1.457664      23.09978       3.706379      29.38922       1.585423      185.0937 15.16015  209.8699 5.674404  -24.77623      16.18731  
1 1 1 12 11 5  o 379.7119 9.723663  96.34045       4.915867      93.54372       6.809322      99.38466       7.104222      373.6219 13.70043  385.0981 13.86696  -11.47626      19.49344  
1 1 1 12 11 6  o 214.2491 6.059610  30.63493       1.728227      31.18483       2.333227      29.96653       2.572405      216.0209 8.120103  211.6665 9.141952  4.354431       12.22748  
1 1 1 12 11 7  o 288.5168 12.23495  55.76954       4.693101      71.15162       7.453635      45.66579       6.040900      325.1202 17.26676  260.2184 17.52386  64.90173       24.60136  
1 1 1 12 11 8  o 523.6957 11.98591  183.4243       8.364186      194.8418       14.25648      177.4315       10.32859      537.5883 19.93618  514.2813 15.08817  23.30701       25.00208  
1 1 1 12 11 9  o 514.8925 8.925487  177.0369       6.123815      179.7940       8.075182      173.3053       9.394551      518.4658 11.68850  508.4332 13.87954  10.03256       18.14559  
1 1 1 12 11 10 o 83.44326 15.72565  4.824742       1.684412      3.350088       2.293557      6.551395       2.481801      70.59763 22.00878  96.85005 19.89671  -26.25242      29.66927  
1 1 1 12 11 11 o 181.9865 8.978797  22.18024       2.170640      20.44270       2.699658      25.35773       3.650764      174.3717 11.68621  193.9073 14.22821  -19.53563      18.41221  
1 1 1 12 11 12 o 315.8808 6.668178  66.59348       2.806751      64.25568       3.409802      71.50610       4.942894      310.0362 8.260960  326.5980 11.37516  -16.56186      14.05837  
1 1 1 12 11 13 o 63.50769 11.11746  2.779621       0.9065602     2.868064       0.9292801     1.036947       4.124992      64.51787 11.21613  67.75222 28.02910  -3.234352      30.18994  
1 1 1 12 11 14 o 195.0230 4.365113  25.36500       1.134370      26.42440       1.203225      16.89535       3.402125      199.0463 4.536482  157.3421 16.47051  41.70419       17.08383  
1 1 1 12 11 15 o 149.3847 6.247082  14.92809       1.240787      15.71523       1.436044      12.60953       2.464629      153.1966 7.053624  136.1429 13.77506  17.05362       15.47598  
1 1 1 12 11 16 o 89.68074 3.210475  5.369084       0.3830370     8.357674       1.066896      4.926870       0.4103983     111.5735 7.214767  85.88055 3.594167  25.69293       8.060452  
1 1 1 12 11 17 o 179.6417 5.244743  21.56502       1.254122      22.91890       1.562674      19.11497       2.102160      185.0743 6.345879  168.5491 9.396986  16.52522       11.33903  
1 1 1 12 11 18 o 239.3885 8.796174  38.49471       2.801118      39.66497       3.738415      36.99668       4.229675      242.2782 11.61358  233.3364 13.66330  8.941727       17.93212  
1 1 1 12 11 19 o 320.0109 9.142582  68.86096       3.894590      72.83485       4.297670      50.60752       9.210799      328.8929 9.817286  265.3833 26.39613  63.50958       28.16265  
1 1 1 12 11 20 o 281.2102 8.629108  53.18009       3.229656      51.79231       5.005422      54.16996       4.227371      275.5923 13.67283  282.9109 11.23600  -7.318665      17.69728  
1 1 1 12 11 21 o 38.94754 17.22108  -0.4460559     1.759826      -0.5201212     2.620271      -0.3851939     2.375267      47.67212 21.04906  45.90487 20.16315  1.767242       29.14816  
1 1 1 12 11 22 o 71.43029 12.34536  3.570261       1.132570      2.161496       3.092398      3.788497       1.217137      64.10069 25.03204  73.48589 12.90009  -9.385208      28.16053  
1 1 1 12 11 23 o 64.96965 13.47076  3.005897       1.127897      4.354435       2.984898      2.781275       1.218216      76.68868 25.23255  62.15516 14.90197  14.53352       29.30444  
1 1 1 12 11 24 o 130.9226 7.701036  11.61471       1.337565      14.26099       5.266078      11.43222       1.382918      130.7893 30.73924  129.7902 8.035556  0.9990540      31.77217  
1 1 1 12 11 25 o 100.6444 7.677432  6.901882       1.021854      9.508785       2.101886      6.095034       1.169345      115.5632 13.93013  93.99332 9.464988  21.56986       16.84145  
1 1 1 12 11 26 o 141.3780 5.091765  13.46055       0.9576656     11.71282       3.243290      13.62749       1.002359      122.4534 20.60760  142.1902 5.299572  -19.73672      21.27813  
1 1 1 12 11 27 o 85.89606 7.032782  5.059498       0.7979177     1.259501       1.662844      6.196211       0.9094635     46.32747 18.27622  95.03472 7.236138  -48.70725      19.65660  
1 1 1 12 11 28 o 17.58250 8.684335  -1.553902      0.7406671     -3.306500      1.236103      -0.5721873     0.9251368     20.64881 10.35784  25.41537 11.72630  -4.766565      15.64580  
1 1 1 12 11 29 o 31.93375 14.53187  -0.4256189     1.356444      1.495313       3.834506      -0.7003810     1.450213      54.94667 24.77432  31.69219 14.64341  23.25448       28.77840  
1 1 1 12 11 30 o 37.04390 15.51846  0.5919021      1.287565      -2.292976      4.089730      0.9093032      1.356548      45.09684 21.86909  39.93032 16.24571  5.166515       27.24298  
1 1 1 12 11 31 o 41.66570 12.90713  1.349655       0.7902064     8.638124       6.714051      1.247277       0.7957369     67.75928 31.37828  40.25760 13.01373  27.50167       33.96989  
1 1 1 12 12 0  o 278.4020 4.372416  51.69037       1.621160      51.69037       1.621160      51.69037       1.621160      278.4020 4.372416  278.4020 4.372416  0.000000       0.000000  
1 1 1 12 12 1  o 313.5719 16.96569  66.15726       7.062556      70.94041       9.133600      59.04454       11.13790      323.8566 21.28283  293.4169 28.85995  30.43973       35.85882  
1 1 1 12 12 2  o 134.3589 12.11150  12.16747       2.145139      10.39542       3.543465      13.19259       2.695109      122.2766 22.57918  139.5872 14.71056  -17.31059      26.94847  
1 1 1 12 12 3  o 290.0243 7.965746  56.17189       3.075551      60.12756       5.943244      54.72517       3.594230      299.2170 14.95348  286.1273 9.439913  13.08969       17.68385  
1 1 1 12 12 4  f 454.1746 11.06115  137.8567       6.694167      143.2137       10.72441      134.4371       8.568364      461.5324 17.46958  447.8044 14.37803  13.72797       22.62552  
1 1 1 12 12 5  o 205.6861 8.806705  28.29584       2.408161      31.08481       5.305050      27.57199       2.702661      214.2173 18.77456  202.9168 10.02645  11.30048       21.28412  
1 1 1 12 12 6  o 103.5826 1.647469  7.149072       0.2273934     7.164835       0.2287951     5.874387       2.057454      103.6968 1.655800  92.03844 17.41359  11.65831       17.49213  
1 1 1 12 12 7  f 146.9123 9.486666  14.47669       1.847215      12.05846       4.764382      14.90452       2.003965      130.6529 28.19438  149.0051 10.15355  -18.35223      29.96694  
1 1 1 12 12 8  o 197.0390 8.897757  25.98204       2.330152      24.40444       2.823481      29.35116       4.126138      190.7025 11.15982  208.6571 14.93896  -17.95462      18.64709  
1 1 1 12 12 9  o 671.0576 4.454370  300.2270       3.983085      298.2121       4.093492      336.0762       17.26640      668.7880 4.593375  706.0439 18.36816  -37.25586      18.93379  
1 1 1 12 12 10 o 360.7419 8.236482  86.92029       3.959240      99.22546       5.810920      76.25817       5.409074      384.8371 11.34407  337.2010 12.05758  47.63614       16.55515  
1 1 1 12 12 11 o 32.74962 14.41677  -0.3401968     1.220518      -0.7977728     1.447941      0.7830046      2.268548      33.49451 15.15136  51.91603 21.05032  -18.42152      25.93607  
1 1 1 12 12 12 o 192.0953 9.809366  24.75883       2.502596      26.09679       3.353603      23.07741       3.759483      196.7459 12.86235  184.4685 15.43579  12.27740       20.09237  
1 1 1 12 12 13 o 106.5615 3.629124  7.579657       0.5145664     5.635900       1.110769      8.110771       0.5806264     91.30422 9.257571  110.2172 3.959863  -18.91302      10.06892  
1 1 1 12 12 14 o 245.4250 7.407187  40.30053       2.419626      40.05662       3.060696      40.70700       3.951050      244.3641 9.417226  245.8039 12.10005  -1.439819      15.33282  
1 1 1 12 12 15 o 177.7049 3.171572  21.05438       0.7510130     21.23339       0.7923333     19.47122       2.356362      178.4523 3.332056  170.0012 10.45253  8.451080       10.97078  
1 1 1 12 12 16 o 344.9022 5.572292  79.44839       2.560963      79.51246       3.036414      79.29052       4.766713      344.8722 6.607379  343.3690 10.43009  1.503174       12.34683  
1 1 1 12 12 17 o 191.3646 6.617113  24.52239       1.684805      25.60002       2.123625      22.69203       2.767652      195.2721 8.179502  183.1560 11.39656  12.11606       14.02804  
1 1 1 12 12 18 o 179.2696 6.767146  21.54019       1.613635      20.23858       1.702976      32.97810       5.048266      173.6626 7.375965  218.5329 17.48179  -44.87030      18.97414  
1 1 1 12 12 19 o 353.2004 9.735802  84.05456       4.577749      86.56023       5.840580      80.06352       7.371170      357.2541 12.28718  341.3191 16.25369  15.93500       20.37541  
1 1 1 12 12 20 o 48.09313 18.24118  1.199810       1.608740      1.380133       1.789079      0.4382037      3.676802      50.95148 19.25663  60.26166 25.77466  -9.310177      32.17376  
1 1 1 12 12 21 o 66.96559 20.19135  3.215780       1.950802      4.416728       2.697998      1.900024       2.824016      77.67731 23.81194  61.17094 23.91151  16.50637       33.74564  
1 1 1 12 12 22 o 130.2054 20.77220  12.38279       3.482982      12.38279       3.482982      0.000000       0.000000      130.2054 20.77220  ?        ?         0.000000       20.77220  
1 1 1 12 12 23 o 100.6247 11.85382  7.038332       1.558951      4.455793       3.232755      7.820890       1.779541      76.91087 26.27118  105.7538 12.89440  -28.84289      29.26500  
1 1 1 12 12 24 o 30.86018 11.82195  0.4693782      0.6799887     -0.4342911     1.634634      0.6584778      0.7477581     36.73814 16.39953  34.00505 12.52838  2.733089       20.63747  
1 1 1 12 12 25 o 90.30573 9.413592  5.651764       1.116165      3.255821       2.370713      6.334117       1.265159      65.08317 22.48793  95.38153 10.10788  -30.29836      24.65515  
1 1 1 12 12 26 o 104.1102 12.34424  7.776711       1.679215      9.743546       1.911788      1.136138       3.512842      116.5559 12.50453  56.29542 24.62945  60.26043       27.62197  
1 1 1 12 12 27 o 52.27808 12.82946  2.049220       0.8869367     0.4518232      1.618811      2.734430       1.060234      40.11942 17.12944  60.21571 13.54281  -20.09630      21.83633  
1 1 1 12 12 28 o 53.09782 7.471182  1.975846       0.5140163     5.413486       4.543167      1.931271       0.5173382     70.54920 29.32105  52.43169 7.628250  18.11752       30.29710  
1 1 1 12 12 29 o 88.80474 7.979288  5.524934       0.9341649     11.11969       4.160141      5.227848       0.9586466     98.91370 29.40742  86.10584 8.464405  12.80786       30.60135  
1 1 1 12 12 30 o 27.10443 11.68597  0.8827380E-01  0.7672435     7.018468       5.677608      -0.4063579E-01 0.7743465     67.61259 30.34384  26.14657 11.49758  41.46601       32.44909  
1 1 1 12 13 0  f 71.02619 26.28040  4.530091       2.305965      4.530091       2.305965      4.530091       2.305965      71.02619 26.28040  71.02619 26.28040  0.000000       0.000000  
1 1 1 12 13 1  o 469.0324 16.53500  147.8479       10.31812      150.4698       17.92535      146.5488       12.61816      469.0998 28.81574  465.9247 20.37314  3.175171       35.29039  
1 1 1 12 13 2  o 460.4059 10.72896  141.6833       6.582217      127.4689       9.162094      156.8452       9.462492      435.6031 15.81071  483.5157 14.70369  -47.91254      21.59113  
1 1 1 12 13 3  o 186.4707 16.40647  23.51917       4.035087      21.97326       4.473333      30.26946       9.347614      179.7250 18.96441  206.9855 35.14692  -27.26048      39.93688  
1 1 1 12 13 4  o 577.2728 20.72727  225.0791       15.91810      215.3668       21.95684      235.8390       23.11064      560.7846 29.48689  586.8090 29.65183  -26.02435      41.81755  
1 1 1 12 13 5  o 225.9597 8.189934  34.13130       2.461874      33.74406       3.099771      34.79285       4.051527      224.4440 10.39270  227.5104 13.42389  -3.066376      16.97672  
1 1 1 12 13 6  o 314.6540 5.980029  66.04048       2.507322      65.41126       3.338997      66.85403       3.796715      312.9062 8.014676  316.2267 9.019444  -3.320526      12.06588  
1 1 1 12 13 7  o 136.7917 8.939917  12.55404       1.620617      14.17292       3.656577      12.15830       1.807877      143.6349 19.61682  134.4701 10.16478  9.164841       22.09394  
1 1 1 12 13 8  o 355.8371 8.768616  84.60217       4.157725      82.26463       5.336959      88.21120       6.631465      350.3526 11.44718  362.3405 13.75970  -11.98795      17.89880  
1 1 1 12 13 9  o 348.5056 9.999990  81.31445       4.639098      80.90335       7.338303      81.58812       5.987285      346.3361 15.94377  348.5310 12.91418  -2.194916      20.51779  
1 1 1 12 13 10 o 299.7368 8.130588  60.07995       3.244399      61.56150       4.682074      58.71146       4.499892      302.8333 11.62434  295.7652 11.43935  7.068176       16.30901  
1 1 1 12 13 11 o 226.7330 6.593803  34.35437       1.990044      35.56768       2.305930      30.81355       3.939241      230.6028 7.514296  213.5816 13.91704  17.02113       15.81609  
1 1 1 12 13 12 o 257.5507 7.193272  44.35773       2.466251      42.86388       3.431848      45.95314       3.546593      252.6991 10.21284  261.6650 10.19115  -8.965897      14.42781  
1 1 1 12 13 13 o 121.3721 7.757127  9.891954       1.247999      10.96534       1.740853      8.757043       1.790049      127.4477 10.33950  113.5110 12.01687  13.93669       15.85277  
1 1 1 12 13 14 o 179.9491 5.974071  21.65295       1.430511      21.58233       1.753403      21.79350       2.473795      179.4890 7.346650  179.8831 10.36436  -0.3941193     12.70406  
1 1 1 12 13 15 o 448.0026 7.099325  134.2603       4.238099      134.8172       5.073895      132.9751       7.707989      448.5448 8.489110  443.5584 13.05538  4.986389       15.57267  
1 1 1 12 13 16 o 67.76299 6.340106  3.096940       0.5658362     3.093652       0.5752192     3.195282       3.145575      67.71188 6.453161  71.76359 25.80582  -4.051712      26.60044  
1 1 1 12 13 17 o 98.94826 7.047629  6.588366       0.9231502     7.043025       0.9541717     -0.6482852E-01 3.650048      102.3228 7.041028  58.58617 25.37428  43.73667       26.33306  
1 1 1 12 13 18 o 126.3594 6.445354  10.71437       1.081660      10.83360       1.132648      9.478738       3.646130      127.0238 6.715559  113.5379 24.79613  13.48587       25.68944  
1 1 1 12 13 19 o 141.3973 11.89973  13.64597       2.221297      14.32209       2.369326      8.736698       6.384416      144.7341 12.40465  106.7861 36.90345  37.94803       38.93251  
1 1 1 12 13 20 o 88.54534 17.60315  5.626581       2.003803      5.275000       2.083844      9.941304       7.300097      85.30573 18.83627  111.0295 39.38071  -25.72381      43.65370  
1 1 1 12 13 21 o 73.97170 21.73701  4.039745       2.283874      2.003163       2.772204      8.342221       4.029336      61.02158 23.73742  103.0609 28.42197  -42.03928      37.03071  
1 1 1 12 13 22 o 255.2970 12.60675  44.97395       4.275403      46.22421       4.500309      33.39496       13.69549      258.4690 13.10934  169.0028 53.92729  89.46622       55.49781  
1 1 1 12 13 23 o 61.35378 17.67713  2.786330       1.523796      2.733711       1.576364      3.536034       5.950202      60.82643 18.10668  78.01846 33.05797  -17.19203      37.69192  
1 1 1 12 13 24 o 114.5547 9.430172  9.048901       1.426745      4.552307       2.583601      11.02185       1.711360      75.22604 23.34426  126.1154 10.27245  -50.88932      25.50446  
1 1 1 12 13 25 o 59.64546 12.01561  2.584513       0.9219353     5.205423       1.540971      1.123380       1.150570      84.12309 14.25544  42.15407 15.53897  41.96902       21.08737  
1 1 1 12 13 26 o 93.37742 9.068123  6.095677       1.114130      10.17377       2.036131      4.352861       1.331076      118.0504 13.16783  76.56464 13.54204  41.48572       18.88859  
1 1 1 12 13 27 o 67.18289 9.735781  3.226528       0.8462018     -3.243561      1.630481      5.611684       0.9899634     25.73459 12.74232  89.61311 8.387844  -63.87851      15.25525  
1 1 1 12 13 28 o 58.47458 15.90948  2.752696       1.272357      -4.245062      4.675105      3.312474       1.322269      45.47477 22.33530  64.45417 15.57137  -18.97940      27.22743  
1 1 1 12 13 29 o 32.89841 10.57459  0.7799877      0.5258948     0.5709848      3.803550      0.7840611      0.5309948     50.17719 23.36608  32.98649 10.62787  17.19070       25.66954  
1 1 1 12 13 30 o 61.26653 16.01775  3.152384       1.322146      5.992387       5.813988      2.997506       1.357719      63.49355 29.33113  59.28418 16.55519  4.209377       33.68069  
1 1 1 12 14 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 12 14 1  o 453.6923 17.91628  138.8081       10.81006      155.1940       13.23640      105.9893       18.73253      478.7795 20.79687  388.8336 36.58411  89.94592       42.08215  
1 1 1 12 14 2  o 341.9206 6.718351  78.01025       3.060987      76.00883       3.263183      92.67538       8.833139      337.4634 7.256734  370.5411 17.94312  -33.07773      19.35499  
1 1 1 12 14 3  o 388.6904 13.38281  101.3967       6.921122      101.7500       7.761606      100.0252       15.29184      389.0057 15.00158  380.3559 30.42494  8.649811       33.92233  
1 1 1 12 14 4  o 298.0085 10.19264  59.45861       4.041560      58.35859       5.315117      60.96647       6.222884      294.6819 13.57231  300.8021 15.57828  -6.120270      20.66133  
1 1 1 12 14 5  o 51.83213 1.285890  1.790064       0.8881293E-01 -0.1347642E-02 0.4585199     1.859893       0.9052736E-01 21.51860 9.149640  52.83343 1.285871  -31.31483      9.239555  
1 1 1 12 14 6  o 393.0664 7.142249  103.1453       3.740885      98.91066       4.885700      109.1458       5.815863      384.6111 9.533041  403.6698 10.82197  -19.05872      14.42199  
1 1 1 12 14 7  o 304.3965 7.265828  61.87220       2.947123      65.17843       6.591981      61.04628       3.294732      310.6970 15.97593  302.1566 8.190592  8.540466       17.95317  
1 1 1 12 14 8  o 365.2298 7.903439  89.13074       3.846412      93.08680       5.242918      84.51969       5.660327      372.6775 10.56830  354.7950 11.98988  17.88248       15.98269  
1 1 1 12 14 9  o 205.9785 9.584522  28.45932       2.623454      28.40346       4.054807      28.49955       3.440636      204.7901 14.96218  205.6186 12.61826  -0.8284607     19.57261  
1 1 1 12 14 10 o 195.6100 7.339612  25.60514       1.909707      25.66169       2.293108      25.47715       3.449801      195.6371 8.818971  194.1312 13.41855  1.505905       16.05714  
1 1 1 12 14 11 o 248.0983 15.11168  41.73091       4.972164      39.26478       6.015764      47.04781       8.833061      239.4209 19.01226  259.3262 25.90822  -19.90535      32.13568  
1 1 1 12 14 12 f 263.1639 8.639774  46.42407       3.025612      48.61859       4.061990      43.68913       4.534644      268.7277 11.36934  254.1846 13.43586  14.54308       17.60069  
1 1 1 12 14 13 o 249.8521 8.820195  41.88543       2.931926      41.18472       3.127328      46.97284       8.426602      247.6127 9.495823  258.6391 24.75198  -11.02640      26.51097  
1 1 1 12 14 14 o 379.3073 6.692648  96.21471       3.382694      94.11105       4.206050      100.0672       5.691914      374.7317 8.423267  385.4236 11.09427  -10.69189      13.92962  
1 1 1 12 14 15 o 192.6513 6.170382  24.84036       1.581966      24.61102       1.804541      25.60180       3.288136      191.6218 7.079384  194.1603 12.78019  -2.538498      14.60996  
1 1 1 12 14 16 o 93.27551 2.838652  5.806802       0.3524095     5.510039       0.3633141     10.52903       1.449276      90.84867 3.005303  124.9223 8.761944  -34.07361      9.263019  
1 1 1 12 14 17 o 51.84889 13.95519  1.892395       0.9853033     1.546718       1.050244      4.431110       2.846176      47.70096 14.89657  78.70352 24.51439  -31.00256      28.68559  
1 1 1 12 14 18 o 185.6456 7.078535  23.13989       1.747854      22.97615       1.828313      24.87840       5.957437      184.9133 7.435245  184.9610 24.79567  -0.4768372E-01 25.88645  
1 1 1 12 14 19 o 76.15486 17.43413  4.182408       1.730914      4.871418       1.866667      -0.4445772E-01 4.623421      82.26231 17.56357  64.28954 28.18788  17.97278       33.21198  
1 1 1 12 14 20 o 47.22504 19.80191  0.4774590      2.099437      1.503530       2.169220      -14.70486      8.344186      54.12296 21.01343  58.60631 28.98374  -4.483349      35.79974  
1 1 1 12 14 21 o 57.89111 19.19147  2.344915       1.725680      1.176548       1.903184      7.746508       4.092154      49.58273 19.55491  97.80985 29.18731  -48.22712      35.13251  
1 1 1 12 14 22 o 123.9666 13.73165  10.83748       2.230309      9.434762       2.335995      25.29586       7.499742      114.6133 15.70834  169.9846 34.29455  -55.37125      37.72092  
1 1 1 12 14 23 o 65.89619 19.97523  3.331307       1.905669      3.398761       2.089379      2.997540       4.647692      66.44311 21.04738  70.39495 29.48640  -3.951843      36.22761  
1 1 1 12 14 24 o 78.80019 13.89432  4.547386       1.405645      5.666870       1.582437      0.3602746      3.060375      88.13715 13.93677  51.49734 22.74267  36.63981       26.67325  
1 1 1 12 14 25 o 38.46717 14.65100  0.8696048      1.040462      -0.6532938E-01 1.398785      2.027587       1.556723      35.06393 15.43472  52.08034 18.20945  -17.01641      23.87079  
1 1 1 12 14 26 f 54.25821 14.44097  2.268100       1.062411      -1.104155      3.475566      2.615682       1.115820      46.93803 22.01314  58.28335 14.44167  -11.34532      26.32755  
1 1 1 12 14 27 o ?        ?         -4.964220      1.338088      2.225530       3.404532      -6.277753      1.455195      56.57465 24.50455  ?        ?         0.000000       24.50455  
1 1 1 12 14 28 o 45.88521 13.20106  1.630997       0.8503943     2.368774       1.558585      1.318258       1.014750      53.09638 18.23830  42.01567 14.70100  11.08071       23.42552  
1 1 1 12 14 29 o 19.66121 9.629236  -1.458091      0.8499029     -2.256364      1.082941      -0.1779277     1.371393      20.75297 10.29478  32.74042 14.78398  -11.98745      18.01523  
1 1 1 12 15 0  o 242.5509 13.90514  39.73576       4.460123      39.73576       4.460123      39.73576       4.460123      242.5509 13.90514  242.5509 13.90514  0.000000       0.000000  
1 1 1 12 15 1  o 145.5261 5.977840  14.15459       1.156733      14.58160       1.536939      13.59672       1.756744      147.5432 7.845631  142.2977 9.316053  5.245544       12.17960  
1 1 1 12 15 2  o 181.0833 5.543778  21.89627       1.336121      21.96499       1.467873      21.56418       3.226770      181.3262 6.083726  178.6930 13.65491  2.633194       14.94885  
1 1 1 12 15 3  o 192.1993 1.166208  24.61348       0.2986766     24.63981       0.2996325     20.50582       3.742167      192.3021 1.169315  173.6849 16.36193  18.61716       16.40366  
1 1 1 12 15 4  o 164.0553 5.217042  17.97194       1.139031      18.06349       1.181026      16.75281       4.309717      164.4602 5.396516  155.6212 21.34471  8.838974       22.01633  
1 1 1 12 15 5  o 231.6372 4.059577  35.77654       1.253034      38.08133       1.418793      27.60565       2.671397      238.9630 4.455690  202.8437 9.913356  36.11931       10.86866  
1 1 1 12 15 6  o 136.2711 5.417853  12.41007       0.9818339     12.71773       1.337690      12.05075       1.445629      137.7828 7.312149  134.0217 8.133118  3.761047       10.93687  
1 1 1 12 15 7  o 59.05863 17.37464  2.401597       1.458456      0.9807234      3.226466      2.766481       1.635035      60.78418 24.93056  63.20680 18.34112  -2.422619      30.95044  
1 1 1 12 15 8  o 255.5084 8.160522  43.70707       2.774849      42.62515       3.404043      45.84987       4.790565      251.9882 10.15857  260.5403 13.84845  -8.552155      17.17486  
1 1 1 12 15 9  o 124.5111 10.21530  10.46458       1.679965      11.54664       2.290637      9.205106       2.471294      130.2577 13.38748  115.4557 16.53478  14.80204       21.27495  
1 1 1 12 15 10 f 182.1730 17.87136  22.78792       4.282488      24.66748       12.90879      22.55548       4.539577      174.2073 51.80421  180.8467 19.12737  -6.639435      55.22257  
1 1 1 12 15 11 o 239.8887 12.85633  38.91221       4.094597      40.22235       4.645500      34.35030       8.668584      243.4597 14.38373  217.9863 30.69184  25.47343       33.89514  
1 1 1 12 15 12 o 202.3927 12.25072  27.71871       3.288451      34.66090       5.205158      23.10732       4.242300      224.6929 17.52333  183.1832 17.59585  41.50972       24.83306  
1 1 1 12 15 13 o 152.0941 9.771604  15.60486       1.969916      13.09837       2.611649      18.91307       3.000396      138.2478 14.38717  166.5896 13.63548  -28.34178      19.82214  
1 1 1 12 15 14 o 70.11162 8.074850  3.338443       0.7406317     4.508007       0.8192786     -1.890901      1.732381      81.67963 7.615135  32.46793 15.32411  49.21171       17.11195  
1 1 1 12 15 15 o 326.9815 6.607286  71.56118       2.878855      78.09733       3.594343      59.86510       4.808159      341.2522 7.904430  297.2144 12.16619  44.03772       14.50848  
1 1 1 12 15 16 o 178.8546 3.843355  21.34930       0.9159760     21.31950       0.9564800     21.67896       3.181305      178.7157 4.016425  178.0388 13.51050  0.6768799      14.09486  
1 1 1 12 15 17 o 83.99428 2.555362  4.708802       0.2856737     4.701996       0.2862039     6.540570       4.695274      83.93311 2.561990  93.97589 31.66562  -10.04278      31.76909  
1 1 1 12 15 18 o 157.2877 8.759571  16.72099       1.828657      16.71665       1.863653      16.83339       9.480587      157.2227 8.932367  136.4720 44.97226  20.75073       45.85075  
1 1 1 12 15 19 o 24.59666 11.27282  -0.5620164     0.8353001     -0.6493068     0.8434503     3.889373       6.023155      24.21076 11.17982  83.25702 34.09567  -59.04626      35.88179  
1 1 1 12 15 20 o 166.6463 8.281498  18.81363       1.833222      19.20673       2.027261      17.05004       4.293975      168.1021 9.084051  151.4249 21.91750  16.67717       23.72544  
1 1 1 12 15 21 o 77.06145 15.79876  4.336926       1.567786      4.260346       1.653231      5.020844       4.940596      75.99354 16.77565  81.50092 31.69330  -5.507385      35.85928  
1 1 1 12 15 22 o 107.4915 11.52903  8.095066       1.625582      7.567890       1.671633      17.26974       6.973619      103.5217 12.36218  130.6602 37.86774  -27.13845      39.83453  
1 1 1 12 15 23 o 73.59346 11.58461  3.869062       1.098530      3.672394       1.120909      8.647223       5.525024      71.39996 12.22057  91.67994 34.00490  -20.27998      36.13413  
1 1 1 12 15 24 o 14.03764 6.958980  -1.134100      0.4917621     -1.172567      0.4931283     5.779459       6.610981      13.91158 6.908882  76.49581 33.61784  -62.58423      34.32043  
1 1 1 12 15 25 o 147.5589 12.96211  15.92769       2.522803      15.63548       2.609458      20.10940       9.871458      145.5351 13.61378  100.2536 42.53374  45.28149       44.65931  
1 1 1 12 15 26 o 82.97563 13.24478  5.164130       1.415224      5.518450       1.452194      -1.530066      6.312132      85.92245 13.09718  56.11113 27.20054  29.81133       30.18950  
1 1 1 12 15 27 o 35.23899 10.51303  0.9102285      0.5309588     0.5107905      0.5938058     2.503264       1.185857      29.48610 11.10499  55.75472 15.43554  -26.26862      19.01517  
1 1 1 12 15 28 o 25.47830 11.73967  -0.4801039     0.9228435     -3.264950      5.872578      -0.4095926     0.9344535     49.06653 24.27477  26.06972 11.93865  22.99681       27.05173  
1 1 1 12 16 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 12 16 1  o 332.6691 11.43788  74.33318       5.062734      75.74754       6.955169      72.73922       7.383595      334.6581 15.63996  327.4951 16.97754  7.163025       23.08344  
1 1 1 12 16 2  o 320.5068 9.387576  68.82484       4.004940      69.43026       4.447639      66.22979       9.208239      321.7137 10.38858  310.3631 22.41657  11.35065       24.70679  
1 1 1 12 16 3  o 499.3133 15.56875  168.4958       10.34593      168.4958       10.34593      0.000000       0.000000      499.3133 15.56875  ?        ?         0.000000       15.56875  
1 1 1 12 16 4  o 125.3670 1.208462  10.47239       0.2018783     10.45351       0.2028315     12.46730       2.084826      125.2538 1.215265  135.7824 11.63469  -10.52860      11.69799  
1 1 1 12 16 5  o 16.80930 7.554958  -0.1749217     0.3533972     -0.3296065     0.3576303     6.243568       2.303705      15.42831 7.177894  94.18995 19.01082  -78.76164      20.32076  
1 1 1 12 16 6  o 127.7089 5.645903  10.90927       0.9584141     11.91881       1.111189      7.976449       1.893962      133.4399 6.266770  108.0020 13.45101  25.43790       14.83921  
1 1 1 12 16 7  o 97.31224 15.84355  6.570191       1.983828      9.464758       2.900142      4.024682       2.719661      116.3073 19.39544  76.43439 23.98668  39.87287       30.84710  
1 1 1 12 16 8  o 200.1073 7.937711  26.83868       2.112366      26.34102       2.433325      28.36072       4.255440      198.0295 9.246928  203.9631 15.78003  -5.933594      18.28975  
1 1 1 12 16 9  o 282.3693 7.410911  53.37857       2.786038      54.23388       3.229486      50.88985       5.508868      284.4030 8.531334  273.6116 15.16901  10.79138       17.40352  
1 1 1 12 16 10 o 216.6962 10.48510  31.63564       3.018606      31.73185       3.291193      31.12593       7.575300      216.8006 11.43292  208.1329 28.02557  8.667725       30.26788  
1 1 1 12 16 11 o 168.0741 7.350031  18.94596       1.642147      18.89911       1.878775      19.09762       3.380070      167.6908 8.435070  166.9208 15.36885  0.7700195      17.53146  
1 1 1 12 16 12 o 157.0073 6.536030  16.51872       1.364447      16.26625       1.578802      17.26373       2.712086      155.6379 7.636015  159.2269 12.89262  -3.589081      14.98427  
1 1 1 12 16 13 o 111.7755 4.913133  8.360511       0.7299891     8.455978       0.7557868     7.033256       2.818045      112.3984 5.059183  98.56516 22.01278  13.83323       22.58668  
1 1 1 12 16 14 o 250.4415 5.683048  41.93697       1.896536      40.14642       2.176606      47.58260       3.864940      244.7819 6.679334  265.2764 10.95738  -20.49455      12.83268  
1 1 1 12 16 15 o 122.8188 4.397607  10.08653       0.7185439     9.849629       0.7318878     16.40615       3.780127      121.3522 4.534066  152.6052 18.99965  -31.25302      19.53317  
1 1 1 12 16 16 o 21.23616 8.264809  0.1875098      0.3361910     0.1621419      0.3402877     1.222093       2.173133      20.90757 8.261563  52.72643 20.86415  -31.81886      22.44028  
1 1 1 12 16 17 o 68.31749 4.051771  3.128482       0.3671938     3.114794       0.3702824     3.938757       2.848896      68.16286 4.095619  74.20201 24.66042  -6.039146      24.99821  
1 1 1 12 16 18 o 207.9681 7.615093  29.16074       2.106743      29.08538       2.296097      29.56192       5.297831      207.4612 8.322663  202.6620 19.87312  4.799164       21.54548  
1 1 1 12 16 19 o 98.78451 4.456225  6.542868       0.5850727     6.557301       0.5867659     4.052763       7.707064      98.89249 4.464258  86.17236 37.09414  12.72014       37.36181  
1 1 1 12 16 20 o 70.75587 4.528383  3.366941       0.4247110     3.316292       0.4284818     6.206707       3.208374      70.20822 4.605486  87.63901 25.76637  -17.43079      26.17473  
1 1 1 12 16 21 o 65.76166 4.996502  2.920366       0.4345599     2.932708       0.4358592     0.8595260      5.632162      65.90050 5.000785  66.90253 30.10724  -1.002037      30.51973  
1 1 1 12 16 22 o 69.57993 16.45348  3.681430       1.501372      3.613635       1.546273      4.798193       6.275753      68.68825 16.98927  77.08074 33.32818  -8.392494      37.40860  
1 1 1 12 16 23 o 106.1404 15.84554  8.492934       2.172570      9.544625       2.391743      3.530750       5.195255      112.0777 16.50877  68.74362 30.01651  43.33403       34.25683  
1 1 1 12 16 24 o 22.64568 9.362272  0.1292558      0.4598027     0.1145981      0.4610590     2.807812       6.232679      22.48759 9.342931  65.96811 30.43669  -43.48051      31.83838  
1 1 1 12 16 25 o 34.14020 7.156893  0.8283980      0.3151591     0.8509718      0.3156849     -5.931121      5.462735      34.63045 7.080206  47.25719 23.38555  -12.62674      24.43385  
1 1 1 12 16 26 o 52.08538 19.68317  2.184525       1.869103      -4.348506      4.320770      3.688492       2.073112      43.35645 21.32999  63.81609 21.02998  -20.45964      29.95377  
1 1 1 12 16 27 o 38.29175 18.70992  -3.115768      3.153427      -0.2716717E-01 4.244467      -6.920976      4.711199      49.92278 23.68758  40.79143 20.42716  9.131351       31.27891  
1 1 1 12 17 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 12 17 1  o 298.9574 14.36430  60.49437       5.705514      60.49437       5.705514      0.000000       0.000000      298.9574 14.36430  ?        ?         0.000000       14.36430  
1 1 1 12 17 2  o 206.7314 16.86917  29.19963       4.606646      30.60009       4.811108      13.76554       15.97167      211.5540 17.21541  143.2268 56.59844  68.32716       59.15871  
1 1 1 12 17 3  o 251.8930 5.435814  42.35990       1.824543      42.29778       2.153793      42.51778       3.433561      251.5251 6.431399  251.5051 10.26688  0.2000427E-01  12.11494  
1 1 1 12 17 4  o 212.4278 3.904782  30.09767       1.105304      29.98623       1.120141      34.22053       6.813477      212.0307 3.964610  221.2890 23.46369  -9.258270      23.79627  
1 1 1 12 17 5  o 400.3607 6.145467  107.0890       3.278536      109.2447       3.794818      100.7442       6.510503      404.1951 7.045737  386.3956 12.66181  17.79950       14.49013  
1 1 1 12 17 6  f 98.06991 3.409130  6.421323       0.4448278     6.641181       0.4754663     4.878444       1.259549      99.72591 3.583809  84.39150 11.49950  15.33441       12.04500  
1 1 1 12 17 7  o 113.0591 11.17237  8.682558       1.661175      6.843756       2.643527      9.882488       2.135474      97.91832 20.89707  120.1777 13.57229  -22.25941      24.91776  
1 1 1 12 17 8  o 151.7645 7.252959  15.44891       1.462514      15.94711       2.034432      14.91609       2.103932      153.7443 9.984497  148.5302 10.70201  5.214111       14.63636  
1 1 1 12 17 9  o 112.2094 15.69578  8.728639       2.282742      8.797564       4.142673      8.698585       2.735511      109.0315 28.27787  111.0012 19.18819  -1.969704      34.17344  
1 1 1 12 17 10 o 106.9887 14.71747  7.920154       2.042652      11.10350       3.272531      5.888303       2.614496      125.2371 20.30468  90.23159 21.95637  35.00551       29.90589  
1 1 1 12 17 11 o 297.8450 15.69065  60.73517       6.205406      49.70954       9.427698      69.16335       8.242725      262.2611 27.38014  315.4954 19.70507  -53.23431      33.73370  
1 1 1 12 17 12 o 72.37673 22.12800  3.712850       2.331880      2.794959       4.193598      4.123694       2.805626      74.10927 29.08832  76.46429 24.40913  -2.355026      37.97283  
1 1 1 12 17 13 o 160.7303 10.59178  17.51227       2.255863      14.20353       3.564502      19.72292       2.913577      141.7756 19.37424  169.9129 12.96640  -28.13733      23.31284  
1 1 1 12 17 14 o 170.3024 8.382383  19.54625       1.896379      19.09477       2.272566      20.58155       3.441336      167.8575 10.20847  172.6063 15.11461  -4.748856      18.23909  
1 1 1 12 17 15 o 127.3246 8.258625  10.95350       1.393619      11.25039       1.542152      9.631139       3.254607      128.8707 9.037780  114.5949 22.11487  14.27584       23.89035  
1 1 1 12 17 16 o 83.32932 10.41760  4.779618       1.131546      5.217426       1.219198      2.059030       3.039231      87.03140 10.74059  62.91570 24.74256  24.11570       26.97322  
1 1 1 12 17 17 o 146.3850 3.214093  14.30593       0.6269436     14.26485       0.6383331     15.42626       3.333727      146.1688 3.277323  147.0530 17.34649  -0.8842468     17.65337  
1 1 1 12 17 18 o 91.28442 9.162403  5.712737       1.099445      5.866784       1.132472      3.186583       4.585972      92.47480 9.317203  73.55179 29.89034  18.92301       31.30882  
1 1 1 12 17 19 o 57.39342 11.67435  2.351621       0.8623990     2.403814       0.8759560     0.7044989      4.920845      58.02497 11.73282  64.73060 28.70023  -6.705631      31.00584  
1 1 1 12 17 20 o 94.42455 12.96246  6.363152       1.587971      6.197705       1.762268      7.077611       3.662111      92.25636 14.83823  90.30673 27.75299  1.949631       31.47065  
1 1 1 12 17 21 o 97.35508 13.11054  6.836987       1.657606      6.770763       1.720580      7.692312       6.183497      96.50980 13.76915  86.05795 34.80448  10.45185       37.42915  
1 1 1 12 17 22 o 51.30320 21.02537  1.487313       2.292540      1.515926       2.647265      1.401490       4.584727      53.21206 22.26889  60.53741 27.20994  -7.325352      35.16084  
1 1 1 12 17 23 o 42.09821 20.21035  -2.665069      3.285933      -1.678966      4.234151      -4.158237      5.210261      49.79399 23.63584  49.67547 24.22356  0.1185150      33.84426  
1 1 1 12 17 24 o 57.06355 26.89327  0.3380337      5.300131      -5.951195      6.582327      11.93409       8.937906      51.40099 25.47762  81.33507 37.12419  -29.93408      45.02571  
1 1 1 12 17 25 o 107.3952 35.04834  15.83952       5.764041      15.06445       10.17735      16.20553       6.993854      79.34251 37.35394  96.72665 37.68160  -17.38414      53.05864  
1 1 1 12 17 26 o 55.00460 24.89811  2.140100       3.917783      -0.9321942     6.767587      3.688700       4.804763      54.55554 26.81087  60.46312 27.44991  -5.907581      38.37082  
1 1 1 12 18 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 12 18 1  o 314.4239 13.62209  66.98487       5.693787      66.36199       6.175726      70.51492       14.70201      312.4560 14.87561  307.5049 36.59708  4.951141       39.50481  
1 1 1 12 18 2  o 340.2351 14.30823  78.56116       6.472439      86.96922       9.043109      69.73000       9.267850      355.4737 19.16219  316.5022 22.11412  38.97153       29.26130  
1 1 1 12 18 3  o 454.2155 10.32686  138.6894       6.250342      137.5095       10.14832      139.4105       7.933670      448.5818 17.00852  453.9730 13.12886  -5.391205      21.48620  
1 1 1 12 18 4  o 329.4117 2.503551  72.33620       1.098927      69.85857       3.395726      72.62603       1.161427      322.9450 7.890974  330.0610 2.640732  -7.116028      8.321114  
1 1 1 12 18 5  o 167.9589 7.283153  18.91877       1.626157      20.68780       2.053567      15.94438       2.662818      175.3911 8.814999  152.9789 13.19154  22.41222       15.86571  
1 1 1 12 18 6  o 36.91591 7.509077  0.9455197      0.3567909     1.036844       0.3744624     0.4587559E-01  1.175307      38.69420 7.533618  34.51889 14.66195  4.175316       16.48418  
1 1 1 12 18 7  o 42.18512 5.575112  1.209672       0.3057265     1.132882       0.3115633     3.201766       1.586902      40.74890 5.910243  67.11751 17.54883  -26.36861      18.51735  
1 1 1 12 18 8  o 86.66232 10.16582  5.122202       1.151649      3.398986       1.458607      7.974656       1.876626      69.20132 16.11899  107.6727 13.36661  -38.47140      20.94011  
1 1 1 12 18 9  o 155.0689 13.75130  16.45749       2.812034      13.44664       4.093929      19.14687       3.869213      136.6370 23.32166  165.9519 17.77365  -29.31487      29.32239  
1 1 1 12 18 10 o 77.91516 16.18522  4.306166       1.625430      1.728901       4.554050      4.682419       1.740037      71.30292 29.46992  81.21252 16.63899  -9.909607      33.84275  
1 1 1 12 18 11 o 317.7682 16.66609  69.67425       7.032292      82.55972       10.45736      59.03665       9.501534      340.6386 23.17657  286.2048 25.17013  54.43381       34.21533  
1 1 1 12 18 12 o 129.0247 15.33272  11.57460       2.584630      11.62362       4.703590      11.55340       3.093540      123.3189 29.09679  127.6324 18.74790  -4.313515      34.61368  
1 1 1 12 18 13 o 188.0682 11.64011  24.11237       2.902768      28.75121       4.145000      19.64780       4.066397      203.7617 15.37965  166.7265 18.62096  37.03516       24.15106  
1 1 1 12 18 14 o 55.45384 15.07792  2.195099       1.143257      2.535699       1.200074      -1.148547      3.760071      59.47248 15.11411  54.43251 24.53847  5.039970       28.81966  
1 1 1 12 18 15 o 250.7665 8.677099  42.53192       2.895095      40.62567       3.239958      50.08355       6.448662      244.4936 9.965738  265.4806 18.34176  -20.98701      20.87430  
1 1 1 12 18 16 o 66.27828 7.238981  2.993625       0.6289431     3.252474       0.6487401     -1.054428      2.565495      69.13467 7.144917  44.14294 20.04754  24.99172       21.28271  
1 1 1 12 18 17 o 138.9290 3.851454  12.91729       0.7123148     13.01313       0.7217067     9.306658       4.429758      139.4379 3.888038  104.7005 30.13151  34.73744       30.38132  
1 1 1 12 18 18 o 25.77080 10.92013  0.5716540E-01  0.6493381     -0.6504571E-01 0.6537224     9.076836       5.616081      24.69455 10.71674  98.14048 34.56548  -73.44593      36.18868  
1 1 1 12 18 19 o 34.96240 12.17426  0.7867578      0.6954269     0.6477167      0.7118325     3.699352       3.257963      33.28636 12.23052  69.15140 26.01862  -35.86504      28.74986  
1 1 1 12 18 20 o 108.0289 6.546134  7.941161       0.9378979     7.769811       0.9725703     10.21663       3.544169      106.7387 6.874496  109.1563 24.91684  -2.417587      25.84778  
1 1 1 12 18 21 o 92.23912 18.67320  6.767284       2.216295      8.043557       2.413473      -0.9995330E-01 5.598370      100.7839 18.65823  59.75008 27.99502  41.03378       33.64299  
1 1 1 12 18 22 o 98.75986 19.95688  8.048621       2.535846      8.508534       2.731544      5.179572       6.822430      100.4961 21.07226  71.71128 32.61649  28.78486       38.83137  
1 1 1 12 18 23 o 64.45353 28.23310  3.678653       4.628494      3.159491       5.035004      6.509893       11.75810      63.31966 28.48309  71.65519 35.23918  -8.335533      45.31099  
1 1 1 12 18 24 o 43.87812 20.03021  -0.3643814E-01 2.603043      -1.861673      4.413547      0.9371060      3.223341      48.15887 23.19736  50.42388 22.72657  -2.265007      32.47483  
1 1 1 12 18 25 f 51.86454 20.19689  2.230471       2.008594      1.173081       2.440180      4.452307       3.537206      47.21538 20.59477  63.81575 26.13074  -16.60037      33.27101  
1 1 1 12 19 0  o 90.44636 46.25724  8.875986       7.046367      8.875986       7.046367      8.875986       7.046367      90.44636 46.25724  90.44636 46.25724  0.000000       0.000000  
1 1 1 12 19 1  o 169.0409 12.09266  19.40158       2.705881      14.74445       3.728959      24.58111       3.932539      144.8450 19.84108  189.2181 15.73923  -44.37311      25.32571  
1 1 1 12 19 2  o 383.3016 8.729119  98.61475       4.458457      96.48020       6.860713      100.1752       5.865931      376.8751 13.68421  385.1399 11.44265  -8.264801      17.83794  
1 1 1 12 19 3  o 169.0501 3.256080  19.06033       0.7334728     19.10054       0.7632179     18.57450       2.653134      169.2211 3.384702  165.3444 12.12627  3.876770       12.58978  
1 1 1 12 19 4  o 126.2459 1.589207  10.62158       0.2673446     10.73490       0.2729736     7.958570       1.323282      126.9171 1.614087  108.4431 9.245587  18.47395       9.385423  
1 1 1 12 19 5  o 98.89326 4.933269  6.548503       0.6480397     6.476243       0.6617637     8.236666       3.198601      98.33119 5.067639  106.4026 23.21413  -8.071396      23.76083  
1 1 1 12 19 6  o 286.1830 11.75213  55.46507       4.472075      56.90676       6.897651      54.41956       5.873917      286.7150 18.14727  281.6836 15.71148  5.031403       24.00363  
1 1 1 12 19 7  o 87.15857 1.341717  5.062341       0.1558276     5.049000       0.1560632     9.471804       2.837243      87.04359 1.345520  115.5544 19.09240  -28.51085      19.13975  
1 1 1 12 19 8  o 208.6042 3.727589  29.04039       1.036155      29.10422       1.080942      28.31775       3.637285      208.8185 3.884723  203.5674 13.48499  5.251175       14.03339  
1 1 1 12 19 9  o 75.52731 22.86704  4.113795       2.498427      4.517457       2.845774      2.756403       5.218474      79.02130 24.49647  78.14054 31.83659  0.8807602      40.17021  
1 1 1 12 19 10 o 145.2607 21.27127  15.17144       3.995329      16.41971       5.421586      13.68787       5.910519      147.1256 28.68534  131.2029 33.64846  15.92273       44.21614  
1 1 1 12 19 11 o 84.31030 14.97020  5.025270       1.620224      2.884114       3.975516      5.451746       1.774261      72.29684 28.33828  87.64765 15.77146  -15.35081      32.43142  
1 1 1 12 19 12 o 155.9808 12.61140  16.73612       2.598912      15.33575       5.756030      17.09470       2.912712      138.3946 31.87094  157.0603 14.06615  -18.66574      34.83696  
1 1 1 12 19 13 o 123.0515 14.03931  10.57576       2.260866      10.60531       2.994316      10.53658       3.448205      120.9011 19.22967  118.7376 22.61944  2.163521       29.68871  
1 1 1 12 19 14 o 95.44810 13.76503  6.423995       1.700191      6.777063       1.760063      1.497719       6.574437      98.04506 13.85779  76.09637 33.48065  21.94869       36.23523  
1 1 1 12 19 15 o 75.61274 10.38477  3.974531       1.018712      3.924788       1.032408      5.812091       6.274882      75.06078 10.61815  87.45261 35.16946  -12.39182      36.73740  
1 1 1 12 19 16 o 22.98666 10.48051  -0.4190376     0.7098515     -0.4650553     0.7285621     0.4425254      3.152448      23.03758 10.54693  54.00363 23.48398  -30.96605      25.74364  
1 1 1 12 19 17 o 96.71410 6.116942  6.331656       0.7842725     6.425297       0.7981886     3.716184       4.218387      97.41332 6.181005  71.86855 28.85903  25.54477       29.51353  
1 1 1 12 19 18 o 70.94904 7.183966  3.452067       0.6698295     3.428962       0.6847995     3.963280       3.221121      70.65311 7.382583  69.95244 25.96093  0.7006683      26.99023  
1 1 1 12 19 19 o 36.52039 13.83223  0.7670401      0.9242690     1.133829       0.9606377     -3.803783      3.391161      40.87900 14.30363  41.23787 19.97789  -0.3588753     24.57051  
1 1 1 12 19 20 o 40.52020 15.16988  1.038744       1.104551      0.8269302      1.182699      2.484502       3.089901      39.14841 15.42283  59.18907 24.34980  -20.04066      28.82320  
1 1 1 12 19 21 o 71.11894 22.29693  4.476483       2.350553      4.800414       2.915887      3.875352       3.972187      71.58781 24.92878  65.91481 27.40764  5.673004       37.04892  
1 1 1 12 19 22 o 60.04336 22.89124  3.122232       2.541560      2.603388       3.418964      3.763077       3.799730      58.55251 24.94349  63.95000 26.71503  -5.397499      36.54956  
1 1 1 12 19 23 o 62.63418 26.52641  3.877013       3.828089      1.907372       4.871752      7.055930       6.189154      57.62698 26.70101  70.95299 31.77453  -13.32601      41.50380  
1 1 1 12 19 24 o 46.06913 19.64966  1.217789       2.126331      2.081993       2.510293      -0.9769716     4.000460      51.93234 21.70579  47.24336 22.57816  4.688980       31.31956  
1 1 1 12 20 0  o 149.9131 30.83269  17.37873       5.441065      17.37873       5.441065      17.37873       5.441065      149.9131 30.83269  149.9131 30.83269  0.000000       0.000000  
1 1 1 12 20 1  o 400.4109 8.443374  107.7030       4.505007      94.33992       9.899236      111.1934       5.059263      367.1368 20.31405  406.4749 9.340711  -39.33813      22.35866  
1 1 1 12 20 2  o 209.6313 7.964614  29.53799       2.220771      29.99479       2.855690      28.83903       3.532444      210.6599 10.20350  205.6550 12.95613  5.004959       16.49159  
1 1 1 12 20 3  o 145.7688 1.506148  14.16088       0.2925539     14.28455       0.2951372     7.189274       2.215996      146.4037 1.512859  100.8845 17.09404  45.51921       17.16085  
1 1 1 12 20 4  o 168.2410 7.235616  19.01378       1.618320      21.07031       2.282968      16.93664       2.294375      176.5510 9.741881  157.9141 10.97183  18.63686       14.67261  
1 1 1 12 20 5  o 96.01436 6.017354  6.194190       0.7659954     6.296062       0.8003535     5.083503       2.642706      96.77334 6.239841  83.21866 23.04393  13.55468       23.87380  
1 1 1 12 20 6  o 150.1764 10.88866  15.33817       2.164161      17.69922       4.202887      14.48627       2.524578      157.5633 20.50379  145.2333 13.18882  12.32994       24.37931  
1 1 1 12 20 7  o 304.3984 6.089386  62.05678       2.469957      61.19054       2.723898      66.06354       5.858262      302.0822 6.766939  310.2146 14.20980  -8.132416      15.73880  
1 1 1 12 20 8  o 183.3551 5.204118  22.50781       1.270206      22.79047       1.403314      21.22631       2.988037      184.4118 5.717649  175.8997 12.83652  8.512100       14.05232  
1 1 1 12 20 9  o 152.4869 0.8350038 15.49379       0.1696658     15.49117       0.1697817     17.40594       4.592584      152.4740 0.8356447 153.8466 23.11657  -1.372650      23.13166  
1 1 1 12 20 10 o 137.6576 13.76225  13.16314       2.490623      14.39301       5.155952      12.78881       2.844514      135.0597 29.47858  134.6386 16.17869  0.4211121      33.62643  
1 1 1 12 20 11 o 115.2221 19.93213  9.737496       2.949575      2.076052       6.210787      11.96869       3.351662      77.05978 33.23642  127.7551 20.37200  -50.69536      38.98304  
1 1 1 12 20 12 o 63.42149 13.96900  2.893086       1.148567      4.723798       1.428547      -0.4540411     1.931614      81.60958 13.61593  40.29824 17.91798  41.31134       22.50439  
1 1 1 12 20 13 o 55.01456 22.53028  1.288410       2.630097      2.003024       3.669779      0.5336973      3.771337      64.32964 26.50794  58.85302 25.63813  5.476620       36.87797  
1 1 1 12 20 14 o 53.33817 15.86411  2.069158       1.210475      2.078483       1.242286      1.894037       5.383471      53.48133 16.10991  70.27343 30.62213  -16.79210      34.60122  
1 1 1 12 20 15 o 109.0669 9.093703  8.183870       1.309607      8.275046       1.353474      6.845292       5.185989      109.5754 9.359165  87.18246 32.82156  22.39293       34.12988  
1 1 1 12 20 16 o 37.67093 12.55102  0.9641985      0.7378632     1.003516       0.7536942     0.5766200E-01  3.619072      38.30543 12.68255  54.09718 24.25634  -15.79176      27.37183  
1 1 1 12 20 17 o 131.9783 5.797862  11.78976       1.017145      11.97139       1.031846      5.551182       6.047337      132.9787 5.837387  77.74046 33.14734  55.23827       33.65741  
1 1 1 12 20 18 o 26.02299 12.27369  -1.047390      1.107795      -0.8295117     1.181595      -2.629926      3.184478      28.14344 13.07774  42.08263 20.12063  -13.93919      23.99723  
1 1 1 12 20 19 o 63.00670 14.61172  3.036131       1.202896      2.720974       1.245193      7.440075       4.654727      59.16326 15.58179  82.10904 31.05441  -22.94578      34.74433  
1 1 1 12 20 20 o 40.90123 15.31403  1.094618       1.125699      0.7732034      1.161870      6.017086       4.546906      38.20073 15.21073  74.24127 29.90933  -36.04055      33.55494  
1 1 1 12 20 21 o 63.04324 22.79058  3.613966       2.457353      5.162245       3.433607      1.988286       3.518387      70.60757 26.67908  55.95963 24.56102  14.64794       36.26316  
1 1 1 12 20 22 f 35.81625 16.37201  -0.4064250     1.746695      -0.1575094     1.834922      -2.809693      5.701547      37.71470 17.05874  50.71628 24.85979  -13.00158      30.14979  
1 1 1 12 20 23 o 42.48301 17.87290  0.9620806      1.719203      0.7506965      1.879079      2.048125       4.259244      42.21627 18.24516  55.44247 25.42663  -13.22621      31.29536  
1 1 1 12 21 0  o 80.95736 17.00690  4.974385       1.615590      4.974385       1.615590      4.974385       1.615590      80.95736 17.00690  80.95736 17.00690  0.000000       0.000000  
1 1 1 12 21 1  o 70.75891 20.26329  3.636824       2.008087      3.253514       3.519720      3.821801       2.445068      72.25298 27.07354  72.74050 22.73132  -0.4875259     35.35095  
1 1 1 12 21 2  o 37.17387 11.75067  0.9287008      0.6515573     1.150395       0.6645841     -4.560635      3.306985      40.65017 11.66231  41.56306 20.03525  -0.9128914     23.18234  
1 1 1 12 21 3  o 317.6268 11.42704  68.65653       4.828545      69.58519       6.955758      67.79282       6.708159      316.1546 16.56876  312.3637 16.17150  3.790833       23.15257  
1 1 1 12 21 4  o 275.4990 11.68952  51.75922       4.281561      50.51429       5.599430      53.51179       6.643693      269.7238 15.64658  275.7052 18.18541  -5.981384      23.99009  
1 1 1 12 21 5  o 91.55561 5.138974  5.626803       0.6244365     5.658120       0.6326779     4.448151       3.881362      91.80362 5.193067  79.59135 28.65982  12.21227       29.12651  
1 1 1 12 21 6  o 236.7121 12.02847  38.36698       3.781623      51.32157       8.876571      35.49442       4.179918      261.9272 25.76579  226.6276 13.90844  35.29964       29.28004  
1 1 1 12 21 7  o 47.33041 17.49121  1.302788       1.459417      2.375450       1.677314      -2.039883      2.960942      58.23927 18.89943  44.70590 20.74934  13.53337       28.06641  
1 1 1 12 21 8  o 145.2546 12.59978  14.59962       2.414646      16.77467       2.901678      9.701760       4.354300      155.0144 14.20542  109.6100 29.26377  45.40442       32.52941  
1 1 1 12 21 9  f 40.48707 14.21899  1.028966       0.9498723     1.075962       0.9596183     -1.249533      6.681793      41.10780 14.30180  69.56012 31.88101  -28.45232      34.94195  
1 1 1 12 21 10 o 140.9357 10.01592  13.60949       1.868728      13.03571       2.087480      15.92476       4.193266      137.3118 11.51479  145.1664 22.39737  -7.854584      25.18397  
1 1 1 12 21 11 o 166.8065 9.624590  19.04351       2.130202      17.98754       2.566915      21.37946       3.817846      160.8905 12.06091  172.2401 16.84984  -11.34958      20.72155  
1 1 1 12 21 12 o 234.4565 11.02024  37.98632       3.433284      39.23681       5.204577      37.02293       4.568219      232.7804 16.89395  227.8924 15.12897  4.888000       22.67799  
1 1 1 12 21 13 o 158.5421 12.54602  17.69138       2.628884      10.63641       4.892943      20.55441       3.116994      107.1141 31.90399  169.9586 13.88407  -62.84453      34.79414  
1 1 1 12 21 14 o 142.1324 9.181267  13.92637       1.729576      14.12124       1.853066      12.60879       4.818503      142.7979 9.797959  116.7986 30.59928  25.99924       32.12968  
1 1 1 12 21 15 o 29.88995 13.41881  -0.3540820     1.111359      0.7908165E-01  1.177281      -3.900216      3.368462      33.59588 14.48013  41.12822 19.92148  -7.532341      24.62802  
1 1 1 12 21 16 o 88.31348 10.62984  5.532091       1.225792      5.984587       1.306304      2.196990       3.546427      91.75855 10.89626  60.05339 25.48682  31.70516       27.71835  
1 1 1 12 21 17 o 16.12488 8.114603  -2.349195      0.7903748     -2.519050      0.7957082     10.19408       6.837866      15.79800 7.974075  87.40705 36.11704  -71.60905      36.98684  
1 1 1 12 21 18 o 48.78775 8.966376  1.700884       0.5614358     1.748336       0.5656241     -1.467809      4.622119      49.50150 8.902302  51.91272 24.65696  -2.411217      26.21482  
1 1 1 12 21 19 o 32.32799 15.08952  -0.9906822     1.601182      -2.499331      2.661109      -0.1345322     2.004673      37.48779 18.04593  39.91282 17.96167  -2.425030      25.46129  
1 1 1 12 21 20 o 35.87816 12.15517  0.9112428      0.6918628     0.8566533      0.6993790     3.410125       4.731845      35.16300 12.21090  62.14266 27.80941  -26.97966      30.37218  
1 1 1 12 21 21 o 116.5321 6.157999  9.319099       0.9528276     9.643602       0.9727815     1.651659       4.728588      118.5364 6.180060  56.06139 26.08825  62.47497       26.81026  
1 1 1 12 22 0  o 209.3806 13.93244  30.15078       3.847115      30.15078       3.847115      30.15078       3.847115      209.3806 13.93244  209.3806 13.93244  0.000000       0.000000  
1 1 1 12 22 1  o 60.89101 10.30830  2.587903       0.8065866     2.268940       0.8261890     9.071357       3.724881      56.68582 11.33422  107.6075 26.22137  -50.92171      28.56614  
1 1 1 12 22 2  o 247.4101 7.447484  41.28027       2.452482      42.12112       2.795496      38.47078       5.109913      249.5027 8.420402  233.3841 16.53831  16.11858       18.55852  
1 1 1 12 22 3  o 70.59478 5.023943  3.354453       0.4695085     3.377298       0.4713645     0.4705983      5.295923      70.83559 5.026459  67.77168 29.92422  3.063911       30.34343  
1 1 1 12 22 4  o 130.2903 6.502722  11.44034       1.125398      11.66120       1.236793      10.37731       2.713392      131.4049 7.089618  119.9231 17.49504  11.48184       18.87694  
1 1 1 12 22 5  o 132.9766 11.49648  12.21161       2.017119      12.61243       3.057204      11.90261       2.684309      132.0353 17.83184  129.2356 15.92386  2.799728       23.90698  
1 1 1 12 22 6  o 39.17192 17.10541  -0.1267014     1.687409      4.933213       5.188491      -0.7251848     1.784414      82.30026 32.33968  37.25031 16.83804  45.04995       36.46059  
1 1 1 12 22 7  o 185.8492 9.523858  23.59439       2.350696      22.04012       3.896920      24.48344       2.947301      175.0530 16.91676  188.0896 11.81918  -13.03659      20.63661  
1 1 1 12 22 8  o 158.0268 8.977608  17.04981       1.882672      17.68070       2.357701      15.93965       3.127530      159.9084 11.13436  148.9469 16.00883  10.96155       19.50017  
1 1 1 12 22 9  o 78.43178 13.76601  4.429473       1.386259      4.778560       1.580097      3.262777       2.888661      80.91597 15.21298  67.00259 24.63473  13.91338       28.95349  
1 1 1 12 22 10 o 90.65119 12.17201  5.817975       1.433189      4.503753       1.657942      9.703517       2.850761      77.70167 16.52178  112.8766 19.66768  -35.17496      25.68632  
1 1 1 12 22 11 o 93.37189 1.517663  5.813326       0.1888274     5.805515       0.1890289     9.471500       4.090770      93.30901 1.520307  103.0799 28.71837  -9.770866      28.75858  
1 1 1 12 22 12 o 78.63972 5.040387  4.177149       0.5253960     4.233796       0.5374076     2.952250       2.498984      79.15569 5.122555  62.42337 22.91936  16.73232       23.48484  
1 1 1 12 22 13 o 143.3077 12.64614  14.69951       2.390157      14.74100       2.611562      14.48548       5.931629      142.4795 13.93333  115.4377 35.29176  27.04182       37.94267  
1 1 1 12 22 14 o 41.24361 14.83054  1.133524       1.038902      0.1941096      1.212303      3.730936       2.015825      34.62747 14.80507  67.32383 20.57205  -32.69636      25.34560  
1 1 1 12 22 15 o 63.57953 25.45490  3.274461       3.271770      -2.744396      6.117079      5.686242       3.872184      56.20074 27.13044  76.03914 28.41624  -19.83840      39.28795  
1 1 1 12 22 16 o 126.8688 12.86188  11.76011       2.144354      12.14618       2.195230      3.719479       10.01834      128.8637 12.96008  71.34134 34.50787  57.52240       36.86131  
1 1 1 12 22 17 o 96.03623 7.872081  6.403142       0.9985577     6.868234       1.014265      -8.264648      5.695933      99.56557 7.704757  45.80340 22.86478  53.76217       24.12802  
1 1 1 12 22 18 f 94.22655 5.740257  6.060650       0.7173197     5.985213       0.7202424     15.29943       7.970624      93.61192 5.802487  90.16905 38.23606  3.442863       38.67384  
1 1 1 12 22 19 o 103.9697 3.483823  7.270646       0.4819728     7.236092       0.4826550     19.46895       9.068460      103.7183 3.497273  91.03362 39.70499  12.68465       39.85871  
1 1 1 12 22 20 o 64.57547 10.72203  3.071570       0.8902674     2.942924       0.9104826     5.872515       4.248410      62.87104 11.28251  69.22099 28.52217  -6.349949      30.67261  
1 1 1 12 23 0  o 73.44234 34.58052  6.007608       3.810582      6.007608       3.810582      6.007608       3.810582      73.44234 34.58052  73.44234 34.58052  0.000000       0.000000  
1 1 1 12 23 1  o 104.7314 8.486069  7.497946       1.174151      7.851266       1.261840      5.217640       3.205655      107.0433 8.927717  80.47574 26.12855  26.56752       27.61169  
1 1 1 12 23 2  o 102.9102 3.198482  7.082957       0.4380749     7.139339       0.4398996     0.3291337      4.814591      103.3193 3.199058  62.98983 28.12965  40.32950       28.31098  
1 1 1 12 23 3  o 39.17212 6.307190  1.059129       0.3180440     1.046561       0.3181939     14.38548       10.36157      38.92439 6.353729  110.0395 44.85043  -71.11509      45.29824  
1 1 1 12 23 4  o 104.7238 6.768089  7.434811       0.9394053     7.688645       0.9627252     2.384830       4.294099      106.4894 6.820424  67.36478 28.28799  39.12467       29.09860  
1 1 1 12 23 5  o 47.11221 17.65899  1.344859       1.497699      1.573237       1.895094      0.9649121      2.444360      51.40042 19.72431  51.24385 21.41849  0.1565628      29.11701  
1 1 1 12 23 6  o 133.0882 8.489600  12.12069       1.497718      11.04025       2.103947      13.23069       2.132527      124.9067 12.82271  137.4539 11.75572  -12.54721      17.39594  
1 1 1 12 23 7  o 103.9717 11.45542  7.602196       1.560812      7.263007       1.859947      8.409717       2.869833      100.1539 14.34584  103.1319 21.57715  -2.977997      25.91093  
1 1 1 12 23 8  o 150.5217 10.80099  15.80766       2.151985      16.34044       2.731055      14.93509       3.495097      151.0072 13.72217  139.7625 19.28008  11.24471       23.66473  
1 1 1 12 23 9  o 166.0784 9.434793  19.07063       2.079356      20.22826       2.855029      17.76291       3.034474      168.5271 12.80951  156.2526 14.74863  12.27446       19.53473  
1 1 1 12 23 10 o 30.58872 12.66647  0.2618130      0.8434859     0.2356316      0.8613203     0.8744686      4.166548      30.60008 12.74627  58.43812 26.12756  -27.83803      29.07089  
1 1 1 12 23 11 o 59.00695 16.41518  2.689554       1.337599      2.396812       1.488240      3.919955       3.051081      55.73448 17.77609  68.01102 25.26151  -12.27654      30.88905  
1 1 1 12 23 12 f 64.61190 15.79023  3.220540       1.347782      3.070222       1.487950      3.907510       3.180908      62.40493 17.29538  67.35320 25.62561  -4.948265      30.91604  
1 1 1 12 23 13 o 78.64137 1.307317  4.124036       0.1369953     4.131211       0.1371113     -0.1123779     3.331833      78.70975 1.307287  49.75474 22.69313  28.95501       22.73075  
1 1 1 12 23 14 o 54.94331 21.86808  2.174427       2.400491      3.130339       2.670704      -1.845357      5.476688      61.31017 23.44326  54.63336 26.19223  6.676811       35.15137  
1 1 1 12 23 15 o 62.90018 18.97486  3.297832       1.722516      2.658711       2.642708      3.769922       2.271275      57.83080 22.96841  65.37020 22.02380  -7.539406      31.82130  
1 1 1 12 23 16 o 36.53593 14.67492  0.6820024      1.091073      1.083796       1.107971      -12.18992      6.271173      40.40802 15.17967  43.75944 22.12303  -3.351418      26.83003  
1 1 1 12 23 17 o 27.62512 12.44761  -0.2742589     0.9662271     -0.2425035     0.9715602     -3.143040      9.234414      27.90656 12.53596  58.29185 29.10114  -30.38530      31.68638  
1 1 1 12 23 18 o 46.26598 12.66921  1.644647       0.8038400     1.678415       0.8065440     -3.366299      9.825007      46.73749 12.64606  57.85335 29.04556  -11.11586      31.67913  
1 1 1 12 24 0  o 21.21507 14.70054  -1.077079      1.434453      -1.077079      1.434453      -1.077079      1.434453      21.21507 14.70054  21.21507 14.70054  0.000000       0.000000  
1 1 1 12 24 1  f 154.2734 10.06630  16.52151       2.058051      16.28643       2.178591      18.47119       6.274165      152.7242 10.77434  136.6363 34.46842  16.08795       36.11314  
1 1 1 12 24 2  o 49.98600 6.872978  1.724367       0.4456840     1.698500       0.4458869     30.14004       14.77846      49.58721 6.937695  120.4573 51.60096  -70.87006      52.06526  
1 1 1 12 24 3  o 50.84118 9.438541  1.832929       0.6158962     1.852829       0.6232067     0.9996127      4.032840      51.10442 9.501293  58.95058 26.06734  -7.846161      27.74492  
1 1 1 12 24 4  o 94.76782 4.857168  6.055217       0.6113169     6.120497       0.6153799     1.160521       5.328629      95.27719 4.863174  64.17626 29.04466  31.10093       29.44899  
1 1 1 12 24 5  o 99.06036 11.57268  6.974433       1.498843      6.622277       1.619485      9.077376       3.957518      95.71661 13.03589  98.91013 28.48480  -3.193520      31.32600  
1 1 1 12 24 6  o 89.53470 10.36339  5.649060       1.213619      6.060401       1.328449      3.573541       2.984057      92.46622 10.99689  66.36475 24.91561  26.10148       27.23453  
1 1 1 12 24 7  o 59.96739 13.78363  2.686984       1.078319      1.548641       1.484281      3.959319       1.569208      47.78579 17.64313  71.53542 16.75761  -23.74962      24.33305  
1 1 1 12 24 8  o 137.0698 9.960656  13.15266       1.806881      13.32149       2.240560      12.83864       3.055705      136.1090 12.49290  128.4230 18.37990  7.685974       22.22371  
1 1 1 12 24 9  o 91.51425 16.40576  6.423506       1.927102      6.201605       2.791252      6.625616       2.663875      83.78314 23.85684  87.86810 22.61826  -4.084961      32.87453  
1 1 1 12 24 10 o 39.08960 17.43035  -0.1344795     1.841378      -0.4493277     2.234369      0.5320172      3.250898      41.15020 18.69653  51.58796 23.07082  -10.43776      29.69550  
1 1 1 12 24 11 o 57.86842 22.69418  2.567259       2.550707      3.597578       2.896271      -0.9940476     5.384657      64.48414 24.47139  56.16310 26.65769  8.321037       36.18676  
1 1 1 12 24 12 f 61.47300 28.32530  1.772517       5.372580      8.512098       9.306311      -1.596481      6.579781      77.01347 36.08699  58.05480 28.05304  18.95867       45.70825  
1 1 1 12 24 13 o 31.17713 15.00302  -2.049005      1.835701      -1.425526      2.102000      -4.052621      3.768159      35.79487 16.88996  41.78040 20.42266  -5.985531      26.50200  
1 1 1 12 24 14 o 97.88551 1.775922  6.396686       0.2316412     6.401178       0.2321952     5.458660       3.355485      97.91947 1.779552  72.37505 26.56068  25.54442       26.62023  
1 1 1 12 24 15 o 37.46223 17.15100  -0.4333365     1.926712      -1.276343      2.046266      6.155128       5.720562      35.35928 16.67837  69.58076 30.89251  -34.22147      35.10719  
1 1 1 12 24 16 o 30.88233 13.91989  -0.2584650     1.209458      -0.6872264E-01 1.388439      -0.8553861     2.462652      33.97556 15.14368  39.92025 18.65965  -5.944698      24.03151  
1 1 1 12 25 0  f 43.01586 25.79283  1.860964       2.647436      1.860964       2.647436      1.860964       2.647436      43.01586 25.79283  43.01586 25.79283  0.000000       0.000000  
1 1 1 12 25 1  f 90.61933 6.095368  5.590504       0.7317467     5.536158       0.7331842     19.40927       11.69131      90.16208 6.139233  98.89170 44.01955  -8.729622      44.44560  
1 1 1 12 25 2  o 103.1307 10.59286  7.526878       1.435037      7.526878       1.435037      0.000000       0.000000      103.1307 10.59286  ?        ?         0.000000       10.59286  
1 1 1 12 25 3  o 59.46123 7.847868  2.462672       0.6066455     2.513682       0.6083916     -6.385481      8.012791      60.10554 7.778405  57.99681 28.63048  2.108730       29.66830  
1 1 1 12 25 4  o 64.29312 4.261545  2.790177       0.3630339     2.813215       0.3636360     -4.148896      6.310820      64.56128 4.250539  55.08973 26.81811  9.471546       27.15287  
1 1 1 12 25 5  o 97.03294 12.18392  6.813465       1.540717      7.086932       1.623993      4.350274       4.873940      98.69685 12.63791  70.07549 29.81460  28.62136       32.38251  
1 1 1 12 25 6  o 131.8812 12.41907  12.57839       2.156764      12.90727       2.529009      11.70130       4.129977      131.6277 14.66772  110.4737 28.01831  21.15404       31.62543  
1 1 1 12 25 7  o 116.5417 14.31999  10.11836       2.177117      9.795520       5.714657      10.17317       2.354691      88.70818 34.19693  115.7002 15.67595  -26.99198      37.61869  
1 1 1 12 25 8  o 76.40182 20.40788  4.937597       2.116999      6.736108       3.225603      3.576701       2.805865      83.64325 26.10417  64.07832 24.13815  19.56493       35.55387  
1 1 1 12 25 9  o 119.8631 11.96970  10.42752       1.886259      13.76585       4.726820      9.795212       2.057153      114.2243 30.48726  114.7037 13.73163  -0.4794464     33.43696  
1 1 1 12 25 10 o 77.28324 17.93961  4.878993       1.811809      5.857929       1.997064      0.3247753      4.307463      84.65894 18.24161  53.93565 25.03086  30.72329       30.97257  
1 1 1 12 25 11 o 58.19358 21.40820  2.895762       2.182041      2.988080       2.428260      2.508540       4.973162      58.87321 22.39188  60.75180 27.71502  -1.878590      35.63030  
1 1 1 12 25 12 o 27.14614 12.93575  -1.302946      1.293280      -1.583683      1.338460      2.646076       5.019959      26.69000 12.83533  60.48839 27.68959  -33.79839      30.51982  
1 1 1 12 25 13 o 38.48096 16.88242  0.2640235      1.660764      0.7333821      1.933506      -1.056536      3.243188      43.04528 18.55493  44.40343 20.96036  -1.358147      27.99325  
1 1 1 12 26 0  o 134.1150 14.05170  12.99629       2.442219      12.99629       2.442219      12.99629       2.442219      134.1150 14.05170  134.1150 14.05170  0.000000       0.000000  
1 1 1 12 26 1  o 15.02430 7.543741  -1.891841      0.6635314     -1.892795      0.6691549     -1.835750      5.128821      15.12936 7.593606  53.02652 25.40190  -37.89716      26.51262  
1 1 1 12 26 2  o 145.5379 1.949901  14.14240       0.3781482     14.14828       0.3786820     12.06004       7.124393      145.5677 1.952253  89.17432 36.85842  56.39342       36.91009  
1 1 1 12 26 3  o 47.58817 16.82802  1.683718       1.332144      1.915896       1.353089      -5.642278      7.600626      49.92278 16.99755  55.37091 27.43341  -5.448139      32.27241  
1 1 1 12 26 4  o 58.66909 19.61460  2.858984       1.801829      3.074246       1.879042      0.3999861      6.350846      60.44128 20.02572  60.20486 28.68242  0.2364197      34.98158  
1 1 1 12 26 5  o 68.97485 12.68684  3.552063       1.123096      3.304155       1.190651      5.552605       3.382312      65.71475 14.02449  73.95373 26.73754  -8.238976      30.19242  
1 1 1 12 26 6  o 49.43130 22.11954  0.6817610      2.993118      17.39868       16.90622      0.1408307      3.041158      77.35942 38.73301  47.73641 21.73705  29.62301       44.41560  
1 1 1 12 26 7  f 35.26995 16.94228  -2.187665      2.316932      -5.573195      8.037713      -1.880860      2.419639      55.21036 27.49704  36.99492 17.64696  18.21545       32.67266  
1 1 1 12 26 8  o 33.54573 15.54154  -0.7775958     1.649863      -2.808570      2.185045      1.916076       2.516404      32.38327 15.76799  52.50776 21.82222  -20.12449      26.92283  
1 1 1 12 26 9  o 113.1493 14.06892  9.729568       2.075537      8.844337       3.427047      10.24235       2.608301      93.20096 26.39998  111.8967 18.11163  -18.69571      32.01547  
1 1 1 12 26 10 o 33.79823 15.21334  -0.2233054     1.439034      -0.3894128E-01 1.524839      -1.724537      4.351207      35.65393 15.88232  48.27705 23.19747  -12.62313      28.11353  
1 1 1 12 27 0  o 66.17564 28.83651  5.023085       2.637967      5.023085       2.637967      5.023085       2.637967      66.17564 28.83651  66.17564 28.83651  0.000000       0.000000  
1 1 1 12 27 1  o 63.57052 6.455545  2.790974       0.5392670     2.780383       0.5409777     4.457724       6.786361      63.43641 6.491239  66.34403 30.99924  -2.907627      31.67158  
1 1 1 12 27 2  o 76.15118 2.476449  3.883099       0.2509583     3.860603       0.2547842     4.615304       1.453602      75.92300 2.521904  77.16362 14.67318  -1.240616      14.88832  
1 1 1 12 27 3  o 31.89099 12.32917  0.5638001      0.7443645     0.4846961      0.8231751     0.9185862      1.743317      31.90637 12.77014  43.11797 18.05975  -11.21160      22.11857  
1 1 1 12 27 4  o 58.24816 13.77758  2.624930       1.052507      3.598449       1.711782      2.033170       1.334593      65.02447 18.73615  50.50609 16.88087  14.51838       25.21918  
1 1 1 13 0  1  f 188.3599 11.76670  23.95628       2.926638      23.95628       2.926638      23.95628       2.926638      188.3599 11.76670  188.3599 11.76670  0.000000       0.000000  
1 1 1 13 0  2  o 317.4331 10.91286  67.47647       4.603603      67.47647       4.603603      67.47647       4.603603      317.4331 10.91286  317.4331 10.91286  0.000000       0.000000  
1 1 1 13 0  3  o 149.5363 15.39410  15.41002       2.986534      15.41002       2.986534      15.41002       2.986534      149.5363 15.39410  149.5363 15.39410  0.000000       0.000000  
1 1 1 13 0  4  o 241.1968 40.16654  42.52526       11.83440      42.52526       11.83440      42.52526       11.83440      241.1968 40.16654  241.1968 40.16654  0.000000       0.000000  
1 1 1 13 0  5  o 742.9988 24.46200  371.8368       24.15932      371.8368       24.15932      371.8368       24.15932      742.9988 24.46200  742.9988 24.46200  0.000000       0.000000  
1 1 1 13 0  6  o 525.1200 34.85265  188.9182       24.13738      188.9182       24.13738      188.9182       24.13738      525.1200 34.85265  525.1200 34.85265  0.000000       0.000000  
1 1 1 13 0  7  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 13 0  8  o 455.8334 20.80358  140.0289       12.57611      140.0289       12.57611      140.0289       12.57611      455.8334 20.80358  455.8334 20.80358  0.000000       0.000000  
1 1 1 13 0  9  o 175.0582 4.518695  20.46356       1.052482      20.46356       1.052482      20.46356       1.052482      175.0582 4.518695  175.0582 4.518695  0.000000       0.000000  
1 1 1 13 0  10 o 50.34027 8.892813  1.839585       0.5409705     1.839585       0.5409705     1.839585       0.5409705     50.34027 8.892813  50.34027 8.892813  0.000000       0.000000  
1 1 1 13 0  11 o 62.86357 11.09122  2.869281       0.8427460     2.869281       0.8427460     2.869281       0.8427460     62.86357 11.09122  62.86357 11.09122  0.000000       0.000000  
1 1 1 13 0  12 o 549.2636 32.92691  205.7124       23.89909      205.7124       23.89909      205.7124       23.89909      549.2636 32.92691  549.2636 32.92691  0.000000       0.000000  
1 1 1 13 0  13 o 124.7048 8.500312  10.51396       1.397199      10.51396       1.397199      10.51396       1.397199      124.7048 8.500312  124.7048 8.500312  0.000000       0.000000  
1 1 1 13 0  14 o 405.1237 9.851639  109.6839       5.311156      109.6839       5.311156      109.6839       5.311156      405.1237 9.851639  405.1237 9.851639  0.000000       0.000000  
1 1 1 13 0  15 f 567.8370 12.05410  215.5800       9.111508      215.5800       9.111508      215.5800       9.111508      567.8370 12.05410  567.8370 12.05410  0.000000       0.000000  
1 1 1 13 0  16 o 100.3681 4.399265  6.752538       0.5857895     6.752538       0.5857895     6.752538       0.5857895     100.3681 4.399265  100.3681 4.399265  0.000000       0.000000  
1 1 1 13 0  17 o 393.9948 8.750473  103.7363       4.588933      103.7363       4.588933      103.7363       4.588933      393.9948 8.750473  393.9948 8.750473  0.000000       0.000000  
1 1 1 13 0  18 o 146.8351 8.469127  14.53245       1.644354      14.53245       1.644354      14.53245       1.644354      146.8351 8.469127  146.8351 8.469127  0.000000       0.000000  
1 1 1 13 0  19 o 82.24302 31.50325  6.243060       3.259430      6.243060       3.259430      6.243060       3.259430      82.24302 31.50325  82.24302 31.50325  0.000000       0.000000  
1 1 1 13 0  20 o 85.37389 9.104123  5.033031       1.006066      5.033031       1.006066      5.033031       1.006066      85.37389 9.104123  85.37389 9.104123  0.000000       0.000000  
1 1 1 13 0  21 o 180.1239 5.827418  21.71478       1.395370      21.71478       1.395370      21.71478       1.395370      180.1239 5.827418  180.1239 5.827418  0.000000       0.000000  
1 1 1 13 0  22 o 47.83325 19.78283  2.168352       1.252082      2.168352       1.252082      2.168352       1.252082      47.83325 19.78283  47.83325 19.78283  0.000000       0.000000  
1 1 1 13 0  23 o 349.9518 11.71027  82.49512       5.446833      82.49512       5.446833      82.49512       5.446833      349.9518 11.71027  349.9518 11.71027  0.000000       0.000000  
1 1 1 13 0  24 o 242.4109 11.46438  39.74446       3.684242      39.74446       3.684242      39.74446       3.684242      242.4109 11.46438  242.4109 11.46438  0.000000       0.000000  
1 1 1 13 0  25 o 34.56757 20.98902  0.8121181      1.798740      0.8121181      1.798740      0.8121181      1.798740      34.56757 20.98902  34.56757 20.98902  0.000000       0.000000  
1 1 1 13 0  26 f 198.7638 23.24659  28.67833       5.936996      28.67833       5.936996      28.67833       5.936996      198.7638 23.24659  198.7638 23.24659  0.000000       0.000000  
1 1 1 13 0  27 o 91.64593 40.13607  9.253016       5.108548      9.253016       5.108548      9.253016       5.108548      91.64593 40.13607  91.64593 40.13607  0.000000       0.000000  
1 1 1 13 0  28 o 31.27764 21.97775  -3.182469      3.532714      -3.182469      3.532714      -3.182469      3.532714      31.27764 21.97775  31.27764 21.97775  0.000000       0.000000  
1 1 1 13 0  29 o 26.76963 19.39670  -6.461141      3.722671      -6.461141      3.722671      -6.461141      3.722671      26.76963 19.39670  26.76963 19.39670  0.000000       0.000000  
1 1 1 13 0  30 o 49.65778 29.44392  2.933776       3.377784      2.933776       3.377784      2.933776       3.377784      49.65778 29.44392  49.65778 29.44392  0.000000       0.000000  
1 1 1 13 0  31 o 70.55498 40.62110  8.593632       6.123776      8.593632       6.123776      8.593632       6.123776      70.55498 40.62110  70.55498 40.62110  0.000000       0.000000  
1 1 1 13 0  32 o 65.32110 36.25486  6.854409       4.647194      6.854409       4.647194      6.854409       4.647194      65.32110 36.25486  65.32110 36.25486  0.000000       0.000000  
1 1 1 13 0  33 o 41.53252 28.59851  0.5063944      5.223040      0.5063944      5.223040      0.5063944      5.223040      41.53252 28.59851  41.53252 28.59851  0.000000       0.000000  
1 1 1 13 1  0  o 238.8061 18.95587  38.88264       5.942006      38.88264       5.942006      38.88264       5.942006      238.8061 18.95587  238.8061 18.95587  0.000000       0.000000  
1 1 1 13 1  1  o 452.4085 3.664560  136.4136       2.209154      136.4745       2.261127      135.1353       10.36322      452.5056 3.749968  448.2652 17.38241  4.240448       17.78231  
1 1 1 13 1  2  o 655.7259 13.26060  287.7890       11.58668      300.0103       16.92235      277.0029       15.89769      667.6255 19.04136  641.6397 18.61352  25.98584       26.62774  
1 1 1 13 1  3  o 188.8024 11.16383  23.90939       2.796091      21.37204       3.689857      27.33143       4.285112      177.8479 15.73203  201.2272 16.11553  -23.37929      22.52126  
1 1 1 13 1  4  o 639.1158 13.63195  273.4631       11.60944      287.1377       19.39055      265.8224       14.49438      651.8871 22.35565  628.9650 17.31063  22.92206       28.27425  
1 1 1 13 1  5  o 364.8943 7.467006  88.83883       3.630673      86.22280       4.546619      93.44284       6.031649      359.1964 9.507473  373.5952 12.13214  -14.39880      15.41366  
1 1 1 13 1  6  o 1298.858 34.13598  1157.897       59.02975      1182.765       69.45106      1093.181       112.0391      1305.689 39.96477  1206.980 69.96184  98.70874       80.57196  
1 1 1 13 1  7  o 603.0031 22.61054  245.6620       18.13569      258.9298       28.48811      236.6209       23.51651      613.2457 35.00770  588.6584 30.08003  24.58728       46.15569  
1 1 1 13 1  8  o 160.6751 6.197011  17.24220       1.324310      14.71179       2.437350      18.30214       1.577474      147.7942 12.49310  165.4818 7.170848  -17.68761      14.40481  
1 1 1 13 1  9  o 98.46774 2.579711  6.465447       0.3381929     6.357623       0.9248649     6.482090       0.3633569     97.36108 7.179347  98.58817 2.768633  -1.227097      7.694696  
1 1 1 13 1  10 o 585.9766 13.60398  229.7708       10.62233      235.9325       11.34093      185.7192       30.32334      593.6390 14.33681  514.3380 44.68712  79.30103       46.93061  
1 1 1 13 1  11 o 280.9223 4.071258  52.59999       1.524012      53.53779       1.668381      47.87399       3.745311      283.4056 4.417873  267.5027 10.52774  15.90295       11.41713  
1 1 1 13 1  12 f 441.6416 17.23321  131.0658       10.12221      148.8178       18.62550      123.6251       12.05836      466.6935 30.11110  427.9609 21.21124  38.73254       36.83198  
1 1 1 13 1  13 o 531.0184 14.03541  188.9171       9.922638      199.4443       18.33845      184.5592       11.79906      542.2341 25.45165  524.1974 16.91406  18.03674       30.55931  
1 1 1 13 1  14 o 497.2214 9.526285  165.1156       6.311708      171.3660       8.361814      156.8382       9.622592      506.1233 12.39854  483.5218 14.95288  22.60147       19.42453  
1 1 1 13 1  15 o 303.4922 5.382400  61.42052       2.176692      59.75420       2.491225      66.79783       4.475226      299.3022 6.246397  315.9245 10.64582  -16.62225      12.34305  
1 1 1 13 1  16 o 342.8423 5.526249  78.39481       2.524634      78.38857       3.464951      78.40187       3.686039      342.6699 7.588355  342.6544 8.072910  0.1544189E-01  11.07949  
1 1 1 13 1  17 o 308.2665 6.213058  63.41255       2.552145      67.46407       4.778603      61.79572       3.018734      317.1883 11.32420  304.2075 7.447001  12.98083       13.55343  
1 1 1 13 1  18 o 158.1763 1.740089  16.67212       0.3667637     17.11758       1.753418      16.65173       0.3750603     159.8092 8.262037  158.0790 1.780547  1.730164       8.451722  
1 1 1 13 1  19 o 92.10250 14.20217  5.847524       1.687047      5.867648       3.230134      5.839975       1.978311      90.79385 25.60018  91.47778 16.85020  -0.6839371     30.64797  
1 1 1 13 1  20 o 25.37366 10.90911  -0.5159509E-01 0.6650345     -0.5159509E-01 0.6650345     0.000000       0.000000      25.37366 10.90911  ?        ?         0.000000       10.90911  
1 1 1 13 1  21 o 189.0333 5.695330  23.89404       1.432964      23.33723       2.267513      24.26427       1.848971      186.2809 9.163105  190.2732 7.306119  -3.992264      11.71929  
1 1 1 13 1  22 o 143.6956 4.848097  13.80463       0.9269705     12.19098       1.870339      14.33006       1.067272      134.1355 10.54896  146.3386 5.482918  -12.20311      11.88878  
1 1 1 13 1  23 f 177.8649 8.094480  21.27673       1.913431      20.13099       2.802071      22.27778       2.619178      171.9399 12.31155  181.3329 10.88982  -9.392960      16.43662  
1 1 1 13 1  24 o 135.6240 9.085916  12.44070       1.632548      11.07393       1.976688      15.37345       2.895537      127.2581 11.79086  149.1295 14.76469  -21.87136      18.89498  
1 1 1 13 1  25 o 217.3099 9.037383  31.91870       2.611240      39.59900       4.960560      28.97476       3.071191      238.7808 15.67713  206.2280 11.21822  32.55280       19.27747  
1 1 1 13 1  26 o 106.7492 16.00107  8.120571       2.206032      9.290833       4.460176      7.741565       2.538245      106.9267 30.05870  102.7625 19.24343  4.164207       35.69083  
1 1 1 13 1  27 o 126.7444 11.76409  11.16028       1.964153      13.21971       4.556374      10.69024       2.176794      127.5125 27.61665  123.2494 13.47361  4.263123       30.72812  
1 1 1 13 1  28 o 73.78558 20.30928  4.256029       2.059614      7.633847       2.729044      -0.2137812     3.139330      98.56192 21.39431  50.68766 22.66960  47.87426       31.17093  
1 1 1 13 1  29 o 63.25048 24.37525  3.049537       2.902790      0.4397506      3.782965      6.786482       4.526767      55.25032 24.78440  83.17459 30.79295  -27.92427      39.52812  
1 1 1 13 1  30 f 71.49747 27.84836  4.991048       3.819424      0.4963298      5.335728      9.714357       5.469727      58.94696 27.52460  88.74779 33.64108  -29.80083      43.46638  
1 1 1 13 1  31 o 45.36417 20.92383  -0.3155832     2.942230      -0.8567333     3.587819      0.7956330      5.141276      47.26339 22.22867  56.82911 26.69040  -9.565727      34.73458  
1 1 1 13 1  32 o 36.75849 17.96791  -3.247463      2.916765      -4.490221      4.674869      -2.455309      3.732338      44.16747 21.81564  43.20451 20.93731  0.9629555      30.23728  
1 1 1 13 1  33 o 45.77787 21.79234  -0.4437348     3.651686      -0.4103687     4.667395      -0.4963907     5.863348      49.05032 23.68355  51.54640 25.25495  -2.496078      34.62258  
1 1 1 13 2  0  o 207.3263 9.272244  28.84189       2.549912      28.84189       2.549912      28.84189       2.549912      207.3263 9.272244  207.3263 9.272244  0.000000       0.000000  
1 1 1 13 2  1  o 156.3515 6.071564  16.32741       1.262554      16.40408       1.938255      16.27091       1.664002      156.4569 9.339505  155.9360 8.035277  0.5208588      12.32039  
1 1 1 13 2  2  o 718.2390 16.33078  346.0924       15.62965      347.1924       17.75370      342.3029       32.95274      718.4234 18.56089  704.6826 35.20481  13.74084       39.79806  
1 1 1 13 2  3  o 686.6152 17.55999  316.8208       16.05294      312.5277       18.37752      330.6433       32.97599      680.9717 20.27535  692.1422 35.87681  -11.17053      41.20965  
1 1 1 13 2  4  o 293.2848 10.24340  57.53442       3.997054      56.82801       4.508169      60.13060       8.642479      291.3103 11.63712  297.7892 21.93381  -6.478943      24.82972  
1 1 1 13 2  5  f 149.4046 11.32753  15.00562       2.238331      11.01562       4.058918      16.74927       2.683203      125.4245 25.16191  157.7012 12.88076  -32.27663      28.26722  
1 1 1 13 2  6  o 487.8996 12.76626  159.3569       8.292667      154.2642       12.30691      163.5920       11.22309      478.5627 19.33892  493.4215 17.09532  -14.85883      25.81170  
1 1 1 13 2  7  o 505.5740 14.89854  171.3743       10.02601      172.7867       14.96460      170.2240       13.50526      505.7103 22.26155  502.5522 20.20854  3.158112       30.06595  
1 1 1 13 2  8  o 460.1051 9.985384  141.3856       6.122029      139.0937       13.44745      141.9848       6.875898      453.6557 22.31385  460.9365 11.19476  -7.280823      24.96459  
1 1 1 13 2  9  o 356.9000 7.072782  84.96768       3.363647      71.45186       7.583766      88.27767       3.752988      325.8289 17.53170  363.7423 7.743010  -37.91339      19.16545  
1 1 1 13 2  10 o 1002.546 33.33678  687.8523       44.47308      719.7271       50.47894      577.3016       94.00866      1022.311 37.11718  861.7128 82.89280  160.5985       90.82346  
1 1 1 13 2  11 o 221.8353 8.478401  32.89043       2.501600      33.68852       12.63684      32.85788       2.552107      216.0576 45.34103  221.7107 8.655135  -5.653030      46.15973  
1 1 1 13 2  12 o 593.1945 12.16249  235.2715       9.613756      246.8887       21.00821      232.1942       10.81232      603.2719 26.19624  589.0090 13.77601  14.26282       29.59766  
1 1 1 13 2  13 o 304.5083 8.291186  61.93073       3.361128      60.84258       3.710846      66.90125       7.931006      301.7295 9.240466  314.9102 18.98849  -13.18076      21.11750  
1 1 1 13 2  14 o 447.1923 7.849951  133.4614       4.677726      133.2268       5.144963      134.5799       11.23397      446.7202 8.643172  446.8923 18.90773  -0.1721497     20.78958  
1 1 1 13 2  15 o 362.5698 6.037131  87.68098       2.916727      89.37373       3.240615      80.46008       6.693120      366.0103 6.644475  346.1053 14.54508  19.90497       15.99088  
1 1 1 13 2  16 o 415.8996 9.244055  115.5888       5.123003      113.4291       7.812400      117.2181       6.785652      410.9040 14.29000  418.1861 12.19024  -7.282135      18.78313  
1 1 1 13 2  17 o 326.7982 5.986537  71.26012       2.606927      58.76108       4.743575      76.66872       3.120395      295.8472 12.05802  338.8899 6.909992  -43.04272      13.89762  
1 1 1 13 2  18 o 171.1185 3.092689  19.51848       0.7051908     19.98409       1.607661      19.40755       0.7847130     172.8362 6.994945  170.6214 3.451467  2.214783       7.800120  
1 1 1 13 2  19 o 122.6713 13.30952  10.24790       2.140779      10.44958       3.406649      10.11628       2.752065      121.8108 21.78774  120.9083 17.59768  0.9025497      28.00686  
1 1 1 13 2  20 o 203.9884 8.245428  27.90476       2.236641      27.25794       2.286941      42.12580       10.72330      201.5598 8.534171  239.5045 34.60206  -37.94466      35.63895  
1 1 1 13 2  21 o 239.3275 7.612829  38.38824       2.424708      35.79441       3.080563      42.61174       3.930938      230.5826 10.05019  251.1512 11.77874  -20.56857      15.48371  
1 1 1 13 2  22 o 95.42679 7.147234  6.131742       0.9022258     7.027822       1.764567      5.814560       1.049830      100.9567 13.45126  92.68833 8.598042  8.268341       15.96443  
1 1 1 13 2  23 o 182.4183 5.350642  22.26230       1.299207      20.19147       2.284856      23.25177       1.579386      172.8295 9.963507  186.2730 6.372427  -13.44350      11.82706  
1 1 1 13 2  24 o 242.2285 8.994396  39.56415       2.898117      40.88232       4.916430      38.86219       3.587729      243.5672 15.22422  239.2504 11.28546  4.316757       18.95094  
1 1 1 13 2  25 o 78.50120 19.94007  4.526173       2.089525      -0.4864452E-01 4.460488      5.812355       2.365084      62.89341 27.62779  88.89769 20.39905  -26.00428      34.34263  
1 1 1 13 2  26 o 103.3875 16.10491  7.638926       2.146460      11.05572       5.778585      7.092033       2.311868      113.3563 34.86687  98.62875 18.26325  14.72755       39.36045  
1 1 1 13 2  27 o 94.23578 18.98754  6.641599       2.301792      6.176085       5.420790      6.743996       2.542377      87.01670 33.36755  94.00044 20.84395  -6.983742      39.34290  
1 1 1 13 2  28 o 99.24715 15.00563  7.171389       1.922581      6.506143       2.715144      7.840368       2.722753      89.84428 22.68021  100.0084 21.09613  -10.16413      30.97481  
1 1 1 13 2  29 o 37.02845 17.13390  -1.059773      1.996074      -0.6098231     3.104807      -1.376763      2.606004      47.72827 21.82119  41.48172 19.32495  6.246552       29.14820  
1 1 1 13 2  30 o 50.63842 22.87794  0.3756341      3.289161      4.118248       4.183416      -5.683543      5.322925      67.27174 28.06167  47.83630 23.56130  19.43544       36.64140  
1 1 1 13 2  31 o 43.26073 20.51552  -1.498856      3.175496      -2.239873      3.928040      -0.1010581     5.394908      45.69627 21.97880  55.52374 26.44764  -9.827469      34.38815  
1 1 1 13 2  32 o 50.29501 21.10416  1.804886       2.387255      9.062003       3.929537      -2.440347      3.005454      86.89959 28.96449  39.01942 18.88021  47.88017       34.57462  
1 1 1 13 2  33 o 36.24445 17.55280  -2.144867      2.612113      -3.910796      3.380797      0.4707328      4.114509      37.51984 18.53586  49.30038 23.37178  -11.78054      29.82982  
1 1 1 13 3  0  o 245.3399 10.82707  40.39754       3.523857      40.39754       3.523857      40.39754       3.523857      245.3399 10.82707  245.3399 10.82707  0.000000       0.000000  
1 1 1 13 3  1  f 258.3667 8.121119  44.59488       2.792455      44.77251       3.605370      44.32854       4.414661      258.6505 10.48247  257.0635 12.92945  1.586975       16.64491  
1 1 1 13 3  2  o 212.3697 11.77820  30.24853       3.320018      33.69094       3.964640      22.16820       6.074171      223.9637 13.34524  179.0286 26.24064  44.93512       29.43920  
1 1 1 13 3  3  o 507.1286 12.34767  172.0233       8.344048      159.5742       11.10327      188.1759       12.64749      487.2579 17.12752  528.9478 17.97005  -41.68982      24.82488  
1 1 1 13 3  4  o 314.5786 7.743036  66.03377       3.245741      66.79741       4.321550      65.04558       4.916043      316.0430 10.27537  311.6726 11.85868  4.370361       15.69113  
1 1 1 13 3  5  o 933.0496 4.355926  580.3099       5.415751      580.7662       5.517880      568.3240       28.27970      933.4081 4.436364  917.1440 23.15854  16.26404       23.57964  
1 1 1 13 3  6  o 76.73809 8.970558  3.984531       0.8999974     -9.294335      6.232632      4.267313       0.9095300     57.23608 27.56888  79.48043 8.731440  -22.24435      28.91852  
1 1 1 13 3  7  f 526.7732 12.75571  185.6142       8.953684      187.2218       15.96075      184.8760       10.81587      526.2927 22.81315  525.0111 15.47725  1.281555       27.56783  
1 1 1 13 3  8  o 417.0208 10.11914  116.1508       5.623088      118.5847       15.59509      115.7871       6.028615      417.0251 28.23056  416.1470 10.88103  0.8781738      30.25494  
1 1 1 13 3  9  o 354.5934 18.14857  84.63969       8.546721      71.76904       12.19702      97.05574       11.97968      323.9230 28.54969  378.4099 23.87975  -54.48688      37.21998  
1 1 1 13 3  10 o 386.7407 12.51159  100.1196       6.439231      104.4214       9.636298      96.64907       8.655373      393.9104 18.40951  379.1835 17.17480  14.72690       25.17705  
1 1 1 13 3  11 o 275.4654 6.646107  50.60926       2.439539      51.14544       2.574993      45.91137       7.622077      276.8178 6.986436  260.0844 22.20525  16.73343       23.27839  
1 1 1 13 3  12 o 656.8405 12.56291  288.5443       10.99572      304.8986       20.90608      282.2900       12.92838      671.6745 23.39396  649.1723 14.94550  22.50220       27.76051  
1 1 1 13 3  13 o 388.8990 8.160372  100.9376       4.228831      105.0513       4.941396      89.67950       8.174622      396.6396 9.349320  365.1840 16.84433  31.45569       19.26503  
1 1 1 13 3  14 o 311.4843 5.117615  64.68916       2.124111      65.40219       2.226912      57.49665       7.072747      313.1863 5.336133  291.8590 18.27795  21.32736       19.04095  
1 1 1 13 3  15 o 146.4819 1.578011  14.29701       0.3080120     14.33550       0.3107156     12.11383       2.339963      146.6789 1.589725  133.8241 13.29778  12.85477       13.39246  
1 1 1 13 3  16 o 166.9675 6.348585  18.62802       1.409907      18.68452       1.720719      18.51258       2.459437      167.1027 7.748847  165.9426 11.18794  1.160049       13.60936  
1 1 1 13 3  17 o 396.5586 7.591164  105.0351       4.011338      107.5311       5.670468      102.5349       5.675312      400.6275 10.63136  391.1474 10.89932  9.480103       15.22567  
1 1 1 13 3  18 o 95.56537 3.812855  6.099050       0.4845646     7.390059       0.7114280     4.981827       0.6618144     105.1241 5.093894  86.20254 5.795268  18.92154       7.715755  
1 1 1 13 3  19 o 116.8973 24.88658  9.785564       3.757530      6.886783       4.646555      15.26349       6.387506      98.86016 31.39600  143.6446 33.91748  -44.78446      46.21801  
1 1 1 13 3  20 o 213.0375 7.030295  30.38175       1.993003      30.24956       2.317014      30.75774       3.907669      212.3920 8.202270  212.9194 13.84814  -0.5274506     16.09498  
1 1 1 13 3  21 o 53.31949 12.86948  1.997420       0.9038530     4.618809       1.658612      0.8901319      1.077977      81.03539 15.92834  40.67067 15.03217  40.36472       21.90156  
1 1 1 13 3  22 o 117.9025 6.490265  9.329386       1.015735      9.408721       1.780095      9.291083       1.236856      117.5002 11.51700  117.4466 7.950094  0.5363464E-01  13.99447  
1 1 1 13 3  23 o 123.9009 6.410017  10.30422       1.054698      12.11006       2.730281      9.987480       1.143460      132.0409 15.83300  121.8781 7.071157  10.16275       17.34028  
1 1 1 13 3  24 o 121.9346 6.432506  9.988876       1.041458      14.05245       3.918865      9.680074       1.080305      139.4563 21.80205  119.9733 6.785192  19.48300       22.83349  
1 1 1 13 3  25 o 150.0961 11.72534  15.43706       2.326540      14.33310       4.612667      15.81374       2.694372      137.4871 26.13272  151.2527 13.51055  -13.76553      29.41860  
1 1 1 13 3  26 o 54.87048 17.76311  2.109485       1.482206      8.414965       4.983348      1.497530       1.552466      100.4037 32.57587  49.51846 18.08346  50.88527       37.25854  
1 1 1 13 3  27 o 55.39895 18.02966  2.199102       1.525879      5.673169       3.296359      1.251691       1.721411      83.70834 26.42654  48.24741 18.72281  35.46093       32.38681  
1 1 1 13 3  28 o 39.74681 17.94498  -0.5883287     2.019630      1.890972       4.519826      -1.206854      2.257541      65.04773 28.20426  39.60662 18.28961  25.44110       33.61532  
1 1 1 13 3  29 o 48.21767 19.24769  1.331297       1.865077      3.334528       3.237231      0.3359948      2.281843      65.00214 25.54407  45.45553 19.86948  19.54661       32.36195  
1 1 1 13 3  30 o 39.06193 17.61222  -0.2521605     1.937916      -0.2650049     5.050803      -0.2499432     2.098529      55.88688 26.31228  40.44315 18.27267  15.44373       32.03478  
1 1 1 13 3  31 o 90.13792 28.74845  8.996409       3.892514      11.96273       4.786837      3.206161       6.687876      99.13258 31.90719  63.75455 30.09627  35.37804       43.86176  
1 1 1 13 3  32 o 28.67210 14.26283  -4.106673      2.136279      -8.386817      3.236244      -0.8013276     2.843941      31.11978 15.75117  42.08949 19.79383  -10.96971      25.29615  
1 1 1 13 3  33 o 27.92821 13.87954  -3.666897      2.003798      -4.714069      2.914562      -2.728255      2.759398      33.26267 16.56485  35.86990 17.52127  -2.607231      24.11201  
1 1 1 13 4  0  o 265.9380 13.90802  47.62094       4.897594      47.62094       4.897594      47.62094       4.897594      265.9380 13.90802  265.9380 13.90802  0.000000       0.000000  
1 1 1 13 4  1  o 540.0665 13.01920  195.1736       9.369251      212.3583       14.71458      183.4556       12.15074      561.4427 19.69892  522.4120 17.47946  39.03070       26.33589  
1 1 1 13 4  2  o 488.8156 15.34644  160.3064       9.983614      162.4042       11.33307      153.0376       21.09579      491.5401 17.32986  471.3463 33.81250  20.19385       37.99486  
1 1 1 13 4  3  o 190.1755 21.67005  24.68542       5.393600      26.69695       8.988997      23.55380       6.742142      194.1688 36.06975  184.1465 28.38754  10.02231       45.90075  
1 1 1 13 4  4  o 207.1024 5.404506  28.61709       1.490196      32.36909       2.645812      26.87387       1.803454      220.0069 9.044327  200.6091 6.756175  19.39774       11.28919  
1 1 1 13 4  5  o 241.9541 7.320293  39.09107       2.357411      39.85469       3.228237      38.21863       3.450628      244.0802 9.946495  238.9138 10.86731  5.166412       14.73198  
1 1 1 13 4  6  o 318.6331 6.877829  67.72119       2.920221      68.13304       6.531329      67.61829       3.264717      318.4958 15.43545  318.3448 7.696164  0.1509705      17.24773  
1 1 1 13 4  7  o 463.7020 11.06034  143.6793       6.834096      143.0901       12.75206      143.9168       8.094699      460.5808 20.83179  463.6264 13.11583  -3.045593      24.61683  
1 1 1 13 4  8  o 257.7740 9.943012  44.44044       3.408910      41.02816       4.955255      47.50627       4.696962      247.0291 15.12626  266.1429 13.28630  -19.11375      20.13280  
1 1 1 13 4  9  o 348.6489 12.08772  81.36098       5.607235      80.25765       9.319349      81.98705       7.020103      344.8215 20.37312  349.5409 15.10771  -4.719360      25.36350  
1 1 1 13 4  10 o 161.1074 7.777256  17.35778       1.664680      17.62748       1.969426      16.68292       3.115320      162.2425 9.146687  157.1144 15.06470  5.128143       17.62405  
1 1 1 13 4  11 o 386.2587 11.78335  99.82156       6.057763      105.1581       8.185306      93.35902       9.007541      395.8518 15.54799  372.4394 18.20518  23.41245       23.94094  
1 1 1 13 4  12 o 674.0897 14.86578  304.3869       13.35300      296.5790       15.21280      330.5918       27.86971      664.5665 17.19341  696.1013 30.11725  -31.53479      34.67942  
1 1 1 13 4  13 o 492.5754 9.209982  162.0138       6.045122      168.7359       7.439278      148.9469       10.37204      502.4368 11.11158  470.8470 16.55722  31.58975       19.94013  
1 1 1 13 4  14 o 341.9926 5.952927  78.00471       2.712819      77.69659       2.823840      81.69375       9.770899      341.3012 6.209101  347.2950 21.21482  -5.993835      22.10479  
1 1 1 13 4  15 o 92.67316 7.087518  5.764804       0.8685882     5.633385       0.8797330     10.85332       5.474160      91.58664 7.268064  123.2933 32.76406  -31.70664      33.56052  
1 1 1 13 4  16 o 18.01328 8.696779  -1.002118      0.6290092     -1.703501      0.9180640     -0.3815660     0.8635441     20.80037 10.14855  26.56609 11.88494  -5.765724      15.62833  
1 1 1 13 4  17 o 108.3652 4.178146  7.841751       0.6021886     7.948641       0.6693758     7.388045       1.379082      109.0752 4.615868  104.5921 10.01733  4.483124       11.02965  
1 1 1 13 4  18 o 357.8824 9.295744  85.79784       4.429251      96.17600       6.557609      77.09097       6.006432      377.9510 13.04030  338.2435 13.35266  39.70749       18.66395  
1 1 1 13 4  19 o 240.5961 8.945714  38.82354       2.862992      37.73026       3.125239      44.52998       7.140018      236.9998 9.917967  253.9472 21.29596  -16.94742      23.49221  
1 1 1 13 4  20 o 58.29354 14.54365  2.390420       1.125954      2.396361       1.232825      2.360543       2.764705      58.40535 15.56129  64.83360 24.05327  -6.428249      28.64810  
1 1 1 13 4  21 o 116.5137 2.347945  9.049322       0.3645346     11.93422       2.256253      8.971997       0.3693876     132.2221 12.97271  116.0138 2.389456  16.20821       13.19094  
1 1 1 13 4  22 o 94.46198 9.179240  6.052866       1.140862      3.121232       3.280348      6.456256       1.216823      71.54815 26.26089  97.53047 9.482535  -25.98232      27.92047  
1 1 1 13 4  23 o 122.3955 8.313910  10.10912       1.347904      7.025738       4.161285      10.47056       1.424716      96.76727 29.55503  124.5117 8.640663  -27.74442      30.79222  
1 1 1 13 4  24 o 23.08909 10.82943  -0.8476879     0.8414932     3.976204       3.242688      -1.195998      0.8713439     75.78932 26.29465  21.90794 10.48820  53.88138       28.30921  
1 1 1 13 4  25 o 62.50798 11.94312  2.750481       0.9585210     0.5803140      3.661997      2.910100       0.9931459     59.77419 25.64760  64.31780 12.03013  -4.543613      28.32884  
1 1 1 13 4  26 o 116.1207 6.734373  9.102221       1.037559      11.41899       6.034609      9.031647       1.053244      113.4232 35.74909  115.6385 6.866137  -2.215263      36.40249  
1 1 1 13 4  27 o 110.1044 12.03352  8.489468       1.736801      8.692025       3.682056      8.431503       1.969691      102.5858 26.68623  108.8684 13.89377  -6.282585      30.08640  
1 1 1 13 4  28 o 72.31138 20.51189  4.149727       2.067345      7.248780       5.677155      3.675946       2.219754      86.49561 33.87598  68.00766 21.71171  18.48795       40.23655  
1 1 1 13 4  29 o 99.27314 21.47876  8.152411       2.758597      6.754449       3.740597      9.819275       4.084544      83.57391 28.26354  100.6803 28.92090  -17.10636      40.43818  
1 1 1 13 4  30 o 118.0488 17.86324  11.10076       2.722177      10.42959       4.966610      11.38897       3.254574      93.01451 32.52504  114.8965 22.05937  -21.88198      39.30005  
1 1 1 13 4  31 o 50.47068 19.80486  1.910990       1.943552      -1.406228      3.733201      3.144375       2.276374      46.26185 22.02598  59.44727 21.86662  -13.18542      31.03696  
1 1 1 13 4  32 o 56.40726 23.90590  2.894760       3.112737      7.139495       4.836026      -0.1077043     4.067263      71.01043 29.93110  49.10495 23.26682  21.90548       37.91063  
1 1 1 13 4  33 o 35.72846 15.83418  0.2102917      1.496168      0.4836482      1.650351      -1.051025      3.545062      38.42113 16.84357  43.66876 20.97157  -5.247631      26.89819  
1 1 1 13 5  0  o 190.9086 10.10074  24.51634       2.552993      24.51634       2.552993      24.51634       2.552993      190.9086 10.10074  190.9086 10.10074  0.000000       0.000000  
1 1 1 13 5  1  o 670.1741 13.69407  300.6357       12.22907      313.1339       19.44946      292.4641       15.72672      681.3417 21.44917  659.6799 17.90744  21.66187       27.94178  
1 1 1 13 5  2  o 877.5158 18.68740  517.4750       21.85130      505.3106       32.91782      527.0579       29.21696      861.6887 28.70872  882.3592 24.87424  -20.67047      37.98576  
1 1 1 13 5  3  o 526.8967 13.82326  185.9608       9.696933      184.1656       13.11532      188.1254       14.40185      523.1476 18.84480  528.2726 20.49801  -5.125061      27.84411  
1 1 1 13 5  4  o 592.7523 3.571302  234.1665       2.820807      217.0396       23.11737      234.4253       2.842044      563.4561 30.90803  593.0786 3.596210  -29.62250      31.11654  
1 1 1 13 5  5  o 137.7372 5.358893  12.66786       0.9816810     7.661059       3.417538      13.11814       1.024873      104.3967 24.91459  140.1594 5.498163  -35.76271      25.51405  
1 1 1 13 5  6  o 277.9027 5.494642  51.49219       2.034725      60.67454       4.570152      49.22207       2.272367      301.0928 11.41152  271.6779 6.276977  29.41483       13.02395  
1 1 1 13 5  7  o 94.41226 1.984228  5.939374       0.2496282     1.677241       4.453786      5.952805       0.2500212     73.25315 29.56949  94.51895 1.985109  -21.26580      29.63605  
1 1 1 13 5  8  o 99.10819 6.070231  6.574398       0.7978109     13.06643       5.005888      6.405200       0.8081404     136.3240 28.47696  97.80727 6.233155  38.51676       29.15115  
1 1 1 13 5  9  o 190.7640 14.78938  24.51314       3.730070      18.80844       5.557093      29.19093       5.032122      164.7784 26.18391  207.7101 18.37029  -42.93169      31.98538  
1 1 1 13 5  10 o 376.7560 11.66110  94.96400       5.847227      108.4959       9.504319      86.72321       7.416977      401.6618 17.80194  359.4386 15.52221  42.22318       23.61880  
1 1 1 13 5  11 o 357.8759 9.758807  85.59058       4.649402      82.78819       6.878731      87.94775       6.308685      351.2804 14.72806  362.3393 13.08772  -11.05893      19.70289  
1 1 1 13 5  12 o 688.0468 15.67964  317.3755       14.37565      293.6016       18.64325      352.2422       22.57752      659.7470 21.23424  721.7115 23.50817  -61.96454      31.67850  
1 1 1 13 5  13 o 223.2184 1.022185  33.19829       0.3040416     33.21145       0.3049003     30.87214       4.053971      223.2626 1.024869  214.1929 14.28537  9.069641       14.32209  
1 1 1 13 5  14 o 237.7665 9.500353  37.82894       3.003922      37.74852       3.414139      38.10456       6.320642      237.3607 10.82288  236.8481 20.22029  0.5126801      22.93458  
1 1 1 13 5  15 o 279.1552 6.844773  52.00560       2.546116      52.01553       2.678715      51.91261       8.194042      279.0642 7.209627  275.8271 22.48900  3.237152       23.61639  
1 1 1 13 5  16 f 516.7512 9.467398  178.5688       6.519070      183.3812       7.302269      159.6755       14.46880      523.4539 10.46902  484.0473 22.49367  39.40659       24.81059  
1 1 1 13 5  17 o 73.69953 8.502770  3.679463       0.8197330     2.741256       1.181034      4.551586       1.138681      62.59089 14.45250  81.73755 10.71214  -19.14666      17.98957  
1 1 1 13 5  18 o 201.5572 7.574515  27.19652       2.030735      19.83714       4.088762      29.60632       2.339709      169.9468 18.34572  210.2015 8.369926  -40.25473      20.16484  
1 1 1 13 5  19 o 79.54136 13.65123  4.386073       1.394812      4.009372       1.464519      8.063022       4.575523      75.69545 15.04960  105.2746 30.72056  -29.57912      34.20882  
1 1 1 13 5  20 o 46.31575 11.59347  1.501169       0.7137747     -0.9580745     2.336549      1.754285       0.7496076     43.42720 19.47968  50.06207 11.48193  -6.634869      22.61178  
1 1 1 13 5  21 o 20.60170 9.520811  -0.4993557     0.6134666     -0.7277110     1.644432      -0.4624372     0.6611996     36.26914 16.29946  21.90564 10.03575  14.36349       19.14129  
1 1 1 13 5  22 o 111.4707 2.526651  8.284565       0.3753009     7.758947       4.283228      8.288631       0.3767499     101.6648 29.73882  111.4978 2.535791  -9.833008      29.84674  
1 1 1 13 5  23 o 46.48911 15.17642  1.436736       1.080722      8.727523       2.942518      0.2999080      1.161928      109.9308 20.85020  36.14265 14.90671  73.78816       25.63086  
1 1 1 13 5  24 o 77.50415 10.67999  4.142208       1.073693      -2.979366      8.128380      4.268673       1.083184      75.23690 34.72938  78.71893 10.59520  -3.482025      36.30961  
1 1 1 13 5  25 o 154.7903 7.580143  16.16936       1.558734      12.43567       4.791450      16.61127       1.648397      125.1264 29.26234  156.8067 7.914623  -31.68040      30.31379  
1 1 1 13 5  26 o 44.66928 14.88380  1.345360       1.037634      -5.821528      6.226980      1.550049       1.052347      57.92459 27.81173  47.14888 14.93740  10.77571       31.56926  
1 1 1 13 5  27 o 29.27503 12.78443  -0.1132218     0.9426947     1.507503       3.704864      -0.2254175     0.9747780     61.19151 26.01296  28.97547 12.81406  32.21604       28.99784  
1 1 1 13 5  28 o 138.7741 13.16047  13.77664       2.404537      23.24512       7.639964      12.73561       2.533277      146.7260 38.57383  132.3579 14.60609  14.36804       41.24655  
1 1 1 13 5  29 o 41.65194 16.99618  0.8137080      1.490039      0.2273553      2.564084      1.112683       1.830924      46.52048 20.66668  46.15655 18.83802  0.3639297      27.96395  
1 1 1 13 5  30 o 51.53548 19.29730  2.022815       1.787542      5.099498       3.414280      0.8610408      2.098064      71.16914 26.66545  45.45768 19.45707  25.71146       33.00945  
1 1 1 13 5  31 o 42.36722 19.70805  -0.6274942     2.694468      8.504889       6.074844      -2.864153      3.006374      75.38422 32.69199  38.53870 18.70316  36.84552       37.66397  
1 1 1 13 5  32 o 77.50273 7.662919  4.226169       0.7810328     1.630108       1.788969      4.837515       0.8681382     46.80844 18.79445  82.78941 7.967662  -35.98096      20.41360  
1 1 1 13 5  33 o 35.33477 13.38896  0.8390295      0.8662019     1.139278       2.109133      0.7781128      0.9500175     44.31350 19.24000  35.28239 13.84602  9.031113       23.70421  
1 1 1 13 6  0  o 95.50627 17.28657  6.659723       1.986260      6.659723       1.986260      6.659723       1.986260      95.50627 17.28657  95.50627 17.28657  0.000000       0.000000  
1 1 1 13 6  1  o 288.0247 8.808692  55.42677       3.376789      53.93134       6.355827      56.01488       3.985870      283.0375 16.92949  289.3965 10.35277  -6.358978      19.84408  
1 1 1 13 6  2  o 240.0049 8.078397  38.48174       2.579880      45.05587       4.746420      35.72507       3.073548      259.0931 13.79766  231.0674 10.00595  28.02574       17.04390  
1 1 1 13 6  3  o 533.0417 10.41015  189.7992       7.394210      189.3679       8.582513      191.0412       14.56461      532.1931 12.10241  532.3963 20.56876  -0.2032471     23.86508  
1 1 1 13 6  4  o 109.6987 9.098062  8.088283       1.317963      10.52114       7.265074      8.005493       1.340201      123.9648 39.24460  109.1096 9.306683  14.85514       40.33303  
1 1 1 13 6  5  o 657.5746 12.10212  289.0866       10.60425      304.1854       21.10930      283.9902       12.26401      670.8886 23.64993  651.3464 14.13015  19.54224       27.54960  
1 1 1 13 6  6  o 459.9958 8.441964  141.2122       5.174530      139.9574       6.556701      143.2843       8.425652      457.7115 10.75029  462.5347 13.68559  -4.823273      17.40299  
1 1 1 13 6  7  o 330.4417 9.033143  72.94147       3.973742      79.55854       6.115822      68.10692       5.227578      344.5944 13.34427  318.9276 12.32404  25.66678       18.16456  
1 1 1 13 6  8  o 308.5078 11.63047  63.70086       4.772641      69.52707       7.351425      59.45623       6.274781      321.4844 17.22369  297.4432 15.88912  24.04123       23.43330  
1 1 1 13 6  9  o 593.5876 13.96478  235.8217       11.04568      228.8650       14.70465      244.8302       16.73309      583.3596 18.94179  602.7908 20.86370  -19.43127      28.17952  
1 1 1 13 6  10 o 546.2157 16.46601  200.2367       11.97098      200.2367       11.97098      0.000000       0.000000      546.2157 16.46601  ?        ?         0.000000       16.46601  
1 1 1 13 6  11 o 863.1962 15.98414  499.5869       18.38536      495.4789       26.95296      503.1617       25.14297      856.1228 23.64902  863.6426 21.86545  -7.519775      32.20829  
1 1 1 13 6  12 f 175.8938 8.079631  20.69223       1.888661      20.73438       1.947591      20.02710       7.736244      176.0525 8.325575  167.5862 35.73493  8.466354       36.69197  
1 1 1 13 6  13 o 475.7570 9.452333  151.1995       5.992358      151.0469       6.343945      152.4631       18.25360      475.4409 10.01358  471.6777 29.18517  3.763214       30.85525  
1 1 1 13 6  14 o 239.8393 13.95832  38.69949       4.441668      38.69949       4.441668      0.000000       0.000000      239.8393 13.95832  ?        ?         0.000000       13.95832  
1 1 1 13 6  15 o 483.8811 9.759254  156.5694       6.292581      152.3051       7.057361      173.1077       13.89835      476.9902 11.10349  505.1864 20.68988  -28.19614      23.48103  
1 1 1 13 6  16 f 182.9214 8.843301  22.42336       2.149136      23.02589       2.400611      19.99097       4.823307      185.2527 9.759295  170.1218 21.77567  15.13086       23.86260  
1 1 1 13 6  17 o 151.1455 9.482365  15.35361       1.900166      15.44134       2.059906      14.85284       4.921309      151.4660 10.26675  144.5535 26.52651  6.912445       28.44401  
1 1 1 13 6  18 o 200.9952 5.998659  27.00179       1.604823      27.06701       1.855045      26.80779       3.199550      201.1314 6.931876  199.3051 12.10457  1.826248       13.94889  
1 1 1 13 6  19 o 78.49957 13.22634  4.268552       1.334377      3.068834       1.596377      7.050547       2.430938      65.97112 17.76608  100.0060 18.93522  -34.03485      25.96491  
1 1 1 13 6  20 o 236.4590 7.572536  37.47684       2.382925      42.67603       3.453157      32.75015       3.292509      251.7140 10.31708  220.2159 11.25766  31.49808       15.27014  
1 1 1 13 6  21 o 132.7732 14.73324  12.13924       2.562818      14.00578       4.203038      11.03453       3.233468      139.5799 23.42704  124.7779 20.13227  14.80197       30.88907  
1 1 1 13 6  22 o 79.51585 6.212831  4.256703       0.6530670     10.97883       2.819650      3.875657       0.6713215     125.1542 17.37540  75.78101 6.717605  49.37316       18.62876  
1 1 1 13 6  23 o 221.9389 3.628924  32.87518       1.073210      38.93479       6.930428      32.72630       1.086314      233.1108 22.59425  221.4302 3.681673  11.68060       22.89225  
1 1 1 13 6  24 o 54.43887 9.362357  2.056376       0.6546715     0.2054967      4.212173      2.102193       0.6627250     62.22261 27.10075  55.05480 9.368949  7.167809       28.67452  
1 1 1 13 6  25 o 67.09018 8.769906  3.093564       0.7652693     12.21265       4.041152      2.754384       0.7793713     126.2850 24.90019  63.05334 9.576802  63.23166       26.67836  
1 1 1 13 6  26 o 125.6505 7.395051  10.69882       1.232692      4.122570       3.198420      11.84605       1.335894      73.90444 26.08035  132.1706 7.617410  -58.26612      27.17001  
1 1 1 13 6  27 o 123.5204 8.770041  10.46452       1.434103      8.464265       5.165510      10.63157       1.492787      94.65982 33.16490  124.3850 9.068816  -29.72514      34.38247  
1 1 1 13 6  28 o 58.93315 19.29897  2.687264       1.746974      0.8716506      4.778249      2.967404       1.876916      61.05277 27.57961  61.45819 19.99594  -0.4054184     34.06570  
1 1 1 13 6  29 o 86.57962 19.75767  6.170037       2.228969      3.205448       5.430034      6.770803       2.444405      66.30080 29.72127  89.86845 20.82096  -23.56764      36.28865  
1 1 1 13 6  30 o 77.77237 5.558556  4.126599       0.5722528     6.778940       6.275979      4.104362       0.5746466     72.87337 32.35574  77.54843 5.598709  -4.675056      32.83656  
1 1 1 13 6  31 o 73.44896 11.25275  3.981641       1.066298      2.633288       5.175602      4.041410       1.089675      59.35165 27.50740  73.89390 11.43565  -14.54224      29.78979  
1 1 1 13 6  32 o 28.43056 12.77661  -0.1862855     1.010380      1.652515       1.854656      -0.9623359     1.204872      46.92147 19.03040  26.95897 12.74084  19.96250       22.90163  
1 1 1 13 7  0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 13 7  1  o 361.1867 14.31484  87.47031       6.875921      90.82088       8.060876      78.52036       13.17448      367.6732 16.49506  338.6574 29.48812  29.01587       33.78811  
1 1 1 13 7  2  o 309.6621 8.296753  64.03658       3.420411      71.06123       5.320634      59.08875       4.465372      325.7812 12.27840  297.1482 11.29804  28.63303       16.68546  
1 1 1 13 7  3  f 342.2810 8.727849  78.24557       3.977491      80.72883       5.892824      76.16748       5.390697      347.2014 12.75874  337.3359 12.01165  9.865570       17.52327  
1 1 1 13 7  4  o 799.2150 3.598258  425.6974       3.832035      0.000000       0.000000      425.6974       3.832035      ?        ?         799.2150 3.598258  0.000000       3.598258  
1 1 1 13 7  5  o 421.2713 8.463041  118.4354       4.750746      0.000000       0.000000      118.4354       4.750746      ?        ?         421.2713 8.463041  0.000000       8.463041  
1 1 1 13 7  6  o 531.3253 8.065895  188.3702       5.710664      190.1731       6.628852      183.1807       11.24631      533.7286 9.320610  522.5357 16.17125  11.19293       18.66502  
1 1 1 13 7  7  o 539.8535 10.30287  194.6510       7.411524      207.5254       12.29628      187.3048       9.288397      556.0931 16.61268  529.1588 13.17290  26.93439       21.20157  
1 1 1 13 7  8  o 262.3511 10.97335  46.06503       3.827681      46.06503       3.827681      0.000000       0.000000      262.3511 10.97335  ?        ?         0.000000       10.97335  
1 1 1 13 7  9  o 548.6566 13.91409  201.6095       10.16432      207.5799       11.77358      184.1378       20.14081      556.2858 15.89948  519.7106 29.20061  36.57520       33.24859  
1 1 1 13 7  10 o 479.0805 11.06129  153.3805       7.061354      153.3805       7.061354      0.000000       0.000000      479.0805 11.06129  ?        ?         0.000000       11.06129  
1 1 1 13 7  11 o 128.3495 1.922796  10.97675       0.3288522     10.99464       0.3291802     2.011346       7.368163      128.4541 1.923147  90.95161 37.52769  37.50244       37.57693  
1 1 1 13 7  12 o 370.2261 7.074399  91.45272       3.490037      92.40372       3.730939      84.79382       9.872575      372.1113 7.524399  353.9233 21.02858  18.18793       22.33423  
1 1 1 13 7  13 o 244.2217 5.590501  39.77790       1.819317      39.44048       1.884522      44.40240       6.976613      243.1737 5.815821  255.6344 20.65683  -12.46062      21.45992  
1 1 1 13 7  14 o 614.3712 11.25502  252.6412       9.214048      251.4179       11.72849      254.6136       14.89215      611.9932 14.38209  614.2255 18.21529  -2.232361      23.20864  
1 1 1 13 7  15 o 555.0394 12.73606  206.6615       9.419598      208.0966       10.14632      197.7062       25.34584      556.6724 13.67840  529.2783 36.15470  27.39404       38.65567  
1 1 1 13 7  16 f 363.1429 8.282288  88.16330       4.007757      88.58844       4.568295      86.74281       8.350436      363.7119 9.433871  357.6569 17.57523  6.054993       19.94710  
1 1 1 13 7  17 o 323.8700 8.956084  70.26964       3.861404      66.41885       4.324097      85.42974       8.579696      314.5781 10.32958  354.1712 18.24109  -39.59311      20.96277  
1 1 1 13 7  18 f 367.3423 7.848340  90.29066       3.841689      88.92681       4.250504      96.37506       8.977720      364.3675 8.754419  375.7244 17.98398  -11.35693      20.00159  
1 1 1 13 7  19 o 60.42457 17.30691  2.552603       1.464753      1.877766       1.817199      3.804313       2.474883      55.57310 19.65409  73.87807 22.83474  -18.30497      30.12821  
1 1 1 13 7  20 o 208.1828 7.547161  29.06773       2.090176      33.72591       3.730525      26.93631       2.523463      222.9898 12.60619  200.0050 9.495646  22.98474       15.78237  
1 1 1 13 7  21 o 34.89857 13.49945  0.5428002      0.8927491     -3.583345      2.705941      1.046782       0.9457006     38.50660 18.44748  41.09085 14.20297  -2.584244      23.28162  
1 1 1 13 7  22 o 391.5073 8.105088  102.9378       4.228352      97.41779       7.963305      105.1052       4.989884      376.3304 15.91594  395.0326 9.479469  -18.70218      18.52505  
1 1 1 13 7  23 o 154.4679 4.153495  15.94757       0.8541439     16.67201       4.834966      15.92423       0.8677926     150.1423 25.04860  154.3465 4.223321  -4.204117      25.40214  
1 1 1 13 7  24 o 66.91808 26.89246  2.204476       3.666138      -1.173565      4.183878      13.37569       7.608461      57.20469 25.82749  122.8794 40.27743  -65.67471      47.84695  
1 1 1 13 7  25 o 32.10815 13.31666  0.2267798      0.9343506     0.6514766      4.030379      0.2026586      0.9605179     61.39954 26.62786  32.27564 13.45350  29.12390       29.83354  
1 1 1 13 7  26 o 161.6191 7.563603  17.71327       1.624384      19.92026       4.358332      17.35724       1.750510      162.9080 20.53237  159.7172 8.253054  3.190796       22.12897  
1 1 1 13 7  27 o 86.12191 8.541241  5.113802       0.9672850     14.48081       6.151546      4.876329       0.9794697     118.9308 35.85406  83.96304 8.889309  34.96773       36.93959  
1 1 1 13 7  28 o 42.64064 10.34168  1.317294       0.5814953     6.056096       5.912604      1.271011       0.5843281     77.94024 32.98584  41.85956 10.49625  36.08068       34.61556  
1 1 1 13 7  29 o 81.81227 7.100779  4.616042       0.7664431     3.416712       6.637664      4.632249       0.7716042     67.21748 31.15239  81.94236 7.137792  -14.72488      31.95965  
1 1 1 13 7  30 o 44.57004 11.55610  1.488754       0.6919822     -5.518616      3.891310      1.717582       0.7031898     39.68137 19.65459  48.01413 11.19748  -8.332764      22.62048  
1 1 1 13 7  31 o 78.09615 12.00475  4.569483       1.209339      1.607369       1.979609      6.333111       1.527503      47.81032 19.55938  91.40701 12.89906  -43.59669      23.42978  
1 1 1 13 7  32 o 62.85267 16.53487  3.365139       1.403198      0.1863377E-01  2.861358      4.424758       1.610095      43.72235 20.32852  71.91289 17.06114  -28.19054      26.53924  
1 1 1 13 8  0  o 178.3069 22.34057  22.27071       5.082741      22.27071       5.082741      22.27071       5.082741      178.3069 22.34057  178.3069 22.34057  0.000000       0.000000  
1 1 1 13 8  1  o 148.2752 14.28718  14.85060       2.787944      14.45714       3.102234      16.50259       6.356659      145.9871 16.22080  152.8486 32.22678  -6.861450      36.07880  
1 1 1 13 8  2  o 158.0604 8.825305  16.72646       1.851392      13.93988       2.775495      18.96033       2.485044      143.5514 14.71791  168.0893 11.15799  -24.53790      18.46937  
1 1 1 13 8  3  o 327.1977 8.037828  71.43356       3.504471      76.13346       6.821528      69.74837       4.084714      336.8102 15.23875  323.0825 9.498312  13.72763       17.95654  
1 1 1 13 8  4  o 298.4454 3.860785  59.36367       1.535373      58.56187       5.752970      59.42516       1.593159      295.3929 14.66148  298.5961 4.004069  -3.203247      15.19841  
1 1 1 13 8  5  o 627.3853 15.79892  263.9097       13.19744      0.000000       0.000000      263.9097       13.19744      ?        ?         627.3853 15.79892  0.000000       15.79892  
1 1 1 13 8  6  f 300.2775 9.455104  60.25714       3.778514      60.44062       7.676025      60.19847       4.340852      299.2968 19.35061  299.9841 10.87734  -0.6872559     22.19826  
1 1 1 13 8  7  o 232.4907 8.106263  36.11125       2.507465      35.83167       4.247926      36.26076       3.106379      230.9802 13.86541  232.8031 10.03722  -1.822922      17.11711  
1 1 1 13 8  8  o 513.1662 18.90944  177.1826       12.90824      169.5994       24.24798      180.1814       15.24843      495.2612 37.01004  516.5458 22.20539  -21.28467      43.16043  
1 1 1 13 8  9  o 611.9445 20.42305  252.3506       16.63019      241.9598       23.91006      262.0878       23.14584      595.1967 30.24633  620.5637 28.06327  -25.36707      41.26001  
1 1 1 13 8  10 o 262.8805 9.762896  46.22121       3.413936      51.80322       5.419261      42.54841       4.395863      277.6708 14.69895  251.7984 13.14694  25.87239       19.72057  
1 1 1 13 8  11 o 201.6217 1.372146  27.08579       0.3686474     27.11548       0.3700457     23.17946       4.244617      201.7322 1.376597  184.9252 17.43101  16.80696       17.48528  
1 1 1 13 8  12 o 55.30401 7.428092  2.077773       0.5335742     2.130519       0.5420802     0.4364954      3.023850      56.01100 7.447392  56.91946 23.80886  -0.9084587     24.94646  
1 1 1 13 8  13 o 263.9816 6.768431  46.53535       2.378904      46.41705       2.502302      47.64684       7.670050      263.6126 7.130155  264.2923 21.97780  -0.6796875     23.10547  
1 1 1 13 8  14 o 180.9279 4.110773  21.82504       0.9910662     21.69500       1.011683      24.91858       4.934332      180.3851 4.208914  190.9248 19.67659  -10.53970      20.12171  
1 1 1 13 8  15 o 392.0579 8.260275  102.7460       4.315372      102.7460       4.315372      0.000000       0.000000      392.0579 8.260275  ?        ?         0.000000       8.260275  
1 1 1 13 8  16 o 384.0400 8.521068  98.66625       4.360578      102.7442       5.095693      87.51154       8.427707      391.6465 9.764174  358.8625 17.67854  32.78394       20.19579  
1 1 1 13 8  17 o 176.7873 5.207618  20.87831       1.225435      21.25218       1.262677      14.81961       5.083061      178.3544 5.318885  143.4756 27.58909  34.87883       28.09712  
1 1 1 13 8  18 o 53.64727 16.90308  1.939900       1.349226      0.8419424      1.723668      3.676991       2.168065      46.80785 18.56270  72.31480 21.15925  -25.50694      28.14761  
1 1 1 13 8  19 o 245.2218 8.953910  40.39949       2.920892      38.92073       3.510155      43.72868       5.266794      240.1788 10.99695  253.0086 15.69938  -12.82980      19.16776  
1 1 1 13 8  20 o 283.2557 11.92601  54.31579       4.491327      58.76042       7.104358      51.35679       5.796676      291.5230 18.38211  273.7081 15.96271  17.81488       24.34564  
1 1 1 13 8  21 o 321.2667 11.29062  69.84671       4.825934      66.46182       5.373177      83.97091       10.97593      312.6245 12.92625  343.1032 24.16177  -30.47867      27.40217  
1 1 1 13 8  22 o 183.0196 7.136478  22.49915       1.737088      26.18300       3.821369      21.53967       1.950229      194.9443 14.82185  178.8345 8.205776  16.10976       16.94172  
1 1 1 13 8  23 o 21.51371 10.55735  -2.051768      1.037310      2.767395       4.717890      -2.296568      1.063330      74.89391 30.36069  21.17220 10.44764  53.72170       32.10801  
1 1 1 13 8  24 f 147.5560 4.443727  14.57427       0.8727352     14.18430       4.560622      14.58910       0.8891677     135.7045 26.16913  147.6183 4.525674  -11.91380      26.55758  
1 1 1 13 8  25 f 30.23715 14.13420  -1.231985      1.413258      -9.126871      5.311054      -0.6303651     1.466118      47.48057 23.41455  33.78302 15.26745  13.69755       27.95239  
1 1 1 13 8  26 o 131.2590 3.257344  11.51622       0.5697260     10.89842       4.316728      11.52717       0.5747539     112.5083 28.70445  131.2766 3.288236  -18.76836      28.89218  
1 1 1 13 8  27 o 24.29221 11.12227  -0.4838741     0.8104499     15.11833       6.191308      -0.7558809     0.8174840     119.1585 35.98003  22.79267 10.68510  96.36584       37.53310  
1 1 1 13 8  28 o 129.7400 7.267155  11.53973       1.251332      11.15643       6.880315      11.55284       1.272555      91.31246 36.79012  129.7515 7.390786  -38.43902      37.52515  
1 1 1 13 8  29 o 89.11117 6.800025  5.464033       0.8013527     -0.9945704     5.012233      5.633454       0.8117951     53.59782 25.51959  90.49712 6.781221  -36.89930      26.40520  
1 1 1 13 8  30 o 22.96942 10.74977  -0.6648875     0.8215385     -0.3426005     1.918928      -0.7372166     0.9090629     37.78383 17.22887  24.04696 11.27138  13.73686       20.58830  
1 1 1 13 8  31 o 42.18593 15.15450  1.340721       1.084483      -0.7464444     2.001868      2.207695       1.290208      36.21736 16.89410  51.46712 16.56508  -15.24976      23.66036  
1 1 1 13 8  32 o 32.65127 14.77837  -0.1668589     1.379872      -0.7419078     1.462059      4.520889       4.174407      30.79322 14.38825  60.46492 26.63800  -29.67170      30.27548  
1 1 1 13 9  0  o 76.31466 27.90125  5.201656       2.615605      5.201656       2.615605      5.201656       2.615605      76.31466 27.90125  76.31466 27.90125  0.000000       0.000000  
1 1 1 13 9  1  o 241.7704 13.70869  39.23522       4.398347      35.38230       5.088432      50.62061       8.747073      229.1120 16.78365  272.7733 24.31987  -43.66121      29.54906  
1 1 1 13 9  2  o 820.6310 8.525891  449.4248       9.323119      414.6303       22.63081      456.5371       10.23170      784.4059 21.67215  826.9719 9.285036  -42.56598      23.57741  
1 1 1 13 9  3  o 768.9805 9.866143  394.8550       10.10965      392.1335       16.07400      396.6361       13.00360      765.0096 15.76825  770.1591 12.67097  -5.149414      20.22847  
1 1 1 13 9  4  o 429.4276 9.998663  123.1450       5.721441      0.000000       0.000000      123.1450       5.721441      ?        ?         429.4276 9.998663  0.000000       9.998663  
1 1 1 13 9  5  o 674.8240 14.32269  304.8478       12.87920      299.5554       55.68643      305.1469       13.23812      636.1694 66.68020  675.0660 14.71657  -38.89655      68.28490  
1 1 1 13 9  6  o 718.5601 21.07109  347.9084       20.15367      0.000000       0.000000      347.9084       20.15367      ?        ?         718.5601 21.07109  0.000000       21.07109  
1 1 1 13 9  7  o 578.2122 14.70000  224.0630       11.31686      212.8925       30.58652      225.8348       12.18132      552.2361 41.87756  580.2394 15.76944  -28.00336      44.74824  
1 1 1 13 9  8  o 363.0815 7.604662  87.96038       3.679235      85.75255       4.745562      91.28723       5.825327      358.1721 9.952761  369.3104 11.85272  -11.13828      15.47722  
1 1 1 13 9  9  o 554.1574 9.396123  205.0868       6.938337      197.5353       8.596177      219.2025       11.75278      543.4768 11.87000  571.5577 15.44561  -28.08093      19.47983  
1 1 1 13 9  10 o 282.2115 8.842176  53.23500       3.321018      54.52193       5.313869      52.41017       4.254184      284.9131 14.03992  279.7096 11.43806  5.203552       18.10935  
1 1 1 13 9  11 o 589.7994 13.32612  233.0784       10.47325      226.2366       12.71257      247.5327       18.47762      579.9930 16.46557  604.0463 22.99833  -24.05322      28.28495  
1 1 1 13 9  12 o 234.5510 7.713441  36.77111       2.407509      36.54937       2.608210      38.04784       6.258481      233.7739 8.386432  236.4655 20.05108  -2.691620      21.73426  
1 1 1 13 9  13 o 217.5931 5.700931  31.60849       1.651544      31.60316       1.780792      31.64127       4.415674      217.5392 6.149477  216.3492 15.41785  1.190033       16.59898  
1 1 1 13 9  14 o 417.2408 8.226795  116.3599       4.573946      113.7417       4.928939      132.5966       12.27458      412.3961 8.969441  441.1006 20.94293  -28.70456      22.78283  
1 1 1 13 9  15 f 99.52643 2.360965  6.601670       0.3131134     6.587864       0.3134948     12.26447       6.349226      99.42224 2.366319  129.0787 35.70906  -29.65643      35.78738  
1 1 1 13 9  16 o 305.8797 8.684927  62.68587       3.536311      62.40639       3.747775      64.95485       10.67872      305.0868 9.229459  304.4599 26.58829  0.6268616      28.14462  
1 1 1 13 9  17 o 57.64232 10.11403  2.294397       0.7485350     2.138560       0.7569979     9.147497       5.019987      55.51836 10.61939  111.4619 32.07577  -55.94355      33.78796  
1 1 1 13 9  18 f 334.7613 7.229850  74.99343       3.225062      69.15903       4.100382      84.45736       5.222303      320.7984 9.603020  354.0423 11.08329  -33.24396      14.66483  
1 1 1 13 9  19 o 51.78473 18.65458  1.581670       1.644600      2.607635       1.918549      -1.261147      3.193604      62.12624 20.21672  50.44238 22.68797  11.68386       30.38848  
1 1 1 13 9  20 o 103.0446 19.56996  7.583502       2.588896      6.088181       3.033367      11.59410       4.967780      91.07073 24.47436  123.6195 30.37834  -32.54879      39.01074  
1 1 1 13 9  21 o 274.7022 9.251800  50.86166       3.381752      49.13615       4.645742      52.80648       4.932137      268.4857 13.02441  278.1996 13.34360  -9.713867      18.64637  
1 1 1 13 9  22 o 180.1044 9.187838  21.92846       2.197727      23.14620       3.917437      21.36916       2.654876      182.3001 16.29830  177.1306 11.30709  5.169525       19.83645  
1 1 1 13 9  23 o 56.29008 10.77436  2.221864       0.7787321     5.310331       4.719336      2.135417       0.7895553     85.72495 31.49280  55.08160 11.14051  30.64334       33.40520  
1 1 1 13 9  24 o 64.41640 6.655004  2.819829       0.5630244     13.26350       5.954334      2.725610       0.5655584     123.2745 34.75727  63.28964 6.813319  59.98483       35.41877  
1 1 1 13 9  25 o 103.6966 5.367146  7.239003       0.7390960     6.840715       5.330896      7.246809       0.7463036     89.25108 33.34415  103.7425 5.417420  -14.49147      33.78137  
1 1 1 13 9  26 o 166.6193 5.534387  18.71156       1.227059      21.32849       4.799371      18.52854       1.269243      164.4487 22.49048  165.7238 5.756340  -1.275040      23.21545  
1 1 1 13 9  27 o 57.49307 10.15341  2.359894       0.7494247     -5.316922      6.942306      2.450408       0.7538298     56.87996 27.78559  58.66452 10.00166  -1.784565      29.53087  
1 1 1 13 9  28 o 66.19390 3.462685  2.946051       0.3043629     18.28965       6.879519      2.915959       0.3046612     116.8870 38.29865  65.85030 3.484452  51.03672       38.45683  
1 1 1 13 9  29 o 34.20406 14.82172  0.1647840      1.246688      -9.019413      5.378463      0.6862482      1.281592      43.08004 21.60923  38.27436 15.70688  4.805687       26.71451  
1 1 1 13 9  30 o 20.73019 10.14334  -1.590262      0.9365047     2.237749       2.148077      -2.488617      1.040608      52.57628 20.76272  19.62660 9.793669  32.94968       22.95662  
1 1 1 13 9  31 o 21.01845 10.25574  -1.480016      0.9380792     -2.319903      1.304288      -0.5799722     1.350191      23.57516 11.62155  30.46447 14.09490  -6.889301      18.26819  
1 1 1 13 10 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 13 10 1  o 435.9693 12.42565  127.1932       7.211164      116.8538       15.34289      130.1248       8.169750      414.1441 27.96639  440.7223 13.92887  -26.57816      31.24312  
1 1 1 13 10 2  o 222.4081 4.733707  32.97405       1.402896      39.93843       5.075680      32.39800       1.459763      243.6345 15.71830  220.4509 4.969318  23.18359       16.48512  
1 1 1 13 10 3  o 306.0887 7.364384  62.50170       3.003705      60.36130       3.947926      65.44375       4.628560      300.4884 9.873198  312.7587 11.12385  -12.27029      14.87347  
1 1 1 13 10 4  o 377.8757 8.101404  95.28469       4.079273      107.5068       11.68858      93.58960       4.352970      398.7846 22.08254  374.4526 8.723993  24.33200       23.74335  
1 1 1 13 10 5  o 252.2657 9.817075  42.56339       3.293700      41.57802       5.818145      43.02811       3.995603      248.2428 17.70495  253.4176 11.86532  -5.174789      21.31317  
1 1 1 13 10 6  o 394.1361 11.46273  103.9288       6.013763      89.57157       14.72126      106.8047       6.588589      361.1183 30.88934  399.4178 12.39417  -38.29953      33.28313  
1 1 1 13 10 7  o 321.6601 9.864667  69.17679       4.223179      71.82294       5.607039      65.70752       6.420154      327.3612 12.87897  312.6782 15.45690  14.68298       20.11924  
1 1 1 13 10 8  o 832.7667 19.89089  467.2007       22.07248      471.5518       28.79565      461.0022       34.36909      833.0252 25.97324  819.8741 31.51788  13.15112       40.84098  
1 1 1 13 10 9  o 364.0985 5.663738  88.40975       2.747866      84.29264       3.736295      93.26023       4.055433      355.3586 7.890432  373.7609 8.142728  -18.40228      11.33856  
1 1 1 13 10 10 o 406.0810 7.331698  110.0628       3.967261      106.1775       4.409051      126.5875       9.092886      398.7498 8.297957  433.8302 15.75543  -35.08047      17.80701  
1 1 1 13 10 11 o 77.19939 4.841115  3.989763       0.4954968     4.021769       0.5053595     3.193721       2.520338      77.50368 4.918707  70.11418 23.19117  7.389496       23.70705  
1 1 1 13 10 12 o 197.6486 7.006861  26.11299       1.842481      24.97163       1.949008      35.70612       5.650445      193.2201 7.584592  229.1227 18.66888  -35.90253      20.15076  
1 1 1 13 10 13 o 148.2218 7.542740  14.71490       1.484856      14.63677       1.600695      15.19684       3.975571      147.7603 8.161455  148.1828 20.69781  -0.4224701     22.24879  
1 1 1 13 10 14 o 484.3119 10.41780  157.2069       6.723177      157.2200       7.517691      157.1543       15.02589      483.9713 11.65712  477.8499 23.67168  6.121399       26.38630  
1 1 1 13 10 15 o 695.8687 10.45725  324.8444       9.696574      319.7037       12.05368      334.2723       16.32361      688.9855 13.12913  701.6227 17.45979  -12.63721      21.84533  
1 1 1 13 10 16 o 100.7826 7.931611  6.839261       1.056595      6.900783       1.074931      5.081870       5.745126      101.2237 8.035270  92.36924 34.59375  8.854477       35.51469  
1 1 1 13 10 17 o 106.3144 6.594149  7.586175       0.9295685     7.584035       0.9849199     7.603624       2.812495      106.2506 6.995503  103.2174 21.15989  3.033150       22.28628  
1 1 1 13 10 18 o 298.8749 7.767822  59.89019       3.090965      62.00807       4.070473      57.00563       4.750450      303.4699 10.07996  290.2061 12.31240  13.26379       15.91228  
1 1 1 13 10 19 o 64.79996 16.42070  2.985774       1.419401      2.436151       1.638422      4.639173       2.841726      59.47995 18.61069  80.38512 24.39794  -20.90517      30.68578  
1 1 1 13 10 20 o 42.25570 19.51860  -1.842838      2.573855      -3.653829      3.981457      -0.5426356     3.373568      49.81142 23.42371  54.29005 23.93110  -4.478626      33.48683  
1 1 1 13 10 21 o 181.0039 7.954990  22.05673       1.913988      17.80345       3.304376      24.20422       2.347975      160.1313 15.68706  189.2631 9.338933  -29.13179      18.25649  
1 1 1 13 10 22 o 265.5779 7.843916  47.50054       2.772824      47.04789       6.241283      47.61185       3.095042      258.3206 18.24928  265.5392 8.759090  -7.218658      20.24248  
1 1 1 13 10 23 o 95.73845 6.038417  6.174788       0.7664167     13.60603       5.118352      6.004344       0.7751561     129.6898 30.18554  94.37463 6.198277  35.31518       30.81534  
1 1 1 13 10 24 o 40.74064 11.33212  1.175308       0.6375136     -2.035620      3.824810      1.267062       0.6465582     50.90619 23.61180  42.21388 11.27931  8.692314       26.16753  
1 1 1 13 10 25 o 125.9213 6.275205  10.71870       1.049615      7.582054       3.288688      11.07445       1.107538      95.74344 25.37308  127.9265 6.518666  -32.18305      26.19706  
1 1 1 13 10 26 o 67.81050 9.168127  3.215255       0.8072181     0.5008014      4.195607      3.319596       0.8225861     57.98881 26.04988  68.91270 9.186574  -10.92389      27.62226  
1 1 1 13 10 27 o 112.1223 4.460120  8.470298       0.6650354     5.308233       6.258455      8.506411       0.6688221     74.09644 32.63100  112.3570 4.476177  -38.26052      32.93658  
1 1 1 13 10 28 o 68.69556 15.19209  3.669038       1.353707      2.904265       4.989827      3.729797       1.406454      63.07735 28.36616  68.97974 15.66049  -5.902397      32.40200  
1 1 1 13 10 29 o 32.04482 12.44930  0.5631455      0.7617454     -1.482631      2.258948      0.8256221      0.8091378     36.62186 17.34842  35.51302 13.04119  1.108845       21.70346  
1 1 1 13 10 30 o 32.52928 13.68946  0.3620872      1.009064      2.747353       1.461164      -1.812627      1.395185      56.68126 17.55005  26.36055 12.78083  30.32071       21.71069  
1 1 1 13 10 31 o 58.27493 13.45854  2.694175       1.024007      -0.1554438     1.583267      4.743410       1.342631      34.72583 15.76216  77.89704 13.41912  -43.17121      20.70069  
1 1 1 13 11 0  o 710.7844 51.62812  352.7706       48.29356      352.7706       48.29356      352.7706       48.29356      710.7844 51.62812  710.7844 51.62812  0.000000       0.000000  
1 1 1 13 11 1  o 311.8354 6.267844  64.85130       2.604456      60.94022       13.47684      65.00304       2.654496      296.1556 34.81449  312.1944 6.380924  -16.03876      35.39442  
1 1 1 13 11 2  o 355.6525 6.831902  84.37299       3.237732      75.95747       8.252605      85.90397       3.519943      335.7089 18.51999  358.8309 7.361602  -23.12201      19.92945  
1 1 1 13 11 3  o 174.0711 6.417628  20.23685       1.486040      29.27752       4.342365      19.03761       1.581533      208.3810 15.75521  168.7841 7.047413  39.59686       17.25957  
1 1 1 13 11 4  o 268.8896 7.027873  48.26692       2.515932      56.63374       4.021334      42.88534       3.225112      290.9560 10.38884  253.2228 9.575282  37.73322       14.12848  
1 1 1 13 11 5  o 233.5184 7.117640  36.41537       2.212195      0.000000       0.000000      36.41537       2.212195      ?        ?         233.5184 7.117640  0.000000       7.117640  
1 1 1 13 11 6  o 158.1520 8.828334  16.75308       1.853105      17.60628       2.868487      16.14195       2.427693      161.5956 13.44304  154.8964 11.85195  6.699142       17.92160  
1 1 1 13 11 7  f 140.8368 5.782397  13.25074       1.082862      13.70074       1.348372      12.43331       1.817308      143.1176 7.092483  136.0279 10.09801  7.089722       12.33990  
1 1 1 13 11 8  o 108.9094 1.949724  7.903655       0.2829515     7.848457       0.2858109     10.62094       2.005339      108.5283 1.976344  125.3786 12.15536  -16.85031      12.31498  
1 1 1 13 11 9  o 226.9905 1.383211  34.33115       0.4183787     34.34514       0.4213300     33.34350       3.540977      227.0367 1.392685  222.8308 11.96936  4.205902       12.05011  
1 1 1 13 11 10 o 254.4363 7.030913  43.24786       2.381485      42.72594       2.931332      44.26114       4.084411      252.7133 8.717949  256.7564 11.97104  -4.043106      14.80906  
1 1 1 13 11 11 o 21.38307 10.17037  -1.012328      0.7918255     -0.8543851     0.8243216     -2.897916      2.848198      22.86130 10.72124  42.37561 19.89063  -19.51431      22.59607  
1 1 1 13 11 12 o 279.1617 8.149177  52.13623       3.028155      53.65915       4.081929      50.27239       4.515775      282.7680 10.85347  273.3758 12.42900  9.392212       16.50085  
1 1 1 13 11 13 o 395.6436 8.960327  104.7616       4.723910      106.1420       5.558875      101.1739       8.961875      397.7744 10.49679  386.0219 17.46788  11.75244       20.37914  
1 1 1 13 11 14 o 360.4969 8.799684  87.01231       4.227096      85.84855       4.527939      94.90731       11.79353      357.8080 9.505212  369.9815 24.05197  -12.17343      25.86207  
1 1 1 13 11 15 o 252.2376 6.319090  42.53814       2.122247      40.75780       2.280808      54.02344       5.793061      246.8099 6.941996  281.9319 15.47962  -35.12199      16.96496  
1 1 1 13 11 16 f 436.6622 13.78521  129.1295       8.011026      121.0090       10.03796      143.3746       13.29498      420.3239 17.96347  454.5188 22.01690  -34.19485      28.41532  
1 1 1 13 11 17 o 92.60473 6.919582  5.770391       0.8476867     5.441396       0.9121634     7.853835       2.295455      89.80301 7.696843  106.0026 16.81137  -16.19958      18.48955  
1 1 1 13 11 18 o 62.43836 8.310802  2.660923       0.6743057     3.040271       0.7115399     -0.6817580     2.112164      66.83791 8.158047  42.02459 18.70803  24.81332       20.40941  
1 1 1 13 11 19 o 49.45051 17.86539  1.441382       1.509716      1.806889       1.780449      0.5061276      2.848040      54.41440 19.43278  54.50085 22.97072  -0.8645248E-01 30.08799  
1 1 1 13 11 20 o 145.3203 7.045352  14.19380       1.360212      10.96663       2.709465      15.28118       1.572764      125.0715 16.67231  150.6387 7.862473  -25.56723      18.43324  
1 1 1 13 11 21 o 91.34130 11.40821  5.751763       1.358348      5.686099       2.779231      5.772372       1.556982      87.21914 23.42118  90.99685 13.22763  -3.777710      26.89837  
1 1 1 13 11 22 o 21.12886 9.502391  -0.2635132     0.5600588     0.8218345      3.321949      -0.2952653     0.5681921     58.27728 24.69722  21.04651 9.508653  37.23077       26.46445  
1 1 1 13 11 23 o 24.69406 11.44605  -0.7168436     0.8964944     4.961964       4.801371      -0.9219754     0.9125425     81.96799 31.41044  23.86826 11.22087  58.09972       33.35452  
1 1 1 13 11 24 o 142.1415 11.05781  14.00649       2.077954      12.37652       4.444982      14.46232       2.350621      121.6331 28.00441  143.7442 12.39299  -22.11103      30.62406  
1 1 1 13 11 25 o 28.10133 13.19137  -1.123937      1.253095      -2.068190      3.794002      -1.008319      1.327597      48.99926 22.98608  29.67612 13.81437  19.32314       26.81785  
1 1 1 13 11 26 o 104.3651 8.039268  7.507736       1.109398      10.34863       4.461813      7.320529       1.145368      101.9407 30.49068  102.8792 8.428788  -0.9384613     31.63426  
1 1 1 13 11 27 o 39.96625 14.22267  1.093558       0.9529051     -0.5532204     1.850158      1.688106       1.111692      37.00913 16.89161  47.31294 15.38871  -10.30381      22.85036  
1 1 1 13 11 28 o 72.45158 9.534124  3.745844       0.8981381     7.757007       5.770395      3.646259       0.9092188     76.49448 32.48928  71.32507 9.827416  5.169411       33.94306  
1 1 1 13 11 29 o 26.46693 12.26648  -0.6167883     1.029202      -2.140095      1.239654      2.762529       1.846381      23.44260 11.51146  56.36351 19.82189  -32.92090      22.92206  
1 1 1 13 11 30 o 21.97093 10.16721  -0.4482866     0.7030531     2.390911       1.426972      -1.358404      0.8079161     52.80760 17.44956  19.31765 9.445608  33.48996       19.84205  
1 1 1 13 12 0  o 314.7960 8.067972  66.21454       3.379263      66.21454       3.379263      66.21454       3.379263      314.7960 8.067972  314.7960 8.067972  0.000000       0.000000  
1 1 1 13 12 1  o 278.8032 4.111041  51.81399       1.527295      51.92193       5.700689      51.80564       1.585247      277.7990 15.46108  278.7755 4.267455  -0.9765625     16.03921  
1 1 1 13 12 2  o 42.30472 12.01918  1.227009       0.7092610     1.782743       4.019915      1.209153       0.7205653     70.75245 28.25293  42.07977 12.16555  28.67268       30.76083  
1 1 1 13 12 3  o 131.5968 12.10735  11.68427       2.099307      13.38572       3.256413      10.47428       2.746122      139.9894 17.86346  123.7123 17.11647  16.27708       24.74018  
1 1 1 13 12 4  o 174.2759 4.448568  20.26095       1.032229      20.28345       2.706833      20.25712       1.116606      173.7263 11.76225  174.2408 4.813853  -0.5145111     12.70920  
1 1 1 13 12 5  o 240.5505 8.182676  38.67917       2.619042      35.31351       6.538748      39.32232       2.858347      227.5102 21.83630  242.4764 8.861412  -14.96625      23.56583  
1 1 1 13 12 6  o 143.8889 9.458304  13.89478       1.803430      14.68082       2.251005      12.48597       3.013545      147.6686 11.53107  135.1906 17.11122  12.47806       20.63393  
1 1 1 13 12 7  o 433.8234 9.125261  125.7666       5.275114      122.1768       10.36612      127.0211       6.127888      425.2874 18.33503  435.7627 10.55328  -10.47531      21.15526  
1 1 1 13 12 8  o 166.2447 1.708122  18.41570       0.3783906     18.53803       0.3827357     13.11948       2.518309      166.7958 1.722028  139.1541 13.76123  27.64169       13.86856  
1 1 1 13 12 9  o 454.6937 17.51570  139.7320       10.59271      146.9215       13.57359      128.5336       16.94042      464.3748 21.99829  430.3468 29.72408  34.02808       36.97900  
1 1 1 13 12 10 o 181.1327 7.593322  21.95686       1.828681      21.46259       2.257704      22.89966       3.118133      178.8518 9.507436  184.2533 12.77924  -5.401550      15.92798  
1 1 1 13 12 11 o 491.2703 8.726551  161.4443       5.712637      161.4715       6.873298      161.3834       10.27322      490.8708 10.50811  488.7160 15.79600  2.154755       18.97193  
1 1 1 13 12 12 o 548.1913 9.715487  201.3288       7.096925      202.0431       9.517191      200.4340       10.65145      547.9575 13.03432  544.8586 14.68411  3.098877       19.63457  
1 1 1 13 12 13 o 297.5622 7.933310  59.27833       3.142810      57.46706       3.673327      64.22577       6.070978      292.6856 9.430877  307.9173 14.83992  -15.23169      17.58308  
1 1 1 13 12 14 f 134.5731 6.143289  12.12433       1.098717      12.57425       1.209540      10.00115       2.627535      136.9971 6.645579  120.1753 16.87223  16.82185       18.13384  
1 1 1 13 12 15 o 166.5696 4.377774  18.52759       0.9708364     18.48565       1.004431      19.12324       3.785464      166.3671 4.535074  166.5457 17.30958  -0.1786194     17.89381  
1 1 1 13 12 16 o 231.4058 3.604868  35.72011       1.111571      35.44137       1.153444      39.35146       4.163236      230.4894 3.755537  240.8161 13.02239  -10.32675      13.55310  
1 1 1 13 12 17 f 314.1833 7.237811  66.12042       3.030148      68.20200       3.975126      63.23325       4.681567      318.3790 9.380083  305.7939 11.50972  12.58505       14.84788  
1 1 1 13 12 18 o 357.4240 7.154195  85.60934       3.407359      86.09794       4.129572      84.56720       6.031052      357.9637 8.657501  352.7647 12.85171  5.199005       15.49577  
1 1 1 13 12 19 f 64.01834 20.27353  2.860436       1.938685      4.825123       2.295174      -2.031995      3.621858      81.32338 21.02618  51.13852 23.45065  30.18486       31.49656  
1 1 1 13 12 20 o 156.0728 10.17388  16.54576       2.104330      15.63543       3.155713      17.27468       2.823814      149.5764 16.08542  158.3546 13.51128  -8.778168      21.00703  
1 1 1 13 12 21 o 185.8938 7.641734  23.30215       1.888876      26.80384       2.490697      18.56208       2.897842      198.7863 9.429763  163.8115 13.39248  34.97484       16.37922  
1 1 1 13 12 22 o 46.17836 20.72947  -0.7210914     2.651518      -2.042672      3.492566      1.076972       4.073806      48.79100 22.60722  63.18266 27.07957  -14.39166      35.27590  
1 1 1 13 12 23 o 62.30290 26.69551  1.314184       3.957162      5.362746       5.166209      -4.433198      6.155404      82.68575 32.33564  59.04478 28.15982  23.64098       42.87854  
1 1 1 13 12 24 o 49.20327 18.35741  1.535096       1.614694      -1.480753      4.629881      1.952708       1.722865      55.82260 25.92172  53.21197 19.10275  2.610630       32.20017  
1 1 1 13 12 25 o 113.5679 11.28774  9.124284       1.685603      11.92599       4.217032      8.591537       1.838892      114.7956 27.85488  109.2350 12.88081  5.560616       30.68892  
1 1 1 13 12 26 o 101.8226 9.253738  7.260517       1.241852      5.170398       2.039230      8.492571       1.565653      79.43723 19.42855  109.1880 10.90664  -29.75080      22.28056  
1 1 1 13 12 27 o 36.67302 17.06993  -0.9881521     2.026345      0.4235238      4.630897      -1.322451      2.253537      55.46426 25.81273  37.53021 17.64035  17.93404       31.26466  
1 1 1 13 12 28 o 72.12380 11.38604  3.831826       1.058004      6.221756       1.679347      2.258936       1.362376      89.82554 14.52586  52.72238 17.02679  37.10316       22.38107  
1 1 1 13 12 29 o 27.49172 11.92542  0.5457628E-01  0.8087720     4.642284       1.284739      -2.957013      1.040914      78.01331 12.80239  18.45519 9.290557  59.55812       15.81820  
1 1 1 13 12 30 o 16.18600 8.079536  -1.748600      0.7108178     -4.454665      1.638653      -1.121388      0.7889053     22.87214 11.53218  19.92234 9.647738  2.949802       15.03563  
1 1 1 13 13 0  o 857.4683 22.50432  495.0594       25.67325      495.0594       25.67325      495.0594       25.67325      857.4683 22.50432  857.4683 22.50432  0.000000       0.000000  
1 1 1 13 13 1  o 292.6320 5.574489  57.11434       2.173704      57.82905       2.549670      55.21269       4.158955      294.4016 6.499355  287.0894 10.89135  7.312195       12.68319  
1 1 1 13 13 2  o 345.1779 6.874976  79.51268       3.162189      82.53280       7.705554      78.90106       3.467633      349.9256 16.57259  343.7885 7.569519  6.137146       18.21945  
1 1 1 13 13 3  o 333.2499 13.41603  74.58247       5.945369      74.97943       6.604051      72.88499       13.65651      333.8331 14.88335  323.4741 32.10629  10.35898       35.38825  
1 1 1 13 13 4  o 615.0397 10.34581  253.0169       8.478937      247.6525       14.58653      255.7545       10.42023      605.7959 18.09001  617.7589 12.65858  -11.96295      22.07913  
1 1 1 13 13 5  o 237.6561 8.663346  37.78883       2.738929      30.12849       4.070179      44.12838       3.702707      211.3059 14.54405  256.5509 10.85563  -45.24500      18.14867  
1 1 1 13 13 6  o 176.8602 8.343803  20.94541       1.960837      18.43965       4.372802      21.57607       2.193760      163.7644 20.48545  179.4123 9.207004  -15.64783      22.45936  
1 1 1 13 13 7  o 262.4611 5.495828  45.95667       1.922081      43.60642       2.329078      50.97499       3.403346      255.4773 6.847784  275.9294 9.269397  -20.45216      11.52449  
1 1 1 13 13 8  o 161.2401 1.467683  17.32343       0.3153398     17.39105       0.3175445     12.50457       2.680708      161.5544 1.475069  135.4557 15.10872  26.09866       15.18055  
1 1 1 13 13 9  o 177.1764 9.136348  21.06080       2.149725      19.76759       2.597481      23.87241       3.829968      171.2910 11.44573  187.5129 15.46555  -16.22192      19.24027  
1 1 1 13 13 10 o 199.0606 7.349137  26.51766       1.946028      26.90475       2.026761      21.94713       6.964301      200.4796 7.600569  174.5351 31.08454  25.94443       32.00027  
1 1 1 13 13 11 o 235.4212 8.132541  37.12327       2.547374      33.97216       3.883710      39.50257       3.374734      224.2436 13.05374  242.4404 10.47095  -18.19685      16.73442  
1 1 1 13 13 12 o 34.78412 14.75024  0.4919790E-01  1.186174      0.5026829      1.506313      -0.6910330     1.924498      42.13294 17.12749  40.07342 17.84738  2.059525       24.73621  
1 1 1 13 13 13 o 83.52165 11.60481  4.782388       1.256707      4.515716       1.484580      5.456603       2.360554      80.53854 14.36003  87.41123 20.60502  -6.872688      25.11528  
1 1 1 13 13 14 o 218.6957 6.606322  32.01254       1.922982      34.24056       2.620222      29.41162       2.831009      225.8054 8.724655  208.9436 10.19888  16.86179       13.42151  
1 1 1 13 13 15 f 254.0706 6.969771  43.23705       2.357415      42.87445       3.022135      43.80058       3.767537      252.5583 8.994411  254.6849 11.12834  -2.126587      14.30872  
1 1 1 13 13 16 o 131.1875 3.393960  11.48773       0.5927997     11.34565       0.6194863     13.03103       2.041689      130.3603 3.569618  138.5340 11.15433  -8.173706      11.71159  
1 1 1 13 13 17 o 191.6767 1.611579  24.48558       0.4116181     24.44291       0.4147822     27.25075       3.338808      191.5091 1.625388  200.0719 12.58747  -8.562820      12.69198  
1 1 1 13 13 18 o 204.3006 7.260759  28.03109       1.973487      27.95139       2.346685      28.22362       3.647277      203.6676 8.666692  203.0226 13.55963  0.6450043      16.09270  
1 1 1 13 13 19 o 220.7767 7.639221  32.79366       2.243990      31.85150       2.423533      38.45486       5.940770      217.3625 8.383121  233.2445 19.28651  -15.88199      21.02965  
1 1 1 13 13 20 o 63.49121 14.84226  2.894915       1.233076      2.355536       1.336126      5.992550       3.201957      57.36378 16.56054  88.46614 25.66550  -31.10236      30.54455  
1 1 1 13 13 21 o 232.1620 9.113776  36.59985       2.813963      37.01231       3.011255      33.75805       7.904144      233.1714 9.712941  205.6405 29.70500  27.53090       31.25266  
1 1 1 13 13 22 o 92.79028 21.86520  6.658337       2.658882      5.942970       3.262163      8.074160       4.589293      85.74769 26.16382  96.65482 31.25354  -10.90714      40.75940  
1 1 1 13 13 23 o 89.59942 31.46168  7.283405       4.650276      4.152779       5.441811      15.75836       8.953578      76.35551 31.93928  113.8709 43.06929  -37.51534      53.61979  
1 1 1 13 13 24 o 98.10962 30.68470  9.297894       4.454422      4.727439       5.372976      19.34403       7.965899      75.30923 31.63453  124.9596 41.22550  -49.65034      51.96427  
1 1 1 13 13 25 o 66.04625 19.19184  3.543948       1.789100      4.158498       1.852633      -4.958009      6.890809      71.58512 19.07757  56.01462 27.43043  15.57050       33.41231  
1 1 1 13 13 26 o 62.15934 14.30201  2.964442       1.159970      -5.126459      2.142340      6.320255       1.379713      27.49763 13.77072  93.54369 11.29735  -66.04605      17.81187  
1 1 1 13 13 27 o 40.06952 14.05804  1.144606       0.9283317     6.368836       5.238140      0.9751982      0.9432633     72.18014 30.81541  38.22491 14.07325  33.95523       33.87692  
1 1 1 13 13 28 o 38.66265 14.71344  0.9901860      1.048812      -3.950631      1.601626      4.699536       1.387748      23.58498 11.82496  77.90816 13.87643  -54.32318      18.23143  
1 1 1 13 13 29 o 22.92453 10.66003  -0.5341185     0.7872165     -1.399842      1.714586      -0.3028792     0.8861364     31.13767 14.85357  25.95495 11.78537  5.182714       18.96110  
1 1 1 13 14 0  o 100.1199 4.304330  6.718113       0.5718268     6.718113       0.5718268     6.718113       0.5718268     100.1199 4.304330  100.1199 4.304330  0.000000       0.000000  
1 1 1 13 14 1  o 412.4646 8.982739  113.7350       4.937067      113.3463       5.583462      115.1279       10.57072      411.5605 10.18114  412.0284 19.30693  -0.4679871     21.82689  
1 1 1 13 14 2  o 436.3874 9.317642  127.3503       5.418160      129.7818       6.578242      122.2213       9.554145      440.0246 11.22831  425.3899 16.88866  14.63474       20.28057  
1 1 1 13 14 3  o 71.24307 25.92371  2.905592       3.186345      0.9595171      3.455309      13.96610       8.237485      62.60057 25.75090  138.2494 41.44777  -75.64886      48.79576  
1 1 1 13 14 4  o 495.3343 13.67454  164.9938       9.017140      170.4954       10.20168      145.3442       19.27982      502.9719 15.23897  455.5578 31.96323  47.41403       35.41009  
1 1 1 13 14 5  o 465.9149 11.58422  145.5576       7.191953      141.5692       10.93818      148.5950       9.545405      457.0967 17.99337  469.4051 15.28101  -12.30835      23.60658  
1 1 1 13 14 6  o 225.8595 7.734895  34.13061       2.324475      35.59494       5.272848      33.77739       2.589695      228.7452 17.43019  224.5655 8.670596  4.179764       19.46768  
1 1 1 13 14 7  o 400.7976 9.082786  107.5055       4.850849      119.9688       9.371822      102.9446       5.669376      420.8356 16.74580  391.6786 10.87307  29.15701       19.96611  
1 1 1 13 14 8  o 105.0707 6.963693  7.408257       0.9694765     6.966754       1.078569      9.265521       2.212168      101.7548 8.019394  116.3340 14.59052  -14.57918      16.64915  
1 1 1 13 14 9  o 212.5194 6.272242  30.19195       1.774269      31.09424       2.333711      28.95599       2.731333      215.4303 8.144222  207.5997 9.902122  7.830536       12.82109  
1 1 1 13 14 10 o 153.9243 4.461346  15.82002       0.9140884     16.36957       1.135928      14.81034       1.539718      156.4937 5.455632  148.5853 7.803998  7.908432       9.521886  
1 1 1 13 14 11 o 243.0005 8.370691  39.59227       2.706406      40.44144       4.067544      38.91769       3.625378      244.6481 12.51882  240.2816 11.35506  4.366440       16.90143  
1 1 1 13 14 12 f 100.5124 8.257338  6.812999       1.096201      8.931952       1.754590      5.456395       1.403918      114.5856 11.65333  89.18019 12.12806  25.40546       16.81933  
1 1 1 13 14 13 o 47.67776 12.99380  1.587121       0.8478934     2.311532       2.090811      1.444538       0.9275918     60.54898 21.10772  45.99788 13.93477  14.55110       25.29255  
1 1 1 13 14 14 o 88.87257 9.208086  5.360923       1.074681      5.964864       1.261154      3.759537       2.053614      93.59524 10.28116  72.59664 20.39229  20.99860       22.83742  
1 1 1 13 14 15 o 79.69270 8.595814  4.312572       0.8983843     4.178782       0.9692966     5.127874       2.392801      78.26994 9.487126  84.14890 21.31829  -5.878952      23.33399  
1 1 1 13 14 16 o 331.4688 6.092851  73.51864       2.691143      73.90241       3.047163      72.15816       5.737245      332.1354 6.885047  325.5370 13.25374  6.598358       14.93538  
1 1 1 13 14 17 o 218.6201 2.332325  31.86630       0.6794426     31.83152       0.6820508     36.38818       7.776669      218.5000 2.342565  222.3876 26.78119  -3.887573      26.88345  
1 1 1 13 14 18 o 132.3623 7.779756  11.81826       1.366107      11.66887       1.451949      12.97074       4.032844      131.4007 8.335360  132.5045 23.71121  -1.103775      25.13363  
1 1 1 13 14 19 o 69.99881 12.30948  3.442746       1.106268      3.289817       1.154954      5.142811       3.850812      68.15464 13.19421  83.14014 28.66361  -14.98550      31.55455  
1 1 1 13 14 20 o 66.90171 18.52476  3.303355       1.707860      3.309090       1.733507      3.113810       9.965298      66.94259 18.71111  89.64307 40.21817  -22.70049      44.35771  
1 1 1 13 14 21 o 67.79594 20.27253  3.466715       1.972590      2.935244       2.085191      7.992801       6.085092      63.33438 21.09904  94.97466 35.59575  -31.64028      41.37906  
1 1 1 13 14 22 o 58.44228 23.29264  1.997796       2.727096      1.871101       3.324075      2.258626       4.769490      60.62821 25.12885  68.06048 29.23763  -7.432266      38.55254  
1 1 1 13 14 23 o 34.43083 15.34334  -0.2969768     1.424506      -0.3267858     1.437926      1.277720       10.45109      34.42897 15.37411  76.26081 36.45886  -41.83184      39.56781  
1 1 1 13 14 24 o 63.20912 19.09840  3.212127       1.744029      3.829974       1.785293      -9.691830      8.158880      68.96688 18.87884  55.31523 27.57396  13.65165       33.41757  
1 1 1 13 14 25 o 42.41200 18.03626  0.6356310      1.782215      0.4669644      1.831647      3.634583       7.723462      41.83209 18.04596  69.00701 32.50427  -27.17492      37.17774  
1 1 1 13 14 26 o 38.12145 18.64866  -3.833114      3.160106      -6.423387      4.987432      -2.095686      4.084675      44.38567 22.03097  47.09747 22.59010  -2.711803      31.55434  
1 1 1 13 14 27 o 45.78086 15.25069  1.628660       1.089433      2.914226       1.663423      0.6630380      1.441647      58.19229 18.81597  39.00113 16.38486  19.19117       24.95003  
1 1 1 13 14 28 o 18.32644 9.041995  -1.573576      0.7954147     0.7736121      1.771313      -2.166434      0.8902187     41.42743 17.80746  18.08363 9.029099  23.34380       19.96573  
1 1 1 13 15 0  o 421.8764 28.33415  122.6374       15.76085      122.6374       15.76085      122.6374       15.76085      421.8764 28.33415  421.8764 28.33415  0.000000       0.000000  
1 1 1 13 15 1  o 430.6865 15.35255  125.2818       8.796706      125.2818       8.796706      0.000000       0.000000      430.6865 15.35255  ?        ?         0.000000       15.35255  
1 1 1 13 15 2  o 267.6665 22.62700  49.36456       7.994864      49.36456       7.994864      0.000000       0.000000      267.6665 22.62700  ?        ?         0.000000       22.62700  
1 1 1 13 15 3  o 300.6941 17.96298  61.52007       7.164613      61.52007       7.164613      0.000000       0.000000      300.6941 17.96298  ?        ?         0.000000       17.96298  
1 1 1 13 15 4  o 121.5005 9.090106  9.936320       1.461037      8.799672       1.784841      12.24484       2.543628      113.8535 11.94218  134.0194 14.47262  -20.16587      18.76360  
1 1 1 13 15 5  o 167.2028 6.547917  18.70234       1.456062      16.37961       3.270210      19.27668       1.626147      154.8145 16.08649  169.6826 7.208411  -14.86803      17.62772  
1 1 1 13 15 6  o 189.6495 6.310750  24.04933       1.592578      21.84023       4.236360      24.41291       1.718645      178.3873 18.07097  191.0289 6.762375  -12.64154      19.29481  
1 1 1 13 15 7  o 432.5446 8.503607  125.2468       4.901258      119.3774       7.267938      130.1425       6.637705      420.7726 12.97806  439.9679 11.33144  -19.19537      17.22880  
1 1 1 13 15 8  o 138.6405 5.983057  12.86211       1.102715      14.30447       1.463233      10.96617       1.677604      146.0426 7.544583  127.4723 9.955334  18.57028       12.49117  
1 1 1 13 15 9  o 128.1396 4.978421  10.97660       0.8484402     11.43789       0.8944583     6.836473       2.679670      130.7939 5.142166  97.90366 21.15865  32.89028       21.77453  
1 1 1 13 15 10 o 236.9038 8.981657  37.68874       2.830185      36.43342       4.397069      38.57666       3.698053      231.5186 14.32305  239.0482 11.64455  -7.529663      18.45929  
1 1 1 13 15 11 o 245.4009 8.982556  40.45919       2.932352      41.66700       3.339746      36.39473       6.126548      248.7716 10.09584  228.8322 20.30259  19.93933       22.67424  
1 1 1 13 15 12 o 320.7573 9.377268  69.17379       4.003685      68.94708       4.267383      70.83994       11.56878      320.0262 10.01931  313.7490 27.96420  6.277191       29.70494  
1 1 1 13 15 13 o 114.0903 15.68597  9.040499       2.321644      10.31020       3.705348      8.219863       2.978879      119.0588 24.18197  106.8453 21.66525  12.21356       32.46769  
1 1 1 13 15 14 o 33.69213 15.60128  -1.319049      1.659360      -2.237186      1.836098      2.773136       3.876319      32.54620 15.48191  72.40784 28.09640  -39.86164      32.07955  
1 1 1 13 15 15 o 37.74954 14.08320  0.7515261      0.9502906     -0.8466952E-01 1.026812      5.742758       2.508655      31.27139 13.50096  88.73753 21.45437  -57.46614      25.34889  
1 1 1 13 15 16 o 122.1385 4.174279  9.974167       0.6783735     10.28725       0.7036262     5.845778       2.555071      124.0335 4.263593  89.19421 21.70632  34.83926       22.12108  
1 1 1 13 15 17 o 142.0359 4.401108  13.49470       0.8319734     13.87953       0.8453903     1.658376       4.688432      144.0478 4.409495  70.34749 29.55052  73.70030       29.87770  
1 1 1 13 15 18 o 72.34875 13.24082  3.701217       1.229470      3.697221       1.255110      3.796019       6.113880      72.22343 13.53888  82.85941 34.18627  -10.63599      36.76958  
1 1 1 13 15 19 o 104.1651 9.139193  7.413428       1.255698      7.309409       1.279603      10.11967       6.526797      103.3543 9.393751  106.4692 37.28135  -3.114937      38.44661  
1 1 1 13 15 20 o 45.69448 18.45090  0.8761600      1.734713      0.5782449      1.780688      6.423031       7.683618      44.14257 18.35230  90.16564 37.84975  -46.02308      42.06437  
1 1 1 13 15 21 o 58.50179 18.63194  2.546303       1.635467      2.263455       1.654234      14.80051       10.88838      55.89325 18.79541  106.9538 44.98676  -51.06051      48.75527  
1 1 1 13 15 22 o 129.5059 9.857997  11.64894       1.688404      11.40498       1.787421      13.66965       5.144215      127.7351 10.59659  119.5923 31.75248  8.142784       33.47398  
1 1 1 13 15 23 o 60.30748 20.24166  2.900767       1.918666      2.431162       2.020221      7.222449       6.128574      56.63695 20.63697  81.18235 33.92198  -24.54540      39.70624  
1 1 1 13 15 24 o 60.99805 25.68480  2.773737       3.555431      3.072485       4.623039      2.341219       5.562598      64.16521 28.15846  63.81990 29.18943  0.3453102      40.55764  
1 1 1 13 15 25 o 44.26072 15.97542  1.407346       1.206838      1.275661       1.266595      2.704973       3.975992      43.27091 16.23525  60.24813 26.28392  -16.97721      30.89382  
1 1 1 13 15 26 o 67.59485 26.18543  4.797361       3.362734      3.518147       3.508318      19.25807       11.79566      61.22631 25.63029  81.01384 38.73174  -19.78753      46.44415  
1 1 1 13 15 27 o 50.89218 18.21215  2.166980       1.564626      2.472459       1.577288      -16.63013      12.37275      53.64399 18.34985  52.62829 26.98891  1.015705       32.63615  
1 1 1 13 16 0  o 450.6406 20.27043  137.9129       12.11590      137.9129       12.11590      137.9129       12.11590      450.6406 20.27043  450.6406 20.27043  0.000000       0.000000  
1 1 1 13 16 1  o 211.9861 5.786997  30.02808       1.633156      29.87973       1.918933      30.41785       3.110513      211.3411 6.822943  212.5501 11.02003  -1.209000      12.96123  
1 1 1 13 16 2  o 294.1614 16.59705  58.87575       6.479252      57.23368       8.898465      60.72874       9.452724      287.0673 23.46719  295.3621 24.23038  -8.294830      33.73159  
1 1 1 13 16 3  o 229.5217 9.703669  35.38369       2.961094      35.89374       3.648886      34.39998       5.067384      230.7056 11.90971  224.4170 17.07365  6.288620       20.81707  
1 1 1 13 16 4  o 116.8592 1.335913  9.099622       0.2080246     9.094595       0.2081830     12.40068       5.334909      116.8269 1.337300  129.6909 31.24310  -12.86401      31.27170  
1 1 1 13 16 5  o 228.2634 6.995101  34.86954       2.125156      31.55307       3.302441      37.21360       2.776395      216.2959 11.49944  235.5065 8.862994  -19.21056      14.51860  
1 1 1 13 16 6  o 320.4245 8.034417  68.78078       3.427765      73.05655       6.203956      66.90198       4.112473      328.3582 14.21271  315.5977 9.790874  12.76056       17.25869  
1 1 1 13 16 7  o 251.8766 7.794015  42.51156       2.612761      43.26883       5.064533      42.23692       3.049965      252.1356 15.14391  250.7920 9.141869  1.343567       17.68931  
1 1 1 13 16 8  o 146.3417 5.530219  14.32542       1.076470      15.48359       1.178564      8.496084       2.644098      152.1182 5.825076  109.9211 18.72231  42.19714       19.60756  
1 1 1 13 16 9  o 192.5140 6.814380  24.82535       1.745326      25.18280       1.898345      22.87244       4.437206      193.8102 7.364035  181.6505 18.59363  12.15973       19.99880  
1 1 1 13 16 10 o 79.91853 16.77000  4.522084       1.728842      4.237015       2.054225      5.214267       3.200985      76.89656 19.89714  85.20848 25.90094  -8.311920      32.66121  
1 1 1 13 16 11 o 283.8894 10.33905  54.34065       3.904607      51.65408       4.447337      63.37678       8.156267      276.1614 12.11495  301.5807 20.41653  -25.41931      23.74040  
1 1 1 13 16 12 o 81.10590 28.49937  4.417991       3.816261      8.902042       6.263610      1.770736       4.812683      108.6714 36.57361  73.01357 30.24703  35.65785       47.46063  
1 1 1 13 16 13 o 186.0268 16.59559  23.96313       4.070636      20.58273       4.839272      32.14209       7.527401      169.9452 21.87654  209.2061 27.68066  -39.26088      35.28175  
1 1 1 13 16 14 o 71.68708 15.82436  3.663174       1.471100      2.948968       2.486474      4.047812       1.824730      66.58413 23.02929  74.90540 18.41354  -8.321266      29.48570  
1 1 1 13 16 15 o 131.5318 8.751248  11.70374       1.525095      12.54862       1.823341      9.735957       2.782638      135.8719 10.14403  116.8223 18.49030  19.04966       21.09011  
1 1 1 13 16 16 o 106.8917 5.873509  7.678756       0.8333794     7.657433       0.8616557     7.987741       3.280016      106.7091 6.085032  102.7497 24.33409  3.959351       25.08337  
1 1 1 13 16 17 f 94.82928 3.600136  6.014957       0.4540937     5.924682       0.4598011     9.583753       2.890982      94.10629 3.673779  114.4731 19.66068  -20.36684      20.00097  
1 1 1 13 16 18 o 126.9295 1.983676  10.74377       0.3355110     10.76432       0.3380447     9.387911       2.745444      127.0501 1.996759  113.0463 18.89180  14.00376       18.99703  
1 1 1 13 16 19 o 64.17634 11.10391  2.908125       0.9152061     2.911268       0.9182154     2.431064       11.31371      64.20182 11.13662  86.69925 40.34830  -22.49743      41.85701  
1 1 1 13 16 20 o 104.3216 6.817982  7.389696       0.9425778     7.241033       0.9510105     15.66120       7.093758      103.2234 6.954660  121.3058 38.82235  -18.08245      39.44036  
1 1 1 13 16 21 o 65.36053 10.70904  3.039065       0.9004229     3.023836       0.9032105     5.494834       11.46974      65.16779 10.77758  82.90697 39.22023  -17.73918      40.67410  
1 1 1 13 16 22 o 92.10577 10.54352  6.006973       1.270741      5.947116       1.321617      6.739823       4.624416      91.36539 11.08179  81.18107 30.89512  10.18433       32.82248  
1 1 1 13 16 23 o 71.20984 10.85195  3.655131       0.9972244     3.571501       1.007525      7.682549       6.991785      70.24002 11.13564  78.31157 34.48845  -8.071548      36.24163  
1 1 1 13 16 24 o ?        ?         -0.8236308     0.1691460     -0.8296961     0.1692483     4.186646       4.864423      ?        ?         66.55094 29.05235  0.000000       29.05235  
1 1 1 13 16 25 o 48.55753 13.50007  1.822383       0.9050027     1.815638       0.9329283     1.930015       3.726760      48.38417 13.79731  55.62292 24.80024  -7.238754      28.37988  
1 1 1 13 16 26 o 20.89382 9.150057  -0.5447334E-01 0.4858865     -0.3450318E-01 0.4862953     -11.91876      11.85305      21.10775 9.200597  54.31351 27.73982  -33.20576      29.22582  
1 1 1 13 16 27 o 36.17594 14.49113  0.7492649      1.060913      0.9831757      1.069703      -13.30760      8.292439      38.40889 14.79826  46.55313 23.72556  -8.144241      27.96231  
1 1 1 13 17 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 13 17 1  o 329.3776 15.67343  73.84432       6.859364      71.15379       7.758339      83.47770       14.68044      322.1513 18.14658  338.5153 32.96219  -16.36392      37.62717  
1 1 1 13 17 2  o 264.0185 17.43326  47.76530       6.098866      46.57604       7.755037      49.69326       9.874029      258.2025 22.77295  263.3610 28.59486  -5.158447      36.55507  
1 1 1 13 17 3  o 126.3377 15.00840  10.97302       2.477308      10.64856       2.534961      17.86361       11.68213      124.2627 15.65613  148.4343 49.94776  -24.17154      52.34399  
1 1 1 13 17 4  o 137.7171 4.953979  12.67862       0.9076272     13.45780       1.146556      11.37081       1.485418      141.7738 6.083279  129.9530 8.626900  11.82080       10.55603  
1 1 1 13 17 5  o 119.7716 1.254687  9.558953       0.2002454     9.569036       0.2008567     7.910020       2.568653      119.8347 1.257854  105.8794 18.89971  13.95527       18.94152  
1 1 1 13 17 6  o 204.6960 7.523353  28.09564       2.048589      28.66075       2.459100      26.81401       3.703321      206.4737 8.959273  198.3769 14.10157  8.096863       16.70697  
1 1 1 13 17 7  o 173.4764 7.921198  20.20939       1.826237      19.84255       2.152751      21.15110       3.449165      171.6054 9.450820  175.7782 14.86490  -4.172821      17.61486  
1 1 1 13 17 8  o 190.0497 6.427209  24.18877       1.625316      23.82326       1.723554      27.12367       4.883983      188.5373 6.871970  197.6044 18.77353  -9.067154      19.99174  
1 1 1 13 17 9  o 202.1911 7.695596  27.44169       2.069590      25.56599       2.974473      29.20188       2.881429      194.2383 11.54424  207.9460 10.43213  -13.70778      15.55952  
1 1 1 13 17 10 o 226.6070 6.992401  34.42650       2.108886      32.94521       2.297717      42.34363       5.312038      221.5056 7.796797  248.1322 16.15369  -26.62660      17.93688  
1 1 1 13 17 11 o 224.9281 15.19498  34.75741       4.527528      31.59416       5.073582      47.12535       10.03222      213.0882 18.03752  251.3883 30.57688  -38.30009      35.50067  
1 1 1 13 17 12 o 185.2522 12.21464  23.39154       2.998385      41.25897       7.177219      19.61389       3.300168      240.2871 22.68418  168.6474 14.83638  71.63965       27.10517  
1 1 1 13 17 13 o 189.8598 7.884820  24.26629       1.990454      22.90671       2.317304      28.09196       3.887185      184.0306 9.481700  201.8892 14.54689  -17.85861      17.36418  
1 1 1 13 17 14 o 245.5867 9.825881  40.85865       3.209018      40.93999       3.731266      40.62754       6.289283      245.1077 11.45589  238.8770 19.94019  6.230667       22.99671  
1 1 1 13 17 15 o 38.66059 6.619568  1.031298       0.3287569     1.033010       0.3319349     0.9431737      2.381490      38.68227 6.681221  52.16476 21.40958  -13.48249      22.42786  
1 1 1 13 17 16 o 178.1474 5.086669  21.27578       1.206262      19.75377       1.320085      28.97725       2.969484      171.4956 5.784924  205.7650 10.86873  -34.26942      12.31238  
1 1 1 13 17 17 o 100.5306 3.392360  6.759898       0.4537860     6.955523       0.4643227     2.595697       2.142263      101.9730 3.421975  60.97346 21.35824  40.99953       21.63064  
1 1 1 13 17 18 o 56.92844 5.461932  2.197084       0.4092555     2.107030       0.4139297     6.117084       2.730986      55.70387 5.654859  87.75682 23.05845  -32.05295      23.74173  
1 1 1 13 17 19 o 47.30486 5.244612  1.522648       0.3250443     1.453697       0.3269246     7.465295       3.035069      46.17583 5.416060  95.36166 23.92707  -49.18582      24.53240  
1 1 1 13 17 20 o 88.06581 4.321697  5.218385       0.5055997     5.166095       0.5079508     10.82780       5.261005      87.61386 4.364604  102.1043 33.49390  -14.49044      33.77708  
1 1 1 13 17 21 o 116.5780 4.994172  9.177604       0.7740091     9.539738       0.7968162     3.121923       3.258406      118.8442 5.043071  63.36766 25.39169  55.47651       25.88766  
1 1 1 13 17 22 o 27.09880 9.302032  0.4771496      0.4054120     0.5013378      0.4067992     -3.051466      4.913381      27.55432 9.320637  50.28492 24.28458  -22.73060      26.01182  
1 1 1 13 17 23 o 69.76149 17.34160  3.943391       1.605118      4.283668       1.646364      -2.593554      7.216010      72.87454 17.22773  57.43224 28.11323  15.44230       32.97193  
1 1 1 13 17 24 o 24.02268 8.850032  0.3351473      0.3731204     0.3547328      0.3741365     -3.255664      5.065926      24.38187 8.881460  48.52908 23.71252  -24.14721      25.32121  
1 1 1 13 17 25 o 50.15923 22.21623  1.388798       2.940947      1.551652       3.047565      -0.8173029     11.21671      51.14260 22.63537  59.96068 30.22471  -8.818073      37.76100  
1 1 1 13 17 26 o 44.27719 21.10394  -1.019455      3.446297      0.2734514E-02  3.696120      -7.823370      9.535861      47.83841 22.51856  52.39967 26.57803  -4.561264      34.83500  
1 1 1 13 18 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 13 18 1  f 220.3918 19.89458  33.80643       5.779727      35.54468       6.601823      28.10182       11.95975      224.8076 22.33337  182.7575 48.36475  42.05014       53.27221  
1 1 1 13 18 2  o 208.1695 19.85158  30.18954       5.440029      22.91618       6.415997      48.79170       10.26072      177.2500 28.10102  258.2159 30.40298  -80.96593      41.40059  
1 1 1 13 18 3  o 71.92567 13.37652  3.613250       1.234863      5.566307       4.169249      3.425444       1.292873      89.02764 29.83788  69.78684 14.38152  19.24080       33.12291  
1 1 1 13 18 4  o 160.5506 6.297321  17.26681       1.344615      18.11148       1.517940      14.18879       2.897651      164.3419 6.947259  143.5110 15.39286  20.83090       16.88800  
1 1 1 13 18 5  o 188.1565 10.77991  23.93893       2.691451      27.18187       3.193091      15.98086       5.002020      200.1855 12.02575  148.0034 26.32795  52.18205       28.94442  
1 1 1 13 18 6  o 326.4186 4.950559  71.17042       2.153291      69.87833       2.321617      79.12400       5.760030      323.3661 5.387938  341.5454 12.67819  -18.17935      13.77557  
1 1 1 13 18 7  o 290.0986 8.141253  56.51735       3.143987      53.70261       4.310651      59.71645       4.595551      281.6641 11.50942  296.9897 11.63493  -15.32562      16.36577  
1 1 1 13 18 8  o 248.2599 7.148487  41.33671       2.362337      43.93929       2.776057      34.50463       4.497832      255.7090 8.157645  224.1836 15.14546  31.52536       17.20267  
1 1 1 13 18 9  o 43.21517 15.28493  1.129751       1.099086      0.4057114      1.503495      1.960751       1.610724      41.09215 16.95329  54.73050 18.54646  -13.63835      25.12738  
1 1 1 13 18 10 o 310.2278 7.348869  64.57412       3.037909      66.30241       4.653285      63.29032       4.010520      312.7235 11.18473  306.1259 9.844465  6.597626       14.90006  
1 1 1 13 18 11 o 120.1364 18.25059  10.26539       2.829846      11.22870       4.887643      9.779639       3.470748      119.8864 30.52062  114.9907 23.44678  4.895729       38.48714  
1 1 1 13 18 12 o 196.8841 20.52289  27.77775       5.305265      35.73889       9.927394      24.59522       6.276730      208.6902 37.05667  180.8051 26.86806  27.88512       45.77215  
1 1 1 13 18 13 f 238.3377 16.04087  39.72577       5.064745      53.76574       9.518850      34.18135       5.981768      266.2795 27.20912  217.4663 20.89960  48.81323       34.30932  
1 1 1 13 18 14 o 172.4083 14.20064  20.72998       3.233521      20.82868       5.518756      20.67838       3.990166      164.7366 26.00230  170.0245 17.87913  -5.287827      31.55602  
1 1 1 13 18 15 o 30.39630 13.71008  -0.5169363     1.175558      -0.1256422     1.266823      -2.942858      3.154297      34.07639 14.85174  43.38583 20.53713  -9.309448      25.34458  
1 1 1 13 18 16 o 134.8496 6.721010  12.29058       1.203889      12.73926       1.321257      10.09640       2.921844      137.1345 7.256307  116.1951 19.56543  20.93937       20.86768  
1 1 1 13 18 17 o 106.7361 6.193934  7.705625       0.8771657     8.283920       0.9322838     3.244213       2.589462      110.6398 6.350258  65.85263 23.44445  44.78716       24.28926  
1 1 1 13 18 18 o 71.09910 9.329268  3.527329       0.8625598     3.289299       0.8903448     7.163477       3.479870      68.36729 10.07486  90.44014 26.89767  -22.07285      28.72259  
1 1 1 13 18 19 o 79.90745 10.71621  4.527829       1.112304      4.992521       1.179917      0.8182126      3.333753      83.92616 10.80081  54.26726 23.86009  29.65890       26.19086  
1 1 1 13 18 20 o 70.50921 13.59031  3.702853       1.230582      3.561479       1.258697      6.761841       5.854974      68.80158 14.20034  78.65458 33.03034  -9.852997      35.95349  
1 1 1 13 18 21 o 27.52010 12.74587  -0.7100267     1.108375      -0.3095239     1.210430      -2.789168      2.757902      31.11681 13.98404  37.91940 18.28326  -6.802589      23.01806  
1 1 1 13 18 22 o 64.51108 16.30058  3.321586       1.401561      3.004954       1.435875      9.709730       6.449513      60.92847 17.02891  82.07607 34.57870  -21.14760      38.54439  
1 1 1 13 18 23 o 53.44052 17.46832  2.341332       1.431563      2.661684       1.468591      -3.772362      6.415628      56.60160 17.60595  52.11293 25.70567  4.488663       31.15688  
1 1 1 13 18 24 o 44.70018 21.15005  -0.8766726     3.338475      1.630472       5.064513      -2.803273      4.439600      56.15207 26.40939  45.69927 22.30124  10.45280       34.56590  
1 1 1 13 19 0  o 314.3765 35.40347  72.57698       14.34774      72.57698       14.34774      72.57698       14.34774      314.3765 35.40347  314.3765 35.40347  0.000000       0.000000  
1 1 1 13 19 1  o 286.8257 12.13049  55.79960       4.625814      58.41738       5.876800      51.53617       7.499876      292.0552 15.15270  270.9344 20.93613  21.12079       25.84426  
1 1 1 13 19 2  o 183.3509 23.60584  24.10144       5.633673      25.54124       6.259940      17.96647       12.92187      187.6348 25.71265  143.0275 52.18081  44.60727       58.17196  
1 1 1 13 19 3  o 17.14096 8.355457  -1.123538      0.6182846     -1.486364      0.7049965     0.8523476E-01  1.286797      17.46082 8.595206  36.23400 15.36402  -18.77318      17.60485  
1 1 1 13 19 4  o 119.0856 5.663138  9.505023       0.8960739     9.791146       0.9268864     5.414901       3.504438      120.8549 5.772263  86.28696 27.24879  34.56789       27.85347  
1 1 1 13 19 5  o 362.3120 10.52060  88.70023       5.073839      98.36436       10.03882      85.38451       5.880173      374.6665 20.18228  354.4684 12.46855  20.19812       23.72318  
1 1 1 13 19 6  o 135.8454 7.448181  12.41748       1.343086      13.32442       1.586247      10.12067       2.524314      140.5264 8.510993  120.3225 16.15187  20.20384       18.25705  
1 1 1 13 19 7  o 197.4226 2.515990  25.98974       0.6618801     26.06682       0.6871746     25.00012       2.462171      197.7090 2.608358  192.2945 9.639730  5.414459       9.986387  
1 1 1 13 19 8  o 144.9277 6.661304  14.11148       1.282984      13.53806       1.517565      15.54825       2.402155      141.6687 8.072369  150.7629 12.05773  -9.094162      14.51041  
1 1 1 13 19 9  o 98.36044 16.37918  6.865863       2.071314      6.610752       2.210291      8.705249       5.935002      95.92212 17.95216  104.5526 35.59864  -8.630455      39.86907  
1 1 1 13 19 10 o 184.4743 15.62581  23.74142       3.804966      23.50975       4.666037      24.20125       6.573737      181.2655 19.63081  177.3609 28.80231  3.904602       34.85601  
1 1 1 13 19 11 o 163.2891 12.25754  18.34804       2.647600      25.92745       8.844600      17.60201       2.774842      172.1300 39.41233  159.5274 13.17082  12.60263       41.55481  
1 1 1 13 19 12 o 87.75433 27.84650  6.056040       3.655937      9.977212       4.958936      1.387079       5.411164      109.2790 32.00773  71.25835 30.87883  38.02063       44.47467  
1 1 1 13 19 13 o 70.92511 26.54972  3.461700       3.383105      5.582395       4.618265      1.005738       4.969933      84.66552 31.14527  67.22378 29.35552  17.44174       42.79923  
1 1 1 13 19 14 o 73.01418 25.04217  4.073521       2.938056      8.059010       5.285503      2.291362       3.534425      95.51998 33.54166  64.66133 26.25419  30.85865       42.59490  
1 1 1 13 19 15 o 69.07889 24.04282  3.650133       2.712131      6.235919       4.325310      1.974742       3.481602      85.24512 30.30512  62.14337 25.73353  23.10176       39.75695  
1 1 1 13 19 16 o 109.1024 9.447587  8.228663       1.359977      7.826915       1.400870      14.81024       5.670036      106.1475 10.02276  124.4329 33.47047  -18.28535      34.93892  
1 1 1 13 19 17 o 80.01772 6.514673  4.364987       0.6886230     4.831193       0.7043043     -5.756211      3.281614      84.26266 6.318678  37.07067 18.30429  47.19199       19.36422  
1 1 1 13 19 18 o 28.57676 10.96036  0.4181187      0.5849578     0.2673860      0.5928955     5.934700       3.586820      26.81667 10.80147  79.47734 27.65011  -52.66068      29.68502  
1 1 1 13 19 19 o 46.55773 9.093488  1.550665       0.5439078     1.525023       0.5476678     3.398920       4.649667      46.11888 9.234131  66.12723 28.63962  -20.00835      30.09147  
1 1 1 13 19 20 f 82.13082 7.241564  4.657117       0.7844144     4.659759       0.7905572     4.489110       6.304599      82.13145 7.299503  69.49569 31.50824  12.63576       32.34272  
1 1 1 13 19 21 o 117.0266 6.237674  9.366047       0.9691907     10.14316       1.013601      1.076211       3.310526      121.7823 6.267185  52.25089 23.33034  69.53139       24.15745  
1 1 1 13 19 22 o 27.91954 13.77064  -3.187063      1.839779      -4.153075      2.183702      -0.8241357     3.415288      29.27872 14.54030  45.90250 21.61931  -16.62377      26.05408  
1 1 1 13 19 23 o 40.89203 19.07928  -0.6524208     2.555719      -2.311200      2.952562      4.304132       5.103811      38.97129 18.82187  62.68757 28.39272  -23.71629      34.06478  
1 1 1 13 20 0  f 112.0748 51.20674  13.96873       8.319011      13.96873       8.319011      13.96873       8.319011      112.0748 51.20674  112.0748 51.20674  0.000000       0.000000  
1 1 1 13 20 1  f 120.0715 13.82630  9.979314       2.171835      10.06852       2.291106      9.188851       6.820149      120.3659 14.58156  108.0373 38.08764  12.32858       40.78345  
1 1 1 13 20 2  o 139.0979 10.88097  13.18117       2.000756      12.56273       5.426559      13.27847       2.152393      126.1365 32.18470  139.3769 11.69711  -13.24047      34.24438  
1 1 1 13 20 3  o 74.63142 9.400631  3.814875       0.9141761     3.587341       1.021512      4.730096       2.048722      71.97453 10.99965  80.60442 19.32509  -8.629890      22.23627  
1 1 1 13 20 4  o 181.9178 4.190138  22.10670       1.015727      21.84143       1.063483      24.86293       3.428059      180.7973 4.414331  190.1310 13.62099  -9.333725      14.31844  
1 1 1 13 20 5  o 60.35337 21.25846  2.374819       2.124314      0.000000       0.000000      2.374819       2.124314      ?        ?         60.35337 21.25846  0.000000       21.25846  
1 1 1 13 20 6  o 304.6886 7.440014  62.40873       3.020671      63.79095       3.650412      59.40663       5.379799      307.3200 8.923550  293.8120 13.77953  13.50800       16.41662  
1 1 1 13 20 7  o 128.1747 2.680628  10.95938       0.4578385     11.11687       0.4717716     8.410699       1.897885      129.0886 2.742650  109.9969 13.21257  19.09171       13.49423  
1 1 1 13 20 8  o 155.5226 1.317789  16.12020       0.2730946     16.10487       0.2740267     18.36211       3.313869      155.4485 1.322918  161.7782 15.56425  -6.329697      15.62038  
1 1 1 13 20 9  o 77.85532 5.982851  4.090909       0.6159267     4.204220       0.6198574     -4.758624      5.477921      78.94004 5.936279  56.35226 26.78773  22.58778       27.43760  
1 1 1 13 20 10 o 102.4488 30.32959  8.694701       4.432673      6.276827       5.675901      12.47499       7.097088      89.62599 34.19920  115.8831 38.93052  -26.25710      51.81863  
1 1 1 13 20 11 o 71.79340 26.36277  3.702449       3.306442      -1.751518      5.645523      6.549996       4.079278      62.66557 28.93243  89.26913 29.50338  -26.60356      41.32233  
1 1 1 13 20 12 o 90.73753 27.94437  6.855910       3.710392      3.344586       7.135062      8.157409       4.343945      80.06771 35.06384  97.30893 30.28152  -17.24122      46.32973  
1 1 1 13 20 13 o 62.70567 21.43571  2.916150       2.152319      2.573102       3.228378      3.190619       2.887710      63.92859 25.38754  66.34308 24.58825  -2.414494      35.34274  
1 1 1 13 20 14 o 173.0601 13.42945  21.28110       3.072692      20.30168       7.008873      21.51412       3.418737      142.4131 36.70340  172.6959 15.00507  -30.28281      39.65213  
1 1 1 13 20 15 o 44.40779 17.39610  1.084145       1.497373      0.5585142      1.583568      5.522047       4.601348      41.33021 17.25457  78.35057 30.55243  -37.02036      35.08805  
1 1 1 13 20 16 o 87.62408 7.981514  5.297343       0.9217096     5.532993       0.9334437     -3.899259      5.831331      89.59697 7.899272  54.62641 26.39955  34.97056       27.55603  
1 1 1 13 20 17 o 80.25132 7.330366  4.436495       0.7752370     4.567142       0.7925680     1.546767       3.727468      81.41311 7.386112  57.65751 25.29403  23.75560       26.35038  
1 1 1 13 20 18 o 65.70634 6.627584  2.970607       0.5723561     3.158511       0.5784220     -5.847709      3.962501      67.81754 6.479409  40.63214 20.07228  27.18540       21.09216  
1 1 1 13 20 19 o 100.6334 5.057987  6.862895       0.6760814     6.872745       0.6788943     5.681606       7.434698      100.6999 5.075777  71.67296 33.13039  29.02690       33.51696  
1 1 1 13 20 20 o 110.7240 7.137149  8.463740       1.047419      8.805987       1.071020      0.9537982      5.017024      112.9396 7.153442  56.89604 26.60718  56.04356       27.55202  
1 1 1 13 20 21 o 26.35974 12.27921  -0.7058245     1.051847      -1.132597      1.113409      2.836392       3.207704      25.26556 12.02917  57.60937 24.33455  -32.34381      27.14537  
1 1 1 13 20 22 o 60.16045 22.11388  3.421832       2.327498      3.397339       2.875795      3.468340       3.962782      59.39446 23.83559  59.80795 26.16289  -0.4134941     35.39254  
1 1 1 13 21 0  o 57.82323 34.89119  2.959472       4.906296      2.959472       4.906296      2.959472       4.906296      57.82323 34.89119  57.82323 34.89119  0.000000       0.000000  
1 1 1 13 21 1  o 35.87849 13.82794  0.6121162      0.9342424     2.042016       1.353555      -0.6888597     1.291094      53.96182 16.92020  31.28508 14.21350  22.67674       22.09789  
1 1 1 13 21 2  o 123.4759 13.38232  10.60613       2.166689      13.27819       3.625848      9.122016       2.702219      134.6006 20.89273  112.1725 18.73900  22.42812       28.06522  
1 1 1 13 21 3  o 39.61899 12.72289  1.058226       0.7614022     0.6549189      0.7896178     6.400884       2.873938      34.64392 12.85427  91.63135 23.44424  -56.98742      26.73695  
1 1 1 13 21 4  o 126.3115 2.347041  10.64147       0.3950364     10.54246       0.3995097     14.98877       2.647248      125.7203 2.384780  146.7310 13.69767  -21.01067      13.90371  
1 1 1 13 21 5  o 113.7836 20.03552  9.543794       2.926852      0.000000       0.000000      9.543794       2.926852      ?        ?         113.7836 20.03552  0.000000       20.03552  
1 1 1 13 21 6  o 24.11117 11.56465  -1.467386      1.070412      -1.936683      1.166526      1.033560       2.692918      23.89658 11.60952  54.49443 22.60491  -30.59785      25.41186  
1 1 1 13 21 7  o 245.9326 10.69715  41.42873       3.497178      52.76777       5.811657      34.99203       4.378682      273.0730 16.04224  223.1996 14.80602  49.87340       21.83052  
1 1 1 13 21 8  o 114.8277 10.25065  9.078578       1.551977      10.50713       1.837909      5.528643       2.897249      123.1717 11.32464  83.70791 24.45088  39.46377       26.94611  
1 1 1 13 21 9  o 129.4755 10.14573  11.53963       1.736459      11.72097       1.756149      3.588650       11.62856      130.4800 10.18107  89.32724 41.34128  41.15274       42.57647  
1 1 1 13 21 10 o 64.99168 5.258614  2.854958       0.4515237     2.861602       0.4546588     2.378183       3.851502      65.06224 5.289847  65.67981 27.11945  -0.6175690     27.63054  
1 1 1 13 21 11 o 106.2908 22.97411  9.020421       3.158891      15.98958       5.608024      5.781576       3.823094      132.6994 32.07391  82.24548 28.55016  50.45393       42.94004  
1 1 1 13 21 12 o 119.9110 20.97991  11.25186       3.230216      7.653181       5.019182      13.79623       4.220387      89.33309 32.53175  128.6755 25.51559  -39.34243      41.34441  
1 1 1 13 21 13 o 95.62115 13.08462  6.596059       1.623520      7.315511       1.774055      2.888309       4.027369      100.4775 13.59904  65.88203 27.51151  34.59552       30.68904  
1 1 1 13 21 14 o 111.9349 14.19634  9.185005       2.069902      9.020830       2.293160      9.907122       4.809335      109.4717 16.20941  97.86672 32.01925  11.60502       35.88840  
1 1 1 13 21 15 o 131.8518 16.29875  13.17324       2.802704      10.94191       3.266487      19.40016       5.456767      114.4126 22.22683  142.5255 29.69711  -28.11292      37.09380  
1 1 1 13 21 16 o 50.62816 11.38690  1.884486       0.7495195     2.094471       0.7594184     -6.013136      4.657313      53.57554 11.00601  44.51741 21.94814  9.058132       24.55306  
1 1 1 13 21 17 o 20.59299 9.927022  -1.135110      0.8119965     -1.307093      0.8264571     3.650871       4.359766      20.11710 9.773014  65.34949 28.01118  -45.23239      29.66711  
1 1 1 13 21 18 f 17.82652 8.899781  -2.158658      0.8638995     -2.109111      0.8694621     -5.993699      7.649399      18.06132 9.003034  54.33728 27.02314  -36.27596      28.48341  
1 1 1 13 21 19 o 87.30783 8.562388  5.369472       0.9833462     5.881468       1.005984      -5.624164      4.661525      91.53128 8.339474  43.34174 21.47545  48.18954       23.03784  
1 1 1 13 21 20 o 39.17887 17.76651  -0.1223411     2.005711      0.6874298      2.181001      -4.561161      5.106327      44.04045 19.33336  46.07191 22.76440  -2.031452      29.86632  
1 1 1 13 22 0  o 28.95510 17.52095  0.5929808      1.244386      0.5929808      1.244386      0.5929808      1.244386      28.95510 17.52095  28.95510 17.52095  0.000000       0.000000  
1 1 1 13 22 1  o 111.0254 17.08280  8.963689       2.446399      11.22361       2.858746      2.780842       4.728495      124.0351 17.80635  71.85658 29.89281  52.17850       34.79434  
1 1 1 13 22 2  o 78.68797 24.62203  4.856049       2.867757      7.970906       3.452204      -2.079216      5.151206      99.50768 25.81704  59.02163 27.38486  40.48605       37.63576  
1 1 1 13 22 3  o 164.6388 7.212757  18.33522       1.578526      19.23475       1.692335      12.31401       4.378443      168.5140 7.555841  122.8798 27.43514  45.63423       28.45659  
1 1 1 13 22 4  o 140.9050 1.224117  13.23334       0.2298384     13.27391       0.2308951     8.830773       2.405168      141.1207 1.227865  110.0185 16.94963  31.10210       16.99405  
1 1 1 13 22 5  o 52.61750 20.59916  1.528636       2.098441      0.000000       0.000000      1.528636       2.098441      ?        ?         52.61750 20.59916  0.000000       20.59916  
1 1 1 13 22 6  o 155.7008 6.435574  16.37415       1.332338      16.03913       1.487488      17.73347       2.996269      153.8062 7.278467  157.8986 14.39888  -4.092346      16.13393  
1 1 1 13 22 7  o 133.5026 9.841234  12.29001       1.738399      14.47786       2.740430      10.81677       2.248771      142.1488 14.67866  123.1238 13.95224  19.02503       20.25162  
1 1 1 13 22 8  o 87.80328 14.25497  5.591272       1.610677      5.160136       1.971861      6.455666       2.792063      82.15964 18.46241  89.12000 23.26559  -6.960365      29.70098  
1 1 1 13 22 9  o 48.79077 15.41832  1.727476       1.121838      1.368675       1.159012      7.053231       4.465311      44.95587 15.71257  87.17146 30.81086  -42.21559      34.58604  
1 1 1 13 22 10 o 80.99025 19.96613  5.209726       2.140857      6.695435       3.533197      4.347800       2.691138      86.42386 27.36906  72.31218 23.96582  14.11168       36.37892  
1 1 1 13 22 11 o 64.51151 2.105954  2.780896       0.1807912     2.780210       0.1809350     3.211690       4.534707      64.50338 2.107902  67.73641 28.78660  -3.233032      28.86368  
1 1 1 13 22 12 o 108.1814 11.80717  8.367200       1.674451      11.47161       2.048629      2.119173       2.906333      126.4705 12.31194  57.62415 23.65094  68.84637       26.66366  
1 1 1 13 22 13 o 54.83528 19.63455  2.288611       1.818845      4.017769       2.172151      -1.768291      3.327131      69.07442 21.39983  45.15088 21.28777  23.92355       30.18480  
1 1 1 13 22 14 f 16.09762 8.106972  -2.402779      0.7968748     -2.505320      0.8021657     5.293666       6.949609      15.93691 8.039544  73.28500 33.16803  -57.34808      34.12847  
1 1 1 13 22 15 o 74.42822 17.73952  4.460827       1.734336      4.103572       1.868522      6.683561       4.660719      70.20100 19.35267  77.64228 30.60757  -7.441277      36.21255  
1 1 1 13 22 16 o 52.24343 13.12872  2.075780       0.9127434     2.168968       0.9590454     1.180001       2.973444      53.26439 13.49774  51.48458 22.58848  1.779816       26.31404  
1 1 1 13 22 17 o 35.95132 13.21814  0.8451283      0.8316509     0.8541815      0.8345100     -0.4692867     10.05531      36.07833 13.24486  62.54459 31.08441  -26.46626      33.78856  
1 1 1 13 22 18 o 83.76730 11.82111  5.197336       1.282853      5.030781       1.297036      12.68833       8.698464      82.11957 12.22527  77.96668 35.96699  4.152885       37.98792  
1 1 1 13 22 19 o 91.26160 10.95421  6.093621       1.305526      6.126834       1.321699      4.761393       8.370844      91.42486 11.07462  64.46532 31.26761  26.95954       33.17093  
1 1 1 13 23 0  o 34.35220 21.32741  0.7537196      1.954860      0.7537196      1.954860      0.7537196      1.954860      34.35220 21.32741  34.35220 21.32741  0.000000       0.000000  
1 1 1 13 23 1  o 129.4048 10.38962  11.62966       1.776485      12.01729       1.904428      9.032051       4.929926      131.2433 10.99049  97.36989 32.44230  33.87340       34.25337  
1 1 1 13 23 2  o 31.53289 11.58048  0.5747296      0.6380499     0.8820393      0.6634465     -3.210269      2.328363      36.09021 11.89697  34.20490 16.56673  1.885311       20.39594  
1 1 1 13 23 3  o 113.8445 5.511617  8.746634       0.8336278     8.935534       0.8431694     0.5417069      5.556950      115.0691 5.515042  64.76465 29.44895  50.30442       29.96091  
1 1 1 13 23 4  o 198.0361 1.772538  26.15922       0.4677495     26.14122       0.4687679     30.28849       7.100190      197.9674 1.777014  185.3026 29.76258  12.66472       29.81558  
1 1 1 13 23 5  o 98.46670 20.64617  7.669838       2.622259      13.81929       5.563530      5.913566       2.973228      117.8830 33.71867  83.32230 24.88251  34.56071       41.90570  
1 1 1 13 23 6  o 28.44320 11.66517  0.2424952      0.7063318     0.1276778      0.7146114     5.111501       4.653570      27.42692 11.52992  76.42490 30.43790  -48.99797      32.54850  
1 1 1 13 23 7  o 75.18479 15.77215  4.269193       1.529626      3.366248       2.128097      5.234307       2.200138      64.80322 21.30470  80.53209 20.46381  -15.72887      29.54078  
1 1 1 13 23 8  f 58.88111 17.19779  2.683488       1.433362      1.970847       2.154841      3.249052       1.919643      54.11153 20.96164  63.67827 20.17470  -9.566742      29.09311  
1 1 1 13 23 9  o 110.0049 11.42649  8.615569       1.650564      8.710849       1.765154      7.952380       4.656940      110.1109 12.23678  87.34887 31.40054  22.76207       33.70063  
1 1 1 13 23 10 o 33.62621 14.79592  -0.8090544E-01 1.284205      0.4656344      1.358844      -4.649910      3.928886      38.06178 15.94336  42.89453 20.94272  -4.832748      26.32087  
1 1 1 13 23 11 o 105.4774 13.76812  8.207760       1.888973      9.016713       2.075809      4.311086       4.555884      110.0467 14.50901  69.56590 29.17006  40.48080       32.57920  
1 1 1 13 23 12 o 55.02003 2.787735  2.030291       0.2037175     2.005572       0.2045347     5.105131       2.281165      54.67944 2.816668  77.10740 21.43173  -22.42796      21.61602  
1 1 1 13 23 13 o 90.68129 7.486145  5.684834       0.8965341     5.933616       0.9267201     2.051534       3.541515      92.61648 7.575203  57.58097 24.96635  35.03550       26.09027  
1 1 1 13 23 14 o 60.56618 19.16022  3.078186       1.732010      2.819903       1.809133      5.915288       5.995973      58.09561 19.65578  71.39329 31.66613  -13.29768      37.27054  
1 1 1 13 23 15 o 58.44749 18.94866  2.886717       1.686298      2.246826       2.348921      3.567238       2.422345      53.88796 21.57043  62.55065 22.62559  -8.662689      31.26021  
1 1 1 13 23 16 o 55.07116 14.90070  2.409569       1.119787      2.895805       1.164132      -3.610327      4.096126      60.62614 14.58792  43.47390 21.25951  17.15224       25.78321  
1 1 1 13 23 17 o 28.82216 13.39051  -0.7172501     1.237857      -0.7138256     1.245203      -1.004900      11.41226      28.93261 13.43784  61.20271 30.80394  -32.27010      33.60741  
1 1 1 13 24 0  o 45.17055 25.96528  2.213552       2.496211      2.213552       2.496211      2.213552       2.496211      45.17055 25.96528  45.17055 25.96528  0.000000       0.000000  
1 1 1 13 24 1  o 103.8148 19.46378  8.525002       2.593631      8.858564       2.706501      4.774175       9.075772      105.4170 19.99891  77.07446 35.95881  28.34253       41.14598  
1 1 1 13 24 2  o 51.61129 9.384658  1.894462       0.6216438     1.914485       0.6244026     -0.3564917     6.620284      51.89286 9.374851  63.45646 29.95198  -11.56359      31.38486  
1 1 1 13 24 3  o 136.3463 4.286076  12.50027       0.7777445     12.66306       0.7819394     -2.549954      7.518451      137.2335 4.281255  62.21832 30.04588  75.01517       30.34937  
1 1 1 13 24 4  o 64.87004 4.248738  2.838621       0.3652420     2.866237       0.3688406     1.444030       2.621077      65.18212 4.270066  52.89069 22.14810  12.29143       22.55597  
1 1 1 13 24 5  o 180.2186 17.47778  24.85575       4.144564      5.281641       13.53755      26.88017       4.353615      78.39080 38.40046  187.1979 17.66199  -108.8071      42.26749  
1 1 1 13 24 6  o 89.85983 19.48223  6.510833       2.265426      2.708865       3.228890      10.19687       3.179279      61.12236 24.98969  110.1698 22.42024  -49.04744      33.57309  
1 1 1 13 24 7  o 110.6858 8.185319  8.472681       1.198719      10.35193       1.546433      5.643710       1.897377      121.5798 9.623897  84.89814 17.35820  36.68166       19.84758  
1 1 1 13 24 8  o 69.97945 12.83645  3.620177       1.152889      4.065180       1.306224      2.051557       2.452420      73.71784 13.80474  54.79232 22.00346  18.92553       25.97543  
1 1 1 13 24 9  o 67.59924 16.42615  3.594022       1.464882      2.265252       2.042503      5.001460       2.102095      54.67134 20.59454  77.25167 20.19710  -22.58033      28.84542  
1 1 1 13 24 10 o 117.2165 11.57628  9.908111       1.784555      9.402132       1.933119      12.82559       4.641909      113.0057 13.07878  110.2009 30.55045  2.804810       33.23228  
1 1 1 13 24 11 o 74.17210 20.61576  4.756761       2.110777      6.738107       2.830994      2.276486       3.167441      85.19705 23.94681  56.94578 24.12374  28.25127       33.99125  
1 1 1 13 24 12 o 51.93044 17.19412  2.151102       1.385291      3.388302       1.461572      -8.781884      4.344799      64.65044 16.81096  38.20967 19.20131  26.44076       25.52056  
1 1 1 13 24 13 o 40.71277 2.042406  1.110130       0.1104478     1.111271       0.1105165     0.1928120      3.132918      40.73373 2.042620  47.81578 21.88328  -7.082047      21.97840  
1 1 1 13 24 14 o 57.48721 7.686833  2.325662       0.5740893     2.427685       0.5802944     -2.368574      3.936238      58.79336 7.583521  44.98708 21.72851  13.80627       23.01386  
1 1 1 13 25 0  f 39.81998 26.26096  0.4556429      3.579361      0.4556429      3.579361      0.4556429      3.579361      39.81998 26.26096  39.81998 26.26096  0.000000       0.000000  
1 1 1 13 25 1  o 45.79244 20.89614  -0.3577737     2.829499      2.559189       3.823196      -3.890402      4.207365      61.19548 26.23075  45.49778 22.09099  15.69770       34.29379  
1 1 1 13 25 2  o 51.71425 13.10025  2.010220       0.9036188     2.087921       0.9075938     -6.801984      9.665462      52.74236 12.99874  60.51475 30.14114  -7.772385      32.82462  
1 1 1 13 25 3  o 22.63777 9.786640  -0.1800501E-01 0.5409777     0.1706646      0.5496383     -5.863720      3.059461      24.85012 10.25119  34.37595 17.09496  -9.525833      19.93300  
1 1 1 13 25 4  o 85.37705 1.944038  4.866361       0.2211665     4.873868       0.2213775     0.9331556      5.067372      85.44283 1.944394  59.22819 27.36866  26.21465       27.43764  
1 1 1 13 25 5  o 62.48131 16.02667  3.070177       1.340704      3.096876       1.435295      2.887415       3.755265      62.31908 16.87319  61.66323 26.20049  0.6558495      31.16360  
1 1 1 13 25 6  o 98.90889 13.84832  7.313419       1.775235      7.989044       1.883949      1.961051       5.302603      103.2685 14.05521  61.61935 28.30046  41.64914       31.59850  
1 1 1 13 25 7  o 58.91703 17.46792  2.816555       1.469454      1.844689       1.637527      6.835216       3.329860      49.80371 18.50511  82.52507 26.61653  -32.72136      32.41726  
1 1 1 13 25 8  o 101.3164 11.37880  7.444843       1.509686      7.320095       1.942475      7.635143       2.399153      97.26393 15.50791  95.68746 19.47910  1.576469       24.89841  
1 1 1 13 25 9  o 25.25719 11.97079  -1.048252      1.078152      -2.544170      1.349602      1.590351       1.792416      23.91611 11.79572  48.03976 18.96771  -24.12365      22.33636  
1 1 1 13 25 10 f 92.31003 18.09136  7.000133       2.145723      7.654898       2.741049      5.963903       3.448277      91.64536 22.59179  74.67658 26.99726  16.96877       35.20286  
1 1 1 13 25 11 o 49.30751 21.85346  1.014504       2.850318      -1.683344      4.477489      2.852721       3.695934      48.91491 23.51112  58.91136 25.52415  -9.996452      34.70238  
1 1 1 13 26 0  o 35.67192 24.41481  -0.8605319     3.676924      -0.8605319     3.676924      -0.8605319     3.676924      35.67192 24.41481  35.67192 24.41481  0.000000       0.000000  
1 1 1 13 26 1  o 73.06351 22.64419  4.902947       2.431848      6.480634       2.532319      -13.80407      8.719876      85.03657 22.13596  50.58931 25.63327  34.44726       33.86835  
1 1 1 13 26 2  o 58.10902 11.61203  2.505397       0.8676670     2.580546       0.8733572     -3.205299      7.613343      59.04227 11.51456  56.89743 28.05371  2.144840       30.32484  
1 1 1 13 26 3  o 99.32820 2.488827  6.602945       0.3291535     6.602770       0.3295622     6.673559       6.611742      99.32632 2.491969  72.05416 32.50568  27.27216       32.60106  
1 1 1 13 26 4  o 90.85780 7.269897  5.716322       0.8728271     5.696834       0.8765721     7.982460       9.452397      90.68006 7.316483  72.38133 34.62284  18.29873       35.38746  
1 1 1 13 26 5  o 81.88590 14.03843  5.119106       1.476694      5.417567       1.521113      0.2314309      6.155575      84.28348 14.03744  57.95840 27.78152  26.32508       31.12655  
1 1 1 13 26 6  o 22.75401 10.97460  -1.329984      0.9955894     -1.171164      1.025304      -3.951516      4.165597      23.87761 11.41655  43.60635 21.34847  -19.72874      24.20940  
1 1 1 13 26 7  o 100.8616 10.40954  7.320471       1.378967      9.452290       1.611120      1.480655       2.666567      114.4956 10.68336  50.69634 21.82100  63.79927       24.29589  
1 1 1 14 0  0  o 951.1100 66.35999  627.0801       83.14582      627.0801       83.14582      627.0801       83.14582      951.1100 66.35999  951.1100 66.35999  0.000000       0.000000  
1 1 1 14 0  1  o 574.1041 13.22459  220.4068       10.10475      220.4068       10.10475      220.4068       10.10475      574.1041 13.22459  574.1041 13.22459  0.000000       0.000000  
1 1 1 14 0  2  o 36.76812 22.70175  0.6716561      2.185335      0.6716561      2.185335      0.6716561      2.185335      36.76812 22.70175  36.76812 22.70175  0.000000       0.000000  
1 1 1 14 0  3  o 294.4230 11.56395  58.11339       4.520892      58.11339       4.520892      58.11339       4.520892      294.4230 11.56395  294.4230 11.56395  0.000000       0.000000  
1 1 1 14 0  4  o 70.99973 31.78481  4.899488       3.201983      4.899488       3.201983      4.899488       3.201983      70.99973 31.78481  70.99973 31.78481  0.000000       0.000000  
1 1 1 14 0  5  o 292.0564 8.818044  57.03691       3.424639      57.03691       3.424639      57.03691       3.424639      292.0564 8.818044  292.0564 8.818044  0.000000       0.000000  
1 1 1 14 0  6  o 444.9316 16.89564  132.9017       9.984237      132.9017       9.984237      132.9017       9.984237      444.9316 16.89564  444.9316 16.89564  0.000000       0.000000  
1 1 1 14 0  7  o 377.1717 26.75013  96.96593       13.28601      96.96593       13.28601      96.96593       13.28601      377.1717 26.75013  377.1717 26.75013  0.000000       0.000000  
1 1 1 14 0  8  o 72.42780 12.99878  3.820189       1.134415      3.820189       1.134415      3.820189       1.134415      72.42780 12.99878  72.42780 12.99878  0.000000       0.000000  
1 1 1 14 0  9  o 743.3054 25.25079  372.0884       24.94463      372.0884       24.94463      372.0884       24.94463      743.3054 25.25079  743.3054 25.25079  0.000000       0.000000  
1 1 1 14 0  10 o 445.0290 35.13405  136.2670       20.52748      136.2670       20.52748      136.2670       20.52748      445.0290 35.13405  445.0290 35.13405  0.000000       0.000000  
1 1 1 14 0  11 x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 14 0  12 o 162.8385 9.868608  17.88271       2.123146      17.88271       2.123146      17.88271       2.123146      162.8385 9.868608  162.8385 9.868608  0.000000       0.000000  
1 1 1 14 0  13 o 44.48597 14.63814  1.688044       0.7700580     1.688044       0.7700580     1.688044       0.7700580     44.48597 14.63814  44.48597 14.63814  0.000000       0.000000  
1 1 1 14 0  14 o 28.51698 14.50128  0.7970502      0.6901538     0.7970502      0.6901538     0.7970502      0.6901538     28.51698 14.50128  28.51698 14.50128  0.000000       0.000000  
1 1 1 14 0  15 o 107.9928 7.068120  7.876737       1.006985      7.876737       1.006985      7.876737       1.006985      107.9928 7.068120  107.9928 7.068120  0.000000       0.000000  
1 1 1 14 0  16 o 344.2378 12.64171  79.54513       5.781024      79.54513       5.781024      79.54513       5.781024      344.2378 12.64171  344.2378 12.64171  0.000000       0.000000  
1 1 1 14 0  17 o 13.18727 9.340700  -0.8782433     0.6805972     -0.8782433     0.6805972     -0.8782433     0.6805972     13.18727 9.340700  13.18727 9.340700  0.000000       0.000000  
1 1 1 14 0  18 o 527.6824 15.46537  187.3778       10.85328      187.3778       10.85328      187.3778       10.85328      527.6824 15.46537  527.6824 15.46537  0.000000       0.000000  
1 1 1 14 0  19 f 19.02267 11.86807  0.1459167      0.6128737     0.1459167      0.6128737     0.1459167      0.6128737     19.02267 11.86807  19.02267 11.86807  0.000000       0.000000  
1 1 1 14 0  20 o 14.92473 10.71326  -1.686746      1.016825      -1.686746      1.016825      -1.686746      1.016825      14.92473 10.71326  14.92473 10.71326  0.000000       0.000000  
1 1 1 14 0  21 o 19.40388 12.79220  -0.1690955     0.8481564     -0.1690955     0.8481564     -0.1690955     0.8481564     19.40388 12.79220  19.40388 12.79220  0.000000       0.000000  
1 1 1 14 0  22 o 172.1871 7.414572  19.92413       1.694024      19.92413       1.694024      19.92413       1.694024      172.1871 7.414572  172.1871 7.414572  0.000000       0.000000  
1 1 1 14 0  23 o 182.8789 6.409691  22.42413       1.557619      22.42413       1.557619      22.42413       1.557619      182.8789 6.409691  182.8789 6.409691  0.000000       0.000000  
1 1 1 14 0  24 o 45.19904 21.16035  2.050351       1.425238      2.050351       1.425238      2.050351       1.425238      45.19904 21.16035  45.19904 21.16035  0.000000       0.000000  
1 1 1 14 0  25 o 24.05412 16.59744  -1.277242      1.781113      -1.277242      1.781113      -1.277242      1.781113      24.05412 16.59744  24.05412 16.59744  0.000000       0.000000  
1 1 1 14 0  26 o 52.21839 28.88491  2.888775       2.938437      2.888775       2.938437      2.888775       2.938437      52.21839 28.88491  52.21839 28.88491  0.000000       0.000000  
1 1 1 14 0  27 o 36.13261 24.12782  -0.5107287     3.181162      -0.5107287     3.181162      -0.5107287     3.181162      36.13261 24.12782  36.13261 24.12782  0.000000       0.000000  
1 1 1 14 0  28 o 98.83690 24.78058  8.218774       2.823016      8.218774       2.823016      8.218774       2.823016      98.83690 24.78058  98.83690 24.78058  0.000000       0.000000  
1 1 1 14 0  29 o 52.25278 29.28396  3.340143       3.067480      3.340143       3.067480      3.340143       3.067480      52.25278 29.28396  52.25278 29.28396  0.000000       0.000000  
1 1 1 14 0  30 o 68.51274 42.68208  9.048630       7.897305      9.048630       7.897305      9.048630       7.897305      68.51274 42.68208  68.51274 42.68208  0.000000       0.000000  
1 1 1 14 0  31 f 59.61159 37.00452  6.107305       5.883031      6.107305       5.883031      6.107305       5.883031      59.61159 37.00452  59.61159 37.00452  0.000000       0.000000  
1 1 1 14 0  32 o 39.67607 26.78115  0.6768970      4.117990      0.6768970      4.117990      0.6768970      4.117990      39.67607 26.78115  39.67607 26.78115  0.000000       0.000000  
1 1 1 14 1  0  o 967.9128 51.53629  649.1705       66.03647      649.1705       66.03647      649.1705       66.03647      967.9128 51.53629  967.9128 51.53629  0.000000       0.000000  
1 1 1 14 1  1  o 753.0895 3.970628  378.0084       3.984551      376.7131       4.031432      432.7292       26.20357      751.7944 4.024267  799.7397 24.61817  -47.94531      24.94492  
1 1 1 14 1  2  o 370.1788 9.557815  91.55978       4.710644      89.02744       8.873187      92.55358       5.558650      363.6224 18.37236  371.9833 11.22715  -8.360931      21.53120  
1 1 1 14 1  3  o 683.5317 22.26842  315.3093       20.25544      321.7680       28.77629      308.9666       28.51649      686.1245 31.55899  672.1089 31.93205  14.01563       44.89572  
1 1 1 14 1  4  o 124.0047 14.78111  10.44165       2.394385      17.10563       4.695427      8.099777       2.783488      157.6507 23.03114  108.0597 20.06954  49.59096       30.54865  
1 1 1 14 1  5  o 291.8441 8.673676  56.89744       3.369344      53.79039       9.691186      57.32465       3.593520      280.7240 26.21036  292.8886 9.219031  -12.16461      27.78441  
1 1 1 14 1  6  o 742.5060 16.24009  369.5697       16.06800      377.7509       33.87128      367.1940       18.25250      742.1472 34.34370  739.2054 18.54500  2.941772       39.03085  
1 1 1 14 1  7  o 1003.337 42.85997  700.1747       57.17030      645.6838       87.45523      740.8372       75.54758      929.9914 71.11149  1017.249 55.94938  -87.25793      90.48302  
1 1 1 14 1  8  o 185.4185 8.997652  23.00242       2.216447      0.000000       0.000000      23.00242       2.216447      ?        ?         185.4185 8.997652  0.000000       8.997652  
1 1 1 14 1  9  o 497.1618 11.08915  165.1491       7.346314      180.8013       15.29469      160.4551       8.375739      517.5104 22.23116  489.6407 12.84836  27.86966       25.67693  
1 1 1 14 1  10 f 204.5515 15.39075  28.18827       4.164270      33.71811       6.191957      23.62172       5.626853      222.8318 21.10495  185.7271 23.24371  37.10475       31.39568  
1 1 1 14 1  11 o 352.5412 9.007274  83.02526       4.227864      83.02526       4.227864      0.000000       0.000000      352.5412 9.007274  ?        ?         0.000000       9.007274  
1 1 1 14 1  12 o 256.2493 7.524189  43.85152       2.566406      42.66626       4.202940      44.55621       3.240728      252.2312 12.54428  258.1301 9.437611  -5.898926      15.69801  
1 1 1 14 1  13 o 650.5966 13.98012  283.6066       12.11982      267.1785       16.61370      302.2948       17.71975      629.3815 19.83451  669.4825 19.88503  -40.10095      28.08598  
1 1 1 14 1  14 o 183.6105 5.827659  22.50884       1.424016      23.88718       1.939617      20.89722       2.097343      189.0086 7.717476  176.6481 8.939243  12.36046       11.80972  
1 1 1 14 1  15 o 222.2000 5.891787  32.96129       1.742935      33.96517       2.130625      30.93057       3.030336      225.4594 7.100796  214.7466 10.62285  10.71277       12.77757  
1 1 1 14 1  16 o 259.7150 5.391184  44.99820       1.865755      43.67508       2.177121      48.65704       3.620399      255.8019 6.387123  269.4471 10.10134  -13.64522      11.95125  
1 1 1 14 1  17 o 225.5578 8.595627  34.07830       2.578776      34.12083       5.418552      34.06585       2.932124      223.6062 18.34673  225.3389 9.788358  -1.732651      20.79457  
1 1 1 14 1  18 f 155.8242 12.93484  16.45627       2.661583      19.26010       4.078096      14.37575       3.512914      167.2488 18.61374  144.1860 18.72592  23.06279       26.40324  
1 1 1 14 1  19 o 316.5526 6.366070  66.96233       2.685288      71.14857       5.062075      65.32301       3.167724      324.9421 11.71008  312.4546 7.608286  12.48746       13.96467  
1 1 1 14 1  20 o 19.36895 8.618258  -0.1724195     0.4476826     -0.4954335     0.6776437     0.7774703E-01  0.5963556     22.03531 10.11910  25.29173 10.57588  -3.256420      14.63712  
1 1 1 14 1  21 o 205.2381 6.639950  28.21753       1.813529      29.44498       2.296086      26.18188       2.956908      209.3545 8.246749  196.6612 11.33153  12.69331       14.01472  
1 1 1 14 1  22 o 73.25848 5.559464  3.608646       0.5386537     6.626666       0.8900746     1.864575       0.6766241     99.24481 6.771020  51.72551 10.17944  47.51931       12.22570  
1 1 1 14 1  23 o 93.75766 7.480038  5.936232       0.9267668     5.966053       1.347263      5.909445       1.276862      93.26591 11.05543  92.94774 10.49254  0.3181686      15.24191  
1 1 1 14 1  24 o 58.46515 8.191477  2.344510       0.6206785     1.375491       1.497155      2.545619       0.6820519     48.46011 17.74864  60.87134 8.652138  -12.41123      19.74522  
1 1 1 14 1  25 o 48.89159 16.86609  1.565438       1.333345      0.6029628E-01  2.241656      2.389485       1.658656      46.11215 19.92835  58.22508 18.78577  -12.11293      27.38694  
1 1 1 14 1  26 o 46.56887 18.21318  1.093632       1.639128      -2.923941      2.793991      3.202019       2.024036      40.05373 19.06588  65.61102 20.70699  -25.55730      28.14760  
1 1 1 14 1  27 o 42.17955 17.10038  0.7323573      1.496858      0.9478095E-01  2.089664      1.404262       2.145182      43.81847 19.08654  51.67257 20.63726  -7.854107      28.11036  
1 1 1 14 1  28 o 40.53624 19.05396  -1.801808      2.629600      -6.579312      4.185441      1.313832       3.379981      42.07459 20.75567  56.75947 24.49996  -14.68488      32.10990  
1 1 1 14 1  29 o 77.12531 20.60818  5.002084       2.158301      10.13323       5.617915      4.113614       2.337702      91.00017 34.18193  68.90004 22.30818  22.10013       40.81739  
1 1 1 14 1  30 o 54.71492 24.66550  1.289117       3.798980      -2.257045      5.541441      4.433699       5.218250      52.72389 25.54132  66.86642 29.60570  -14.14253      39.10059  
1 1 1 14 1  31 o 48.29799 21.45338  0.9607391      2.762052      1.349546       3.142677      -0.3590355     5.790055      51.29250 22.82772  54.73632 26.41652  -3.443817      34.91328  
1 1 1 14 1  32 f 77.90240 23.52665  6.245110       2.646997      7.241872       4.010833      5.475973       3.523228      73.69645 28.58434  67.26451 26.58209  6.431938       39.03424  
1 1 1 14 2  0  o 84.32481 22.39415  5.652889       2.174005      5.652889       2.174005      5.652889       2.174005      84.32481 22.39415  84.32481 22.39415  0.000000       0.000000  
1 1 1 14 2  1  o 617.3655 15.23283  255.3475       12.53131      257.7992       17.55863      252.8024       17.88991      618.3260 21.34279  612.0801 21.97007  6.245972       30.63003  
1 1 1 14 2  2  o 564.3843 11.64353  212.9122       8.756549      211.6644       10.94305      215.1337       14.60051      562.0160 14.62464  565.3730 19.40903  -3.357056      24.30207  
1 1 1 14 2  3  o 207.7651 1.722869  28.76201       0.4769782     32.40071       4.741359      28.72481       0.4794102     219.2343 16.34777  207.6306 1.732776  11.60367       16.43934  
1 1 1 14 2  4  f 488.3042 12.89497  159.5945       8.383085      168.0876       9.596639      132.2396       17.22274      500.8579 14.39401  440.0907 29.53991  60.76721       32.86022  
1 1 1 14 2  5  o 596.1412 12.32002  237.6170       9.786652      226.2974       13.43198      250.4263       14.28852      580.4998 17.38418  610.6362 17.57857  -30.13647      24.72278  
1 1 1 14 2  6  o 415.2935 13.14602  115.4822       7.265668      112.5809       13.40764      116.6885       8.645080      407.4521 24.81224  417.0410 15.58408  -9.588898      29.30036  
1 1 1 14 2  7  o 361.0897 12.87034  87.31006       6.182775      86.57640       8.719435      88.05196       8.768296      358.6459 18.30576  361.7079 18.25112  -3.061920      25.84965  
1 1 1 14 2  8  o 722.7733 27.00646  354.3597       25.96443      354.8865       40.18971      353.9824       34.01611      714.0935 42.42759  717.6589 35.68267  -3.565430      55.43784  
1 1 1 14 2  9  o 362.3400 15.07972  88.08324       7.264954      73.92610       9.773910      105.5619       10.86011      330.4744 22.32613  395.5690 20.67516  -65.09460      30.42890  
1 1 1 14 2  10 o 412.6046 20.56730  114.8426       11.27233      0.000000       0.000000      114.8426       11.27233      ?        ?         412.6046 20.56730  0.000000       20.56730  
1 1 1 14 2  11 o 319.6831 8.029796  68.24184       3.417857      68.24184       3.417857      0.000000       0.000000      319.6831 8.029796  ?        ?         0.000000       8.029796  
1 1 1 14 2  12 o 210.8525 1.470533  29.62279       0.4131684     29.57428       0.4144573     37.38655       5.243015      210.6797 1.476330  235.4112 16.82492  -24.73151      16.88957  
1 1 1 14 2  13 o 283.7326 6.946750  53.71258       2.626421      52.17283       4.819925      54.36285       3.132304      278.8444 13.00778  285.2438 8.249557  -6.399353      15.40317  
1 1 1 14 2  14 o 270.9786 7.294096  49.04509       2.631388      47.84013       3.072973      52.35730       5.094869      267.4926 8.632618  279.1201 13.74059  -11.62747      16.22732  
1 1 1 14 2  15 o 224.2957 4.920263  33.54983       1.470560      33.85777       1.573370      31.42186       4.135999      225.3086 5.240581  215.8270 14.46491  9.481613       15.38497  
1 1 1 14 2  16 o 317.6786 6.135014  67.35384       2.597030      65.84343       2.845448      74.88857       6.355321      314.0351 6.799845  333.4082 14.33851  -19.37308      15.86918  
1 1 1 14 2  17 o 216.1286 7.841375  31.26640       2.254538      34.57317       4.452181      30.12601       2.614549      225.9761 14.86813  211.9477 9.280013  14.02846       17.52655  
1 1 1 14 2  18 o 365.1940 10.33976  89.53578       5.026554      92.92777       7.697817      87.01437       6.636841      370.2608 15.63743  358.9120 13.90344  11.34879       20.92450  
1 1 1 14 2  19 o 134.3458 4.020965  12.05051       0.7190165     11.07976       1.345914      12.43821       0.8505605     128.4164 7.903740  136.4411 4.685233  -8.024780      9.188065  
1 1 1 14 2  20 o 119.5410 2.495660  9.526079       0.3975355     9.332104       1.308330      9.545810       0.4172637     117.6937 8.397561  119.6615 2.616873  -1.967804      8.795855  
1 1 1 14 2  21 o 155.9308 1.818611  16.20514       0.3778724     12.49295       1.365366      16.51305       0.3932319     136.3362 7.545038  157.4035 1.874825  -21.06737      7.774481  
1 1 1 14 2  22 o 146.9461 6.987133  14.49950       1.364221      16.99339       1.803019      11.15984       2.086471      158.8142 8.551494  127.7257 12.41562  31.08849       15.07567  
1 1 1 14 2  23 o 162.4611 6.655324  17.71758       1.437711      16.83315       2.073417      18.53662       1.995294      157.6228 9.922091  165.6551 9.073825  -8.032303      13.44553  
1 1 1 14 2  24 o 87.57869 10.34953  5.265785       1.184487      2.907386       2.443796      5.989961       1.354186      65.59164 22.82287  93.28332 11.11256  -27.69168      25.38449  
1 1 1 14 2  25 o 115.3001 6.323816  8.954102       0.9678687     7.723526       2.699216      9.135669       1.036816      101.9693 20.57562  116.3874 6.713810  -14.41814      21.64327  
1 1 1 14 2  26 o 132.8805 9.190663  12.06876       1.617326      9.522671       2.024323      16.56220       2.689261      116.3287 13.29793  153.7952 13.25161  -37.46646      18.77339  
1 1 1 14 2  27 o 176.6297 12.63044  21.95043       2.953113      28.52900       5.712656      19.55134       3.449816      190.6575 22.94667  164.0798 15.98081  26.57773       27.96312  
1 1 1 14 2  28 o 47.38411 18.02115  1.418833       1.572767      -20.33622      13.65463      1.711336       1.583305      63.16887 32.01483  49.87576 18.25456  13.29311       36.85347  
1 1 1 14 2  29 o 48.79192 21.81238  0.3624150      2.903076      -1.678371      4.869034      1.488059       3.616135      52.90275 25.17841  56.32799 24.80503  -3.425236      35.34461  
1 1 1 14 2  30 o 51.84536 22.59519  1.385856       2.931942      4.552615       3.413475      -7.523349      5.725438      67.67900 26.33654  46.21999 23.04939  21.45901       34.99839  
1 1 1 14 2  31 o 38.97626 17.50574  0.2229805E-01  1.893732      4.259048       3.425717      -1.842143      2.272528      64.05149 25.90517  35.37657 16.93665  28.67492       30.95041  
1 1 1 14 2  32 o 43.84704 20.21346  0.1540674      2.740708      4.198566       6.112767      -0.8635424     3.066169      60.10965 28.49354  42.46491 20.14428  17.64474       34.89519  
1 1 1 14 3  0  o 579.1080 14.68580  224.4401       11.31617      224.4401       11.31617      224.4401       11.31617      579.1080 14.68580  579.1080 14.68580  0.000000       0.000000  
1 1 1 14 3  1  f 450.3934 13.47449  135.8529       8.077729      146.5771       10.45308      119.9558       12.72690      467.1866 16.81859  421.1538 22.76278  46.03281       28.30210  
1 1 1 14 3  2  o 535.2179 14.54328  191.9468       10.36248      191.9468       10.36248      0.000000       0.000000      535.2179 14.54328  ?        ?         0.000000       14.54328  
1 1 1 14 3  3  o 346.3228 12.44998  80.30326       5.736093      87.43542       7.090609      66.79642       9.757760      361.0428 14.76961  313.7631 23.50954  47.27979       27.76400  
1 1 1 14 3  4  o 452.8050 11.76673  137.1368       7.093693      135.4809       8.035334      142.9858       15.10178      449.7982 13.42143  459.3524 24.76379  -9.554260      28.16700  
1 1 1 14 3  5  o 203.4485 7.130791  27.64351       1.930162      30.05511       3.054213      26.03992       2.490546      211.8277 10.85661  197.2631 9.502863  14.56464       14.42811  
1 1 1 14 3  6  o 282.3750 8.783386  53.26979       3.300907      55.03875       5.502888      52.27552       4.125554      286.3707 14.46764  279.4963 11.09934  6.874359       18.23480  
1 1 1 14 3  7  o 711.9019 17.23769  339.9534       16.35207      358.4010       21.50372      314.6600       25.17947      729.0369 22.16130  680.7015 27.81841  48.33533       35.56666  
1 1 1 14 3  8  o 247.8508 5.718601  40.95916       1.888660      45.31151       5.523775      40.38299       2.009788      259.5298 16.05113  246.0877 6.128961  13.44212       17.18147  
1 1 1 14 3  9  o 870.3114 20.88312  509.7747       24.21829      551.6325       41.60344      488.3204       29.78509      896.6895 34.88535  848.8850 26.36352  47.80444       43.72668  
1 1 1 14 3  10 o 410.8349 19.35846  113.7108       10.56790      113.6416       14.06449      113.8005       16.01537      408.9234 25.94500  407.9910 29.66123  0.9323425      39.40725  
1 1 1 14 3  11 o 563.6186 19.03482  213.8207       14.27526      226.2704       17.42163      188.3817       24.90344      578.6044 22.63980  522.1363 36.01394  56.46808       42.53897  
1 1 1 14 3  12 o 427.2053 9.569396  121.8996       5.447467      122.0227       5.882593      121.1584       14.43245      427.3327 10.33069  421.8733 25.79679  5.459412       27.78844  
1 1 1 14 3  13 o 430.5923 7.204938  123.7245       4.133996      128.4240       5.408391      117.1202       6.411469      438.4708 9.256652  418.2780 11.51416  20.19278       14.77368  
1 1 1 14 3  14 o 485.4192 10.18908  157.5550       6.590605      164.1200       7.727838      140.0427       12.62150      495.1451 11.71257  454.5953 20.89176  40.54971       23.95099  
1 1 1 14 3  15 o 484.4746 8.217840  156.8038       5.305206      156.5209       5.763764      158.3723       13.57243      483.9182 8.938420  482.8138 21.14751  1.104431       22.95893  
1 1 1 14 3  16 o 131.1439 1.981920  11.46095       0.3463439     11.46672       0.3469354     9.772266       5.933706      131.1768 1.984805  116.7919 35.21444  14.38496       35.27033  
1 1 1 14 3  17 f 207.1468 6.781617  28.69352       1.869387      27.95444       2.296870      30.14372       3.217389      204.2511 8.457442  211.6220 11.45224  -7.370956      14.23664  
1 1 1 14 3  18 o 116.0700 16.53595  9.311193       2.485295      6.631976       3.205837      13.34677       3.934507      96.03741 24.85965  137.7336 22.19157  -41.69614      33.32368  
1 1 1 14 3  19 o 205.9221 5.973052  28.35360       1.637245      26.37717       2.179984      30.91084       2.479690      198.2789 8.269087  214.5954 8.689654  -16.31653      11.99533  
1 1 1 14 3  20 o 73.38602 5.614847  3.619202       0.5448967     1.826147       0.7627904     5.487617       0.7786552     51.06109 11.48950  90.35075 6.511223  -39.28967      13.20623  
1 1 1 14 3  21 o 83.53423 5.409582  4.682599       0.5989078     7.552442       2.295419      4.472959       0.6203972     103.6298 17.22738  81.59700 5.742545  22.03278       18.15928  
1 1 1 14 3  22 o 88.38687 4.704700  5.233156       0.5521103     5.431105       1.335212      5.192329       0.6063787     88.88591 11.54567  87.98836 5.194960  0.8975525      12.66058  
1 1 1 14 3  23 o 116.8293 8.632616  9.234711       1.334409      5.640231       2.651871      10.45344       1.544146      87.39449 22.60370  124.1692 9.402448  -36.77467      24.48129  
1 1 1 14 3  24 o 137.1618 7.383465  12.68320       1.344507      10.54853       2.249265      13.87000       1.677114      123.1508 13.95212  143.0990 8.838469  -19.94824      16.51606  
1 1 1 14 3  25 o 210.6086 7.123330  29.89486       1.996215      36.12116       5.945156      29.10369       2.119251      222.9334 20.23326  207.6091 7.673800  15.32423       21.63959  
1 1 1 14 3  26 o 130.2247 7.226339  11.48636       1.249048      13.17592       3.776919      11.27889       1.323517      131.1241 22.42144  128.8844 7.742162  2.239639       23.72050  
1 1 1 14 3  27 o 129.1520 6.531094  11.29947       1.120337      9.306178       4.159620      11.45538       1.163327      102.2524 29.12572  129.9729 6.740021  -27.72057      29.89541  
1 1 1 14 3  28 o 96.56463 19.31288  7.362092       2.398192      0.6643467      5.377066      9.025236       2.679451      62.20122 28.54212  107.0043 19.51056  -44.80313      34.57332  
1 1 1 14 3  29 o 45.81914 18.08424  1.293967       1.628787      6.367013       4.619446      0.5737330      1.740573      76.75321 30.40436  41.79592 17.80101  34.95729       35.23210  
1 1 1 14 3  30 o 48.53740 20.85264  1.171023       2.426501      0.1793616      2.525398      13.09362       8.756559      44.71959 20.13935  82.44920 37.28160  -37.72961      42.37348  
1 1 1 14 3  31 o 37.20929 17.71625  -1.575162      2.415437      -6.327733      5.255778      -0.3025806     2.719665      44.31734 22.09790  43.22256 19.99997  1.094772       29.80463  
1 1 1 14 3  32 o 78.24749 24.73139  6.653372       2.886258      16.01895       6.674908      4.499552       3.200978      88.36702 36.00505  62.95580 25.18721  25.41122       43.94041  
1 1 1 14 4  0  o 390.3737 13.39958  102.1023       6.951563      102.1023       6.951563      102.1023       6.951563      390.3737 13.39958  390.3737 13.39958  0.000000       0.000000  
1 1 1 14 4  1  o 278.7540 9.422741  51.93688       3.495000      53.50658       6.022538      51.13983       4.291564      282.0887 16.08885  276.3665 11.67984  5.722137       19.88140  
1 1 1 14 4  2  o 283.8435 9.621603  53.85538       3.633889      50.30597       4.800895      58.61698       5.560582      273.9153 13.19201  295.5915 14.15857  -21.67621      19.35186  
1 1 1 14 4  3  o 217.6607 18.83590  32.05553       5.409397      35.53922       8.769382      29.91579       6.872737      226.8404 29.72643  208.9273 25.19462  17.91310       38.96703  
1 1 1 14 4  4  o 69.14087 13.79345  3.311589       1.226239      3.075151       1.789493      3.520891       1.683668      66.86839 19.12206  71.05895 17.81641  -4.190567      26.13575  
1 1 1 14 4  5  o 393.1314 10.09813  103.2795       5.285578      104.1177       6.823648      102.0222       8.357240      394.3394 13.00371  389.8305 16.12322  4.508820       20.71364  
1 1 1 14 4  6  o 224.8405 7.481363  33.76169       2.238327      29.27822       4.187347      35.55529       2.648469      208.5402 15.17248  230.6535 8.632338  -22.11322      17.45627  
1 1 1 14 4  7  o 361.3452 8.333750  87.13235       4.012696      70.56653       13.13665      88.83707       4.214107      320.4913 31.15322  364.8391 8.668234  -44.34787      32.33669  
1 1 1 14 4  8  o 284.9774 5.154328  54.14151       1.957294      63.22494       7.869149      53.54249       2.020802      306.1285 19.39045  283.3897 5.351384  22.73883       20.11534  
1 1 1 14 4  9  o 423.7313 17.67789  120.7157       9.959546      105.9750       16.27908      129.5337       12.59089      393.1183 31.33574  437.9907 21.64038  -44.87238      38.08195  
1 1 1 14 4  10 o 170.0674 5.738842  19.30769       1.298663      18.15451       2.613475      19.68579       1.496497      164.3452 12.01711  171.6763 6.553756  -7.331070      13.68805  
1 1 1 14 4  11 o 480.2039 14.15450  154.5734       9.047311      155.5994       10.19023      150.7541       19.66168      481.4136 15.90703  468.5849 31.67513  12.82870       35.44499  
1 1 1 14 4  12 o 618.1540 10.61281  255.4062       8.741791      282.0416       12.06012      225.9188       12.68939      648.8311 13.94911  579.8494 16.43957  68.98163       21.56008  
1 1 1 14 4  13 o 490.9617 9.753531  161.0826       6.380916      158.1374       7.010700      175.3010       15.40395      486.2840 10.81927  508.2809 22.80143  -21.99686      25.23810  
1 1 1 14 4  14 o 490.7582 10.57370  161.1170       6.914618      160.5744       7.288311      166.0053       21.87505      489.8167 11.16657  488.0687 33.84488  1.748016       35.63942  
1 1 1 14 4  15 o 224.1099 2.001105  33.46872       0.5975914     33.46101       0.5984122     36.27649       11.41346      224.0840 2.004085  223.2286 39.83150  0.8553772      39.88189  
1 1 1 14 4  16 o 121.3947 6.760743  9.871179       1.089303      10.52852       1.163258      5.189084       3.104570      125.3611 6.991391  86.07178 25.35692  39.28933       26.30310  
1 1 1 14 4  17 o 247.9454 7.348370  41.12612       2.425164      42.44659       2.761640      36.67618       5.069684      251.7672 8.242905  232.2058 16.49187  19.56140       18.43711  
1 1 1 14 4  18 o 295.1535 9.239955  58.44200       3.629578      58.34914       4.851024      58.56010       5.470651      294.1128 12.40573  294.1541 13.99711  -0.4135132E-01 18.70351  
1 1 1 14 4  19 o 251.0792 6.768783  42.18721       2.262552      42.64949       3.022181      41.59771       3.412767      252.0250 9.013705  248.5925 10.32503  3.432419       13.70595  
1 1 1 14 4  20 o 204.4595 7.310467  28.02691       1.988503      20.47048       4.403864      29.96211       2.228632      171.2114 19.65940  211.2943 7.929543  -40.08292      21.19835  
1 1 1 14 4  21 o 109.8458 4.933668  8.076201       0.7203064     5.698722       1.278617      9.181499       0.8718098     91.32453 10.71029  117.0618 5.605273  -25.73726      12.08840  
1 1 1 14 4  22 o 142.5936 3.256787  13.56441       0.6188178     15.31550       2.555041      13.45530       0.6378068     149.5807 12.94617  142.0124 3.370461  7.568237       13.37772  
1 1 1 14 4  23 o 110.1532 2.631819  8.092160       0.3863018     10.43563       2.077073      8.008196       0.3931614     123.0977 12.85186  109.5777 2.692620  13.52001       13.13090  
1 1 1 14 4  24 o 214.4156 10.83375  31.32591       3.085312      39.05406       5.818023      28.30230       3.639162      234.4588 18.77928  202.5016 13.56474  31.95724       23.16600  
1 1 1 14 4  25 o 216.8091 10.94749  32.20660       3.152520      32.85036       5.123614      31.81440       3.999142      213.9427 18.14332  213.5378 14.13414  0.4048462      22.99900  
1 1 1 14 4  26 o 66.28330 11.92038  3.122983       1.014148      3.071966       2.957982      3.129778       1.079582      66.34881 24.82787  66.09715 12.71907  0.2516556      27.89620  
1 1 1 14 4  27 o 31.81326 14.04681  -0.2000367     1.166916      -5.544603      4.949473      0.1145286      1.200765      49.06759 23.85549  34.36447 14.71450  14.70313       28.02857  
1 1 1 14 4  28 o 64.95473 11.59653  3.054151       0.9668895     7.331161       4.937927      2.883628       0.9859759     83.82677 31.91968  62.81364 12.21981  21.01313       34.17879  
1 1 1 14 4  29 o 94.07922 22.06906  7.678828       2.718562      4.014334       4.581135      9.670759       3.377562      66.83891 28.68272  102.5516 24.95644  -35.71274      38.02003  
1 1 1 14 4  30 o 57.60561 20.43451  2.829393       1.965629      0.6421059      2.763114      5.070388       2.796832      47.75056 21.31808  72.02628 24.43870  -24.27572      32.43009  
1 1 1 14 4  31 o 46.61187 19.83134  1.273013       2.156324      4.792151       4.666225      0.3174459      2.431521      64.28635 28.24813  43.62004 19.69219  20.66631       34.43456  
1 1 1 14 4  32 o 30.83905 15.12618  -2.841207      2.121322      3.201547       6.051179      -3.687882      2.265066      57.69902 27.62722  30.27630 14.99602  27.42272       31.43476  
1 1 1 14 5  0  f 324.9718 16.25023  71.09843       6.996520      71.09843       6.996520      71.09843       6.996520      324.9718 16.25023  324.9718 16.25023  0.000000       0.000000  
1 1 1 14 5  1  o 312.3711 10.11447  65.23083       4.204504      66.12224       6.529937      64.59956       5.495182      313.7650 15.66777  310.4703 13.31371  3.294739       20.56049  
1 1 1 14 5  2  o 447.6597 9.810953  133.8120       5.852383      130.0008       9.335041      136.2799       7.511929      440.1627 15.94217  451.2884 12.50382  -11.12564      20.26075  
1 1 1 14 5  3  o 265.3856 14.67325  47.29563       5.168726      48.01061       8.329392      46.84791       6.591297      265.7189 23.77530  263.4414 18.90208  2.277496       30.37357  
1 1 1 14 5  4  o 208.8829 8.740176  29.17131       2.427370      29.80447       3.887007      28.76655       3.107875      210.5873 13.93020  207.1838 11.30008  3.403458       17.93718  
1 1 1 14 5  5  o 187.3501 8.753538  23.47735       2.179259      22.61236       4.141726      23.80851       2.562693      182.8211 17.20348  188.5354 10.23913  -5.714294      20.01998  
1 1 1 14 5  6  o 281.6959 6.948044  52.92779       2.608054      52.09074       3.632492      53.81837       3.746858      279.1385 9.780997  283.7210 9.925943  -4.582520      13.93529  
1 1 1 14 5  7  o 544.9639 10.16904  198.3391       7.384500      207.0825       14.41768      195.2298       8.597865      554.7479 19.53461  540.4332 11.93919  14.31464       22.89422  
1 1 1 14 5  8  o 471.6355 15.20351  149.1556       9.542368      141.1316       13.67985      156.7600       13.31735      457.0067 22.53338  482.2002 20.77480  -25.19357      30.64874  
1 1 1 14 5  9  o 434.1738 12.62946  126.1835       7.298946      127.4832       11.84625      125.3882       9.266894      434.7556 20.50632  432.1683 16.12017  2.587280       26.08389  
1 1 1 14 5  10 o 151.5199 11.58952  15.43718       2.322203      19.46272       4.741663      14.16700       2.663486      168.5931 21.60228  144.7978 13.97787  23.79538       25.73013  
1 1 1 14 5  11 o 174.6781 9.330973  20.43534       2.164015      20.43534       2.164015      0.000000       0.000000      174.6781 9.330973  ?        ?         0.000000       9.330973  
1 1 1 14 5  12 o 627.7619 16.94309  265.0157       14.16002      265.0157       14.16002      0.000000       0.000000      627.7619 16.94309  ?        ?         0.000000       16.94309  
1 1 1 14 5  13 o 338.1549 5.940531  76.27737       2.676791      76.17654       2.810519      77.26192       8.782362      337.9103 6.241824  337.7912 19.59557  0.1191101      20.56567  
1 1 1 14 5  14 o 217.1970 1.112817  31.43200       0.3220706     31.50594       0.3231984     20.89288       3.858639      217.4523 1.115403  175.3598 16.71513  42.09241       16.75231  
1 1 1 14 5  15 o 457.1129 7.950495  139.6185       4.842741      149.4236       5.604344      110.7174       9.621744      472.7200 8.897076  404.3205 17.90329  68.39957       19.99214  
1 1 1 14 5  16 o 294.8922 8.213307  58.19411       3.224272      58.39080       3.345541      55.62751       12.08500      295.3430 8.509797  279.2156 33.12604  16.12738       34.20162  
1 1 1 14 5  17 o 248.7864 6.828813  41.38997       2.261697      40.65673       2.402519      47.10032       6.704653      246.5032 7.322382  262.1530 19.32915  -15.64983      20.66962  
1 1 1 14 5  18 o 217.4069 7.321444  31.65052       2.117989      30.50100       2.451483      35.03435       4.206059      213.2048 8.646896  227.2833 13.95511  -14.07849      16.41688  
1 1 1 14 5  19 o 230.4055 8.368351  35.62632       2.564982      36.31573       3.688698      34.98088       3.569122      231.7563 11.98522  227.4932 11.81436  4.263107       16.82927  
1 1 1 14 5  20 o 211.4002 8.215968  30.01653       2.309990      29.39566       4.680131      30.21650       2.656065      206.4358 17.16899  211.8343 9.433209  -5.398468      19.58979  
1 1 1 14 5  21 o 185.0688 6.949502  22.97346       1.710757      22.30121       3.108930      23.26543       2.048846      180.8339 12.98853  185.9813 8.288177  -5.147354      15.40766  
1 1 1 14 5  22 o 112.1132 4.997836  8.417438       0.7447650     4.665246       1.677376      9.338785       0.8311889     81.04753 16.09931  118.0655 5.296763  -37.01794      16.94826  
1 1 1 14 5  23 o 180.6217 4.234603  21.79445       1.019192      21.11921       3.710128      21.84957       1.059971      174.0033 16.18704  180.8308 4.398941  -6.827454      16.77411  
1 1 1 14 5  24 o 113.2221 2.809705  8.553360       0.4239022     10.53104       3.755342      8.527835       0.4266289     117.5597 24.75632  113.0162 2.835170  4.543495       24.91814  
1 1 1 14 5  25 o 84.25435 12.70804  5.001663       1.382404      1.730003       2.998265      5.884933       1.557876      59.78987 24.21577  91.34879 13.17909  -31.55891      27.56977  
1 1 1 14 5  26 o 125.0637 10.12408  10.79717       1.672764      14.80513       3.934290      9.912759       1.848131      138.5176 22.05386  119.0573 11.80467  19.46031       25.01445  
1 1 1 14 5  27 o 22.67955 10.40060  -0.4530905     0.7125195     1.665087       5.045454      -0.4961932     0.7197325     65.37867 29.02044  22.53138 10.37667  42.84729       30.81982  
1 1 1 14 5  28 o 119.8116 9.062209  9.986339       1.436066      7.314075       8.345872      10.06787       1.457809      79.74226 36.19271  120.2433 9.167538  -40.50101      37.33572  
1 1 1 14 5  29 o 107.6416 8.527398  8.087268       1.213137      7.962938       5.680439      8.093210       1.241786      79.24147 32.84705  107.5597 8.739333  -28.31826      33.98977  
1 1 1 14 5  30 o 79.88653 27.08130  6.850144       3.434324      8.090485       4.431392      4.984791       5.434381      81.04487 30.37601  66.99950 29.90523  14.04536       42.62657  
1 1 1 14 5  31 o 37.04716 16.91306  -0.2610213     1.856308      -2.889997      4.126356      0.4060264      2.078509      43.87727 21.43119  41.64832 18.54835  2.228951       28.34320  
1 1 1 14 5  32 o 32.78498 16.23031  -3.891239      2.640851      3.059663       7.037109      -5.030602      2.849080      57.55908 28.08629  32.35355 16.15384  25.20553       32.40040  
1 1 1 14 6  0  f 320.1526 4.756731  68.35271       2.028257      68.35271       2.028257      68.35271       2.028257      320.1526 4.756731  320.1526 4.756731  0.000000       0.000000  
1 1 1 14 6  1  o 645.5667 12.94676  278.7183       11.13719      279.6429       12.74203      275.7259       22.92390      646.2639 14.79637  637.5191 27.04642  8.744751       30.82923  
1 1 1 14 6  2  o 525.1124 10.85470  184.2046       7.595279      169.2259       15.46220      188.9684       8.719804      500.4167 23.25171  531.6578 12.30838  -31.24115      26.30852  
1 1 1 14 6  3  o 515.6932 13.70438  178.0623       9.408912      182.5581       12.69236      172.5777       14.01872      521.1664 18.30489  506.0472 20.83404  15.11914       27.73313  
1 1 1 14 6  4  o 552.5585 14.57297  204.5431       10.72064      211.3816       22.50838      202.5365       12.19245      556.6542 30.46096  549.3748 16.67446  7.279480       34.72618  
1 1 1 14 6  5  o 442.0898 12.05754  130.7439       7.096383      0.000000       0.000000      130.7439       7.096383      ?        ?         442.0898 12.05754  0.000000       12.05754  
1 1 1 14 6  6  o 315.7891 5.851607  66.49343       2.462327      65.69231       7.019526      66.60583       2.629408      312.5312 16.91855  316.0387 6.243731  -3.507477      18.03390  
1 1 1 14 6  7  o 530.2084 13.67432  188.2447       9.653021      186.6458       11.95254      191.2434       16.36901      527.2203 17.03589  531.9426 23.14862  -4.722229      28.74161  
1 1 1 14 6  8  o 428.6457 11.55116  122.8983       6.591763      134.5980       10.18332      114.4604       8.648034      447.5723 17.10616  412.9565 15.74475  34.61575       23.24904  
1 1 1 14 6  9  o 650.6255 18.87494  284.8049       16.34673      281.5664       22.53780      288.3996       23.74495      643.9677 26.32026  651.2273 27.42447  -7.259583      38.01128  
1 1 1 14 6  10 o 467.8160 14.09262  146.7222       8.774957      156.0385       11.87883      135.5322       13.01867      481.3702 18.55389  447.6313 21.89233  33.73886       28.69706  
1 1 1 14 6  11 o 472.7837 11.20973  149.4741       7.062056      159.7534       9.347360      135.8034       10.77957      487.9820 14.39085  448.9816 18.05453  39.00040       23.08815  
1 1 1 14 6  12 o 383.4649 7.665672  98.15855       3.916962      96.40436       4.336154      105.9379       9.131425      379.9326 8.564946  396.4452 17.32734  -16.51260      19.32861  
1 1 1 14 6  13 o 75.91816 3.458697  3.849702       0.3489710     3.907217       0.3564525     2.522545       1.712274      76.48167 3.506938  61.24353 19.00426  15.23814       19.32512  
1 1 1 14 6  14 o 506.9713 8.855514  171.8140       5.982334      175.2346       6.697067      158.3059       13.30864      511.7973 9.820039  482.6226 20.74282  29.17468       22.94989  
1 1 1 14 6  15 o 374.0453 12.97535  94.10862       6.457411      91.52835       7.825610      99.61432       11.43121      367.9684 15.99828  381.2248 22.60432  -13.25641      27.69296  
1 1 1 14 6  16 o 113.6529 6.554565  8.656071       0.9884435     9.067108       1.017527      1.772544       4.164001      116.3250 6.591437  70.78168 28.58439  45.54337       29.33452  
1 1 1 14 6  17 f 229.2325 6.997293  35.15919       2.134868      34.84365       2.301212      37.10808       5.719071      228.1167 7.581058  232.5891 18.60790  -4.472473      20.09294  
1 1 1 14 6  18 o 105.3174 14.88994  7.658183       2.031399      8.217854       2.118298      1.253598       7.165822      109.1488 14.95747  84.51633 36.06100  24.63251       39.04000  
1 1 1 14 6  19 o 82.30904 9.408211  4.607643       1.013363      3.957730       1.782045      4.918237       1.231935      74.53063 18.12156  84.73265 11.18378  -10.20202      21.29478  
1 1 1 14 6  20 o 101.2261 8.707678  6.929816       1.163138      2.898928       2.233829      8.429182       1.362396      65.63887 21.83734  111.6169 9.242892  -45.97799      23.71288  
1 1 1 14 6  21 o 197.2378 7.483298  26.12441       1.963217      31.15247       3.148622      22.92630       2.511116      214.4465 11.05596  184.1002 10.27700  30.34636       15.09473  
1 1 1 14 6  22 f 93.12798 6.472032  5.838262       0.7981486     3.687589       2.028261      6.232321       0.8681957     71.42867 20.33564  96.18143 6.818320  -24.75276      21.44826  
1 1 1 14 6  23 o 283.3292 6.090129  53.80318       2.299277      46.47191       4.685610      56.12844       2.638835      259.9586 13.57362  289.1602 6.848575  -29.20163      15.20349  
1 1 1 14 6  24 o 108.3184 4.178080  7.855732       0.6019179     13.87741       2.831065      7.570642       0.6160017     140.3448 15.39057  106.3086 4.357742  34.03616       15.99561  
1 1 1 14 6  25 o 91.62620 7.837571  5.718517       0.9477370     2.107296       3.141787      6.080019       0.9940424     62.16200 24.92476  94.46263 7.971497  -32.30063      26.16846  
1 1 1 14 6  26 o 24.53301 11.58723  -1.042136      0.9937366     -0.6830343     3.568057      -1.072333      1.034675      52.10328 23.65471  25.06946 11.83543  27.03382       26.45038  
1 1 1 14 6  27 o 31.79799 14.40339  -0.5126483     1.313797      2.441981       5.241140      -0.7107517     1.357126      67.43291 29.77208  31.34809 14.36771  36.08482       33.05764  
1 1 1 14 6  28 o 23.94049 11.00518  -0.4933441     0.8043262     4.031356       4.830637      -0.6223637     0.8157130     68.59898 29.44599  23.35728 10.85786  45.24171       31.38406  
1 1 1 14 6  29 o 123.4434 13.11288  11.28178       2.123987      12.72159       3.605334      10.51645       2.628557      119.1905 23.53575  114.6320 17.78419  4.558571       29.49930  
1 1 1 14 6  30 o 48.92170 15.85433  1.897546       1.180585      2.106651       4.751204      1.883785       1.218811      58.04306 26.70572  48.76036 16.12726  9.282700       31.19750  
1 1 1 14 6  31 o 49.89964 19.47597  2.037035       1.871169      3.346903       5.172685      1.839824       2.007092      58.91675 27.37240  48.86168 19.80442  10.05507       33.78555  
1 1 1 14 6  32 o 65.37075 8.544624  3.070865       0.7265044     19.61996       12.15020      3.011485       0.7278066     69.51769 34.48480  64.66273 8.664595  4.854965       35.55667  
1 1 1 14 7  0  o 506.0479 20.92432  172.3285       14.05469      172.3285       14.05469      172.3285       14.05469      506.0479 20.92432  506.0479 20.92432  0.000000       0.000000  
1 1 1 14 7  1  o 358.6201 12.06226  86.06440       5.755969      83.29286       8.663302      88.25478       7.701633      351.7336 18.54958  362.5644 15.98058  -10.83081      24.48399  
1 1 1 14 7  2  o 484.4865 9.368397  156.7003       6.048121      123.5720       12.81734      166.1896       6.859862      427.6273 22.57356  498.8347 10.32013  -71.20746      24.82077  
1 1 1 14 7  3  o 302.1558 8.830347  60.98738       3.551535      53.71126       4.708158      70.59413       5.409901      283.1554 12.50909  324.6934 12.52731  -41.53796      17.70342  
1 1 1 14 7  4  o 219.0158 7.753339  32.04280       2.259187      27.95375       6.820143      32.54679       2.394367      201.7061 25.97719  220.7031 8.155606  -18.99709      27.22735  
1 1 1 14 7  5  o 639.7051 12.12418  273.5731       10.33489      0.000000       0.000000      273.5731       10.33489      ?        ?         639.7051 12.12418  0.000000       12.12418  
1 1 1 14 7  6  o 263.0135 10.31100  46.27505       3.606700      48.09368       5.234280      44.63098       4.976747      267.5892 14.73652  257.7734 14.54789  9.815735       20.70764  
1 1 1 14 7  7  o 128.6683 6.322947  11.06757       1.080768      13.88166       3.403631      10.75202       1.139753      142.6218 18.33300  126.7842 6.770959  15.83763       19.54340  
1 1 1 14 7  8  o 895.8304 22.15083  541.3206       26.44170      563.6472       39.28363      522.8264       35.75357      907.1566 32.55070  874.9606 30.71366  32.19604       44.75351  
1 1 1 14 7  9  o 142.9846 9.383667  13.71193       1.777986      9.457234       10.44858      13.83881       1.804301      126.9493 46.82150  143.6376 9.479867  -16.68829      47.77154  
1 1 1 14 7  10 o 177.6484 9.582644  21.14347       2.260007      20.82541       2.390509      23.82014       6.934912      176.2355 10.22332  184.7403 29.13561  -8.504852      30.87718  
1 1 1 14 7  11 o 219.2782 7.358008  32.12730       2.146909      31.68364       2.721571      32.85823       3.493255      217.5592 9.410158  221.2586 11.89201  -3.699432      15.16479  
1 1 1 14 7  12 o 466.9185 10.07914  145.7846       6.271017      143.1717       7.174483      154.2432       12.90875      462.2867 11.65607  477.1926 20.34769  -14.90588      23.44979  
1 1 1 14 7  13 o 307.3877 5.122777  63.02069       2.098290      63.33195       2.215032      60.29909       6.549753      308.1279 5.394803  298.7332 16.51817  9.394684       17.37682  
1 1 1 14 7  14 o 501.2327 11.08552  168.3666       7.404042      166.0372       8.452276      176.0495       15.35014      497.1209 12.77020  507.3454 22.76369  -10.22446      26.10102  
1 1 1 14 7  15 f 207.2719 1.505721  28.62718       0.4158707     28.65560       0.4179374     25.77462       4.186930      207.3746 1.512454  194.6136 16.29487  12.76102       16.36491  
1 1 1 14 7  16 o 303.5453 7.325302  61.59999       2.962938      61.29677       3.051854      66.57722       12.36473      302.7628 7.564630  305.7203 30.77004  -2.957458      31.68626  
1 1 1 14 7  17 f 86.55604 5.706701  5.025088       0.6545249     4.874590       0.6622036     11.40191       4.310497      85.22787 5.866700  125.4727 26.60753  -40.24482      27.24663  
1 1 1 14 7  18 o 99.68549 14.70659  6.877598       1.894916      7.040042       2.017612      5.662547       5.518007      100.6697 15.54033  93.54568 34.10334  7.124046       37.47719  
1 1 1 14 7  19 o 53.93979 16.47912  2.000512       1.293579      0.8520207      1.571445      4.414584       2.278298      45.24019 17.79147  78.37445 21.27461  -33.13426      27.73347  
1 1 1 14 7  20 f 260.0164 7.106264  45.32525       2.459847      45.91869       3.142030      44.38561       3.953677      261.2165 9.040477  255.9828 11.62120  5.233749       14.72354  
1 1 1 14 7  21 o 152.9808 8.956335  15.79865       1.817762      13.59567       2.591357      17.93276       2.550535      140.5119 14.02740  162.2449 11.87976  -21.73294      18.38197  
1 1 1 14 7  22 o 97.41963 9.391952  6.460458       1.204107      2.206602       2.667123      7.549426       1.349458      62.14331 23.50616  105.3018 9.727120  -43.15848      25.43926  
1 1 1 14 7  23 o 68.83815 9.351393  3.261108       0.8356261     4.727512       2.629618      3.096397       0.8813076     79.46008 23.31751  66.84167 10.21885  12.61841       25.45842  
1 1 1 14 7  24 o 157.2399 5.450990  16.59874       1.140393      16.02720       3.462750      16.66827       1.207769      149.2391 17.76068  157.4988 5.764564  -8.259735      18.67276  
1 1 1 14 7  25 o 78.01884 26.92271  4.835289       3.397536      3.603706       3.794767      9.811297       7.627703      71.73734 27.80946  100.2013 39.25987  -28.46397      48.11136  
1 1 1 14 7  26 o 58.41481 25.84376  0.6798099      3.968911      0.3052375      4.511940      1.961007       8.344560      59.85315 26.94003  75.77968 35.05352  -15.92653      44.20989  
1 1 1 14 7  27 o 50.14811 14.28991  1.880437       1.001093      -0.6947513     4.502117      2.014389       1.026799      55.12452 25.58521  51.81015 14.37059  3.314369       29.34479  
1 1 1 14 7  28 o 45.20133 17.22978  1.349982       1.439704      11.63131       7.117211      0.9113296      1.470095      89.16240 36.84536  41.91682 16.96389  47.24558       40.56297  
1 1 1 14 7  29 o 83.39218 9.234104  4.928159       1.008936      4.753082       3.547523      4.943566       1.052396      68.43061 26.78520  83.29405 9.660785  -14.86344      28.47416  
1 1 1 14 7  30 o 44.29204 8.811554  1.421427       0.5017536     -3.936754      6.048061      1.458561       0.5034892     50.03335 24.73151  44.91147 8.727687  5.121880       26.22632  
1 1 1 14 7  31 o 26.49021 11.60617  -0.8114167E-02 0.7825375     17.37790       5.920887      -0.3172078     0.7894630     103.3468 35.54601  24.32820 11.07686  79.01865       37.23191  
1 1 1 14 8  0  o 108.2196 34.55638  9.941180       4.389744      9.941180       4.389744      9.941180       4.389744      108.2196 34.55638  108.2196 34.55638  0.000000       0.000000  
1 1 1 14 8  1  o 240.8404 15.84463  39.03283       5.056685      36.69848       6.100378      44.15879       9.039855      232.8242 19.85244  253.9452 27.13456  -21.12096      33.62148  
1 1 1 14 8  2  o 619.6469 8.216061  256.2184       6.783931      244.7599       13.54229      260.0571       7.838349      603.8954 16.84540  624.1177 9.425069  -20.22235      19.30284  
1 1 1 14 8  3  o 63.67966 8.857064  2.758449       0.7312466     4.096993       1.458231      2.308778       0.8451959     76.94829 14.75853  57.78206 11.38229  19.16623       18.63789  
1 1 1 14 8  4  o 369.4972 7.908159  91.09702       3.893678      81.28812       13.49264      91.98809       4.066690      344.5495 29.67704  371.2780 8.219934  -26.72852      30.79438  
1 1 1 14 8  5  o 301.0838 5.281734  60.43810       2.119031      68.47821       19.42915      60.34131       2.131748      308.7097 48.85560  300.8412 5.317715  7.868408       49.14415  
1 1 1 14 8  6  o 485.5112 16.31803  158.2670       10.54200      0.000000       0.000000      158.2670       10.54200      ?        ?         485.5112 16.31803  0.000000       16.31803  
1 1 1 14 8  7  o 459.9516 13.86185  141.7818       8.486156      158.9235       14.92023      133.5848       10.31754      484.4919 23.17805  445.6872 17.40638  38.80469       28.98627  
1 1 1 14 8  8  o 71.66632 22.96487  3.395194       2.481642      5.443294       7.631688      3.153023       2.624261      103.7580 39.64027  70.43759 23.67310  33.32039       46.17105  
1 1 1 14 8  9  o 563.9022 13.74705  213.0395       10.32968      209.8213       11.54111      225.9999       23.16072      558.9952 15.50908  573.9259 30.39301  -14.93066      34.12135  
1 1 1 14 8  10 o 163.3523 5.499727  17.81600       1.195419      18.50493       1.544239      16.78582       1.888366      166.3793 6.980840  158.2660 8.991150  8.113251       11.38301  
1 1 1 14 8  11 o 222.5244 4.830321  33.01895       1.432278      33.56458       1.463578      20.67003       6.962763      224.3529 4.895653  170.5801 31.80194  53.77278       32.17656  
1 1 1 14 8  12 o 400.3702 8.209208  107.0899       4.379621      106.9864       4.794863      107.6106       10.75898      400.0679 8.994333  398.0772 20.35044  1.990753       22.24946  
1 1 1 14 8  13 o 410.4409 10.99089  112.9497       6.005732      109.3345       7.259196      120.7921       10.69168      403.1592 13.53176  421.8273 19.07051  -18.66806      23.38360  
1 1 1 14 8  14 o 452.3119 9.677914  136.9939       5.833017      137.7046       6.371222      133.3126       14.50063      453.2701 10.54853  439.4370 24.86522  13.83319       27.01020  
1 1 1 14 8  15 o 394.4521 9.520817  104.2425       5.004285      108.4681       5.642620      88.67230       10.83146      401.9805 10.54332  358.4821 22.79298  43.49835       25.11337  
1 1 1 14 8  16 o 179.2739 6.613899  21.50778       1.577259      22.19485       1.630126      11.42762       6.243912      182.1047 6.729367  123.7172 35.82477  58.38745       36.45132  
1 1 1 14 8  17 o 209.8455 6.183267  29.45426       1.727099      28.83897       1.833344      34.30600       5.148201      207.5782 6.636622  223.5788 17.41764  -16.00056      18.63918  
1 1 1 14 8  18 o 258.0883 9.778357  44.83199       3.356769      43.21965       3.838333      50.07535       6.921794      252.9333 11.41785  268.8827 19.45037  -15.94934      22.55403  
1 1 1 14 8  19 o 409.5341 8.424519  112.5650       4.597363      107.7373       5.744569      121.1653       7.667337      399.5796 10.79889  422.1905 13.64689  -22.61087      17.40269  
1 1 1 14 8  20 o 226.9106 8.491212  34.63806       2.562897      29.02633       3.029109      48.77670       4.808065      206.9934 11.02182  267.4304 13.53632  -60.43698      17.45602  
1 1 1 14 8  21 o 293.6802 9.742905  58.25069       3.807458      56.05713       5.231613      60.72092       5.551753      286.1759 13.75952  297.7083 14.03427  -11.53244      19.65414  
1 1 1 14 8  22 o 280.3587 13.45301  53.98329       5.011155      56.33046       5.805996      47.12800       9.922427      285.1348 15.33749  246.9706 30.81972  38.16414       34.42519  
1 1 1 14 8  23 o 144.3590 8.431021  14.12176       1.614743      15.24897       3.958004      13.89669       1.768620      143.9686 21.27138  142.9290 9.337376  1.039536       23.23054  
1 1 1 14 8  24 o 125.2709 6.932674  10.60807       1.152730      11.65463       3.320445      10.46465       1.229178      124.7981 20.69146  124.2787 7.456697  0.5194092      21.99406  
1 1 1 14 8  25 o 82.81083 9.771989  4.759903       1.057567      -2.083510      4.101576      5.247280       1.094578      51.76886 24.15948  87.05711 9.594513  -35.28825      25.99491  
1 1 1 14 8  26 o 40.90423 13.43018  1.167137       0.8457865     3.247788       4.302040      1.083482       0.8626218     68.36748 28.48290  39.92292 13.57201  28.44456       31.55115  
1 1 1 14 8  27 o 105.6380 7.956890  7.700297       1.111815      9.470633       4.628557      7.591895       1.145350      94.47188 31.43397  104.7427 8.273312  -10.27085      32.50449  
1 1 1 14 8  28 o 19.45226 8.781023  -0.2155175     0.4833755     -5.509789      6.460140      -0.1857097     0.4847344     51.99640 25.67562  19.75436 8.865848  32.24203       27.16322  
1 1 1 14 8  29 o 60.07713 8.752614  2.568940       0.6800987     3.096794       3.601549      2.549421       0.6925586     60.08105 25.59796  59.74927 8.975807  0.3317757      27.12601  
1 1 1 14 8  30 o 23.25287 10.98053  -0.8097450     0.8916164     -0.7422791     12.15587      -0.8101099     0.8940246     60.15778 30.45747  23.29034 10.99735  36.86744       32.38208  
1 1 1 14 8  31 o 58.38779 11.45749  2.588130       0.8595763     -4.831975      4.301548      2.896752       0.8772703     40.84261 20.30402  62.13760 10.99746  -21.29499      23.09107  
1 1 1 14 9  0  o 196.2210 13.68501  26.08174       3.537513      26.08174       3.537513      26.08174       3.537513      196.2210 13.68501  196.2210 13.68501  0.000000       0.000000  
1 1 1 14 9  1  o 636.2403 17.50547  271.9003       14.82707      272.9523       20.50529      270.7475       21.46490      635.1125 24.27403  632.0186 25.54000  3.093872       35.23522  
1 1 1 14 9  2  o 218.7191 7.524544  31.95399       2.189743      29.96459       3.782083      32.95714       2.685670      211.1778 13.51118  222.0010 9.097988  -10.82318      16.28881  
1 1 1 14 9  3  o 150.1940 9.476174  15.12248       1.886860      12.08814       2.992361      17.12527       2.431077      133.1194 17.27651  159.6527 11.50459  -26.53328      20.75652  
1 1 1 14 9  4  o 763.7031 12.90349  390.2256       13.13122      424.3223       34.61565      384.4944       14.19199      786.5917 33.09949  757.7783 14.05490  28.81342       35.95993  
1 1 1 14 9  5  o 199.7350 8.332073  26.67403       2.212717      0.000000       0.000000      26.67403       2.212717      ?        ?         199.7350 8.332073  0.000000       8.332073  
1 1 1 14 9  6  f 638.9112 24.28945  276.7137       20.64145      0.000000       0.000000      276.7137       20.64145      ?        ?         638.9112 24.28945  0.000000       24.28945  
1 1 1 14 9  7  o 362.5789 10.71129  87.95327       5.169416      81.90774       5.687695      116.6638       12.39479      349.6625 12.22594  414.8625 22.50561  -65.19995      25.61203  
1 1 1 14 9  8  o 446.7471 10.38754  133.4136       6.183694      126.2050       7.774981      145.8232       10.20119      433.8189 13.46616  465.6197 16.46760  -31.80084      21.27250  
1 1 1 14 9  9  o 555.7027 11.60740  206.6738       8.595098      204.1008       11.18513      210.3840       13.43147      551.1298 15.24512  558.6025 18.06837  -7.472717      23.64064  
1 1 1 14 9  10 o 609.5386 13.41085  249.1843       10.89259      236.6977       14.95175      263.3066       15.90092      591.8224 18.98407  624.1606 19.14106  -32.33826      26.95877  
1 1 1 14 9  11 f 37.23165 7.625965  0.9596323      0.3656012     0.9102857      0.3685431     4.013556       2.899271      36.22118 7.861864  77.40089 24.82410  -41.17971      26.03929  
1 1 1 14 9  12 o 531.6978 12.68951  189.7702       8.990485      184.9487       10.87394      200.1867       15.98286      523.6774 15.60034  541.5255 22.19645  -17.84802      27.13030  
1 1 1 14 9  13 o 501.6657 13.79914  169.5062       9.215680      171.9925       11.29355      164.5514       15.94314      504.0085 16.83951  488.5952 24.56670  15.41327       29.78408  
1 1 1 14 9  14 o 248.2533 6.773565  41.20594       2.238617      41.99508       2.457736      37.36292       5.423685      250.5406 7.369805  234.0245 17.51955  16.51604       19.00654  
1 1 1 14 9  15 o 483.5236 9.024404  156.6400       5.814465      158.4745       6.793238      151.6140       11.24417      485.8714 10.49257  471.5353 17.92798  14.33606       20.77274  
1 1 1 14 9  16 o 239.9814 2.412805  38.38805       0.7715666     38.31121       0.7759978     45.05809       7.230214      239.7404 2.429102  254.6930 21.50472  -14.95261      21.64148  
1 1 1 14 9  17 o 136.2682 7.705536  12.47600       1.393469      12.42513       1.442511      13.18630       5.389920      135.9452 7.998435  132.7662 31.02723  3.179001       32.04160  
1 1 1 14 9  18 o 89.25194 6.323224  5.354900       0.7471516     5.328709       0.7758860     5.689000       2.771088      88.99833 6.589219  88.44651 23.22111  0.5518188      24.13789  
1 1 1 14 9  19 o 41.38194 16.72917  0.5537010      1.427940      -0.7692822     1.807241      2.752026       2.329619      38.02916 17.08912  64.76376 22.29584  -26.73460      28.09168  
1 1 1 14 9  20 o 258.5893 8.055506  44.95748       2.772342      45.38099       3.095583      43.24138       6.231370      259.5271 8.964764  248.5830 18.95509  10.94409       20.96813  
1 1 1 14 9  21 o 114.2081 16.80154  9.215351       2.480586      9.680384       2.815078      7.599926       5.246771      116.3146 18.80409  99.20409 33.47374  17.11051       38.39382  
1 1 1 14 9  22 o 215.3910 11.87038  31.77136       3.393777      32.07080       4.994595      31.51452       4.625660      212.8965 17.76776  211.8677 16.51496  1.028809       24.25772  
1 1 1 14 9  23 o 38.50720 15.16122  0.6539632      1.142317      10.18313       3.754238      -0.3182853     1.199176      114.1616 25.34038  31.96381 14.17024  82.19784       29.03327  
1 1 1 14 9  24 o 47.65469 15.57393  1.582656       1.137930      -3.279939      2.945538      2.435688       1.233711      40.31405 19.29555  57.58044 15.66592  -17.26638      24.85436  
1 1 1 14 9  25 o 137.8445 7.763728  12.95834       1.420281      10.33887       5.674612      13.13340       1.466972      101.3646 34.80124  138.6890 7.971495  -37.32443      35.70254  
1 1 1 14 9  26 o 119.4049 5.629313  9.648756       0.8931547     7.356812       4.812000      9.730533       0.9089490     85.09361 31.70179  119.8855 5.706212  -34.79187      32.21125  
1 1 1 14 9  27 o 121.6429 4.874547  9.997212       0.7885225     16.72600       4.909543      9.819043       0.7988939     131.4673 28.82162  120.5139 4.985598  10.95343       29.24965  
1 1 1 14 9  28 o 81.31850 9.762480  4.713606       1.036722      15.44305       8.864821      4.564827       1.043885      88.75993 38.97077  79.86923 10.02899  8.890701       40.24055  
1 1 1 14 9  29 o 43.22487 13.00931  1.424414       0.8103610     4.520751       6.216162      1.370883       0.8173360     64.84419 30.08515  42.48352 13.12111  22.36067       32.82194  
1 1 1 14 9  30 o 26.78175 11.07719  0.2442279      0.6440700     5.118208       6.000114      0.1874128      0.6478131     62.83825 29.29058  26.24598 11.00208  36.59227       31.28871  
1 1 1 14 10 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 14 10 1  o 647.5770 17.09231  281.7517       14.73621      261.1689       32.51808      287.0710       16.53109      612.0622 40.09159  653.0189 19.01802  -40.95667      44.37365  
1 1 1 14 10 2  o 387.0180 9.342166  100.0278       4.817839      107.7413       9.700007      97.50172       5.550944      399.9467 18.24914  381.7820 10.92256  18.16467       21.26813  
1 1 1 14 10 3  o 457.2652 7.302049  139.5127       4.449246      141.9139       7.684661      138.3020       5.456897      460.3611 12.53884  455.1045 8.998313  5.256592       15.43347  
1 1 1 14 10 4  o 214.3323 8.989962  30.73001       2.561849      23.60736       8.878472      31.37690       2.675655      181.5025 37.93352  216.5507 9.294138  -35.04822      39.05551  
1 1 1 14 10 5  o 263.1853 6.861659  46.24424       2.404328      45.89943       4.904343      46.35333       2.758570      261.3340 14.13614  263.4109 7.867990  -2.076904      16.17825  
1 1 1 14 10 6  o 196.5703 13.85426  26.02244       3.605654      0.000000       0.000000      26.02244       3.605654      ?        ?         196.5703 13.85426  0.000000       13.85426  
1 1 1 14 10 7  o 299.9549 10.57646  60.23952       4.220749      70.60166       12.11085      58.80695       4.503068      320.0453 28.70261  296.2405 11.42894  23.80478       30.89434  
1 1 1 14 10 8  f 151.5564 8.360206  15.38779       1.681818      15.16153       2.545486      15.56309       2.240498      149.8698 12.87079  152.1006 11.13161  -2.230789      17.01676  
1 1 1 14 10 9  o 454.8969 8.192397  138.2282       4.965895      140.1265       7.549402      136.7805       6.593023      457.0791 12.40651  452.0487 10.94525  5.030365       16.54449  
1 1 1 14 10 10 o 209.9307 4.619289  29.38961       1.292185      29.05635       1.356600      32.65099       4.243840      208.7261 4.877548  219.9051 14.56479  -11.17894      15.35981  
1 1 1 14 10 11 o 284.0147 4.969444  53.80715       1.880712      53.76345       1.947091      54.41549       7.264679      283.8871 5.147153  282.6115 19.40877  1.275696       20.07968  
1 1 1 14 10 12 o 193.4700 7.664340  25.05661       1.971976      21.66604       2.469080      31.02891       3.276951      179.5151 10.36601  214.7381 11.49404  -35.22296      15.47795  
1 1 1 14 10 13 o 270.4688 9.696738  49.08005       3.489097      49.28394       3.924086      48.31033       7.624475      270.7841 10.89757  264.6499 21.81396  6.134247       24.38455  
1 1 1 14 10 14 o 326.0314 7.457289  71.09090       3.239768      69.31353       3.605554      78.54137       7.382021      321.6539 8.419439  339.8733 16.34783  -18.21933      18.38854  
1 1 1 14 10 15 o 93.60518 4.689978  5.862218       0.5831208     5.896032       0.5844884     -1.338544      8.529331      93.87565 4.687329  84.46166 37.59732  9.413986       37.88838  
1 1 1 14 10 16 o 301.2003 6.396586  60.65958       2.567303      60.30748       2.725459      63.43196       7.647745      300.2534 6.812056  303.2742 19.02028  -3.020782      20.20334  
1 1 1 14 10 17 o 516.8488 11.42470  180.2415       7.868317      189.8075       10.04830      165.0784       12.65085      528.3415 14.28575  488.4813 19.47465  39.86023       24.15253  
1 1 1 14 10 18 o 251.3663 7.478216  42.38841       2.502046      42.71210       2.898648      41.44237       4.955516      252.0354 8.643779  245.9224 15.19652  6.112961       17.48282  
1 1 1 14 10 19 o 175.4739 7.434563  20.68818       1.734428      19.99988       2.109482      22.12441       3.047187      172.1334 9.230563  180.0309 12.78538  -7.897430      15.76925  
1 1 1 14 10 20 o 162.7160 9.395983  17.91449       2.028594      19.43386       2.260223      11.62053       4.600247      169.3101 10.06373  123.1506 28.58482  46.15945       30.30463  
1 1 1 14 10 21 o 205.9527 12.42898  29.08024       3.395085      28.77565       5.002633      29.34031       4.622602      201.2394 18.87608  204.3255 17.13586  -3.086151      25.49400  
1 1 1 14 10 22 o 63.28246 21.01048  2.844816       2.068108      -0.8705015E-01 2.475607      9.617372       3.762581      47.47107 20.72432  111.0173 25.90920  -63.54627      33.17806  
1 1 1 14 10 23 o 51.23900 19.65740  1.485730       1.881934      -0.5010145     2.450230      4.343796       2.938812      44.96644 20.07499  75.13432 25.04860  -30.16788      32.10043  
1 1 1 14 10 24 o 87.04277 5.365422  5.111725       0.6192902     1.122301       3.291947      5.258091       0.6305483     57.18874 24.42250  88.28051 5.385817  -31.09177      25.00931  
1 1 1 14 10 25 o 117.4591 6.611912  9.375803       1.030696      13.26548       6.010018      9.257937       1.046196      111.2448 35.74712  116.6651 6.758675  -5.420326      36.38044  
1 1 1 14 10 26 o 86.57890 7.881734  5.181602       0.8993426     4.491025       4.386892      5.211899       0.9188586     70.74393 29.04883  86.77139 8.038283  -16.02745      30.14048  
1 1 1 14 10 27 o 63.38242 10.99950  2.925043       0.8953262     7.069422       4.701683      2.769103       0.9120148     78.57619 30.81248  61.36351 11.57807  17.21268       32.91596  
1 1 1 14 10 28 o 90.23380 7.787367  5.672976       0.9271863     12.26409       7.828397      5.579202       0.9337587     82.39642 36.38190  89.41414 7.918885  -7.017715      37.23374  
1 1 1 14 10 29 o 55.96039 9.609054  2.279500       0.6907279     19.24240       5.079440      1.959914       0.6972044     131.6508 29.66764  51.37888 10.53750  80.27187       31.48345  
1 1 1 14 10 30 o 31.44071 14.14970  -0.1565790     1.244233      -1.757433      1.901692      1.041647       1.645257      31.76815 15.28305  42.06054 17.57552  -10.29239      23.29100  
1 1 1 14 11 0  o 593.6140 43.18550  244.9089       33.73565      244.9089       33.73565      244.9089       33.73565      593.6140 43.18550  593.6140 43.18550  0.000000       0.000000  
1 1 1 14 11 1  o 386.8948 10.36984  100.1268       5.341298      72.48762       12.30025      106.5498       5.929532      324.6395 28.73036  398.9959 11.16363  -74.35645      30.82305  
1 1 1 14 11 2  o 97.10063 2.281286  6.282857       0.2951721     4.670078       3.979118      6.291781       0.2959875     85.64463 29.14872  97.16953 2.285966  -11.52490      29.23822  
1 1 1 14 11 3  o 388.2872 10.38076  100.8637       5.366190      100.4711       7.413246      101.2959       7.777748      386.7966 14.40827  388.2416 15.06271  -1.444977      20.84427  
1 1 1 14 11 4  o 585.2095 11.68321  229.1923       9.110604      231.1012       14.32425      227.8955       11.80639      585.4465 18.38441  582.4549 15.22488  2.991638       23.87014  
1 1 1 14 11 5  o 75.79899 13.75567  3.970122       1.338219      0.8097803      3.008588      4.749603       1.494165      58.56585 24.05325  83.04127 14.00043  -24.47542      27.83111  
1 1 1 14 11 6  o 160.6570 7.257222  17.26436       1.549605      0.000000       0.000000      17.26436       1.549605      ?        ?         160.6570 7.257222  0.000000       7.257222  
1 1 1 14 11 7  o 272.1609 12.42211  49.74705       4.493120      46.82390       5.924362      53.70501       6.893689      263.1058 16.98890  281.4760 18.48188  -18.37012      25.10384  
1 1 1 14 11 8  o 189.2099 7.063948  23.93529       1.777877      22.78153       2.242993      25.88531       2.916011      184.3654 9.158764  196.2797 11.19554  -11.91437      14.46455  
1 1 1 14 11 9  o 614.9102 11.11519  253.3595       9.107563      261.3756       12.23161      243.3854       13.64390      623.2275 14.72866  600.1408 17.07865  23.08673       22.55247  
1 1 1 14 11 10 o 112.1445 2.199104  8.381207       0.3286224     8.448846       0.3337635     6.236220       1.879541      112.5958 2.224555  95.01325 15.37003  17.58253       15.53018  
1 1 1 14 11 11 o 120.3906 1.687229  9.658252       0.2706700     9.648537       0.2726119     10.33294       2.271761      120.3299 1.700191  123.0677 14.10778  -2.737839      14.20986  
1 1 1 14 11 12 o 300.3272 9.507808  60.49550       3.800153      61.67171       4.163263      54.62134       9.303918      303.0563 10.32456  279.7812 25.22660  23.27512       27.25762  
1 1 1 14 11 13 o 96.89445 5.426087  6.287563       0.6977836     6.225299       0.7393264     6.795364       2.111370      96.37805 5.783451  98.77248 16.63217  -2.394432      17.60901  
1 1 1 14 11 14 o 265.4257 8.057917  47.21825       2.846663      47.77218       3.052784      43.52682       7.880696      266.8707 8.595844  249.0621 24.04419  17.80862       25.53451  
1 1 1 14 11 15 o 370.6386 8.257420  92.06970       4.078200      93.17567       4.341290      83.76559       11.89578      372.7255 8.740900  343.6534 26.17449  29.07208       27.59542  
1 1 1 14 11 16 o 251.5491 4.451828  42.23960       1.492226      42.03924       1.530969      46.04866       6.675298      250.9379 4.578536  257.5003 19.60176  -6.562378      20.12938  
1 1 1 14 11 17 f 110.1326 12.80875  8.326279       1.844701      6.596786       2.289074      11.53016       3.115577      96.29462 18.51188  127.9557 18.83581  -31.66110      26.40979  
1 1 1 14 11 18 o 141.6733 7.300600  13.49205       1.373576      14.10365       1.502802      10.38761       3.385774      144.7641 7.819557  119.8792 22.00604  24.88490       23.35405  
1 1 1 14 11 19 o 308.3712 6.641933  63.73444       2.729240      61.95665       3.223243      68.23781       5.130046      303.5406 7.975890  316.6490 12.18093  -13.10837      14.55987  
1 1 1 14 11 20 o 117.9754 10.29825  9.497167       1.602719      9.285123       1.987721      9.891197       2.709616      115.8025 13.11186  117.7880 17.81999  -1.985489      22.12404  
1 1 1 14 11 21 o 185.4765 7.452268  23.20032       1.838086      23.54230       2.863405      22.96064       2.397183      185.2406 11.65954  183.6985 9.828931  1.542191       15.24968  
1 1 1 14 11 22 o 149.9873 7.683601  15.23392       1.530534      13.88166       3.714369      15.51048       1.679769      136.2772 21.13883  151.1187 8.374508  -14.84151      22.73725  
1 1 1 14 11 23 o 99.64166 7.778268  6.769181       1.024578      4.852022       3.084517      7.006946       1.086255      77.69275 25.65417  101.2855 8.116304  -23.59272      26.90745  
1 1 1 14 11 24 f 42.16230 12.52531  1.274878       0.7549265     -4.825043      3.385197      1.594120       0.7744293     39.87057 19.46052  46.81627 12.26826  -6.945694      23.00483  
1 1 1 14 11 25 o 120.2214 9.461911  10.06656       1.503564      6.030803       4.876301      10.49057       1.580576      78.39093 31.17846  122.5740 9.757541  -44.18311      32.66965  
1 1 1 14 11 26 o 25.73931 10.88893  0.1013469      0.6438728     -4.932407      4.160669      0.2248543      0.6517239     43.21228 21.19282  27.14427 11.17657  16.06801       23.95936  
1 1 1 14 11 27 o 44.37382 16.56204  1.373507       1.314556      0.8223704      5.685178      1.404637       1.351172      58.87865 27.78056  44.82228 16.77864  14.05637       32.45432  
1 1 1 14 11 28 o 134.0527 7.408045  12.46139       1.318137      9.813087       3.760190      12.83242       1.407448      95.17179 27.87075  135.7415 7.814219  -40.56973      28.94548  
1 1 1 14 11 29 o 94.62766 9.013827  6.396916       1.122869      2.919119       2.020850      7.950202       1.350541      56.45072 20.62919  104.9713 9.767316  -48.52062      22.82464  
1 1 1 14 12 0  o 402.3654 19.58720  109.3668       10.44487      109.3668       10.44487      109.3668       10.44487      402.3654 19.58720  402.3654 19.58720  0.000000       0.000000  
1 1 1 14 12 1  o 174.4738 2.848276  20.28762       0.6621947     26.22138       4.431529      20.15210       0.6697139     196.6344 17.08233  173.8893 2.890300  22.74504       17.32512  
1 1 1 14 12 2  o 135.4765 8.162742  12.30248       1.466743      15.11464       4.432349      11.95666       1.554314      147.4615 23.33257  133.4870 8.787157  13.97449       24.93237  
1 1 1 14 12 3  o 42.05253 10.58902  1.229279       0.5929111     2.338891       3.487436      1.196252       0.6016704     69.89382 26.77324  41.51594 10.78139  28.37788       28.86251  
1 1 1 14 12 4  o 295.4642 7.816928  58.34296       3.074913      63.15051       5.816291      56.47804       3.622548      306.3271 14.28846  290.5042 9.370368  15.82291       17.08695  
1 1 1 14 12 5  o 99.58896 8.391352  6.673535       1.103217      13.17556       5.348497      6.384607       1.127463      135.5883 30.36002  97.34615 8.786283  38.24216       31.60585  
1 1 1 14 12 6  o 534.9896 12.61176  192.0176       8.990726      199.7709       14.48441      187.1580       11.46726      542.4717 20.07242  526.6935 16.35894  15.77814       25.89434  
1 1 1 14 12 7  o 258.8543 10.78559  44.96204       3.712103      41.96539       5.495152      47.47730       5.034461      248.8263 16.66950  265.3085 14.29338  -16.48219      21.95843  
1 1 1 14 12 8  o 641.5840 9.932970  275.6216       8.491925      287.4912       10.69767      255.3993       13.96320      654.3998 12.26796  614.3986 17.07193  40.00128       21.02269  
1 1 1 14 12 9  o 348.4534 7.389621  81.13975       3.431155      81.16282       4.055991      81.08169       6.434227      348.1855 8.748969  346.7296 13.95468  1.455902       16.47051  
1 1 1 14 12 10 f 276.3260 4.464567  50.93396       1.643897      51.40381       1.715046      45.62097       5.767188      277.5845 4.636679  258.9668 16.80342  18.61771       17.43140  
1 1 1 14 12 11 o 160.3097 6.694739  17.20260       1.426954      18.04006       1.833510      15.91617       2.272447      163.9538 8.420650  153.5315 11.18437  10.42221       13.99991  
1 1 1 14 12 12 o 148.6232 6.299608  14.78543       1.244766      14.58123       1.337305      16.10954       3.405414      147.5324 6.820978  153.0293 16.98600  -5.496887      18.30437  
1 1 1 14 12 13 o 114.8497 4.215612  8.812568       0.6440604     9.149646       0.6692786     4.590824       2.368578      117.0221 4.299365  80.15205 21.66450  36.87008       22.08699  
1 1 1 14 12 14 o 99.81287 10.96634  6.786268       1.434556      7.370603       1.616105      4.615026       3.115248      103.8793 11.88920  81.05457 25.70313  22.82477       28.31967  
1 1 1 14 12 15 o 404.3792 10.21575  110.1230       5.500279      104.6006       5.954376      142.2425       14.36005      393.6038 11.36471  449.0092 24.08906  -55.40546      26.63531  
1 1 1 14 12 16 o 267.2402 5.746600  47.74967       2.046380      47.54846       2.092167      52.19625       9.835308      266.6533 5.888110  267.8875 27.96389  -1.234283      28.57707  
1 1 1 14 12 17 f 237.7515 3.197229  37.70618       1.012909      37.56903       1.045069      39.83213       4.114707      237.3089 3.304892  241.8626 12.81294  -4.553680      13.23230  
1 1 1 14 12 18 o 272.1223 9.417727  49.97919       3.409798      48.94666       5.422003      50.65471       4.385586      266.4890 15.33361  272.8263 12.09340  -6.337250      19.52870  
1 1 1 14 12 19 o 222.3650 5.720044  33.13358       1.693474      35.68592       2.111253      28.52862       2.835854      230.4839 6.881972  204.9496 10.41814  25.53424       12.48596  
1 1 1 14 12 20 f 48.82100 11.25025  1.687946       0.7168458     -2.504511      1.711093      2.580404       0.7894657     29.80919 14.37993  60.89904 10.08096  -31.08986      17.56155  
1 1 1 14 12 21 f 71.77049 12.19570  3.634726       1.124650      3.474010       2.472652      3.676647       1.262836      68.76898 22.97731  71.71185 13.71509  -2.942871      26.75931  
1 1 1 14 12 22 o 158.4189 10.80806  17.33063       2.267875      15.63593       3.611254      18.43425       2.914214      145.1843 19.13173  161.7515 13.64793  -16.56721      23.50084  
1 1 1 14 12 23 o 58.50690 13.86039  2.516809       1.063873      0.8848905      2.977023      2.755728       1.139092      53.86882 23.11949  61.13471 14.24762  -7.265892      27.15705  
1 1 1 14 12 24 o 77.46478 25.86166  5.294891       3.132501      5.022083       5.946800      5.399657       3.685219      75.99805 32.64741  77.19901 27.90936  -1.200951      42.95097  
1 1 1 14 12 25 o 57.65750 25.87551  1.220015       4.128330      -4.824772      6.390578      5.549328       5.408279      54.01542 26.44400  74.09165 31.46043  -20.07624      41.09798  
1 1 1 14 12 26 o 35.92079 15.06798  0.4296341      1.216373      6.154518       4.667914      0.1257883E-01  1.259901      74.36168 30.17949  33.53992 14.70987  40.82175       33.57353  
1 1 1 14 12 27 o 28.73576 12.43764  0.5685464E-01  0.8758254     3.279906       5.072278      -0.4219239E-01 0.8891810     62.36495 28.26983  28.16485 12.35491  34.20010       30.85170  
1 1 1 14 12 28 o 110.0182 9.629268  8.679234       1.397448      9.384198       2.274397      8.251690       1.771221      107.8062 16.34438  104.3175 13.02516  3.488701       20.89961  
1 1 1 14 12 29 o 46.95053 14.24845  1.767350       0.9692332     -0.5752808     2.219935      2.319083       1.077340      38.25976 17.82802  53.37949 14.68693  -15.11973      23.09858  
1 1 1 14 13 0  o 49.21571 5.462517  1.673578       0.3469653     1.673578       0.3469653     1.673578       0.3469653     49.21571 5.462517  49.21571 5.462517  0.000000       0.000000  
1 1 1 14 13 1  o 318.3284 9.355236  67.83399       3.963988      69.08577       5.393768      66.36387       5.845263      320.6322 12.64925  313.9373 14.00821  6.694916       18.87415  
1 1 1 14 13 2  o 300.3535 6.955790  60.23605       2.783894      49.99609       8.222039      61.56200       2.958649      269.7929 23.09234  303.6064 7.313225  -33.81351      24.22270  
1 1 1 14 13 3  o 530.6910 6.620941  188.0205       4.682039      206.3993       12.46462      185.0013       5.051990      552.6849 16.94499  526.3153 7.203489  26.36963       18.41257  
1 1 1 14 13 4  o 87.52705 18.57600  5.378365       2.099427      5.908144       2.731302      4.613381       3.282074      91.29629 22.57874  82.51038 26.40697  8.785912       34.74374  
1 1 1 14 13 5  o 368.5142 9.228904  90.92416       4.528309      106.4216       8.983100      85.64453       5.243224      396.4219 17.04555  357.2728 11.02669  39.14908       20.30120  
1 1 1 14 13 6  o 125.8511 12.53636  10.74299       2.074402      13.19471       4.325036      10.01049       2.364065      136.6328 24.66264  120.9686 14.98629  15.66419       28.85887  
1 1 1 14 13 7  o 150.4739 7.069338  15.16133       1.413506      13.38775       1.713652      18.93672       2.500223      141.1262 9.162108  167.6214 11.25906  -26.49525      14.51587  
1 1 1 14 13 8  o 200.1829 4.366910  26.72999       1.164863      26.70898       1.282555      26.82897       2.783697      200.0795 4.810607  199.7336 10.49601  0.3459167      11.54591  
1 1 1 14 13 9  o 171.6059 1.799863  19.62454       0.4115713     19.51619       0.4138858     29.23072       3.897184      171.1312 1.815005  207.6400 14.17023  -36.50883      14.28599  
1 1 1 14 13 10 f 80.07300 7.304343  4.323103       0.7707928     4.811869       0.8163426     0.3063367      2.340238      84.51134 7.321243  49.57438 20.85426  34.93696       22.10205  
1 1 1 14 13 11 o 207.6347 9.704779  28.99256       2.677663      28.22791       3.295795      30.47737       4.592644      204.3323 12.15957  211.1019 16.45658  -6.769623      20.46153  
1 1 1 14 13 12 o 239.7545 6.226341  38.44812       1.987492      39.92108       2.533664      36.09186       3.204538      244.0376 7.801479  231.4686 10.41631  12.56903       13.01394  
1 1 1 14 13 13 o 169.8853 8.860411  19.41846       1.998847      20.09246       2.336179      17.57695       3.861547      172.5445 10.20648  158.9584 18.58087  13.58607       21.19955  
1 1 1 14 13 14 o 23.58539 10.74292  -0.4647419     0.7435144     -0.9221620     0.8138637     1.843282       1.828160      22.21513 10.49059  55.16473 19.69247  -32.94960      22.31246  
1 1 1 14 13 15 o 24.71078 11.23665  -0.4857245     0.8091497     -0.6395507     0.8750424     0.4218026      2.125415      24.96943 11.47839  47.76349 19.96867  -22.79406      23.03261  
1 1 1 14 13 16 f 141.2789 7.287731  13.41740       1.367329      14.73823       4.465370      13.28074       1.436323      142.1460 24.45672  140.4828 7.702297  1.663269       25.64091  
1 1 1 14 13 17 o 74.06335 5.016527  3.683707       0.4921639     2.924727       0.8055205     4.135814       0.6217021     65.19162 9.556466  78.37206 5.998752  -13.18044      11.28322  
1 1 1 14 13 18 o 44.56716 10.49945  1.398929       0.6132040     1.886051       1.107130      1.183367       0.7364889     51.73815 15.11536  41.38733 12.38987  10.35082       19.54438  
1 1 1 14 13 19 o 90.70356 7.179858  5.567128       0.8607143     6.468345       1.126237      4.301639       1.334579      97.46587 8.765216  78.10310 13.29952  19.36277       15.92816  
1 1 1 14 13 20 o 127.6722 9.678095  11.14489       1.634227      12.06255       2.596738      10.54307       2.102897      130.5023 15.21789  122.8888 13.04082  7.613457       20.04113  
1 1 1 14 13 21 o 95.94279 15.87344  6.683479       1.958449      8.777985       2.380299      2.294300       3.445740      109.7162 16.81649  64.11190 25.96226  45.60435       30.93273  
1 1 1 14 13 22 o 106.1670 12.69461  7.998208       1.760347      10.35394       2.481713      5.612655       2.497374      118.9364 16.06973  83.78191 22.06748  35.15445       27.29853  
1 1 1 14 13 23 o 61.33284 21.39954  2.913865       2.149283      2.664940       2.912472      3.211528       3.184849      61.45125 24.20448  65.16138 25.41578  -3.710125      35.09727  
1 1 1 14 13 24 o 50.82418 24.18571  -2.179148      4.489442      2.289552       7.013293      -5.281571      5.843620      68.07086 31.70873  51.65977 25.28998  16.41109       40.55893  
1 1 1 14 13 25 o 81.11448 35.75687  9.558928       7.532291      7.975050       8.937761      13.44096       13.99257      76.31668 35.63139  79.84007 39.09579  -3.523392      52.89685  
1 1 1 14 13 26 o 48.85533 23.19473  -1.217143      4.081426      -0.7783852     4.559446      -2.986622      9.156345      51.78539 24.56537  59.81568 29.71707  -8.030293      38.55595  
1 1 1 14 13 27 o 92.38385 12.66942  6.416294       1.518608      2.435858       2.304385      9.472054       2.019061      54.04980 21.45394  111.2161 13.92874  -57.16628      25.57893  
1 1 1 14 13 28 o 79.87537 12.28715  4.833340       1.265944      0.9811996      2.374333      6.363384       1.496382      45.62011 20.09425  91.53768 12.60193  -45.91758      23.71893  
1 1 1 14 14 0  o 101.7875 5.928510  6.979406       0.7978094     6.979406       0.7978094     6.979406       0.7978094     101.7875 5.928510  101.7875 5.928510  0.000000       0.000000  
1 1 1 14 14 1  o 452.8700 9.120847  137.2655       5.504048      143.7612       6.690271      123.6617       9.681974      463.0283 10.84333  427.1166 17.04579  35.91168       20.20239  
1 1 1 14 14 2  o 76.73105 6.409968  3.958857       0.6494086     4.136420       0.6931406     2.683420       1.857697      78.41271 6.697855  63.06051 19.82927  15.35220       20.92991  
1 1 1 14 14 3  o 219.8628 15.25242  32.78165       4.440824      31.15860       5.145719      37.51833       8.790562      213.5106 18.26161  230.1821 29.32458  -16.67143      34.54587  
1 1 1 14 14 4  o 194.9908 15.80743  25.86263       4.072039      19.54784       5.117252      36.76439       6.723652      167.0959 23.64209  230.6516 22.14826  -63.55560      32.39589  
1 1 1 14 14 5  o 282.7551 9.902318  53.65139       3.725202      53.34128       9.764320      53.70422       4.030016      275.7790 26.91304  282.7217 10.71670  -6.942719      28.96825  
1 1 1 14 14 6  o 214.3695 8.746247  30.81754       2.493133      30.93613       3.625967      30.71120       3.433542      214.0002 12.77371  213.3623 12.12671  0.6378632      17.61320  
1 1 1 14 14 7  o 187.1444 5.639107  23.40553       1.404640      22.93059       2.056968      23.82051       1.922741      184.8952 8.370595  188.5562 7.668555  -3.661026      11.35225  
1 1 1 14 14 8  o 142.4071 3.045314  13.52057       0.5778797     13.72681       0.5965485     10.37934       2.328152      143.4868 3.120042  123.0890 14.47055  20.39776       14.80309  
1 1 1 14 14 9  o 268.9006 4.035506  48.23582       1.445983      48.43197       1.502789      45.78741       5.309402      269.4340 4.185738  259.3566 15.43274  10.07742       15.99030  
1 1 1 14 14 10 f 304.2403 11.64373  62.44781       4.711727      63.47046       6.398068      61.23599       6.964712      305.1444 15.78881  298.9122 17.56322  6.232269       23.61679  
1 1 1 14 14 11 o 228.4519 7.691421  34.99413       2.338058      35.61144       2.713026      33.21244       4.609136      230.2229 8.860195  220.3069 15.80569  9.916000       18.11968  
1 1 1 14 14 12 o 36.97243 15.82249  -0.1248925E-01 1.387012      -1.743470      1.794968      2.552832       2.185151      33.83073 15.85118  62.81712 21.59468  -28.98639      26.78788  
1 1 1 14 14 13 o 223.5244 6.971868  33.48662       2.074036      32.08957       3.331454      34.37078       2.650286      217.6898 11.52584  226.0611 8.815087  -8.371292      14.51037  
1 1 1 14 14 14 o 90.77103 5.487383  5.527854       0.6606219     8.537196       1.722386      5.008786       0.7153305     111.7579 11.74101  86.29290 6.263610  25.46504       13.30730  
1 1 1 14 14 15 o 174.0435 7.447611  20.35569       1.723229      20.20031       2.368779      20.53037       2.511508      172.6949 10.34106  173.9513 10.88974  -1.256378      15.01746  
1 1 1 14 14 16 o 120.9559 9.274539  9.919232       1.483431      8.914159       2.526654      10.44792       1.832515      112.1650 17.47408  123.6656 11.24330  -11.50067      20.77872  
1 1 1 14 14 17 o 222.1456 4.758486  32.99796       1.408575      32.79926       1.510174      34.32742       3.906300      221.4132 5.118585  223.5540 13.17160  -2.140854      14.13120  
1 1 1 14 14 18 o 162.0266 1.699151  17.50054       0.3668527     17.47154       0.3687373     20.31520       3.633204      161.8918 1.709301  169.7986 16.25593  -7.906784      16.34554  
1 1 1 14 14 19 o 24.30445 11.02735  -0.4197598     0.7739668     -0.6505176     0.8204626     1.444825       2.332231      23.69815 10.97241  54.22646 21.56401  -30.52831      24.19505  
1 1 1 14 14 20 o 147.0239 7.300416  14.64196       1.425767      14.65605       1.516739      14.53494       4.179727      146.9341 7.774333  136.4988 23.84725  10.43529       25.08249  
1 1 1 14 14 21 o 62.77154 19.43406  3.000541       1.791762      1.872088       1.997668      7.643566       4.052120      53.94526 20.35711  92.83066 29.29890  -38.88540      35.67685  
1 1 1 14 14 22 o 48.14090 21.03064  0.3765367      2.552985      1.695169       2.916595      -3.944922      5.279944      56.50754 23.48974  52.90343 25.45462  3.604111       34.63677  
1 1 1 14 14 23 o 75.72198 30.63107  5.613954       4.790671      7.131565       5.626294      1.612651       9.135724      80.95763 33.02975  70.67174 33.86735  10.28590       47.30710  
1 1 1 14 14 24 o 53.97464 24.29827  0.8427690      3.672222      7.254821       5.207083      -5.501868      5.179637      79.06150 31.95161  47.46582 23.35211  31.59568       39.57558  
1 1 1 14 14 25 o 69.48284 34.92861  3.367309       14.43935      0.000000       0.000000      3.367309       14.43935      ?        ?         69.48284 34.92861  0.000000       34.92861  
1 1 1 14 14 26 o 65.06414 20.83333  3.831235       2.042631      3.856105       2.168576      3.635596       6.082325      64.73590 21.51543  62.95229 29.39234  1.783611       36.42559  
1 1 1 14 14 27 f 57.01786 22.86719  3.037883       2.645089      1.550298       2.896981      10.49337       6.485489      50.28694 22.17106  75.84124 33.31479  -25.55430      40.01788  
1 1 1 14 15 0  o 161.6612 5.786038  17.49813       1.242783      17.49813       1.242783      17.49813       1.242783      161.6612 5.786038  161.6612 5.786038  0.000000       0.000000  
1 1 1 14 15 1  f 141.9723 6.026480  13.48546       1.137501      13.19283       1.339534      14.24205       2.153913      140.2959 7.189285  145.1818 11.22080  -4.885864      13.32637  
1 1 1 14 15 2  o 144.7230 1.112871  13.95580       0.2146130     13.96665       0.2147199     3.064795       6.802128      144.7793 1.112993  89.18756 36.34386  55.59171       36.36090  
1 1 1 14 15 3  o 145.3422 7.130792  14.15674       1.376814      14.23451       1.392706      10.80711       9.139991      145.7344 7.193967  123.6247 44.04254  22.10970       44.62621  
1 1 1 14 15 4  o 181.0124 17.17447  22.46704       4.092967      22.42020       4.414523      22.75389       10.92429      180.3747 18.63484  169.1230 46.85990  11.25163       50.42923  
1 1 1 14 15 5  o 376.1855 8.285487  94.75755       4.153303      100.4509       5.804017      88.78255       5.945866      386.3406 11.28627  362.8405 12.31561  23.50009       16.70491  
1 1 1 14 15 6  f 169.9676 6.806423  19.34613       1.538436      21.79015       2.252074      17.20773       2.106561      179.9963 9.422379  159.8061 9.941764  20.19016       13.69744  
1 1 1 14 15 7  o 127.0642 9.098311  10.88212       1.530290      0.000000       0.000000      10.88212       1.530290      ?        ?         127.0642 9.098311  0.000000       9.098311  
1 1 1 14 15 8  o 329.5123 6.048505  72.56531       2.655787      73.45600       3.240516      70.74317       4.634898      331.2868 7.340684  324.0995 10.74705  7.187317       13.01479  
1 1 1 14 15 9  o 344.4053 9.153300  79.67654       4.196971      79.64817       6.012586      79.70348       5.861138      342.8511 13.18538  343.1174 12.84200  -0.2663574     18.40574  
1 1 1 14 15 10 o 195.4811 10.08721  25.77227       2.618654      26.71082       2.933488      22.09040       5.810208      198.7611 11.12025  175.1993 25.64727  23.56181       27.95429  
1 1 1 14 15 11 o 440.3069 9.928027  130.4505       5.824947      133.9874       8.703759      127.5811       7.839326      443.3828 14.75230  433.3788 13.59173  10.00394       20.05905  
1 1 1 14 15 12 o 256.9648 9.334709  44.46393       3.190991      43.07830       4.576424      45.77504       4.451648      251.3890 13.71369  259.4874 12.91511  -8.098389      18.83787  
1 1 1 14 15 13 o 68.21780 12.05309  3.242024       1.055586      -0.4186848     2.396315      4.123383       1.175811      46.07585 20.24481  77.20111 11.80426  -31.12526      23.43486  
1 1 1 14 15 14 o 176.4445 6.545972  20.88588       1.536393      21.87695       1.874735      18.85888       2.681110      180.3262 7.820625  166.2283 12.18894  14.09785       14.48214  
1 1 1 14 15 15 o 88.18756 9.664000  5.312247       1.117055      5.380571       1.191450      4.815824       3.211540      88.61816 10.28025  81.10770 26.13758  7.510460       28.08660  
1 1 1 14 15 16 o 103.2539 6.857945  7.189990       0.9382223     7.475296       1.005401      5.266556       2.610493      105.2247 7.214125  83.85685 22.77709  21.36787       23.89224  
1 1 1 14 15 17 o 160.8308 3.891964  17.28487       0.8340876     17.15571       0.8524573     20.18527       4.039555      160.2163 3.992935  167.8172 18.36386  -7.600891      18.79295  
1 1 1 14 15 18 o 52.85546 7.558824  1.922266       0.5172338     1.848795       0.5248016     4.414804       3.056735      51.75120 7.856879  76.13952 25.54902  -24.38832      26.72981  
1 1 1 14 15 19 o 78.64895 8.535326  4.249369       0.8801881     4.658957       0.9754283     2.453850       2.042286      82.24428 9.049924  59.13157 20.84263  23.11271       22.72260  
1 1 1 14 15 20 o 98.47171 10.45499  6.757139       1.350916      6.963067       1.360989      -7.000274      11.12411      100.0133 10.36225  70.95634 34.76921  29.05695       36.28049  
1 1 1 14 15 21 o 76.24335 19.68194  4.618057       2.013214      4.806007       2.041914      -1.927343      12.04994      77.80136 19.68401  74.47725 36.42980  3.324112       41.40762  
1 1 1 14 15 22 o 37.53480 17.65738  -1.590716      2.266276      -1.584758      2.395802      -1.641399      6.987077      38.72743 18.19854  61.55896 29.53143  -22.83154      34.68850  
1 1 1 14 15 23 o 53.82944 21.30474  2.052963       2.266286      2.587204       2.588481      0.2987641      4.690467      57.97008 22.82304  56.45577 26.17262  1.514313       34.72603  
1 1 1 14 15 24 o 42.23673 15.88103  1.191901       1.213317      1.343095       1.225890      -6.065485      8.493259      43.74424 16.05405  56.54586 28.17878  -12.80162      32.43110  
1 1 1 14 15 25 o 69.83456 33.42284  7.245692       8.834561      11.24865       11.15501      0.5100986      14.46996      73.20116 35.63941  65.01351 32.95049  8.187653       48.53764  
1 1 1 14 15 26 o 36.02396 17.01079  -1.183093      2.139529      -1.038440      2.186144      -4.466933      10.41609      36.87729 17.34630  56.61281 28.60830  -19.73552      33.45638  
1 1 1 14 16 0  o 447.5845 20.63131  136.5385       12.24508      136.5385       12.24508      136.5385       12.24508      447.5845 20.63131  447.5845 20.63131  0.000000       0.000000  
1 1 1 14 16 1  o 397.6490 12.10826  106.6696       6.408387      100.0631       7.777301      120.6411       11.31005      383.7414 15.23987  418.2764 20.35322  -34.53500      25.42651  
1 1 1 14 16 2  o 162.2324 9.084541  17.70569       1.956032      18.60819       2.030180      6.022964       7.304354      166.3086 9.196884  100.6987 38.70281  65.60987       39.78052  
1 1 1 14 16 3  o 338.5928 7.754263  76.75930       3.498579      77.13062       3.591372      69.85091       15.49076      339.3701 7.941698  303.7198 39.18838  35.65033       39.98499  
1 1 1 14 16 4  o 130.8327 6.228110  11.46726       1.082673      11.45561       1.172850      11.53439       2.815596      130.7029 6.757104  129.0616 16.76795  1.641235       18.07823  
1 1 1 14 16 5  o 45.80064 1.526678  1.399446       0.9304330E-01 0.2951336      0.9095758     1.411124       0.9353395E-01 32.74227 13.30960  45.99149 1.528347  -13.24922      13.39706  
1 1 1 14 16 6  o 371.6700 7.055009  92.44614       3.494046      85.81861       6.331639      95.34814       4.189751      355.8186 13.37790  377.1270 8.337332  -21.30838      15.76323  
1 1 1 14 16 7  o 167.2751 3.416964  18.66291       0.7616320     18.91178       0.8278286     17.29084       1.943761      168.3715 3.689762  160.2180 9.142494  8.153503       9.858983  
1 1 1 14 16 8  o 263.2078 3.503442  46.21247       1.228761      46.65719       1.318216      43.26545       3.393425      264.4492 3.740854  253.3885 10.07033  11.06065       10.74270  
1 1 1 14 16 9  o 52.24129 9.033653  1.884719       0.6061093     1.848633       0.6451942     2.155781       1.768298      51.60093 9.740358  57.45931 19.43272  -5.858376      21.73719  
1 1 1 14 16 10 o 107.8686 6.778581  7.821111       0.9694064     8.285417       1.030686      4.261095       2.853975      111.0042 7.003786  77.56874 24.60216  33.43549       25.57966  
1 1 1 14 16 11 o 213.4484 12.44310  30.99967       3.523771      32.14065       4.409679      28.98389       5.861239      216.1712 15.40965  201.8982 22.14952  14.27304       26.98256  
1 1 1 14 16 12 o 224.6154 12.92972  34.43054       3.853570      31.15638       4.642931      41.68008       6.908718      212.0206 16.56531  242.2593 21.62870  -30.23877      27.24354  
1 1 1 14 16 13 o 142.8188 12.53403  13.98763       2.361171      13.59626       2.491038      17.45022       7.409500      140.4838 13.47191  145.1962 37.89851  -4.712418      40.22176  
1 1 1 14 16 14 f 116.7615 13.08520  9.434410       2.000904      10.03332       2.423565      8.152199       3.546125      119.5609 15.58262  103.4207 25.81455  16.14027       30.15309  
1 1 1 14 16 15 o 244.5775 7.693902  40.31779       2.504357      42.82106       3.199581      36.35867       4.023828      251.2780 9.573269  229.6833 13.20293  21.59465       16.30843  
1 1 1 14 16 16 o 107.1043 7.602768  7.772231       1.078003      8.193374       1.158222      5.044048       2.947909      109.8944 7.963411  81.02462 24.90004  28.86978       26.14246  
1 1 1 14 16 17 o 77.42490 6.483636  4.061942       0.6627808     4.305228       0.7128054     2.508890       1.800963      79.66462 6.779115  59.22232 19.60464  20.44230       20.74364  
1 1 1 14 16 18 o 29.95900 12.34755  0.2336483      0.7964649     0.5181044E-01  0.8303981     2.323142       2.814912      28.83540 12.28869  61.17154 23.88418  -32.33614      26.86012  
1 1 1 14 16 19 o 43.63900 14.66442  1.311743       1.006995      1.290146       1.078545      1.458508       2.811600      43.76964 15.16582  55.63363 23.08932  -11.86398      27.62461  
1 1 1 14 16 20 o 45.50919 16.60823  1.367338       1.309179      1.341130       1.338505      1.945832       6.288661      45.43399 16.75796  68.75983 31.28987  -23.32584      35.49486  
1 1 1 14 16 21 o 45.08473 18.77143  0.8792125      1.866871      1.227934       1.958843      -2.574923      6.164958      47.86616 19.50411  57.33447 27.56576  -9.468307      33.76805  
1 1 1 14 16 22 o 54.29340 20.37280  2.235007       1.994539      2.032343       2.037966      6.838938       9.713447      52.96540 20.42071  75.59419 35.85830  -22.62880      41.26527  
1 1 1 14 16 23 o 57.33301 15.75794  2.598622       1.240942      2.162461       1.288630      8.166507       4.604156      52.33735 16.52295  83.22593 31.00889  -30.88858      35.13629  
1 1 1 14 16 24 o 36.55104 16.63766  -0.3579586     1.779604      -0.4110642     1.809209      1.225003       9.877654      36.58678 16.70067  63.40169 31.38759  -26.81490      35.55409  
1 1 1 14 16 25 o 38.49665 19.19591  -6.059381      3.966811      -5.481798      4.226537      -10.33029      11.49310      40.62909 20.18582  54.91471 27.98192  -14.28562      34.50298  
1 1 1 14 17 0  o 126.7235 12.88361  11.10549       2.119791      11.10549       2.119791      11.10549       2.119791      126.7235 12.88361  126.7235 12.88361  0.000000       0.000000  
1 1 1 14 17 1  o 364.5323 8.937703  89.19334       4.341456      88.93830       5.482425      89.62222       7.109348      363.0216 11.34751  362.8347 14.73506  0.1868896      18.59806  
1 1 1 14 17 2  f 99.57424 17.08567  6.961926       2.185407      7.001142       2.263633      6.423757       8.385570      99.69246 17.68773  104.0982 41.04956  -4.405739      44.69813  
1 1 1 14 17 3  o 279.7395 12.48622  53.01120       4.642613      53.33925       4.873362      49.79107       15.26844      280.3813 13.07990  245.1918 48.45077  35.18959       50.18527  
1 1 1 14 17 4  o 224.1282 30.11483  36.86823       8.766562      31.68613       12.37949      42.08108       12.41618      194.1346 48.10266  230.3789 41.99232  -36.24428      63.85313  
1 1 1 14 17 5  o 102.5164 7.935431  7.087339       1.075586      6.868713       1.388785      7.415030       1.700267      100.4500 10.53197  103.9728 12.52418  -3.522797      16.36390  
1 1 1 14 17 6  o 226.7950 6.933310  34.47079       2.092846      31.69516       2.792284      38.02884       3.161434      216.8554 9.687543  237.4844 10.01270  -20.62901      13.93207  
1 1 1 14 17 7  o 285.0503 5.876052  54.33648       2.231930      54.34198       2.573265      54.31976       4.484557      284.8910 6.778480  283.1484 11.91251  1.742615       13.70605  
1 1 1 14 17 8  o 258.7233 3.406292  44.65624       1.174332      44.42973       1.232409      46.89101       3.871061      258.0483 3.584103  263.2605 11.05960  -5.212250      11.62585  
1 1 1 14 17 9  o 85.34080 5.255929  4.886711       0.5947954     4.814124       0.6364024     5.388009       1.672446      84.65266 5.674576  87.66372 14.84658  -3.011055      15.89408  
1 1 1 14 17 10 o 182.7037 6.508781  22.38960       1.582072      21.83249       1.731202      25.21170       3.896382      180.2741 7.221386  191.0470 15.43686  -10.77290      17.04245  
1 1 1 14 17 11 o 366.1487 13.64726  91.78163       6.646850      96.80930       7.662681      76.50067       13.35897      374.7097 15.37929  315.6321 32.21393  59.07758       35.69677  
1 1 1 14 17 12 o 283.8398 10.84268  54.73618       4.093399      53.56965       4.573494      59.43378       9.177757      280.0273 12.28663  284.9753 24.40352  -4.947937      27.32203  
1 1 1 14 17 13 o 35.87363 16.91921  -2.113369      2.104789      -0.8932466     2.308146      -8.136672      5.128365      42.61788 19.21782  48.72836 23.82025  -6.110481      30.60602  
1 1 1 14 17 14 o 147.8588 13.15139  15.17110       2.564141      15.71358       2.808079      12.44942       6.289772      150.0022 14.21852  119.2873 36.31661  30.71489       39.00080  
1 1 1 14 17 15 o 186.8615 8.766006  23.71752       2.176621      29.36662       3.140710      18.49676       3.019293      206.6112 11.45257  162.4857 14.08388  44.12556       18.15261  
1 1 1 14 17 16 o 38.81052 14.59921  0.8312281      1.025603      1.006940       1.115721      -0.1265519     2.604882      41.40088 15.29468  47.75254 21.03984  -6.351662      26.01158  
1 1 1 14 17 17 o 18.25383 8.604357  -0.5813195     0.5429944     -0.5818994     0.5552089     -0.5685725     2.603002      18.53441 8.725493  45.47553 20.46600  -26.94113      22.24840  
1 1 1 14 17 18 o 144.8856 7.624649  14.31384       1.466855      14.37808       1.649741      14.07133       3.205333      144.7676 8.590690  136.8365 18.01643  7.931122       19.95975  
1 1 1 14 17 19 o 29.24004 11.74312  0.3332671      0.6985807     0.4717546      0.7320791     -1.076942      2.336117      31.24298 12.18558  40.26703 18.59834  -9.024046      22.23481  
1 1 1 14 17 20 o 81.18443 8.215247  4.575485       0.8765061     4.760757       0.8898284     -1.473278      5.084344      82.84552 8.166612  55.01420 26.05111  27.83132       27.30117  
1 1 1 14 17 21 o ?        ?         -1.924575      0.3696624     -1.918112      0.3701225     -4.519284      7.416203      ?        ?         56.94841 28.00259  0.000000       28.00259  
1 1 1 14 17 22 o 87.40722 10.12341  5.455941       1.157317      5.486714       1.164208      2.879649       10.65223      87.63669 10.15733  68.32868 33.59093  19.30801       35.09305  
1 1 1 14 17 23 o 29.39438 14.13368  -1.792614      1.621489      -1.746477      1.630148      -6.100605      15.75205      29.64249 14.23179  62.97627 32.14841  -33.33379      35.15770  
1 1 1 14 17 24 o 9.421968 4.768801  -1.017972      0.2965508     -1.019349      0.2968880     -0.4129619     6.223948      9.426416 4.771104  54.84038 26.68230  -45.41396      27.10551  
1 1 1 14 18 0  o 81.99451 42.83863  7.260691       6.130342      7.260691       6.130342      7.260691       6.130342      81.99451 42.83863  81.99451 42.83863  0.000000       0.000000  
1 1 1 14 18 1  o 84.41114 21.06315  5.161319       2.361396      4.562440       2.426527      15.87025       10.26098      79.42553 22.11449  137.6071 46.80847  -58.18162      51.76952  
1 1 1 14 18 2  f 221.8275 6.963117  32.99069       2.055675      34.14227       2.106714      10.08446       9.395836      225.6592 7.014664  116.7863 44.13180  108.8729       44.68580  
1 1 1 14 18 3  f 85.98090 29.15679  5.205558       3.980929      5.794483       4.180398      -0.5275623     13.04317      89.79680 29.87330  100.2595 45.40160  -10.46271      54.34813  
1 1 1 14 18 4  o 138.6526 11.72418  13.09703       2.145843      23.69363       11.88467      12.73993       2.181699      162.8902 49.98468  136.6362 12.10793  26.25403       51.43025  
1 1 1 14 18 5  o 112.3391 7.581042  8.502822       1.128191      8.343247       1.256281      9.167821       2.564574      111.1064 8.551173  114.1234 17.41500  -3.016945      19.40115  
1 1 1 14 18 6  o 259.5399 4.804890  45.00751       1.661733      44.66418       1.818085      46.75003       4.095860      258.4723 5.278696  262.4241 11.74274  -3.951813      12.87465  
1 1 1 14 18 7  o 166.8359 1.832967  18.55288       0.4074907     18.57389       0.4107986     17.26369       3.217476      166.9298 1.846807  157.8526 15.49591  9.077255       15.60557  
1 1 1 14 18 8  o 119.9360 7.002401  9.680808       1.114235      9.905875       1.187293      8.019002       3.226209      121.2597 7.382968  103.8902 23.81478  17.36954       24.93295  
1 1 1 14 18 9  o 272.9153 10.09133  50.44037       3.663544      50.17506       3.731953      57.47875       19.22195      272.0988 10.31152  231.2747 61.36646  40.82410       62.22676  
1 1 1 14 18 10 f 162.2457 9.349738  17.84350       2.012811      18.51418       2.790998      17.11664       2.905545      164.0432 12.87115  157.2328 14.01464  6.810349       19.02831  
1 1 1 14 18 11 o 272.9794 9.959730  50.58957       3.616781      52.10646       4.065809      44.83756       7.917334      276.4505 11.05945  245.7672 24.50198  30.68333       26.88231  
1 1 1 14 18 12 o 150.5254 5.986043  15.22713       1.198274      15.16475       1.276114      15.69214       3.484270      150.1255 6.393775  147.8725 18.05689  2.252930       19.15546  
1 1 1 14 18 13 o 104.6799 3.716647  7.332395       0.5176050     7.299674       0.5294937     8.036598       2.456398      104.4342 3.811304  104.8121 18.25064  -0.3778915     18.64436  
1 1 1 14 18 14 o 104.7508 4.201112  7.355076       0.5852120     7.369488       0.5928190     6.804296       3.664779      104.8458 4.252061  90.97961 27.72573  13.86620       28.04989  
1 1 1 14 18 15 o 110.3756 19.80251  9.220143       2.805497      15.27833       5.280587      6.837642       3.311521      132.9404 30.46341  91.01051 26.00829  41.92993       40.05559  
1 1 1 14 18 16 o 81.85435 2.802460  4.480937       0.3052205     4.489165       0.3065335     3.526501       3.301310      81.92852 2.811988  68.61058 26.10559  13.31794       26.25660  
1 1 1 14 18 17 o 94.50890 3.030901  5.978196       0.3812028     5.952269       0.3838232     7.857528       3.267811      94.29958 3.058601  95.60758 25.27160  -1.307999      25.45602  
1 1 1 14 18 18 o 38.65433 4.648616  1.019056       0.2346396     0.9967010      0.2356814     3.531060       2.498299      38.20634 4.730257  65.49886 23.05534  -27.29252      23.53559  
1 1 1 14 18 19 o 36.73593 6.742931  0.9465619      0.3179155     0.9809743      0.3199658     -1.712771      2.812760      37.43441 6.658486  41.52149 19.57555  -4.087086      20.67698  
1 1 1 14 18 20 o 23.15622 8.319109  0.3203978      0.3268161     0.3202808      0.3275564     0.3461966      4.863768      23.16526 8.327760  56.96141 26.49064  -33.79614      27.76879  
1 1 1 14 18 21 o 85.38567 3.627214  4.904427       0.4117572     4.899411       0.4134825     5.501790       4.512129      85.33801 3.644536  71.23329 29.37702  14.10471       29.60223  
1 1 1 14 18 22 o 15.56538 7.303364  -0.3684018     0.3833449     -0.3868257     0.3875104     0.4747733      2.621510      15.53171 7.304962  46.00117 20.63389  -30.46945      21.88881  
1 1 1 14 18 23 o 65.60275 16.85845  3.584356       1.481600      3.636236       1.525284      2.717332       6.235407      65.81347 17.20322  60.00798 28.54102  5.805492       33.32478  
1 1 1 14 19 0  o 87.93600 47.91861  8.793169       7.957418      8.793169       7.957418      8.793169       7.957418      87.93600 47.91861  87.93600 47.91861  0.000000       0.000000  
1 1 1 14 19 1  o 300.5055 14.30408  61.93550       5.711332      52.58948       7.077522      79.38403       9.670461      273.4685 19.55127  334.1295 21.83965  -60.66098      29.31250  
1 1 1 14 19 2  o 57.96225 21.46196  1.965125       2.199141      1.016658       3.278876      2.740636       2.964884      59.79928 24.88594  67.15467 24.90989  -7.355389      35.21097  
1 1 1 14 19 3  o 83.09498 11.40500  4.765269       1.229545      6.024110       4.581985      4.667589       1.276357      90.63721 31.26587  82.06766 12.02844  8.569557       33.49982  
1 1 1 14 19 4  o 156.6725 14.72166  16.99214       3.037416      14.61960       12.03091      17.15366       3.139107      128.0942 49.55457  157.2415 15.16996  -29.14726      51.82454  
1 1 1 14 19 5  o 200.5563 5.655279  26.94706       1.509837      26.95969       1.584086      26.82165       4.990102      200.5477 5.934245  194.4099 19.52687  6.137772       20.40867  
1 1 1 14 19 6  o 160.9918 1.179005  17.27210       0.2529256     17.30711       0.2539229     12.84181       2.856478      161.1548 1.182457  135.2644 16.16780  25.89040       16.21098  
1 1 1 14 19 7  f 234.5168 1.674828  36.66006       0.5233809     36.66706       0.5283477     36.29270       3.826001      234.5382 1.690568  230.1103 12.52494  4.427887       12.63852  
1 1 1 14 19 8  o 131.5746 6.613420  11.65220       1.155785      10.77536       1.361239      13.91720       2.187812      126.1811 8.139343  142.3917 11.63186  -16.21054      14.19680  
1 1 1 14 19 9  o 163.3892 5.846062  17.92587       1.270749      18.55008       1.391489      14.79006       3.118817      166.1102 6.297924  144.4724 16.49589  21.63774       17.65725  
1 1 1 14 19 10 o 116.3253 13.88088  9.494526       2.109209      7.205145       2.783304      12.58272       3.232613      97.55951 21.94335  131.4950 18.99912  -33.93547      29.02546  
1 1 1 14 19 11 o 176.7143 8.485669  21.19806       1.992326      17.67666       2.800410      24.80715       2.835059      159.1636 13.32619  189.8969 11.25441  -30.73329      17.44274  
1 1 1 14 19 12 o 55.87775 19.75943  2.124179       1.836684      2.700374       2.057938      -0.1315268     4.071824      61.34526 20.96071  58.05456 25.90115  3.290695       33.31998  
1 1 1 14 19 13 o 41.21624 18.87440  -1.083447      2.335322      -8.660850      5.107204      0.9197273      2.625926      46.19630 22.81484  52.45781 22.08023  -6.261509      31.74985  
1 1 1 14 19 14 o 150.3922 12.89755  15.98456       2.559741      18.24113       3.312741      12.64090       4.032509      158.4401 15.90586  124.1538 25.23599  34.28634       29.83038  
1 1 1 14 19 15 o 189.3427 14.04197  25.74526       3.517612      22.43108       5.168482      28.60506       4.801116      165.8055 24.09824  194.2922 18.77818  -28.48668      30.55070  
1 1 1 14 19 16 o 79.53920 13.41398  4.628998       1.371192      5.198941       1.459705      0.3524122      3.998511      84.37817 13.43247  56.00904 25.27184  28.36913       28.61987  
1 1 1 14 19 17 o 42.42668 9.562522  1.296620       0.5276329     1.315965       0.5339386     0.4920781      3.443354      42.73535 9.610130  52.88198 23.68972  -10.14664      25.56477  
1 1 1 14 19 18 o 36.25299 12.90627  0.8658528      0.7847456     1.204205       0.8204374     -2.771063      2.689846      40.83592 13.21528  37.58435 18.10525  3.251575       22.41525  
1 1 1 14 19 19 o 64.18473 10.74724  2.985162       0.8867157     3.170178       0.9090362     -0.6441830     4.026152      66.22300 10.66349  50.94574 23.82805  15.27726       26.10529  
1 1 1 14 19 20 o 47.05550 15.49146  1.699020       1.125041      1.705395       1.146486      1.533369       5.844055      47.14884 15.64315  60.32792 28.37206  -13.17908      32.39880  
1 1 1 14 19 21 o 70.72851 13.70674  3.847308       1.245166      3.997399       1.266340      -0.5287704     6.837769      72.15148 13.67169  57.02599 27.79515  15.12549       30.97556  
1 1 1 14 19 22 o 68.85658 15.76540  3.842208       1.415264      5.106244       1.641962      0.1891257      2.791341      79.44469 16.06328  45.16166 20.66383  34.28304       26.17294  
1 1 1 14 20 0  o 98.71920 52.69907  12.17318       9.438943      12.17318       9.438943      12.17318       9.438943      98.71920 52.69907  98.71920 52.69907  0.000000       0.000000  
1 1 1 14 20 1  f 75.16428 20.61069  4.175739       2.125767      4.226708       2.235469      3.694336       6.870227      75.53901 21.29623  85.39487 35.81504  -9.855858      41.66830  
1 1 1 14 20 2  o 79.00423 26.03052  4.624340       3.176272      3.208961       3.433454      13.02441       8.364431      70.98045 26.70946  120.0774 42.19250  -49.09694      49.93598  
1 1 1 14 20 3  o 207.0758 9.511929  29.09371       2.617640      34.52939       6.037477      27.83538       2.904867      218.3571 21.00882  201.9992 10.83164  16.35796       23.63673  
1 1 1 14 20 4  o 62.24416 26.56212  0.9150522      3.888975      -0.6748350     10.55814      1.164618       4.183082      86.06529 39.67522  64.91529 27.62004  21.15000       48.34242  
1 1 1 14 20 5  o 108.9514 5.071956  7.965262       0.7343249     7.903453       0.8301704     8.187532       1.574282      108.4144 5.767298  109.0723 10.98095  -0.6578903     12.40334  
1 1 1 14 20 6  o 26.99776 8.425529  0.4894525      0.3360379     0.5230146      0.3388223     -1.527428      2.626563      27.73670 8.425838  43.10247 19.84050  -15.36577      21.55551  
1 1 1 14 20 7  o 157.3913 8.550729  16.81296       1.786583      15.14557       2.139800      20.65047       3.246228      148.5079 10.88879  171.7646 14.31308  -23.25670      17.98416  
1 1 1 14 20 8  o 206.1743 6.201486  28.60051       1.701805      28.76557       2.154136      28.32643       2.775810      206.1627 7.855697  203.4633 10.27158  2.699432       12.93125  
1 1 1 14 20 9  o 109.5403 4.277683  8.043512       0.6231896     8.041917       0.6329316     8.094165       3.565630      109.5187 4.345683  99.91048 26.39297  9.608223       26.74835  
1 1 1 14 20 10 o 89.05650 20.31937  6.070919       2.357852      6.018369       2.439323      6.818420       9.200023      88.28976 21.03497  91.80714 40.01800  -3.517387      45.20962  
1 1 1 14 20 11 o 56.37679 21.12315  2.081416       2.142493      0.7957683      2.620234      4.675073       3.721648      51.63375 21.91018  76.45050 27.98604  -24.81675      35.54258  
1 1 1 14 20 12 o 46.09663 19.89440  0.3453137      2.228013      0.3048464      6.345581      0.3510040      2.379508      67.44057 30.96843  47.33246 20.49384  20.10810       37.13544  
1 1 1 14 20 13 f 51.58845 21.59715  1.132578       2.491311      0.5106306      3.637059      1.682341       3.419489      55.54790 24.64899  59.03812 25.04002  -3.490211      35.13652  
1 1 1 14 20 14 o 64.59503 22.79331  3.349401       2.442962      -1.823600      5.455431      4.646923       2.732217      57.20873 27.05900  73.78198 24.13349  -16.57325      36.25762  
1 1 1 14 20 15 o 73.56473 25.33156  4.826877       3.007247      -1.181417      5.617146      7.240876       3.560482      58.12224 27.48093  87.53890 27.44150  -29.41666      38.83603  
1 1 1 14 20 16 o 104.2839 11.60164  7.807419       1.584908      8.725134       1.751815      3.668178       3.720443      109.9186 12.16363  66.07862 26.89668  43.83998       29.51923  
1 1 1 14 20 17 o 29.24485 10.95394  0.4872195      0.5760646     0.4949283      0.5764687     -5.005625      15.38795      29.35575 10.96544  68.50105 34.63410  -39.14530      36.32853  
1 1 1 14 20 18 o 80.28091 8.742483  4.531260       0.9201445     4.669353       0.9473946     2.233807       3.864275      81.44437 8.872938  58.62130 25.73429  22.82307       27.22099  
1 1 1 14 20 19 o 80.05325 9.803717  4.588503       1.023986      4.587689       1.042630      4.610663       5.438972      79.93275 10.00758  66.37748 29.75144  13.55527       31.38948  
1 1 1 14 20 20 o 36.35377 14.04471  0.8044243      0.9654306     0.8840893      0.9700643     -7.474674      9.889139      37.20119 14.15195  55.37641 27.97062  -18.17522      31.34698  
1 1 1 14 20 21 o 76.58698 8.492768  4.157685       0.8521665     3.994859       0.8688170     8.284064       4.373707      74.84961 8.884021  79.50670 30.09510  -4.657089      31.37898  
1 1 1 14 21 0  o 111.2839 34.58724  11.19655       4.493269      11.19655       4.493269      11.19655       4.493269      111.2839 34.58724  111.2839 34.58724  0.000000       0.000000  
1 1 1 14 21 1  o 78.19438 24.99315  4.726938       2.940764      4.617361       3.229445      5.258946       7.115880      77.58939 26.26141  87.54121 36.56375  -9.951813      45.01744  
1 1 1 14 21 2  o 290.6694 12.11173  58.32468       4.680868      51.25753       8.760018      61.14891       5.537740      257.0733 25.92641  295.8292 14.08860  -38.75595      29.50707  
1 1 1 14 21 3  o 82.68601 19.47345  5.142130       2.109943      5.460667       4.476658      5.051160       2.392330      83.43733 30.66904  81.10584 21.70789  2.331490       37.57423  
1 1 1 14 21 4  o 56.47250 21.96807  1.815573       2.374353      0.000000       0.000000      1.815573       2.374353      ?        ?         56.47250 21.96807  0.000000       21.96807  
1 1 1 14 21 5  o 23.39032 10.93805  -0.7828450     0.8477636     -0.6518825     0.8788586     -2.535955      3.215511      24.70519 11.40953  44.70035 21.02963  -19.99516      23.92536  
1 1 1 14 21 6  o 117.3860 2.320764  9.194166       0.3630118     9.253386       0.3670792     6.566270       2.445305      117.7620 2.339273  92.73937 20.34796  25.02267       20.48199  
1 1 1 14 21 7  o 129.3593 8.110988  11.40300       1.391085      12.39398       1.488120      4.539137       3.916437      134.8042 8.325019  76.34554 28.56853  58.45863       29.75679  
1 1 1 14 21 8  o 84.24156 7.610235  4.849626       0.8450722     4.592624       0.9378499     5.959176       1.948674      81.62909 8.758965  89.53734 16.95342  -7.908249      19.08240  
1 1 1 14 21 9  o 96.00540 1.500152  6.145561       0.1919131     6.144182       0.1919857     7.966012       6.976243      95.99459 1.500889  90.01338 36.75856  5.981209       36.78919  
1 1 1 14 21 10 o 86.84303 10.25693  5.279539       1.164056      5.127345       1.214220      7.008123       4.092080      85.29155 10.93483  87.48941 29.56170  -2.197861      31.51928  
1 1 1 14 21 11 o 153.4632 12.20004  16.70039       2.474299      16.05090       2.595389      23.17755       8.196129      149.7173 13.14261  139.7149 41.21082  10.00243       43.25575  
1 1 1 14 21 12 o 98.46331 22.02467  8.000237       2.817271      1.465664       4.883302      11.26021       3.449152      62.67081 28.13245  116.3346 23.06510  -53.66378      36.37903  
1 1 1 14 21 13 o 51.36767 20.65740  1.598610       2.164798      6.186697       5.756066      0.8427423      2.336323      77.70569 32.69812  48.10780 20.56031  29.59789       38.62504  
1 1 1 14 21 14 o 60.54877 24.40920  2.758548       3.030560      8.557211       5.747111      0.5250970      3.566760      84.97123 33.83093  53.21954 23.95357  31.75169       41.45245  
1 1 1 14 21 15 o 37.29487 17.95758  -2.681675      2.639015      -10.55131      6.344278      -1.035092      2.901996      46.84639 23.49435  43.90851 20.43444  2.937874       31.13761  
1 1 1 14 21 16 o 116.8940 10.07242  9.688683       1.553629      10.59663       1.636797      1.429194       4.936756      122.2303 10.14064  59.28368 27.25670  62.94664       29.08196  
1 1 1 14 21 17 o 17.29267 8.267182  -0.6795626     0.5373254     -0.6588074     0.5376300     -18.98743      15.96758      17.42339 8.313132  59.84907 30.68963  -42.42568      31.79563  
1 1 1 14 21 18 o 83.38097 8.111265  4.876942       0.8898398     4.760520       0.8971660     11.91836       6.977238      82.27773 8.296259  82.83707 35.46986  -0.5593414     36.42717  
1 1 1 14 21 19 o 59.69508 7.927600  2.517700       0.6150255     2.594987       0.6181984     -4.953598      6.078169      60.65802 7.830854  48.94344 24.29799  11.71458       25.52870  
1 1 1 14 22 0  o 43.46685 26.26616  1.641818       2.788691      1.641818       2.788691      1.641818       2.788691      43.46685 26.26616  43.46685 26.26616  0.000000       0.000000  
1 1 1 14 22 1  o 103.3362 11.53500  7.488246       1.561284      6.082280       2.647341      8.238048       1.933283      87.25553 22.59282  107.3191 13.84097  -20.06361      26.49543  
1 1 1 14 22 2  o 50.05537 20.36310  1.157076       2.131058      0.3311002E-01  2.624836      3.330674       3.650187      48.01274 21.13868  68.84745 27.10338  -20.83471      34.37204  
1 1 1 14 22 3  o 45.82161 20.78020  -0.7402613     2.744431      3.635293       4.291400      -3.768157      3.569874      71.72874 28.99990  43.79456 21.03533  27.93419       35.82568  
1 1 1 14 22 4  o 139.7313 14.42339  14.02308       2.647009      0.000000       0.000000      14.02308       2.647009      ?        ?         139.7313 14.42339  0.000000       14.42339  
1 1 1 14 22 5  o 67.43067 6.448930  3.099796       0.5724018     3.097857       0.5742075     3.406701       7.223477      67.40382 6.472548  76.57645 34.30738  -9.172623      34.91261  
1 1 1 14 22 6  o 98.25922 2.246768  6.444481       0.2941746     6.469478       0.2965116     4.877481       2.347675      98.44850 2.260263  77.63689 21.80183  20.81161       21.91868  
1 1 1 14 22 7  o 81.05657 5.897892  4.458152       0.6326696     4.715584       0.6507902     0.2755685E-01  2.699855      83.37602 5.895710  47.80441 21.22363  35.57161       22.02730  
1 1 1 14 22 8  o 28.47931 12.02856  0.1248912      0.7836097     0.3012682      0.8069849     -2.788013      3.279500      30.48759 12.48216  43.04843 20.53735  -12.56084      24.03304  
1 1 1 14 22 9  o 35.57363 11.47612  0.8787842      0.6190086     0.8694280      0.6198102     4.488952       12.17515      35.43425 11.48791  79.28471 38.27442  -43.85046      39.96127  
1 1 1 14 22 10 o 75.85036 2.543914  3.848794       0.2567549     3.858167       0.2569132     -3.750940      7.315513      75.94295 2.542366  59.71575 29.02546  16.22720       29.13659  
1 1 1 14 22 11 o 128.0311 11.69274  11.71419       1.972832      11.93365       2.029636      7.957168       8.397582      129.0505 11.93808  80.78034 36.51989  48.27018       38.42161  
1 1 1 14 22 12 o 72.62921 24.32450  4.745214       2.770882      -0.2667659E-01 6.515807      5.798686       3.061500      61.94646 29.37992  78.98699 25.52545  -17.04053      38.91951  
1 1 1 14 22 13 o 47.75998 19.51363  1.295773       1.967223      3.432211       3.452215      0.2684220      2.393934      63.87980 25.94331  45.10804 20.00805  18.77176       32.76243  
1 1 1 14 22 14 o 27.55369 12.99818  -1.092754      1.243543      -0.5423387     1.490741      -2.352032      2.254853      33.17016 15.14820  34.55780 16.62936  -1.387646      22.49452  
1 1 1 14 22 15 o 37.31821 17.04103  -0.4609611     1.886027      0.4757452E-02  2.055119      -2.946815      4.748024      40.78554 18.28384  48.45502 23.51302  -7.669476      29.78524  
1 1 1 14 22 16 o 46.11745 19.77564  1.015980       2.174643      -0.1294780     2.467996      4.993386       4.598908      42.83636 19.53511  67.30859 28.80826  -24.47222      34.80713  
1 1 1 14 22 17 o 89.33737 7.155681  5.538812       0.8447222     5.623576       0.8584728     2.956222       4.738578      89.99027 7.219607  59.98254 27.24294  30.00773       28.18334  
1 1 1 14 23 0  o 55.89089 30.30542  3.701042       3.166969      3.701042       3.166969      3.701042       3.166969      55.89089 30.30542  55.89089 30.30542  0.000000       0.000000  
1 1 1 14 23 1  o 84.29848 19.87329  5.668632       2.195695      4.293550       2.465830      10.93322       4.824817      71.79969 22.87926  104.8149 31.78634  -33.01520      39.16417  
1 1 1 14 23 2  o 96.68289 19.80710  7.403898       2.465909      5.723347       2.941259      11.37967       4.523955      81.08962 24.86306  109.2502 30.11091  -28.16055      39.04919  
1 1 1 14 23 3  o 58.96563 14.33251  2.606517       1.115005      2.331899       1.192966      4.503998       3.135829      55.47040 15.52850  72.24470 25.79090  -16.77430      30.10490  
1 1 1 14 23 4  o 50.95125 22.16708  0.7367479      2.811579      1.787861       4.836699      0.2002905      3.455351      63.46284 28.27714  52.57786 23.62803  10.88498       36.84943  
1 1 1 14 23 5  o 102.5736 2.583237  7.035105       0.3527994     7.040546       0.3553211     6.655847       2.966554      102.6108 2.600785  87.12818 24.52187  15.48265       24.65940  
1 1 1 14 23 6  o 101.6566 2.075161  6.898698       0.2811002     6.877886       0.2816599     12.12011       4.461316      101.5025 2.082451  112.3322 29.45018  -10.82967      29.52371  
1 1 1 14 23 7  o 55.89898 15.21248  2.387811       1.163145      3.148294       1.243551      -2.928952      3.288081      64.40948 14.80019  42.15554 20.23240  22.25394       25.06782  
1 1 1 14 23 8  o 87.57909 5.330088  5.199068       0.6190804     5.579116       0.6488908     1.345570       2.066234      90.71664 5.392313  49.08907 20.02063  41.62756       20.73409  
1 1 1 14 23 9  o 40.52445 16.63345  0.7284228      1.437609      0.9492067      1.495359      -1.965519      5.223432      42.60593 17.15657  54.16754 25.86324  -11.56160      31.03635  
1 1 1 14 23 10 o 22.33331 10.90324  -1.783159      1.064408      -2.246420      1.096320      5.828604       4.443927      21.35414 10.55062  74.99706 29.78505  -53.64292      31.59849  
1 1 1 14 23 11 f 86.16512 1.343541  4.951562       0.1542609     4.956017       0.1544237     2.841997       3.360619      86.20381 1.344355  60.54964 25.19590  25.65417       25.23174  
1 1 1 14 23 12 o 138.7033 5.760420  13.09096       1.062351      13.20651       1.110767      11.85147       3.637938      139.1908 6.002901  113.4344 24.76410  25.75632       25.48127  
1 1 1 14 23 13 o 40.54031 16.69997  0.8084219      1.455927      0.9563761      1.636823      0.2478486      3.186062      42.83436 17.68222  48.58998 22.17311  -5.755627      28.36032  
1 1 1 14 23 14 o 54.21720 20.89102  2.393962       2.132023      0.3148163      2.574949      6.927074       3.802107      45.20921 20.34998  78.15959 28.33576  -32.95038      34.88606  
1 1 1 14 23 15 o 78.66396 14.79926  4.836448       1.494358      5.046379       1.683135      4.054907       3.247558      78.98474 16.52377  63.72434 25.41154  15.26040       30.31141  
1 1 1 14 24 0  o 24.25760 16.88958  -1.479532      1.953896      -1.479532      1.953896      -1.479532      1.953896      24.25760 16.88958  24.25760 16.88958  0.000000       0.000000  
1 1 1 14 24 1  o 43.96621 19.20059  0.3478775      2.126484      -0.1653279     2.438155      1.979099       4.346825      44.03833 19.81428  61.18160 27.05805  -17.14327      33.53720  
1 1 1 14 24 2  o 88.09481 20.47165  6.404111       2.357236      8.959503       3.648161      4.572554       3.088557      97.42545 27.11183  71.13710 25.57207  26.28835       37.26905  
1 1 1 14 24 3  o 83.22231 11.29156  4.976841       1.219910      4.978839       1.269407      4.952708       4.411661      82.96223 11.81642  72.19258 29.32460  10.76965       31.61581  
1 1 1 14 24 4  o 78.80563 29.49943  6.368494       4.176581      11.98780       5.720772      -0.4513868E-01 6.111748      99.45367 34.89759  60.83197 28.73298  38.62171       45.20427  
1 1 1 14 24 5  o 96.51114 5.707104  6.330997       0.7306737     6.546626       0.7784017     4.732663       2.119264      98.05009 5.986279  74.98363 20.58633  23.06646       21.43905  
1 1 1 14 24 6  o 104.5112 8.027427  7.564810       1.109366      7.540078       1.280061      7.639438       2.223558      103.6361 9.370423  98.47300 17.59123  5.163078       19.93129  
1 1 1 14 24 7  f 149.1524 6.522397  15.19450       1.293182      16.19779       1.520748      12.57435       2.457575      153.4319 7.460571  129.6050 14.47720  23.82689       16.28648  
1 1 1 14 24 8  o 33.27416 15.02084  -0.3492859     1.414552      -1.986688      2.126135      0.9511250      1.894757      34.39917 16.44526  44.90501 18.81936  -10.50585      24.99230  
1 1 1 14 24 9  o 59.01253 18.17902  2.865827       1.570131      7.475464       2.584294      0.1685843      1.976826      92.86331 21.33375  41.09174 18.20646  51.77157       28.04646  
1 1 1 14 24 10 o 41.79081 17.76449  0.6865084      1.727634      1.735553       2.026602      -2.103144      3.304811      49.99205 20.02742  42.73002 20.44829  7.262035       28.62220  
1 1 1 14 24 11 o 24.46596 11.64069  -1.085704      1.039126      -1.202696      1.147750      -0.5539095     2.447042      25.57132 12.18556  41.26454 19.05042  -15.69322      22.61430  
1 1 1 14 24 12 o 84.69552 17.06558  5.821595       1.859360      6.397651       2.217102      4.455945       3.413678      86.29576 19.71375  66.00105 26.13943  20.29472       32.73991  
1 1 1 14 25 0  f 144.3589 27.16995  17.66328       4.685833      17.66328       4.685833      17.66328       4.685833      144.3589 27.16995  144.3589 27.16995  0.000000       0.000000  
1 1 1 14 25 1  o 43.26112 18.02525  0.8821633      1.723215      1.405422       2.250858      0.1411620      2.678547      49.40815 20.59480  45.97379 20.71935  3.434353       29.21365  
1 1 1 14 25 2  o 171.7213 10.50429  20.97863       2.392112      20.38971       2.577916      24.62790       6.417161      168.1543 11.57565  149.9571 33.01049  18.19719       34.98125  
1 1 1 14 25 3  o 18.31748 8.747478  -0.7390461     0.5980577     -0.7655929     0.5998574     3.665312       7.726510      18.20742 8.712746  67.39280 31.97181  -49.18538      33.13772  
1 1 1 14 25 4  o 59.74037 25.57659  2.748890       3.626938      -3.209989      4.694308      11.57443       5.712945      48.01614 23.31853  92.22595 34.50560  -44.20981      41.64601  
1 1 1 14 25 5  o 32.65231 13.65207  0.3386299      0.9935505     0.4697637      1.045433      -0.8850319     3.193519      34.32784 14.14709  45.33187 21.20862  -11.00404      25.49403  
1 1 1 14 25 6  f 163.7181 9.686884  18.96124       2.103821      18.36476       2.346627      21.40435       4.749210      159.6801 11.09764  153.6271 23.98282  6.053024       26.42599  
1 1 1 14 25 7  o 31.00444 12.32778  0.4629374      0.7621258     0.2356820      0.7932321     3.191209       2.748444      29.13726 12.19155  60.08879 23.55965  -30.95154      26.52718  
1 1 1 14 25 8  o 19.26252 9.622656  -2.517101      1.016850      -2.995104      1.090429      0.6705387      2.815895      19.20119 9.645029  47.99556 21.46751  -28.79437      23.53466  
1 1 1 14 25 9  o 57.12017 18.58125  2.745546       1.620770      2.683352       2.688502      2.781055       2.031416      56.79718 22.95705  56.95573 20.70286  -0.1585541     30.91334  
1 1 1 15 0  1  o 144.0197 13.73180  14.22036       2.576798      14.22036       2.576798      14.22036       2.576798      144.0197 13.73180  144.0197 13.73180  0.000000       0.000000  
1 1 1 15 0  2  o 872.3476 18.61183  509.6720       21.61254      509.6720       21.61254      509.6720       21.61254      872.3476 18.61183  872.3476 18.61183  0.000000       0.000000  
1 1 1 15 0  3  o 464.5916 14.35499  144.5526       8.867626      144.5526       8.867626      144.5526       8.867626      464.5916 14.35499  464.5916 14.35499  0.000000       0.000000  
1 1 1 15 0  4  o 197.7951 18.84783  26.86876       4.857591      26.86876       4.857591      26.86876       4.857591      197.7951 18.84783  197.7951 18.84783  0.000000       0.000000  
1 1 1 15 0  5  o 560.9869 19.41088  211.3187       14.47071      211.3187       14.47071      211.3187       14.47071      560.9869 19.41088  560.9869 19.41088  0.000000       0.000000  
1 1 1 15 0  6  o 1053.213 31.12646  749.1181       43.59732      749.1181       43.59732      749.1181       43.59732      1053.213 31.12646  1053.213 31.12646  0.000000       0.000000  
1 1 1 15 0  7  o 406.5646 18.61984  111.2623       10.03906      111.2623       10.03906      111.2623       10.03906      406.5646 18.61984  406.5646 18.61984  0.000000       0.000000  
1 1 1 15 0  8  o 1784.099 112.9950  2464.663       266.1274      2464.663       266.1274      2464.663       266.1274      1784.099 112.9950  1784.099 112.9950  0.000000       0.000000  
1 1 1 15 0  9  o 164.6235 8.445787  18.21441       1.841512      18.21441       1.841512      18.21441       1.841512      164.6235 8.445787  164.6235 8.445787  0.000000       0.000000  
1 1 1 15 0  10 o 667.2581 16.86630  298.3361       14.97476      298.3361       14.97476      298.3361       14.97476      667.2581 16.86630  667.2581 16.86630  0.000000       0.000000  
1 1 1 15 0  11 o 571.2621 16.39125  218.8133       12.45408      218.8133       12.45408      218.8133       12.45408      571.2621 16.39125  571.2621 16.39125  0.000000       0.000000  
1 1 1 15 0  12 o 363.5210 26.69541  90.45637       12.76747      90.45637       12.76747      90.45637       12.76747      363.5210 26.69541  363.5210 26.69541  0.000000       0.000000  
1 1 1 15 0  13 o 368.6773 13.36944  91.21480       6.548378      91.21480       6.548378      91.21480       6.548378      368.6773 13.36944  368.6773 13.36944  0.000000       0.000000  
1 1 1 15 0  14 o 46.05855 25.54249  1.970978       2.304452      1.970978       2.304452      1.970978       2.304452      46.05855 25.54249  46.05855 25.54249  0.000000       0.000000  
1 1 1 15 0  15 o 27.48218 17.38428  0.1991893      1.364966      0.1991893      1.364966      0.1991893      1.364966      27.48218 17.38428  27.48218 17.38428  0.000000       0.000000  
1 1 1 15 0  16 o 23.50604 15.48615  -0.2418886     1.239747      -0.2418886     1.239747      -0.2418886     1.239747      23.50604 15.48615  23.50604 15.48615  0.000000       0.000000  
1 1 1 15 0  17 o 179.0073 9.130617  21.57504       2.164932      21.57504       2.164932      21.57504       2.164932      179.0073 9.130617  179.0073 9.130617  0.000000       0.000000  
1 1 1 15 0  18 o 18.83227 12.52672  -0.2481407     0.8433349     -0.2481407     0.8433349     -0.2481407     0.8433349     18.83227 12.52672  18.83227 12.52672  0.000000       0.000000  
1 1 1 15 0  19 o 82.67192 6.126434  4.635742       0.6661872     4.635742       0.6661872     4.635742       0.6661872     82.67192 6.126434  82.67192 6.126434  0.000000       0.000000  
1 1 1 15 0  20 o 100.6836 4.913739  6.810415       0.6556451     6.810415       0.6556451     6.810415       0.6556451     100.6836 4.913739  100.6836 4.913739  0.000000       0.000000  
1 1 1 15 0  21 o 31.08553 16.12298  0.9536546      0.8638772     0.9536546      0.8638772     0.9536546      0.8638772     31.08553 16.12298  31.08553 16.12298  0.000000       0.000000  
1 1 1 15 0  22 o 58.46912 16.71398  2.801187       1.128461      2.801187       1.128461      2.801187       1.128461      58.46912 16.71398  58.46912 16.71398  0.000000       0.000000  
1 1 1 15 0  23 f 122.7482 9.439596  10.28520       1.522434      10.28520       1.522434      10.28520       1.522434      122.7482 9.439596  122.7482 9.439596  0.000000       0.000000  
1 1 1 15 0  24 o 177.6995 8.036959  21.30029       1.894166      21.30029       1.894166      21.30029       1.894166      177.6995 8.036959  177.6995 8.036959  0.000000       0.000000  
1 1 1 15 0  25 o 97.90141 9.483550  6.631889       1.208752      6.631889       1.208752      6.631889       1.208752      97.90141 9.483550  97.90141 9.483550  0.000000       0.000000  
1 1 1 15 0  26 o 119.2941 31.42172  12.34298       4.315353      12.34298       4.315353      12.34298       4.315353      119.2941 31.42172  119.2941 31.42172  0.000000       0.000000  
1 1 1 15 0  27 o 212.7879 12.43752  31.39479       3.498764      31.39479       3.498764      31.39479       3.498764      212.7879 12.43752  212.7879 12.43752  0.000000       0.000000  
1 1 1 15 0  28 f 25.27226 17.62470  -1.640648      2.151405      -1.640648      2.151405      -1.640648      2.151405      25.27226 17.62470  25.27226 17.62470  0.000000       0.000000  
1 1 1 15 0  29 o 58.00555 35.98037  4.933206       5.551506      4.933206       5.551506      4.933206       5.551506      58.00555 35.98037  58.00555 35.98037  0.000000       0.000000  
1 1 1 15 0  30 o 37.81317 23.09325  1.425621       2.205133      1.425621       2.205133      1.425621       2.205133      37.81317 23.09325  37.81317 23.09325  0.000000       0.000000  
1 1 1 15 0  31 o 28.08363 19.74359  -1.997209      2.862200      -1.997209      2.862200      -1.997209      2.862200      28.08363 19.74359  28.08363 19.74359  0.000000       0.000000  
1 1 1 15 0  32 o 26.82298 19.06537  -2.641068      2.923518      -2.641068      2.923518      -2.641068      2.923518      26.82298 19.06537  26.82298 19.06537  0.000000       0.000000  
1 1 1 15 1  0  o 414.3598 26.07415  116.6016       14.26440      116.6016       14.26440      116.6016       14.26440      414.3598 26.07415  414.3598 26.07415  0.000000       0.000000  
1 1 1 15 1  1  o 464.8981 7.138038  144.1634       4.421913      142.5755       4.913062      150.9351       10.14611      462.2653 7.976041  474.3237 16.07604  -12.05838      17.94593  
1 1 1 15 1  2  o 286.5116 8.249393  54.82091       3.146193      53.50910       4.020614      56.89293       5.053059      282.8336 10.68734  291.3755 13.04761  -8.541901      16.86592  
1 1 1 15 1  3  o 219.9028 8.333853  32.31491       2.437605      32.02676       2.544061      35.54349       8.515666      218.8860 8.739974  227.1602 28.77761  -8.274231      30.07554  
1 1 1 15 1  4  o 347.0302 14.72662  80.77316       6.794469      77.96101       7.712569      90.52042       14.35887      340.5377 17.05078  363.7983 29.88327  -23.26059      34.40550  
1 1 1 15 1  5  o 411.3766 10.82899  113.1287       5.930934      108.3427       8.490782      117.6889       8.288105      401.7976 15.89001  418.9797 14.86887  -17.18210      21.76179  
1 1 1 15 1  6  o 326.9679 9.514597  71.43562       4.141016      74.06516       5.670904      68.43176       6.061113      332.5477 12.82151  319.4284 14.27592  13.11935       19.18835  
1 1 1 15 1  7  o 302.4552 11.94883  61.24697       4.806228      58.93521       6.604841      63.84885       7.007042      295.9708 16.81631  308.0431 17.13820  -12.07230      24.01054  
1 1 1 15 1  8  o 423.4154 20.12021  120.8750       11.31953      117.6027       16.03392      124.1264       15.98268      414.9377 29.18517  426.6610 28.27155  -11.72336      40.63317  
1 1 1 15 1  9  o 585.7700 17.14577  230.4961       13.36873      240.9109       21.74162      224.1644       16.95222      595.0856 27.49249  576.0959 22.12412  18.98969       35.28901  
1 1 1 15 1  10 o 315.9086 7.077575  66.58102       2.979336      77.10668       6.541463      63.82613       3.346594      338.9285 14.51779  309.1312 8.131372  29.79727       16.63988  
1 1 1 15 1  11 f 392.4776 7.051193  102.7795       3.687661      107.8483       5.582651      98.85579       4.911803      401.5557 10.44215  384.6758 9.582361  16.87991       14.17251  
1 1 1 15 1  12 o 565.2975 12.27328  213.9641       9.245091      224.6681       10.86339      185.8493       17.60589      578.8136 14.08487  522.0792 25.38351  56.73444       29.02941  
1 1 1 15 1  13 o 304.7363 9.294187  62.12831       3.769652      55.24997       5.802060      67.15273       4.958875      286.3300 15.26208  316.4409 11.78083  -30.11090      19.28002  
1 1 1 15 1  14 o 367.2976 8.533527  90.16287       4.176575      97.65303       7.248148      86.43961       5.110272      380.9217 14.30507  359.1608 10.68969  21.76089       17.85790  
1 1 1 15 1  15 o 415.7928 8.932110  115.6450       4.948853      120.4723       6.277085      107.7160       8.044781      423.7750 11.12564  399.5255 15.13849  24.24951       18.78706  
1 1 1 15 1  16 o 267.0945 9.023942  47.81131       3.207087      48.56409       3.666065      45.35694       6.619677      268.9638 10.24774  257.3925 19.44425  11.57123       21.97942  
1 1 1 15 1  17 o 84.74403 6.237668  4.823200       0.6994407     3.894035       0.8109577     7.521943       1.382078      75.84827 8.151564  105.4394 9.954693  -29.59112      12.86639  
1 1 1 15 1  18 o 263.8890 5.733819  46.51619       2.016224      46.94021       2.399668      45.49819       3.718174      264.8637 6.804795  259.9286 10.75826  4.935150       12.72970  
1 1 1 15 1  19 f 244.1504 4.027994  39.77382       1.310448      38.13087       1.588556      43.27326       2.318414      238.9608 4.988871  254.2202 6.850202  -15.25935      8.474319  
1 1 1 15 1  20 o 240.1337 2.855787  38.45166       0.9138029     37.41807       1.018623      42.71263       2.068199      236.8567 3.227411  252.7045 6.141943  -15.84779      6.938273  
1 1 1 15 1  21 o 75.82421 5.745239  3.866957       0.5761631     7.706526       1.231339      2.790648       0.6519356     106.7316 8.734192  64.03107 7.801695  42.70054       11.71122  
1 1 1 15 1  22 o 34.44182 11.45937  0.7639801      0.6151337     0.3948776      0.8252209     1.225528       0.9227949     32.36921 12.84165  42.99478 14.02299  -10.62557      19.01453  
1 1 1 15 1  23 o 119.6357 7.158973  9.648178       1.136041      9.757833       1.549187      9.520613       1.670918      119.7156 9.796963  117.9860 10.74578  1.729584       14.54140  
1 1 1 15 1  24 o 234.1734 7.425270  36.97200       2.314057      38.48923       2.893155      34.27772       3.855376      238.2195 9.131158  222.7408 13.04666  15.47868       15.92461  
1 1 1 15 1  25 o 181.6164 6.697463  22.25181       1.618059      20.63563       2.262645      23.94336       2.314809      173.6517 9.818306  187.3387 9.301962  -13.68700      13.52500  
1 1 1 15 1  26 o 200.3567 6.443524  27.12403       1.718050      25.58729       3.161446      27.76806       2.046639      190.9589 12.49291  202.1692 7.610775  -11.21025      14.62862  
1 1 1 15 1  27 f 37.81876 13.11826  0.9502047      0.8070717     1.262442       1.861658      0.8779405      0.8956094     48.09879 19.22006  37.62288 13.73571  10.47591       23.62373  
1 1 1 15 1  28 o 60.51228 19.89976  2.980533       1.856625      0.1699800      3.220966      4.379025       2.272062      50.11417 22.64046  71.41679 21.84385  -21.30262      31.46020  
1 1 1 15 1  29 o 52.29272 20.26721  2.043864       2.015194      2.707921       2.413973      0.5170553      3.660347      57.51072 22.21111  52.02364 23.75003  5.487083       32.51764  
1 1 1 15 1  30 o 49.28788 17.90481  1.907658       1.519104      5.280076       2.533081      0.1357345E-01  1.898358      74.20895 23.12868  39.16465 17.56374  35.04430       29.04171  
1 1 1 15 1  31 o 53.73937 21.20586  2.551244       2.239207      4.293887       3.449613      1.282297       2.943663      62.35494 25.69799  49.11140 21.95912  13.24354       33.80221  
1 1 1 15 1  32 o 46.38241 20.83704  1.042060       2.684812      7.434807       5.347492      -1.112489      3.104449      67.32899 29.88183  41.62453 19.89196  25.70446       35.89727  
1 1 1 15 2  0  o 440.8327 17.66982  130.5489       10.34160      130.5489       10.34160      130.5489       10.34160      440.8327 17.66982  440.8327 17.66982  0.000000       0.000000  
1 1 1 15 2  1  o 495.3740 7.414775  163.6988       4.894459      163.5595       5.114056      165.2177       16.88391      495.1348 7.751192  493.6709 25.75530  1.463898       26.89641  
1 1 1 15 2  2  o 386.8391 13.39106  100.2221       6.892287      105.8416       8.775038      91.17238       11.13573      396.9994 16.62447  367.0822 22.87949  29.91724       28.28152  
1 1 1 15 2  3  o 258.2057 11.66806  44.64567       4.004187      46.61948       6.520198      43.45052       5.073649      262.8349 18.73970  254.2897 15.04050  8.545197       24.02900  
1 1 1 15 2  4  o 578.5412 15.34457  224.3435       11.81895      233.4645       14.87979      208.7527       19.45407      589.2678 18.97479  554.8097 26.39001  34.45813       32.50347  
1 1 1 15 2  5  o 237.9007 10.93522  37.88940       3.457271      35.66582       4.610474      40.74608       5.225769      230.2867 15.10805  246.0717 16.02447  -15.78496      22.02355  
1 1 1 15 2  6  o 175.2294 12.18162  20.62544       2.826658      16.28606       8.692793      21.13853       2.989102      150.9692 41.78965  177.3400 12.73389  -26.37079      43.68669  
1 1 1 15 2  7  o 387.4139 16.45030  100.8111       8.472916      106.6131       17.91455      99.13929       9.616484      393.1692 34.54509  383.6945 18.86648  9.474670       39.36124  
1 1 1 15 2  8  f 137.4347 14.91046  12.79853       2.686920      12.84857       3.431893      12.71928       4.319014      136.9345 19.34652  135.1022 24.90849  1.832306       31.53920  
1 1 1 15 2  9  o 392.3352 27.93123  105.0916       14.50679      0.000000       0.000000      105.0916       14.50679      ?        ?         392.3352 27.93123  0.000000       27.93123  
1 1 1 15 2  10 o 699.8481 17.07499  328.9349       15.92347      353.4458       28.48033      317.7885       19.20579      719.0807 29.78758  686.1738 21.02992  32.90692       36.46310  
1 1 1 15 2  11 o 21.15130 9.277443  -0.1297992     0.5012739     1.223046       0.6603330     -1.969641      0.7700682     42.08842 11.46545  17.13352 8.529603  24.95490       14.29023  
1 1 1 15 2  12 o 445.5454 13.72716  133.2167       8.140062      140.8109       15.73852      130.4433       9.510965      453.8695 26.13362  440.2466 16.24052  13.62286       30.76882  
1 1 1 15 2  13 o 281.1378 13.28773  53.12893       4.963782      43.80522       6.853591      63.41562       7.198823      253.6236 20.45272  306.2010 17.71905  -52.57744      27.06064  
1 1 1 15 2  14 o 306.6782 9.628844  62.97934       3.929996      70.05029       6.009097      57.69440       5.195055      322.5662 14.01375  292.8274 13.34900  29.73880       19.35409  
1 1 1 15 2  15 o 224.7416 5.429996  33.70286       1.626134      33.08221       1.754398      37.48789       4.332515      222.5526 5.921176  235.6521 13.85852  -13.09949      15.07046  
1 1 1 15 2  16 o 334.6861 10.28965  75.17268       4.583484      74.29745       5.438676      77.31799       8.514840      332.2153 12.30698  336.5166 19.06676  -4.301361      22.69368  
1 1 1 15 2  17 o 482.5935 9.155211  156.0707       5.887398      153.0773       6.615969      167.4605       12.90528      477.5439 10.39697  494.4290 19.62700  -16.88507      22.21071  
1 1 1 15 2  18 o 319.4225 6.158602  68.18507       2.621326      68.29881       2.947865      67.75529       5.730140      319.5615 6.922766  316.2766 13.62840  3.284821       15.28588  
1 1 1 15 2  19 o 25.23298 10.27274  0.1652169      0.5428317     -0.3506969     0.7061532     0.9104757      0.8487189     23.66447 10.65405  38.65887 13.45002  -14.99440      17.15843  
1 1 1 15 2  20 o 48.53642 11.45579  1.653854       0.7289133     1.423369       1.145092      1.810871       0.9451287     46.82895 15.63624  50.77930 13.66791  -3.950348      20.76785  
1 1 1 15 2  21 o 107.4306 3.597534  7.709800       0.5142726     8.025123       1.156109      7.632014       0.5742118     109.0525 8.011829  106.8498 4.040246  2.202690       8.972903  
1 1 1 15 2  22 o 49.49495 12.51202  1.730561       0.8255062     4.678946       1.183022      -1.067462      1.152462      82.42323 11.04942  27.38492 12.78869  55.03830       16.90090  
1 1 1 15 2  23 o 133.7129 6.882191  12.03557       1.222109      11.84103       1.277447      14.13615       4.197669      132.5482 7.260344  138.0215 23.67581  -5.473267      24.76402  
1 1 1 15 2  24 o 107.4543 10.54980  7.936439       1.491122      8.022271       3.250043      7.913553       1.678172      102.0396 24.26012  106.8257 11.99634  -4.786087      27.06410  
1 1 1 15 2  25 o 227.7330 8.251969  35.19589       2.499991      34.18959       3.025073      37.36380       4.440094      223.3840 10.18956  230.3110 14.54210  -6.927002      17.75668  
1 1 1 15 2  26 o 87.98453 11.39020  5.450229       1.304092      6.376764       2.227909      4.967312       1.608431      91.41297 18.91422  82.26307 15.23407  9.149902       24.28631  
1 1 1 15 2  27 o 96.68230 7.927043  6.427955       1.012289      2.853497       2.911076      6.919637       1.079669      62.32511 24.30191  100.2454 8.152960  -37.92027      25.63306  
1 1 1 15 2  28 o 26.33204 12.29863  -0.8332425     1.066409      0.6601138      3.310505      -1.006145      1.126454      52.19166 23.31526  26.40621 12.43044  25.78545       26.42191  
1 1 1 15 2  29 o 71.53146 21.67107  4.562572       2.243422      6.086106       3.091707      2.868284       3.260362      78.42915 25.67324  59.60239 24.81074  18.82676       35.70277  
1 1 1 15 2  30 o 36.55001 17.15261  -1.083631      2.116147      -4.096375      4.105782      0.6190277E-02  2.469406      42.63973 20.94050  43.12314 19.61732  -0.4834137     28.69397  
1 1 1 15 2  31 o 50.27986 18.73892  2.122591       1.681616      -0.3409288     3.743980      2.745173       1.882149      47.07692 22.31093  55.18600 19.94628  -8.109085      29.92710  
1 1 1 15 3  0  o 792.6215 18.36781  420.8291       19.37626      420.8291       19.37626      420.8291       19.37626      792.6215 18.36781  792.6215 18.36781  0.000000       0.000000  
1 1 1 15 3  1  o 443.1700 9.353017  131.1101       5.523262      124.0467       11.48167      133.2367       6.300109      429.0829 20.13741  446.6269 10.58595  -17.54395      22.75033  
1 1 1 15 3  2  o 176.9108 14.39840  21.08593       3.364914      18.79269       3.810488      29.20734       7.170865      166.4883 17.43428  206.0885 26.74224  -39.60022      31.92337  
1 1 1 15 3  3  o 249.8777 12.10038  41.83447       4.017048      32.89952       5.653056      50.94805       5.709290      220.4447 19.44374  275.3380 15.62531  -54.89325      24.94413  
1 1 1 15 3  4  o 534.2174 26.11506  193.5051       18.53380      185.6027       29.91936      198.4256       23.60906      515.0361 44.01698  538.1854 33.08088  -23.14929      55.06213  
1 1 1 15 3  5  o 723.3567 12.63690  349.8861       12.18054      337.0143       15.14107      373.4962       20.50622      709.1451 16.02315  744.8220 20.68141  -35.67682      26.16223  
1 1 1 15 3  6  o 427.1747 8.868106  121.8009       5.047890      120.1705       5.595657      128.9263       11.69822      424.2106 9.899108  437.3843 20.12559  -13.17374      22.42837  
1 1 1 15 3  7  o 329.7617 13.07354  72.85851       5.733309      82.56196       12.26241      70.14384       6.485895      348.1273 26.63636  323.2459 15.09959  24.88141       30.61851  
1 1 1 15 3  8  o 256.5285 16.62132  44.32542       5.651065      45.99943       7.553994      42.19799       8.515801      260.3110 21.98292  248.2759 26.13191  12.03510       34.14858  
1 1 1 15 3  9  o 323.0629 13.66759  70.00077       5.870436      67.45861       7.125524      75.37184       10.35729      316.5638 16.95388  333.1539 23.48110  -16.59012      28.96198  
1 1 1 15 3  10 o 299.9730 10.99677  60.23810       4.388188      59.00177       5.956011      61.70604       6.489987      296.2447 15.13818  302.7906 16.14360  -6.545990      22.13099  
1 1 1 15 3  11 o 200.7570 6.070322  26.90754       1.622022      24.09127       2.321259      29.59477       2.267457      189.6851 9.211221  210.3906 8.103115  -20.70547      12.26813  
1 1 1 15 3  12 o 428.0956 10.77952  122.6724       6.144238      118.2661       6.690394      146.4030       15.52637      420.1050 11.96363  463.0135 25.26102  -42.90845      27.95081  
1 1 1 15 3  13 o 447.6817 8.853603  133.9447       5.281568      132.5512       6.163986      137.7935       10.24399      445.0871 10.39305  451.8738 17.04345  -6.786774      19.96233  
1 1 1 15 3  14 o 95.83035 6.371856  6.156896       0.8090376     6.194969       0.8578807     5.850817       2.432410      96.09179 6.742677  91.08775 20.53281  5.004044       21.61157  
1 1 1 15 3  15 o 152.2452 4.698070  15.47588       0.9519552     16.54554       1.013122      7.411317       2.781822      157.4139 4.835715  102.4791 21.07547  54.93482       21.62313  
1 1 1 15 3  16 o 338.8839 10.53287  77.11270       4.750547      78.58276       5.561676      73.14646       9.135412      341.6408 12.23670  326.2392 21.12810  15.40161       24.41585  
1 1 1 15 3  17 o 213.0740 8.174060  30.43671       2.316517      35.98254       2.988746      22.09195       3.666169      231.4163 9.713781  179.9438 15.43888  51.47250       18.24052  
1 1 1 15 3  18 o 174.0313 1.792195  20.18428       0.4156103     20.11059       0.4197686     23.84842       2.960023      173.7128 1.813446  187.7395 11.89334  -14.02676      12.03080  
1 1 1 15 3  19 o 167.6267 9.163028  18.92417       2.038924      18.41965       2.377813      20.32542       3.962771      165.0079 10.87495  171.3542 17.60540  -6.346298      20.69335  
1 1 1 15 3  20 o 110.7712 5.888857  8.228246       0.8661003     10.90537       1.282379      5.982865       1.174429      127.3257 7.592831  93.84249 9.523660  33.48323       12.17995  
1 1 1 15 3  21 o 51.11863 11.61875  1.837851       0.7734188     -0.2644813     1.194256      3.356520       1.015029      32.56433 14.30054  69.58846 11.33617  -37.02413      18.24868  
1 1 1 15 3  22 o 135.2466 3.851946  12.22219       0.6934854     12.75533       1.328264      12.02241       0.8131056     137.6677 7.266401  134.0581 4.558402  3.609589       8.577855  
1 1 1 15 3  23 o 190.4411 2.777464  24.19532       0.7048272     23.48557       3.663860      24.22259       0.7182426     183.6917 15.10166  190.5438 2.828804  -6.852081      15.36432  
1 1 1 15 3  24 o 195.9796 1.870605  25.60853       0.4885022     26.13517       2.407845      25.58592       0.4988770     196.0997 9.240626  195.8899 1.911208  0.2097473      9.436201  
1 1 1 15 3  25 o 127.3661 9.175499  11.10096       1.546809      10.58609       2.193820      11.60996       2.181271      122.4213 13.68208  128.6573 12.89707  -6.236031      18.80249  
1 1 1 15 3  26 o 30.16469 13.14127  -0.7924595E-01 0.9909270     0.9197681      2.821359      -0.2198234     1.058353      53.11736 22.64450  30.18799 13.35110  22.92938       26.28735  
1 1 1 15 3  27 o 82.72025 7.145827  4.690224       0.7799428     3.180199       2.453578      4.859960       0.8226107     63.28399 22.78683  84.12545 7.414052  -20.84146      23.96264  
1 1 1 15 3  28 o 160.7093 7.250390  17.71763       1.548660      18.79071       3.604174      17.47465       1.715057      155.0093 17.77006  159.0222 8.120591  -4.012924      19.53763  
1 1 1 15 3  29 o 41.31004 19.72288  -2.023981      3.036532      -0.3236276     3.335954      -10.24076      7.333331      47.76885 22.11998  49.37195 24.82871  -1.603100      33.25295  
1 1 1 15 3  30 o 38.81625 18.01736  -0.6847248     2.233316      9.524274       4.753451      -3.576625      2.529933      84.42377 31.49729  33.36739 16.39703  51.05639       35.50974  
1 1 1 15 3  31 o 35.33513 17.21984  -2.703203      2.621305      -0.2358067E-01 6.144393      -3.299412      2.898288      53.61197 26.17857  36.01584 17.66845  17.59613       31.58309  
1 1 1 15 4  0  o 880.1291 18.59152  518.7943       21.78197      518.7943       21.78197      518.7943       21.78197      880.1291 18.59152  880.1291 18.59152  0.000000       0.000000  
1 1 1 15 4  1  o 512.3906 14.11739  175.8376       9.629750      179.2252       12.84697      171.4933       14.54819      516.2969 18.70449  504.2286 21.70332  12.06836       28.65121  
1 1 1 15 4  2  f 112.9803 13.97990  8.670351       2.059791      8.670351       2.059791      0.000000       0.000000      112.9803 13.97990  ?        ?         0.000000       13.97990  
1 1 1 15 4  3  o 534.7336 24.24278  193.4194       17.22910      265.3713       34.01185      168.5831       19.98263      617.9393 41.54725  497.0183 30.31638  120.9209       51.43206  
1 1 1 15 4  4  o 197.4722 10.79278  26.12711       2.829168      27.96009       3.168179      18.91102       6.286111      204.2059 11.69195  164.4286 29.78646  39.77731       31.99898  
1 1 1 15 4  5  o 194.4694 7.634724  25.26967       1.974574      27.51200       4.514015      24.73909       2.195797      201.8403 16.93961  192.3393 8.589097  9.500992       18.99270  
1 1 1 15 4  6  o 540.9269 12.81299  195.7031       9.235547      196.3844       12.89797      194.9862       13.23045      540.5804 17.93036  538.5108 18.46501  2.069641       25.73819  
1 1 1 15 4  7  f 153.7114 6.319853  15.78377       1.291693      17.37137       4.869446      15.66360       1.339686      158.7067 23.75500  153.1068 6.581890  5.599884       24.64998  
1 1 1 15 4  8  o 354.5102 8.906259  83.95673       4.203911      98.27843       10.41018      81.16612       4.595264      381.4708 20.55560  348.4543 9.906772  33.01648       22.81835  
1 1 1 15 4  9  o 109.4539 18.33414  8.267411       2.579540      8.602513       3.283818      7.727439       4.168466      110.8479 22.98685  104.8689 28.90378  5.979065       36.92999  
1 1 1 15 4  10 o 514.5814 18.03417  178.3219       12.34673      170.4912       16.58371      188.0604       18.49386      500.7119 24.93382  525.2528 26.50892  -24.54095      36.39256  
1 1 1 15 4  11 o 813.5343 23.58872  449.3464       25.54436      435.9326       34.31847      466.0104       38.25099      794.6809 32.47713  819.2795 35.11937  -24.59863      47.83444  
1 1 1 15 4  12 o 262.2368 9.559839  46.03234       3.334957      47.37180       3.817223      41.71333       6.854493      265.8602 10.79755  247.3679 20.99307  18.49231       23.60712  
1 1 1 15 4  13 o 282.9336 5.670569  53.40672       2.137887      51.06661       2.436868      61.22645       4.454618      276.5988 6.611624  302.1685 11.08215  -25.56967      12.90456  
1 1 1 15 4  14 o 146.7195 1.749394  14.34443       0.3420181     14.33345       0.3436102     15.52187       3.556935      146.6632 1.758213  150.4138 18.11056  -3.750641      18.19570  
1 1 1 15 4  15 o 288.1986 6.876888  55.48568       2.640933      51.77370       2.931356      71.48328       6.085456      278.1602 7.916661  325.4526 14.06561  -47.29242      16.14047  
1 1 1 15 4  16 o 99.50694 5.924005  6.635393       0.7819375     6.495875       0.7969858     10.22562       4.042942      98.43353 6.106294  119.1189 26.18588  -20.68533      26.88842  
1 1 1 15 4  17 f 391.9799 9.968595  103.1933       5.202580      106.4455       6.883963      98.86176       7.944616      396.9956 13.03071  381.4272 15.66437  15.56845       20.37577  
1 1 1 15 4  18 o 45.29913 14.59350  1.358024       1.001207      1.001257       1.031233      7.218320       4.179498      41.40722 14.78914  99.35138 29.46037  -57.94416      32.96410  
1 1 1 15 4  19 o 234.7075 7.964042  36.97149       2.487164      38.18903       3.605079      35.86561       3.435789      237.6419 11.41802  230.3395 11.22781  7.302475       16.01358  
1 1 1 15 4  20 o 165.7712 5.955179  18.40339       1.313322      20.51135       1.783373      15.90559       1.941295      174.7303 7.678253  153.4583 9.540720  21.27197       12.24667  
1 1 1 15 4  21 o 111.3019 5.489194  8.304515       0.8116015     5.929050       1.062017      11.63949       1.258355      93.51854 8.619272  131.5563 7.205756  -38.03780      11.23454  
1 1 1 15 4  22 o 50.04207 13.88259  1.767499       0.9581556     3.427376       2.257660      1.402847       1.058181      69.30966 21.86877  45.86929 15.01999  23.44038       26.53005  
1 1 1 15 4  23 o 153.1418 4.246258  15.68739       0.8656735     16.07628       2.992675      15.65188       0.9043344     151.6818 15.00282  152.9397 4.442176  -1.257904      15.64664  
1 1 1 15 4  24 o 128.7267 9.690694  11.32872       1.650048      11.96447       1.919916      9.532063       3.227534      131.8220 11.03107  112.0757 22.39539  19.74632       24.96474  
1 1 1 15 4  25 o 160.4800 2.322416  17.18446       0.4966316     20.41849       2.761758      17.07639       0.5048615     171.1838 12.18706  159.9698 2.368431  11.21400       12.41507  
1 1 1 15 4  26 o 46.74924 17.42501  1.372402       1.454143      1.308764       2.270339      1.416668       1.893511      51.48817 20.99103  49.83535 19.55042  1.652817       28.68523  
1 1 1 15 4  27 o 95.77201 11.90395  6.575097       1.486466      7.716800       5.665926      6.490707       1.540424      84.30466 33.58271  94.81763 12.49595  -10.51297      35.83221  
1 1 1 15 4  28 o 42.11003 14.18085  1.280474       0.9416536     3.473104       2.359727      0.8651823      1.026965      63.51178 22.40247  38.03889 14.53918  25.47289       26.70690  
1 1 1 15 4  29 o 29.07400 13.62593  -0.9667960     1.327812      4.992313       4.370789      -1.572678      1.393680      68.56181 28.64773  27.52227 13.19947  41.03954       31.54232  
1 1 1 15 4  30 o 55.20794 16.02689  2.492605       1.248216      -1.996505      5.481172      2.738144       1.281898      50.95624 24.84750  57.81812 16.06426  -6.861877      29.58815  
1 1 1 15 4  31 o 27.81376 12.78664  -0.4646097     1.086084      1.055726       5.514129      -0.5259713     1.107785      54.00977 25.99359  27.77310 12.82041  26.23666       28.98326  
1 1 1 15 5  0  o 460.1239 16.75519  142.0629       10.24206      142.0629       10.24206      142.0629       10.24206      460.1239 16.75519  460.1239 16.75519  0.000000       0.000000  
1 1 1 15 5  1  o 72.08105 16.90763  3.623379       1.595732      5.969097       2.847000      2.548908       1.926847      92.30962 23.18098  62.54197 20.25347  29.76765       30.78248  
1 1 1 15 5  2  o 716.7377 9.578046  342.9798       9.147674      332.6306       15.48664      348.5257       11.33675      704.4010 16.49923  722.1238 11.78157  -17.72278      20.27388  
1 1 1 15 5  3  o 339.8646 14.81264  77.49230       6.692184      82.45768       8.524215      69.51522       10.80438      349.9731 18.34277  319.6325 25.58074  30.34064       31.47747  
1 1 1 15 5  4  o 363.8043 13.57907  88.68142       6.571260      93.36732       8.501451      81.72639       10.35728      372.6868 17.16498  347.4968 22.48848  25.19003       28.29078  
1 1 1 15 5  5  o 268.7318 10.56636  48.31672       3.776336      48.76417       4.491129      47.23697       6.976701      269.7478 12.52887  264.2890 19.95808  5.458801       23.56476  
1 1 1 15 5  6  o 23.95832 10.85187  -0.4333465     0.7456876     0.4747656E-01  2.164630      -0.4980897     0.7943063     46.88849 19.90623  24.47615 11.13119  22.41234       22.80705  
1 1 1 15 5  7  o 226.3693 4.730678  34.16066       1.426969      36.25781       3.484634      33.73812       1.564129      232.6340 11.27472  224.9511 5.218084  7.682922       12.42367  
1 1 1 15 5  8  o 346.1223 7.481787  79.93859       3.450710      81.31725       8.822351      79.68958       3.749409      347.1368 19.14677  345.5348 8.143246  1.601990       20.80652  
1 1 1 15 5  9  o 249.0540 17.87256  41.91531       5.891919      40.51752       11.46189      42.41731       6.868931      239.4174 37.12915  249.9300 20.81391  -10.51256      42.56515  
1 1 1 15 5  10 o 304.6446 10.19851  62.10558       4.134195      66.22400       8.949201      60.98822       4.661403      312.2640 21.64133  301.6921 11.61693  10.57190       24.56217  
1 1 1 15 5  11 o 492.2639 14.31950  162.7424       9.382913      158.9212       12.90402      167.0293       13.66778      484.6102 20.02606  496.5777 20.70098  -11.96750      28.80232  
1 1 1 15 5  12 o 138.9516 5.731445  12.90231       1.058932      13.07564       1.205528      12.31680       2.215655      139.8253 6.487891  134.9903 12.45806  4.834976       14.04621  
1 1 1 15 5  13 o 301.3185 5.780199  60.58295       2.320823      61.80565       2.628986      56.26543       4.940215      304.2847 6.483875  289.2460 12.84962  15.03864       14.39283  
1 1 1 15 5  14 o 162.6559 1.930889  17.63062       0.4185050     17.65586       0.4210747     15.58193       3.793971      162.7721 1.941358  150.2953 19.39592  12.47676       19.49283  
1 1 1 15 5  15 f 476.1342 9.939672  151.9401       6.306304      151.7557       7.015529      152.7166       14.39333      475.5073 11.07209  470.8241 23.01159  4.683228       25.53673  
1 1 1 15 5  16 o 271.3130 7.745218  49.28564       2.797261      49.71639       3.030105      46.80167       7.276489      272.3873 8.358176  260.2840 21.16221  12.10330       22.75298  
1 1 1 15 5  17 o 46.90392 13.83368  1.511862       0.9235877     1.666725       0.9436007     -2.023267      4.508342      48.99476 13.84414  58.98767 26.70417  -9.992912      30.07945  
1 1 1 15 5  18 o 438.8033 10.22429  129.4957       5.978286      130.6304       7.058833      126.6168       11.24338      439.7627 12.05733  428.0595 19.76483  11.70319       23.15227  
1 1 1 15 5  19 o 254.4517 6.477263  43.34930       2.194407      45.63956       2.427671      33.12028       5.130555      260.9875 6.986947  218.8306 17.74691  42.15689       19.07277  
1 1 1 15 5  20 o 110.5852 5.698265  8.199262       0.8368474     8.298663       0.9651944     7.898283       1.679522      111.1445 6.546070  107.3850 11.93890  3.759483       13.61574  
1 1 1 15 5  21 o 138.2926 8.392324  12.90483       1.539237      16.80233       3.534651      11.99277       1.709878      154.9155 17.42474  133.0086 9.714416  21.90691       19.94972  
1 1 1 15 5  22 o 302.1955 10.39382  61.92906       4.179168      66.72663       9.210745      60.68535       4.689685      303.7122 22.92866  298.3784 11.81851  5.333771       25.79536  
1 1 1 15 5  23 o 26.02153 11.42680  -0.1684259     0.7624280     2.401107       1.211771      -1.852198      0.9809232     57.73121 15.44867  21.19179 10.37171  36.53942       18.60736  
1 1 1 15 5  24 o 17.21941 8.562037  -1.875533      0.7665070     0.5013726      1.607859      -2.574600      0.8719696     42.15202 17.47438  17.13619 8.610088  25.01583       19.48044  
1 1 1 15 5  25 o 126.0019 7.520033  10.79095       1.256869      7.505357       2.279644      12.22591       1.506536      100.4994 17.66734  133.7895 8.494390  -33.29010      19.60330  
1 1 1 15 5  26 o 50.08971 15.01555  1.849720       1.081164      4.986456       3.567503      1.532491       1.134519      76.17916 27.47075  46.53127 15.56439  29.64789       31.57360  
1 1 1 15 5  27 o 31.05239 13.27855  0.1163517      0.9754640     -5.766095      7.904613      0.2073187      0.9829774     58.60552 28.83563  31.87727 13.46834  26.72825       31.82592  
1 1 1 15 5  28 o 52.09097 18.21241  2.109472       1.557220      -3.577200      3.193453      3.883489       1.783653      39.25231 19.10131  68.38681 18.92958  -29.13450      26.89218  
1 1 1 15 5  29 o 86.05723 13.00078  5.549642       1.444397      8.979603       5.807499      5.323483       1.491256      79.56635 33.11654  83.64535 13.86466  -4.079002      35.90173  
1 1 1 15 5  30 o 69.34095 15.62851  3.890490       1.409376      4.005593       6.040213      3.883863       1.449384      62.04874 29.07419  68.92064 16.07782  -6.871895      33.22356  
1 1 1 15 5  31 o 25.81286 12.55141  -1.839758      1.371495      -5.205665      5.206563      -1.588789      1.421707      44.00810 21.95167  27.23833 13.13173  16.76977       25.57964  
1 1 1 15 6  0  o 759.2985 3.894098  384.2193       3.939737      384.2193       3.939737      384.2193       3.939737      759.2985 3.894098  759.2985 3.894098  0.000000       0.000000  
1 1 1 15 6  1  o 394.6016 11.30851  104.1361       5.940045      105.7831       7.335231      100.9985       10.12431      397.3357 13.87554  387.1207 19.69131  10.21506       24.08897  
1 1 1 15 6  2  o 506.6058 11.12609  171.4894       7.510798      153.7978       12.52398      181.4260       9.385975      477.8982 19.70909  520.5415 13.54315  -42.64328      23.91370  
1 1 1 15 6  3  o 735.4433 15.03292  362.2979       14.73215      366.2645       21.49043      358.7811       20.23500      736.9378 21.90903  729.7889 20.82941  7.148865       30.23028  
1 1 1 15 6  4  o 414.9244 16.64318  115.6544       9.183258      124.1443       16.11446      111.5711       11.17552      426.5930 28.51208  406.6081 20.69420  19.98492       35.23050  
1 1 1 15 6  5  o 200.6740 7.171425  26.89864       1.914570      0.000000       0.000000      26.89864       1.914570      ?        ?         200.6740 7.171425  0.000000       7.171425  
1 1 1 15 6  6  o 557.6172 9.141318  207.6109       6.792327      190.7911       13.28245      213.5669       7.903964      532.3997 18.75192  565.3666 10.49159  -32.96692      21.48739  
1 1 1 15 6  7  o 347.3060 6.367955  80.45332       2.947038      77.30348       6.829640      81.17400       3.266829      339.2438 15.14638  348.8164 7.028394  -9.572601      16.69764  
1 1 1 15 6  8  o 762.1742 21.52499  392.4953       21.83914      419.2574       37.13198      378.3419       27.00349      778.2258 35.90384  745.1843 27.24044  33.04150       45.06803  
1 1 1 15 6  9  o 467.9828 15.09391  147.0992       9.400192      149.1720       11.88826      143.6411       15.35508      470.1676 19.01467  459.1609 25.19308  11.00674       31.56341  
1 1 1 15 6  10 o 447.4758 16.87355  134.8913       10.04317      146.0508       13.10020      118.9817       15.64176      464.1725 21.23622  416.0131 28.38670  48.15942       35.45111  
1 1 1 15 6  11 f 157.8750 8.282578  16.69507       1.736323      17.52667       2.528194      15.95265       2.388795      161.3333 11.84267  153.8934 11.73747  7.439911       16.67384  
1 1 1 15 6  12 o 186.3208 7.446220  23.22151       1.844995      23.65588       2.398683      22.59223       2.887116      187.8119 9.616664  183.2083 11.89044  4.603622       15.29257  
1 1 1 15 6  13 o 214.8389 6.239116  30.83645       1.784224      30.67123       1.970230      31.58963       4.206577      214.1952 6.911984  216.1181 14.69450  -1.922882      16.23896  
1 1 1 15 6  14 o 463.9108 7.492424  143.8423       4.631592      144.0539       5.134185      142.9177       10.73347      464.0848 8.302343  458.8408 17.58771  5.244019       19.44882  
1 1 1 15 6  15 o 209.0048 1.152035  29.10673       0.3208452     29.11097       0.3212124     27.25841       6.711753      209.0200 1.153270  196.4075 26.30595  12.61244       26.33122  
1 1 1 15 6  16 o 129.3348 6.080783  11.19964       1.045035      11.13167       1.112381      11.71054       3.049710      128.8961 6.497457  129.8632 18.11617  -0.9671631     19.24611  
1 1 1 15 6  17 o 349.4892 8.878380  81.96751       4.131324      82.22809       4.321683      79.20363       14.07503      349.9296 9.276454  329.3636 32.49287  20.56595       33.79111  
1 1 1 15 6  18 o 49.93085 13.49994  1.746318       0.9195534     1.882381       0.9386768     -1.491333      4.578898      51.75733 13.47917  60.69234 27.24315  -8.935009      30.39535  
1 1 1 15 6  19 o 183.8622 5.779339  22.62513       1.414180      22.71387       1.445249      20.62750       6.857123      184.2060 5.895561  164.9133 32.36039  19.29269       32.89305  
1 1 1 15 6  20 o 220.7786 9.018314  32.84452       2.647530      34.20871       3.407995      30.76806       4.204594      224.5689 11.42630  211.5742 15.01127  12.99471       18.86527  
1 1 1 15 6  21 o 132.7600 9.747085  11.95889       1.712291      7.611487       3.107077      13.85510       2.052016      101.2713 23.48210  142.6466 10.87761  -41.37527      25.87917  
1 1 1 15 6  22 o 73.16570 12.68104  3.757997       1.191555      8.234023       3.259184      3.067414       1.280178      104.5311 23.91789  65.41083 15.00680  39.12024       28.23596  
1 1 1 15 6  23 o 246.3135 6.770868  40.83022       2.220209      40.35281       2.855918      41.55949       3.529752      244.0314 8.797064  246.6361 10.76618  -2.604706      13.90320  
1 1 1 15 6  24 o 54.49685 18.08820  2.093134       1.532852      1.690015       1.697372      3.875431       3.569035      51.64784 18.90108  73.13083 27.29086  -21.48299      33.19702  
1 1 1 15 6  25 o 19.16164 9.513703  -2.184098      0.9326754     1.067152       2.793952      -2.591839      0.9894321     53.87877 22.73236  18.96709 9.477660  34.91168       24.62897  
1 1 1 15 6  26 o 82.05260 28.32286  6.174301       3.760216      7.795667       6.241196      5.250406       4.711273      86.02408 34.90255  76.64930 30.59330  9.374779       46.41269  
1 1 1 15 6  27 o 29.53075 13.31519  -0.3650330     1.107738      1.876354       2.602168      -0.8611133     1.224202      54.49727 22.37462  28.52445 13.27397  25.97282       26.01580  
1 1 1 15 6  28 o 91.13165 5.980858  5.671951       0.7222695     8.232162       3.752180      5.573436       0.7360346     88.72186 28.21741  90.26823 6.155970  -1.546379      28.88110  
1 1 1 15 6  29 o 56.01942 26.05570  1.190064       4.707576      4.134021       4.917910      -31.03516      16.27094      64.32874 28.59728  55.37596 28.54694  8.952782       40.40709  
1 1 1 15 6  30 o 43.05965 15.47044  1.405040       1.130217      -5.324059      6.338820      1.625990       1.148622      48.32076 24.12131  45.42659 15.65493  2.894169       28.75612  
1 1 1 15 6  31 o 27.88074 12.16074  0.5067450E-01  0.8507279     7.321883       7.705679      -0.3904611E-01 0.8559604     63.77738 30.70301  27.26933 12.03594  36.50805       32.97785  
1 1 1 15 7  0  o 244.0012 14.86403  40.21148       4.791324      40.21148       4.791324      40.21148       4.791324      244.0012 14.86403  244.0012 14.86403  0.000000       0.000000  
1 1 1 15 7  1  o 211.3855 10.13306  29.91361       2.845919      28.13461       4.251547      31.35788       3.830741      204.2828 15.73987  216.0672 13.37067  -11.78444      20.65232  
1 1 1 15 7  2  o 264.4317 7.817767  46.69824       2.751646      46.15414       5.002023      46.93434       3.295012      262.1454 14.37458  264.9655 9.347059  -2.820129      17.14632  
1 1 1 15 7  3  o 516.2338 10.20333  178.0190       7.018781      181.3943       9.343326      173.6472       10.63346      520.4282 13.48445  508.7137 15.70537  11.71445       20.69998  
1 1 1 15 7  4  o 348.1781 11.37422  81.12300       5.270032      83.02468       10.64117      80.50500       6.066218      349.9282 22.94775  346.5923 13.15877  3.335907       26.45283  
1 1 1 15 7  5  o 283.0680 6.229345  53.44070       2.349669      62.46708       12.31510      53.09970       2.393641      300.8649 31.16896  282.1570 6.366410  18.70795       31.81250  
1 1 1 15 7  6  o 254.2398 3.533130  43.08055       1.196952      0.000000       0.000000      43.08055       1.196952      ?        ?         254.2398 3.533130  0.000000       3.533130  
1 1 1 15 7  7  o 348.5579 7.766607  81.08870       3.607279      87.41308       4.467352      69.23866       6.115065      361.6411 9.278069  321.0905 14.32833  40.55069       17.06996  
1 1 1 15 7  8  o 74.50656 8.440406  3.754033       0.8232323     8.343151       2.899455      3.351646       0.8585657     109.4426 20.63849  70.20741 9.414412  39.23518       22.68432  
1 1 1 15 7  9  o 451.9623 12.50447  136.9297       7.523560      169.0078       17.46528      129.6209       8.336719      497.0632 26.46418  439.3220 14.25983  57.74121       30.06153  
1 1 1 15 7  10 o 67.33402 23.00350  2.847280       2.478591      3.110635       3.740179      2.641060       3.309683      75.51602 27.98406  70.50860 26.28686  5.007423       38.39410  
1 1 1 15 7  11 o 158.6496 10.53596  16.92126       2.214721      16.92126       2.214721      0.000000       0.000000      158.6496 10.53596  ?        ?         0.000000       10.53596  
1 1 1 15 7  12 o 262.3979 7.252093  46.02415       2.533265      44.66375       3.214513      48.25371       4.115222      258.2057 9.358250  268.0196 11.54978  -9.813873      14.86520  
1 1 1 15 7  13 o 443.0424 8.864290  131.3375       5.233144      130.1896       5.944303      135.2924       11.03340      440.8171 10.11973  446.0741 18.60300  -5.256958      21.17736  
1 1 1 15 7  14 o 86.47622 2.732107  4.989657       0.3144290     5.001991       0.3164108     4.014312       2.813812      86.58250 2.745978  76.69173 24.44063  9.890778       24.59441  
1 1 1 15 7  15 o 214.3042 2.221375  30.60942       0.6343459     30.53080       0.6378946     37.61682       6.022225      214.0283 2.236682  233.7696 19.51057  -19.74132      19.63836  
1 1 1 15 7  16 f 337.9714 12.21226  77.10081       5.490791      73.21064       8.843641      79.54111       7.004364      325.5243 20.49195  341.9845 15.41012  -16.46017      25.63965  
1 1 1 15 7  17 o 101.3149 4.957001  6.870404       0.6671842     6.879162       0.6712466     6.153397       6.073517      101.3771 4.984277  96.99352 35.71056  4.383583       36.05672  
1 1 1 15 7  18 o 118.5182 6.372768  9.423865       1.002736      9.731501       1.034634      4.664202       4.069643      120.4298 6.471085  83.47055 29.42199  36.95924       30.12521  
1 1 1 15 7  19 o 164.3034 10.25168  18.26609       2.233293      17.60172       2.361963      23.87027       6.860017      161.0702 11.07222  178.8542 29.83440  -17.78404      31.82271  
1 1 1 15 7  20 o 334.5014 7.662733  75.10667       3.415506      75.58488       4.092861      74.00977       6.198709      334.9022 9.180057  328.8196 14.18052  6.082550       16.89262  
1 1 1 15 7  21 o 112.6385 15.38909  8.894341       2.249457      12.10410       3.575082      6.790829       2.894161      128.9925 21.55960  95.49348 23.01635  33.49900       31.53679  
1 1 1 15 7  22 o 72.07901 13.82939  3.690326       1.279969      5.549383       2.659827      3.130074       1.460154      85.72884 22.86432  65.67087 16.66203  20.05797       28.29135  
1 1 1 15 7  23 o 144.3308 7.501965  14.09007       1.437853      13.74717       1.797036      14.70020       2.397086      141.8989 9.559741  145.5487 12.47986  -3.649811      15.72055  
1 1 1 15 7  24 o 183.8499 7.774694  22.93844       1.900372      24.77804       3.360004      22.07319       2.304350      187.7043 13.52425  179.4494 9.672548  8.254959       16.62719  
1 1 1 15 7  25 o 49.43982 19.95150  1.224044       2.027037      1.206806       3.092516      1.237029       2.684017      55.81840 23.74885  53.64052 22.43378  2.177876       32.66929  
1 1 1 15 7  26 o 24.03608 11.53994  -1.395236      1.071735      6.234041       5.494576      -1.696978      1.092723      79.13447 32.50381  23.21395 11.26823  55.92052       34.40162  
1 1 1 15 7  27 o 81.08997 26.06130  6.298105       3.194287      5.070418       3.365498      17.45167       10.14408      72.70369 26.61348  94.14876 41.49942  -21.44507      49.29988  
1 1 1 15 7  28 o 53.79746 17.60330  2.330196       1.453598      3.173160       4.955876      2.250850       1.520472      63.07230 28.32445  53.00782 18.01872  10.06448       33.57005  
1 1 1 15 7  29 o 43.59830 19.57662  0.3059735      2.366584      6.555404       6.574617      -0.6242973     2.536617      68.95967 31.61270  41.23101 19.15998  27.72866       36.96576  
1 1 1 15 7  30 f 49.81098 18.88538  2.058888       1.723971      4.694266       6.377771      1.851149       1.790630      61.78527 29.23362  48.36847 19.00081  13.41680       34.86596  
1 1 1 15 8  0  o 34.12686 21.23114  0.5026223      1.947249      0.5026223      1.947249      0.5026223      1.947249      34.12686 21.23114  34.12686 21.23114  0.000000       0.000000  
1 1 1 15 8  1  o 268.1402 11.75135  48.16903       4.188584      49.72680       6.911486      47.26480       5.265745      271.2123 19.24953  265.1508 14.96441  6.061462       24.38192  
1 1 1 15 8  2  o 443.8810 9.941337  131.6194       5.880102      134.2546       10.82978      130.5178       7.002117      446.5543 18.23840  441.6084 11.91009  4.945862       21.78278  
1 1 1 15 8  3  o 522.9678 10.22198  182.7386       7.123336      192.1168       11.93110      177.5441       8.879618      534.6791 16.76683  514.8775 12.95274  19.80157       21.18727  
1 1 1 15 8  4  o 332.4876 10.37506  73.94704       4.591003      77.34646       8.778198      72.66710       5.386400      338.3668 19.55229  329.3298 12.29581  9.036987       23.09716  
1 1 1 15 8  5  o 422.1873 5.335665  118.8539       3.001700      0.000000       0.000000      118.8539       3.001700      ?        ?         422.1873 5.335665  0.000000       5.335665  
1 1 1 15 8  6  o 279.2709 11.63885  52.26833       4.321718      0.000000       0.000000      52.26833       4.321718      ?        ?         279.2709 11.63885  0.000000       11.63885  
1 1 1 15 8  7  o 499.1516 14.05862  167.2035       9.341485      170.4610       13.60400      164.2972       12.84993      502.0168 20.37880  493.1213 19.59472  8.895508       28.27099  
1 1 1 15 8  8  o 276.9613 9.230917  51.31753       3.401968      51.68951       4.262452      50.66476       5.646492      277.6444 11.54638  274.1672 15.51911  3.477173       19.34326  
1 1 1 15 8  9  o 110.6050 12.79498  8.309278       1.851031      5.727042       2.382544      12.24117       2.939977      90.26231 20.30231  133.7954 16.86419  -43.53307      26.39289  
1 1 1 15 8  10 o 417.1878 12.74786  116.8731       7.078355      131.8266       10.88409      105.9132       9.317995      441.2018 18.55461  395.6749 17.71795  45.52686       25.65540  
1 1 1 15 8  11 o 422.5511 9.542409  119.4780       5.372926      116.6384       7.301223      122.8322       7.935241      416.4807 13.17267  427.1664 13.95960  -10.68579      19.19348  
1 1 1 15 8  12 o 121.8890 11.93431  10.06745       1.913551      7.290368       2.506465      13.94764       2.962743      102.0332 19.13799  142.8903 15.82525  -40.85710      24.83347  
1 1 1 15 8  13 o 141.2180 2.928615  13.29381       0.5510942     13.28297       0.5609673     13.59377       2.950347      141.1590 2.982327  140.8897 15.99813  0.2692871      16.27374  
1 1 1 15 8  14 o 297.3877 5.010018  59.02451       1.985344      59.45351       2.099026      55.38278       6.115695      298.4385 5.278244  285.3553 16.14964  13.08319       16.99031  
1 1 1 15 8  15 o 178.9485 3.681940  21.35756       0.8779674     21.43683       0.8838853     15.49742       7.599820      179.2794 3.699917  141.9204 38.99240  37.35899       39.16755  
1 1 1 15 8  16 o 222.2186 2.003168  32.91207       0.5931591     32.81277       0.5952960     46.66937       7.006807      221.8827 2.013428  259.2919 20.44482  -37.40927      20.54372  
1 1 1 15 8  17 o 118.8687 6.117729  9.472920       0.9657565     9.467520       0.9812426     9.639985       5.457464      118.8224 6.218979  112.7930 33.71794  6.029388       34.28666  
1 1 1 15 8  18 o 152.6169 6.063231  15.60395       1.230594      15.66699       1.278064      14.80227       4.557648      152.8940 6.286601  142.7150 24.86958  10.17896       25.65185  
1 1 1 15 8  19 o 320.8411 10.02620  69.47846       4.281209      69.74021       4.790337      68.43973       9.542867      320.9262 11.21904  309.8552 23.28277  11.07098       25.84481  
1 1 1 15 8  20 o 244.5312 8.069613  40.24189       2.625822      40.84908       3.083643      38.64027       5.008224      245.9243 9.427451  236.1748 16.00851  9.749481       18.57819  
1 1 1 15 8  21 o 219.0477 10.54557  32.62565       3.069055      36.24832       4.384539      29.14559       4.297371      228.9336 14.44645  204.3920 15.90357  24.54158       21.48542  
1 1 1 15 8  22 o 140.5146 8.892021  13.41477       1.656388      13.94174       1.711708      5.655133       6.568413      143.2199 9.014911  89.60488 36.00084  53.61503       37.11239  
1 1 1 15 8  23 o 90.71909 17.57664  6.061041       2.048001      6.462103       2.165204      2.654456       6.310345      93.52789 18.02695  76.83995 33.32150  16.68793       37.88526  
1 1 1 15 8  24 o 50.28391 14.34187  1.842112       1.007926      1.955688       3.565744      1.832249       1.050780      62.22304 25.92774  50.18781 14.74312  12.03523       29.82629  
1 1 1 15 8  25 o 22.17442 10.89011  -2.112518      1.110565      0.6641642      2.827323      -2.619091      1.207628      51.32466 22.28020  22.15551 10.96946  29.16915       24.83417  
1 1 1 15 8  26 o 21.78580 10.33767  -0.8920261     0.8086497     1.305586       2.335667      -1.191322      0.8619581     50.41387 20.99385  21.33082 10.26883  29.08305       23.37073  
1 1 1 15 8  27 f 79.07036 12.05329  4.582017       1.229868      6.999412       3.928138      4.319294       1.294976      81.04863 28.87321  76.02718 13.26480  5.021454       31.77447  
1 1 1 15 8  28 o 105.0713 5.949891  7.544511       0.8296375     11.40641       5.444941      7.452722       0.8394390     91.30596 33.77752  104.3790 6.061428  -13.07304      34.31707  
1 1 1 15 8  29 o 50.43711 23.80001  0.5443075E-01  4.174620      -3.528012      6.894680      2.127981       5.245438      52.24548 25.92721  57.59279 27.02063  -5.347313      37.44776  
1 1 1 15 8  30 o 16.10058 8.002456  -1.526518      0.6668748     3.371875       4.864373      -1.620345      0.6732314     58.12234 26.84247  15.90667 7.927919  42.21567       27.98875  
1 1 1 15 9  0  o 172.0984 17.70271  20.43732       3.952798      20.43732       3.952798      20.43732       3.952798      172.0984 17.70271  172.0984 17.70271  0.000000       0.000000  
1 1 1 15 9  1  o 296.2922 13.18948  58.90215       5.194355      63.15420       8.266822      56.12825       6.677058      305.3631 20.43409  288.4532 17.45311  16.90985       26.87309  
1 1 1 15 9  2  o 269.1555 6.284223  48.32339       2.253867      48.39777       3.055755      48.23465       3.337784      269.0958 8.532720  268.5576 9.341336  0.5381470      12.65179  
1 1 1 15 9  3  o 292.9089 7.054736  57.24882       2.753511      47.08175       6.439423      59.52376       3.046030      263.8457 18.43161  298.5335 7.663493  -34.68777      19.96130  
1 1 1 15 9  4  o 255.4755 5.165368  43.52197       1.758425      39.94608       3.861781      44.45730       1.975054      244.0245 11.91228  258.1805 5.740929  -14.15598      13.22349  
1 1 1 15 9  5  o 472.2876 5.593244  148.7666       3.520009      0.000000       0.000000      148.7666       3.520009      ?        ?         472.2876 5.593244  0.000000       5.593244  
1 1 1 15 9  6  o 310.8179 10.96185  64.71523       4.532970      141.2828       21.15304      61.02987       4.640779      449.4256 35.61262  301.7339 11.56373  147.6917       37.44300  
1 1 1 15 9  7  f 267.5507 11.47765  48.01472       4.082455      45.55235       7.079694      49.24139       4.996908      258.6226 20.71662  270.5327 13.90811  -11.91019      24.95223  
1 1 1 15 9  8  o 184.1828 8.192654  22.70741       2.005667      17.87507       4.232441      24.10682       2.277642      161.2973 20.12891  189.6909 9.036826  -28.39363      22.06439  
1 1 1 15 9  9  o 261.3211 7.391996  45.64482       2.571420      44.08555       4.285925      46.52176       3.214181      256.0265 12.60151  263.5951 9.164751  -7.568573      15.58174  
1 1 1 15 9  10 o 214.1162 11.41323  30.82541       3.244589      32.61457       3.504215      20.07581       8.589390      220.1574 11.99020  164.3426 39.67677  55.81482       41.44889  
1 1 1 15 9  11 o 292.4310 7.574256  57.19225       2.948976      57.25121       4.112933      57.12986       4.230515      292.0563 10.58597  291.6809 10.90378  0.3753662      15.19721  
1 1 1 15 9  12 o 90.46530 4.338065  5.471403       0.5214157     5.457991       0.5286605     5.950716       3.160378      90.34931 4.404423  91.30215 25.16833  -0.9528351     25.55081  
1 1 1 15 9  13 o 168.8736 8.238817  19.13263       1.848364      19.11275       2.126864      19.19398       3.736229      168.5934 9.505794  167.2940 16.99588  1.299408       19.47357  
1 1 1 15 9  14 o 293.5007 9.910567  57.88351       3.870418      57.71483       4.486065      58.37470       7.655007      292.6362 11.52695  291.0806 19.85486  1.555603       22.95835  
1 1 1 15 9  15 o 148.7520 4.213779  14.77635       0.8343920     14.71882       0.8559755     15.87406       3.739209      148.4522 4.331774  150.9935 19.00440  -2.541245      19.49183  
1 1 1 15 9  16 o 109.3580 2.466459  7.972491       0.3594165     7.959896       0.3599176     12.48727       6.814350      109.2715 2.471854  126.7969 37.62205  -17.52541      37.70317  
1 1 1 15 9  17 o 57.11132 7.783712  2.226357       0.5769551     2.233755       0.5809637     1.695759       4.919939      57.20026 7.827240  73.41399 30.51226  -16.21373      31.50021  
1 1 1 15 9  18 o 47.63062 13.91609  1.575685       0.9383957     1.502353       0.9544793     3.696781       5.133337      46.73746 14.13029  82.04111 32.18849  -35.30365      35.15343  
1 1 1 15 9  19 o 81.13216 14.46647  4.630389       1.506606      3.960772       1.729978      6.732764       3.065369      74.16720 17.74316  95.17293 24.13885  -21.00573      29.95836  
1 1 1 15 9  20 o 151.4616 9.760490  15.57069       1.959429      14.12599       2.381193      18.60050       3.448363      143.3507 12.59370  163.1680 16.06831  -19.81732      20.41548  
1 1 1 15 9  21 o 351.5076 9.737925  83.83126       4.556759      80.69492       5.270685      93.11327       9.067266      343.6255 11.52718  361.6651 18.88003  -18.03958      22.12084  
1 1 1 15 9  22 o 100.3750 15.01925  7.184337       1.947197      6.629645       2.132742      9.962568       4.773060      95.30304 17.43650  108.5896 31.28550  -13.28658      35.81639  
1 1 1 15 9  23 o 146.2021 14.19644  15.16033       2.730934      16.33164       2.929856      7.402578       7.540109      151.4617 14.70146  91.71788 37.91498  59.74387       40.66545  
1 1 1 15 9  24 o 71.03285 14.69700  3.722564       1.345204      10.41972       3.150316      2.229139       1.487648      115.2117 21.30486  54.92838 17.79680  60.28329       27.76010  
1 1 1 15 9  25 o 41.39957 14.00519  1.193485       0.9184741     -4.179327      2.842564      1.819814       0.9705337     36.22620 17.71416  49.42586 14.06551  -13.19966      22.61924  
1 1 1 15 9  26 o 69.06326 13.87835  3.590135       1.232838      2.736917       3.048659      3.756938       1.347970      60.02591 24.37921  70.11678 14.88790  -10.09087      28.56564  
1 1 1 15 9  27 f 114.1759 8.499341  9.101954       1.283828      10.46747       6.584873      9.047998       1.308946      84.18861 35.16896  113.7092 8.704974  -29.52055      36.23027  
1 1 1 15 9  28 o 71.18481 5.798133  3.474275       0.5452237     -0.7900921     5.051098      3.524547       0.5484280     52.50931 25.16863  71.70422 5.789036  -19.19491      25.82582  
1 1 1 15 9  29 o 31.95204 14.06705  0.5051705E-01  1.162285      -7.732761      6.411949      0.3149514      1.181865      46.10516 23.18995  33.94297 14.56735  12.16219       27.38579  
1 1 1 15 10 0  o 409.2491 23.81209  113.7647       12.88402      113.7647       12.88402      113.7647       12.88402      409.2491 23.81209  409.2491 23.81209  0.000000       0.000000  
1 1 1 15 10 1  o 158.8356 21.66123  17.37328       4.465293      17.60034       5.672224      17.00325       7.240963      158.3021 27.90968  153.5219 36.02031  4.780197       45.56768  
1 1 1 15 10 2  o 367.5348 8.061183  90.20029       3.947942      93.60891       6.439521      88.14754       4.997264      373.5368 12.95701  362.9220 10.34401  10.61478       16.57958  
1 1 1 15 10 3  o 432.3792 8.039365  124.8435       4.631909      137.0091       7.796321      118.2069       5.758357      451.9501 12.95909  420.4251 10.27866  31.52502       16.54052  
1 1 1 15 10 4  o 554.0101 11.25980  205.4399       8.312311      236.0914       32.43465      203.2852       8.599510      575.2413 42.61684  550.9930 11.71262  24.24829       44.19706  
1 1 1 15 10 5  o 494.8864 4.520778  163.3031       2.981207      152.4724       12.09128      164.0041       3.076175      474.6883 19.15505  495.9358 4.654919  -21.24747      19.71254  
1 1 1 15 10 6  o 180.0784 6.122811  21.66329       1.467080      0.000000       0.000000      21.66329       1.467080      ?        ?         180.0784 6.122811  0.000000       6.122811  
1 1 1 15 10 7  o 236.2126 9.605874  37.38569       3.017218      31.97040       9.171031      38.04296       3.195082      211.6691 33.63956  238.2146 10.08845  -26.54559      35.11975  
1 1 1 15 10 8  o 39.10835 18.12543  -1.877963      2.247223      -7.925653      3.413946      2.745935       2.985149      37.04184 18.35821  69.10516 25.09982  -32.06332      31.09703  
1 1 1 15 10 9  o 136.6061 7.795961  12.51262       1.413209      13.00522       2.065042      12.07869       1.938147      138.8102 11.26099  133.7871 10.96794  5.023102       15.71959  
1 1 1 15 10 10 o 151.4730 5.570442  15.33420       1.122427      13.34537       1.508684      17.79967       1.679765      141.0410 8.061051  162.9892 7.756470  -21.94820      11.18675  
1 1 1 15 10 11 o 235.5712 5.636061  37.04675       1.769178      35.84127       1.900394      44.88281       4.845226      231.5805 6.163882  257.5608 14.17222  -25.98026      15.45462  
1 1 1 15 10 12 f 282.8248 5.890939  53.42095       2.220115      52.37724       2.476423      57.69454       5.011065      279.9586 6.638311  292.3316 12.89588  -12.37302      14.50416  
1 1 1 15 10 13 o 74.51102 3.928431  3.713594       0.3886655     3.801195       0.3916036     -2.058901      3.178873      75.38837 3.911619  47.87554 21.96008  27.51283       22.30574  
1 1 1 15 10 14 f 126.9132 5.861235  10.78525       0.9885420     10.91400       1.007631      7.483442       5.102756      127.6615 5.939640  101.7378 32.96033  25.92376       33.49124  
1 1 1 15 10 15 o 292.9979 6.167414  57.40003       2.407915      57.15469       2.580980      59.04755       6.688347      292.2911 6.626671  293.2191 17.19345  -0.9279785     18.42627  
1 1 1 15 10 16 o 198.3548 17.92815  27.27197       4.687512      25.75510       6.006907      29.63408       7.495958      189.6976 24.32272  201.0330 28.80448  -11.33543      37.70004  
1 1 1 15 10 17 o 308.4977 5.350967  63.61339       2.199671      63.30850       2.289786      67.25977       7.918748      307.7133 5.584382  310.7993 19.21461  -3.085999      20.00967  
1 1 1 15 10 18 o 180.5865 8.888585  21.99735       2.132333      22.20499       2.261795      20.33776       6.394422      181.3096 9.393826  163.4913 30.47249  17.81825       31.88756  
1 1 1 15 10 19 o 126.8288 6.182603  10.80262       1.041723      10.67957       1.087047      12.18667       3.645633      126.0512 6.493730  129.3157 21.94008  -3.264465      22.88090  
1 1 1 15 10 20 o 63.74749 15.97576  2.934588       1.354209      4.254834       1.695994      0.6121554      2.249410      76.61147 17.05226  49.28387 20.56904  27.32760       26.71825  
1 1 1 15 10 21 o 93.36334 11.61755  6.056602       1.414144      5.882660       1.486838      7.706083       4.578629      91.70492 12.49183  96.72411 31.21219  -5.019188      33.61914  
1 1 1 15 10 22 o 83.37304 17.45847  5.148136       1.877293      4.587119       1.960629      11.32992       6.508250      77.97805 19.03751  108.9704 37.27428  -30.99234      41.85450  
1 1 1 15 10 23 o 153.9130 20.04771  17.98128       4.014007      18.89262       4.437775      13.88148       9.412505      155.9951 21.95584  106.7596 43.02483  49.23547       48.30315  
1 1 1 15 10 24 o 116.4156 15.46343  9.999605       2.339511      12.08476       3.365843      8.050574       3.254122      123.2186 21.26795  96.82643 25.03716  26.39220       32.85095  
1 1 1 15 10 25 f 68.04613 15.89779  3.572232       1.415367      2.490935       3.829490      3.743309       1.523223      61.67967 26.34076  69.24461 16.70277  -7.564941      31.19003  
1 1 1 15 10 26 f 65.80236 17.09739  3.475004       1.512574      0.9928277      7.707381      3.574432       1.542571      64.23631 30.86800  66.66564 17.23810  -2.429337      35.35513  
1 1 1 15 10 27 o 99.95449 6.689111  6.872818       0.8858030     8.932757       4.845156      6.801586       0.9009883     83.96728 31.69978  99.35880 6.847043  -15.39152      32.43082  
1 1 1 15 10 28 o 28.25481 12.37412  -0.6148664E-02 0.8886923     -8.197248      4.569408      0.3158628      0.9059922     39.13765 19.67085  31.08700 13.01984  8.050657       23.58937  
1 1 1 15 10 29 o 80.15473 13.06599  4.948187       1.347520      4.163007       5.944648      4.990717       1.383534      60.52979 28.51291  80.22054 13.41628  -19.69075      31.51162  
1 1 1 15 11 0  o 331.0787 38.31729  77.89808       16.31572      77.89808       16.31572      77.89808       16.31572      331.0787 38.31729  331.0787 38.31729  0.000000       0.000000  
1 1 1 15 11 1  o 71.00135 19.96035  3.506386       1.966703      1.125154       3.586317      4.530476       2.351890      64.43111 26.33880  80.34133 21.53269  -15.91022      34.02042  
1 1 1 15 11 2  o 204.0317 4.169541  27.75518       1.133599      25.57036       4.628564      27.89459       1.169207      193.8092 18.13302  204.5392 4.289841  -10.73007      18.63355  
1 1 1 15 11 3  o 259.0451 3.040311  44.72622       1.049463      44.08652       2.847656      44.82675       1.128923      256.7290 8.335182  259.3284 3.266938  -2.599335      8.952550  
1 1 1 15 11 4  o 240.0521 8.372126  38.55654       2.673927      39.90668       6.186028      38.24631       2.965255      242.0451 19.34049  238.9607 9.330340  3.084381       21.47347  
1 1 1 15 11 5  f 183.0987 4.771299  22.37473       1.163122      11.44350       3.460656      23.76679       1.234964      128.2147 20.98068  188.7026 4.915555  -60.48788      21.54882  
1 1 1 15 11 6  f 476.4411 11.98807  152.3782       7.604785      0.000000       0.000000      152.3782       7.604785      ?        ?         476.4411 11.98807  0.000000       11.98807  
1 1 1 15 11 7  o 48.91112 21.24641  -0.3346204     2.574522      0.000000       0.000000      -0.3346204     2.574522      ?        ?         48.91112 21.24641  0.000000       21.24641  
1 1 1 15 11 8  o 298.1446 16.57392  60.30389       6.558632      57.38475       10.87415      61.97300       8.222593      285.6394 28.96978  300.7895 20.64015  -15.15012      35.57055  
1 1 1 15 11 9  f 74.08125 8.627748  3.721789       0.8357649     4.563682       0.9990458     1.758885       1.525479      82.03275 9.303645  52.89750 18.04714  29.13524       20.30412  
1 1 1 15 11 10 o 227.0217 6.236865  34.45110       1.884932      36.10183       2.752191      32.99272       2.586875      232.0090 8.918868  221.8033 8.769820  10.20567       12.50824  
1 1 1 15 11 11 o 187.6677 3.728861  23.48828       0.9324793     23.96178       1.018219      21.02661       2.321642      189.5340 4.031627  176.7643 9.896114  12.76978       10.68584  
1 1 1 15 11 12 o 172.8236 1.777811  19.90475       0.4094136     19.84187       0.4127886     23.70303       3.208226      172.5500 1.795309  186.9652 12.95764  -14.41519      13.08142  
1 1 1 15 11 13 o 31.11218 13.14761  0.6217091E-01  0.9370129     0.4230447E-01  0.9741328     0.3080439      3.426995      31.53239 13.36899  58.66877 24.98222  -27.13638      28.33445  
1 1 1 15 11 14 o 256.6440 8.081113  44.19545       2.760160      44.64883       3.161269      42.74120       5.661764      257.6850 9.221457  249.3284 17.14583  8.356537       19.46831  
1 1 1 15 11 15 o 279.1395 7.346444  52.23571       2.730199      52.41682       2.888067      50.71370       8.372459      279.5236 7.761327  267.4374 23.74044  12.08612       24.97692  
1 1 1 15 11 16 o 78.00259 6.497809  4.100735       0.6692536     4.133132       0.6736412     1.638049       5.873318      78.30989 6.514574  77.81582 32.90191  0.4940720      33.54065  
1 1 1 15 11 17 o 138.7179 2.172837  12.82818       0.4016365     12.81677       0.4033518     14.16191       4.359679      138.6557 2.183095  139.0843 24.41365  -0.4285583     24.51107  
1 1 1 15 11 18 o 237.8348 10.79145  38.39143       3.411110      38.69854       3.857852      37.29102       7.302590      238.1839 12.19573  225.9480 24.65417  12.23586       27.50571  
1 1 1 15 11 19 o 138.3845 11.05175  13.10026       2.021020      12.06839       2.427747      15.42954       3.647561      131.7330 14.04686  146.7092 19.11219  -14.97617      23.71898  
1 1 1 15 11 20 o 71.60403 21.52154  3.816434       2.218866      6.212758       4.201999      2.889898       2.612850      88.75185 29.95616  65.36182 23.51737  23.39003       38.08462  
1 1 1 15 11 21 o 218.4363 8.238153  32.36139       2.393586      32.25431       3.006356      32.54679       3.955909      216.9258 10.43111  215.6434 13.83998  1.282379       17.33070  
1 1 1 15 11 22 o 37.24354 16.03608  0.7929709E-01  1.441069      0.2659784      1.596795      -0.7401904     3.345568      40.11999 17.06729  50.63886 22.95633  -10.51888      28.60569  
1 1 1 15 11 23 o 56.25451 22.17426  1.983162       2.446012      0.7623590      2.766078      6.361514       5.238380      51.60188 22.21775  82.70739 32.49626  -31.10551      39.36540  
1 1 1 15 11 24 o 74.94868 6.980422  3.855359       0.6891234     8.529265       3.198513      3.627839       0.7056970     99.06171 24.39495  72.55254 7.403115  26.50918       25.49353  
1 1 1 15 11 25 o 133.0901 8.137826  12.25836       1.436305      6.556089       5.990944      12.60610       1.479452      75.98666 32.70702  134.8886 8.270753  -58.90196      33.73654  
1 1 1 15 11 26 o 36.00174 16.16380  -0.2082724     1.612870      3.013221       3.556411      -1.042399      1.809670      60.79253 25.64821  34.33321 16.03089  26.45931       30.24599  
1 1 1 15 11 27 o ?        ?         -1.794259      0.2736741     -7.480711      4.133495      -1.769222      0.2742759     38.09212 19.08388  ?        ?         0.000000       19.08388  
1 1 1 15 11 28 o 58.42274 13.25452  2.662383       1.008087      -0.5652068     6.978668      2.731167       1.018772      55.08065 27.09989  59.19691 13.24673  -4.116253      30.16421  
1 1 1 15 12 0  o 393.3622 22.67032  105.3658       11.79187      105.3658       11.79187      105.3658       11.79187      393.3622 22.67032  393.3622 22.67032  0.000000       0.000000  
1 1 1 15 12 1  o 191.6269 3.750783  24.48223       0.9577493     15.88813       5.803131      24.72287       0.9710656     148.7353 30.31004  192.5652 3.784403  -43.82985      30.54538  
1 1 1 15 12 2  o 86.70262 2.072594  5.009559       0.2394528     3.293332       2.919168      5.021185       0.2402625     72.30323 24.95527  86.80313 2.077194  -14.49990      25.04157  
1 1 1 15 12 3  o 183.9297 8.029788  22.65552       1.963278      18.37743       3.113358      25.47981       2.529640      164.6278 14.33509  194.8483 9.774117  -30.22052      17.35016  
1 1 1 15 12 4  o 217.3600 6.945566  31.58840       2.009106      34.09195       4.110988      30.80282       2.302851      224.6885 13.79721  214.5048 8.071058  10.18364       15.98452  
1 1 1 15 12 5  o 341.3995 3.949191  77.72065       1.796572      112.4673       17.18354      77.33663       1.806473      398.3990 32.65467  340.5527 3.980829  57.84631       32.89643  
1 1 1 15 12 6  o 179.1368 9.652500  21.55554       2.295574      19.67467       4.190780      22.36182       2.743833      169.1330 18.91858  182.1853 11.35891  -13.05223      22.06666  
1 1 1 15 12 7  o 84.68068 32.29092  3.840035       5.058026      0.000000       0.000000      3.840035       5.058026      ?        ?         84.68068 32.29092  0.000000       32.29092  
1 1 1 15 12 8  o 61.85839 12.17894  2.661544       0.9681315     2.902523       1.015152      0.2395572      3.218306      64.65511 12.23085  57.09052 24.25623  7.564590       27.16539  
1 1 1 15 12 9  o 179.5655 6.924167  21.58582       1.653672      19.77298       2.028236      25.18048       2.856063      171.5741 8.901864  193.2645 11.13744  -21.69034      14.25784  
1 1 1 15 12 10 o 222.9159 5.640825  33.20737       1.674203      32.19385       1.820156      38.77751       4.267039      219.4123 6.231811  239.2773 13.43693  -19.86493      14.81170  
1 1 1 15 12 11 o 88.55240 3.250952  5.235989       0.3829540     5.189556       0.3892421     6.638391       2.139158      88.15421 3.319555  97.33838 17.11704  -9.184174      17.43596  
1 1 1 15 12 12 o 102.5909 1.920284  7.014590       0.2625111     7.065892       0.2650802     4.406324       1.890105      102.9651 1.932029  78.65003 18.36900  24.31510       18.47033  
1 1 1 15 12 13 o 228.8572 9.111619  35.22725       2.773094      35.14671       3.295577      35.42259       5.132315      228.1417 10.87189  226.8344 17.10578  1.307266       20.26834  
1 1 1 15 12 14 o 169.2791 6.032444  19.18776       1.358549      19.12142       1.461871      19.60798       3.678998      168.9168 6.506923  168.4226 16.60882  0.4942780      17.83796  
1 1 1 15 12 15 o 131.7735 5.399471  11.62644       0.9460886     11.56474       0.9558477     14.60174       6.637717      131.4142 5.470457  135.8782 36.06474  -4.463959      36.47728  
1 1 1 15 12 16 o 140.8694 5.568796  13.29337       1.043266      13.11104       1.053689      22.37269       7.435486      139.8853 5.664557  169.2045 34.15643  -29.31921      34.62295  
1 1 1 15 12 17 f 219.9323 3.503421  32.28378       1.026726      32.11091       1.033570      45.20839       8.936788      219.3390 3.536312  246.2574 27.71512  -26.91844      27.93982  
1 1 1 15 12 18 o 202.4095 7.863027  27.61936       2.116739      28.10639       2.401514      25.92342       4.481426      203.8687 8.861341  191.5671 17.75797  12.30162       19.84613  
1 1 1 15 12 19 o 30.39739 13.78356  -0.6161500     1.207008      -1.463686      1.369320      2.336605       2.555874      28.77338 13.59357  61.50665 23.06573  -32.73326      26.77337  
1 1 1 15 12 20 o 114.1603 6.633826  8.802382       1.004796      8.946305       1.070051      7.729164       2.922012      115.0011 7.016174  100.2916 22.42788  14.70952       23.49971  
1 1 1 15 12 21 o 170.9578 6.766466  19.75932       1.538387      20.53411       2.499853      19.28705       1.951718      172.2912 10.94533  168.0849 8.744009  4.206299       14.00921  
1 1 1 15 12 22 o 21.07478 9.085153  -0.2585247E-01 0.4636180     1.133846       1.613143      -0.1302669     0.4840393     45.90166 18.03372  20.45392 9.038339  25.44774       20.17192  
1 1 1 15 12 23 o 88.24929 8.413369  5.389372       0.9774020     3.100015       3.065409      5.648458       1.031226      63.75726 24.91542  90.25609 8.681359  -26.49883      26.38454  
1 1 1 15 12 24 f 78.79919 11.84487  4.506610       1.205283      6.009094       4.218116      4.373031       1.257721      76.83572 29.44160  77.16241 12.67169  -0.3266907     32.05276  
1 1 1 15 12 25 o 89.65086 14.93270  6.137249       1.721165      8.896361       5.157320      5.791430       1.825845      84.83504 32.54261  85.81104 16.56786  -0.9760056     36.51733  
1 1 1 15 12 26 o 44.31440 20.96109  -1.299771      3.274357      -1.299771      3.274357      0.000000       0.000000      44.31440 20.96109  ?        ?         0.000000       20.96109  
1 1 1 15 12 27 o 82.20621 17.70225  5.662571       1.881746      3.133844       4.894136      6.101250       2.038443      59.61165 27.30779  84.49822 18.60825  -24.88657      33.04515  
1 1 1 15 12 28 o 43.14376 17.16636  1.289329       1.478779      2.281586       5.892731      1.222641       1.527664      57.05257 27.30302  42.86788 17.31293  14.18468       32.32943  
1 1 1 15 13 0  o 277.2565 6.939165  51.38306       2.560044      51.38306       2.560044      51.38306       2.560044      277.2565 6.939165  277.2565 6.939165  0.000000       0.000000  
1 1 1 15 13 1  o 266.4496 3.409606  47.33315       1.210578      39.83542       5.258317      47.75279       1.243994      242.1166 16.39524  267.6239 3.488348  -25.50731      16.76223  
1 1 1 15 13 2  o 127.4296 5.811503  10.86279       0.9842098     12.34185       3.864617      10.76020       1.017768      132.4089 22.72149  126.8046 6.040753  5.604301       23.51078  
1 1 1 15 13 3  o 425.3635 11.21302  121.5425       6.350054      122.0484       10.06278      121.2077       8.185725      423.5997 17.86756  423.6071 14.52323  -0.7415771E-02 23.02551  
1 1 1 15 13 4  o 284.8548 7.246893  54.27213       2.748502      62.05513       4.332182      49.02893       3.555753      303.9260 10.71384  270.2778 9.889643  33.64819       14.58052  
1 1 1 15 13 5  o 127.8442 10.28940  11.03269       1.738056      14.91093       3.353094      9.607859       2.032405      147.2079 17.43178  118.7469 13.05975  28.46098       21.78128  
1 1 1 15 13 6  o 116.3007 12.76849  9.215858       1.946268      11.46639       3.253608      7.961826       2.428718      128.1695 19.67844  106.8774 17.67063  21.29210       26.44792  
1 1 1 15 13 7  o 87.28507 18.49366  5.384893       2.084023      0.000000       0.000000      5.384893       2.084023      ?        ?         87.28507 18.49366  0.000000       18.49366  
1 1 1 15 13 8  o 103.4858 7.748876  7.206946       1.060787      7.752819       1.562678      6.740434       1.444625      106.8117 11.14306  99.52724 11.08045  7.284431       15.71446  
1 1 1 15 13 9  o 263.1138 8.554811  46.44258       2.995366      48.07187       3.739025      43.52365       5.004632      267.2284 10.52087  252.9308 14.91520  14.29761       18.25245  
1 1 1 15 13 10 o 97.81252 2.438284  6.377565       0.3177989     6.354796       0.3197875     8.191154       2.854041      97.60635 2.460687  107.2650 20.71778  -9.658691      20.86340  
1 1 1 15 13 11 o 29.28159 11.50574  0.3365169      0.6567297     0.1853790      0.6747402     3.054775       2.861510      27.88436 11.41471  69.55229 24.65701  -41.66793      27.17100  
1 1 1 15 13 12 o 164.5578 8.805783  18.23050       1.923869      17.84630       2.232121      19.34053       3.794048      162.4856 10.36332  167.1223 17.28631  -4.636765      20.15477  
1 1 1 15 13 13 o 107.7551 7.228702  7.813235       1.031934      9.737759       1.216601      2.877652       1.948300      120.2869 7.629567  64.47116 20.31173  55.81579       21.69739  
1 1 1 15 13 14 o 278.9760 7.729061  52.25090       2.870439      54.06166       3.319983      46.88963       5.712656      283.4543 8.800466  260.7255 16.52808  22.72888       18.72500  
1 1 1 15 13 15 o 181.6578 9.042921  22.27040       2.182071      22.30115       2.439094      22.14715       4.883551      181.4910 10.12570  176.2515 21.21999  5.239487       23.51208  
1 1 1 15 13 16 o 161.2363 7.098072  17.48138       1.521287      17.14958       1.630116      19.72037       4.234539      159.5687 7.689130  166.5661 19.44388  -6.997452      20.90902  
1 1 1 15 13 17 o 38.94649 12.07458  1.034425       0.6913927     1.152023       0.7092716     -1.210357      3.098853      40.78020 12.14705  48.84583 22.12361  -8.065624      25.23895  
1 1 1 15 13 18 f 221.6309 1.868778  32.74960       0.5519015     32.88165       0.5554767     22.59017       4.872253      222.0766 1.877110  175.4751 21.27105  46.60152       21.35372  
1 1 1 15 13 19 f 18.34526 8.492265  -0.4004829     0.4911060     -0.7758821     1.066661      -0.2994983     0.5532317     27.24688 12.57846  20.62542 9.344202  6.621458       15.66946  
1 1 1 15 13 20 o 106.1200 5.659663  7.592182       0.7974207     7.588921       1.319612      7.594058       1.000818      104.9796 9.537377  105.7674 7.143066  -0.7877655     11.91574  
1 1 1 15 13 21 o 67.25500 10.71756  3.199175       0.9282838     0.7212169      1.584037      4.495281       1.145614      42.73392 17.49108  79.82861 11.06707  -37.09469      20.69826  
1 1 1 15 13 22 o 105.2731 11.57127  7.870031       1.596469      5.241303       2.811698      9.120724       1.939417      77.99841 24.37631  112.4090 13.19898  -34.41064      27.72035  
1 1 1 15 13 23 o 104.0645 13.27602  7.929029       1.799096      1.131498       4.464550      9.246866       1.965771      58.86381 26.61833  112.3859 13.38945  -53.52209      29.79619  
1 1 1 15 13 24 o 45.87022 19.36242  0.9485703      2.028509      4.107762       3.582662      -0.5421028     2.460985      66.77275 26.66934  42.16568 19.33395  24.60707       32.94017  
1 1 1 15 13 25 o 80.93291 20.99874  5.743891       2.283799      6.266431       2.712512      4.471504       4.232739      81.79070 23.59088  66.66884 28.04586  15.12186       36.64833  
1 1 1 15 13 26 o 52.04189 24.71711  -0.1138606     4.643586      -0.1138606     4.643586      0.000000       0.000000      52.04189 24.71711  ?        ?         0.000000       24.71711  
1 1 1 15 13 27 o 40.92923 19.78748  -2.176996      3.283727      -0.9554697     3.617562      -7.894080      7.826216      45.34178 21.61432  49.50721 24.99120  -4.165428      33.04147  
1 1 1 15 14 0  o 70.93464 2.717302  3.368011       0.2559870     3.368011       0.2559870     3.368011       0.2559870     70.93464 2.717302  70.93464 2.717302  0.000000       0.000000  
1 1 1 15 14 1  o 220.2626 12.06285  32.74109       3.526982      30.22639       7.444121      33.46900       4.005042      206.0465 27.82319  222.3287 13.58363  -16.28224      30.96199  
1 1 1 15 14 2  o 155.1695 5.144540  16.08887       1.062248      19.30471       2.461087      15.35263       1.177584      169.1687 10.97703  151.5084 5.843820  17.66037       12.43565  
1 1 1 15 14 3  o 112.3636 13.66930  8.643074       2.004600      -1.801204      4.883225      10.75981       2.198371      62.54480 28.09948  125.6145 13.33732  -63.06966      31.10410  
1 1 1 15 14 4  f 235.3853 11.88521  37.38655       3.715797      38.03689       5.501309      36.84093       5.038941      235.6625 17.64685  232.3465 16.38031  3.316040       24.07750  
1 1 1 15 14 5  o 160.2621 4.849204  17.15821       1.034368      25.35166       7.353780      16.99283       1.044754      186.6349 30.63121  159.4807 4.922126  27.15422       31.02416  
1 1 1 15 14 6  o 165.5259 11.35003  18.52296       2.488286      23.55359       3.820492      14.81696       3.279149      185.6438 15.58803  146.5289 17.11646  39.11488       23.15080  
1 1 1 15 14 7  o 186.2144 8.120332  23.27253       2.010088      25.53605       3.857817      22.42901       2.355028      193.4061 15.08850  182.5131 9.718451  10.89297       17.94745  
1 1 1 15 14 8  o 197.9083 7.552352  26.26322       1.988026      24.82342       2.657188      28.09388       2.996234      191.8388 10.43398  203.9683 11.06544  -12.12950      15.20895  
1 1 1 15 14 9  o 287.5317 7.087460  55.33733       2.715501      51.73329       3.101825      67.16272       5.618621      277.6296 8.394156  314.6251 13.43271  -36.99548      15.83981  
1 1 1 15 14 10 o 214.1896 1.837285  30.57614       0.5243828     30.70077       0.5288634     23.31422       4.037000      214.6252 1.849223  183.9110 16.65350  30.71417       16.75585  
1 1 1 15 14 11 o 68.26099 2.609019  3.111189       0.2368771     3.108944       0.2374011     3.617941       3.567024      68.23595 2.615779  75.72585 27.44687  -7.489906      27.57124  
1 1 1 15 14 12 o 352.8727 13.61213  84.78545       6.388554      92.66634       8.184861      72.49865       10.21981      366.8989 16.78586  318.9014 24.23126  47.99750       29.47744  
1 1 1 15 14 13 o 130.6465 6.657898  11.46216       1.155245      11.66016       1.210507      9.440915       3.867624      131.7316 6.920375  112.4275 26.28898  19.30409       27.18460  
1 1 1 15 14 14 o 103.7950 13.35571  7.460458       1.804449      7.298292       2.296773      7.721968       2.916626      101.2732 17.66150  102.6698 21.98193  -1.396622      28.19812  
1 1 1 15 14 15 o 178.2857 9.005816  21.49131       2.132575      23.25748       2.515342      16.97641       4.021659      185.0959 10.23816  153.9202 20.08691  31.17567       22.54560  
1 1 1 15 14 16 o 77.27934 3.752789  3.998114       0.3852926     4.919142       1.098294      3.868858       0.4114411     84.65024 9.925084  75.98344 4.078585  8.666794       10.73043  
1 1 1 15 14 17 o 164.4475 4.125333  18.09167       0.9032682     16.95175       1.028819      21.92578       1.886830      159.0518 4.860006  180.1002 7.881302  -21.04840      9.259297  
1 1 1 15 14 18 o 83.77200 6.741313  4.756038       0.7461691     4.656078       0.7603176     7.367173       3.885931      82.83688 6.952154  94.63478 28.48937  -11.79790      29.32536  
1 1 1 15 14 19 o 122.3412 8.272314  10.21031       1.340639      10.63871       1.833997      9.718709       1.964640      123.6946 11.24985  117.4888 12.75345  6.205803       17.00616  
1 1 1 15 14 20 o 62.56483 9.819979  2.751437       0.7917503     2.544105       1.003869      3.092669       1.287859      59.04831 13.10107  64.45895 15.23615  -5.410645      20.09424  
1 1 1 15 14 21 o 91.97764 21.05174  6.844464       2.524247      4.490248       3.791485      8.718717       3.382987      72.46691 27.87582  100.2453 25.32212  -27.77841      37.65994  
1 1 1 15 14 22 o 48.92616 22.22906  -0.1632952     3.158256      -5.746592      10.95458      0.3428570      3.298306      65.17131 32.39904  51.46960 23.11109  13.70171       39.79724  
1 1 1 15 14 23 o 45.94175 19.77289  0.7523727      2.189149      0.9087226      2.580018      0.3504199      4.136772      49.02085 21.28177  54.35559 24.97619  -5.334747      32.81347  
1 1 1 15 14 24 o 63.11481 24.60423  3.610448       2.983409      4.693467       4.970362      3.000489       3.730100      67.86444 29.49986  60.85754 25.99336  7.006905       39.31790  
1 1 1 15 14 25 o 48.22899 21.29829  0.9847375      2.683696      1.886988       2.961793      -3.154262      6.343643      53.11489 22.93058  52.38649 25.78669  0.7283936      34.50747  
1 1 1 15 14 26 o 57.21671 26.37891  2.518682       4.668904      3.382297       4.965055      -4.079620      13.72398      59.71473 27.41065  59.22613 30.21433  0.4886055      40.79521  
1 1 1 15 15 0  o 193.1188 11.33579  25.23114       2.893876      25.23114       2.893876      25.23114       2.893876      193.1188 11.33579  193.1188 11.33579  0.000000       0.000000  
1 1 1 15 15 1  f 178.3028 1.473944  21.18539       0.3501971     21.22433       0.3529679     18.73434       2.800420      178.4664 1.484244  166.1242 12.74818  12.34221       12.83429  
1 1 1 15 15 2  o 399.0181 12.40669  107.5169       6.588614      107.1378       13.20068      107.6427       7.603380      390.0075 25.54148  398.3557 14.34736  -8.348145      29.29529  
1 1 1 15 15 3  o 377.2496 13.70465  96.42922       6.877777      98.87227       7.470669      82.84461       17.61641      381.5162 14.72275  328.6992 41.11725  52.81702       43.67365  
1 1 1 15 15 4  o 199.6344 11.95856  26.97013       3.166595      30.09435       4.343455      23.42561       4.626409      209.7985 15.64946  183.7419 19.17768  26.05664       24.75256  
1 1 1 15 15 5  o 281.3407 8.773799  53.14396       3.285206      52.64261       5.683330      53.39554       4.025954      277.8007 15.41352  281.4659 10.75398  -3.665161      18.79427  
1 1 1 15 15 6  o 111.0064 14.26936  8.490763       2.061935      8.806024       3.130083      8.249077       2.740609      110.8135 21.97415  107.8279 19.80359  2.985619       29.58117  
1 1 1 15 15 7  o 113.9962 7.721578  8.746194       1.166002      9.750718       1.862419      8.098644       1.495319      119.6233 11.83902  109.2149 10.40033  10.40843       15.75847  
1 1 1 15 15 8  o 100.5704 5.936461  6.785549       0.7920181     7.317508       0.8516607     3.381660       2.154344      104.4262 6.147653  69.43325 21.27678  34.99290       22.14712  
1 1 1 15 15 9  f 349.6799 7.953340  82.00220       3.705900      81.17601       4.128374      85.43040       8.409560      347.5096 8.922736  351.8066 17.99872  -4.296936      20.08903  
1 1 1 15 15 10 o 430.1120 9.109641  124.3831       5.221031      122.0535       5.750099      135.3233       12.46092      425.6048 10.13900  439.3332 21.34935  -13.72839      23.63460  
1 1 1 15 15 11 o 319.0842 10.80264  68.84934       4.586505      71.00195       6.752689      67.00581       6.249135      321.3575 15.81799  312.6246 15.04527  8.732941       21.83046  
1 1 1 15 15 12 o 271.8068 8.948050  49.78560       3.236457      49.14922       3.836982      51.35486       6.025303      269.4047 10.70970  272.3039 16.68560  -2.899200      19.82692  
1 1 1 15 15 13 o 120.8840 4.671158  9.781105       0.7510153     8.802067       1.020486      10.93787       1.109250      114.3733 6.725580  127.5692 6.547344  -13.19592      9.386221  
1 1 1 15 15 14 o 88.85163 6.622305  5.326046       0.7784193     6.561496       2.346021      5.173203       0.8251664     94.95964 19.20118  87.47112 7.141617  7.488518       20.48628  
1 1 1 15 15 15 o 52.58360 9.876109  1.933646       0.6666017     2.422552       1.074167      1.627435       0.8500981     58.13034 14.02909  47.87745 12.99510  10.25289       19.12296  
1 1 1 15 15 16 o 140.2172 6.733000  13.25642       1.254332      12.05579       1.568553      15.38606       2.089043      133.1075 8.894523  149.8456 10.52940  -16.73811      13.78335  
1 1 1 15 15 17 o ?        ?         -3.390330      0.8538072     -4.118125      0.9931425     -1.328691      1.671526      ?        ?         33.20213 15.47086  0.000000       15.47086  
1 1 1 15 15 18 o 106.3922 6.556046  7.664738       0.9249341     7.782252       0.9662853     6.379200       3.195963      107.1420 6.803320  88.00262 25.67342  19.13940       26.55955  
1 1 1 15 15 19 o 95.74125 12.76290  6.544950       1.587732      6.061510       1.734187      9.049927       3.947541      91.07013 14.79799  101.1755 28.21977  -10.10535      31.86434  
1 1 1 15 15 20 o 53.89898 11.11672  2.099743       0.7718980     2.264534       0.7912487     -1.146305      3.511760      56.06877 10.98362  48.93550 22.67246  7.133274       25.19286  
1 1 1 15 15 21 o 29.82689 12.96964  -0.1442731E-01 0.9613912     0.3227627E-01  0.9631854     -12.51583      15.75847      30.20338 13.05802  67.71600 34.32735  -37.51262      36.72708  
1 1 1 15 15 22 o 31.66337 15.01537  -1.519385      1.700874      -1.822589      1.719154      12.51107       11.69455      30.83492 14.75387  82.13210 39.07024  -51.29719      41.76315  
1 1 1 15 15 23 o 94.31587 24.82458  8.379382       3.161834      8.731478       3.432919      6.410430       8.118027      94.30875 26.32040  72.05668 33.74505  22.25207       42.79594  
1 1 1 15 15 24 o 40.19577 19.15753  -1.735157      2.839090      -2.734693      3.794431      -0.4638391     4.279317      43.63598 21.13794  50.65571 23.96126  -7.019733      31.95238  
1 1 1 15 15 25 o 48.51606 21.80423  0.9618981      2.943095      3.456956       3.190243      -13.29535      7.626079      59.60636 24.65347  45.81426 23.29168  13.79210       33.91602  
1 1 1 15 16 0  o 26.09246 17.16607  -0.2551590     1.515092      -0.2551590     1.515092      -0.2551590     1.515092      26.09246 17.16607  26.09246 17.16607  0.000000       0.000000  
1 1 1 15 16 1  o 184.9947 6.616388  22.92393       1.628373      20.54821       2.555619      24.54767       2.112794      174.2807 11.06165  191.1519 8.314671  -16.87119      13.83813  
1 1 1 15 16 2  o 140.5984 1.588341  13.17370       0.2975758     13.17984       0.2978224     9.473599       7.313266      140.6311 1.589287  113.2566 39.47691  27.37450       39.50889  
1 1 1 15 16 3  o 236.2039 15.67582  38.20085       4.905987      38.17438       5.263474      38.37608       13.54317      235.6212 16.87602  214.1663 48.57724  21.45491       51.42517  
1 1 1 15 16 4  o 15.55196 7.705193  -1.407600      0.5995979     -1.451626      0.6007893     9.659395       9.525367      15.41251 7.649421  116.8563 44.37159  -101.4438      45.02612  
1 1 1 15 16 5  o 320.0836 8.463012  68.79835       3.606457      72.50507       5.078650      65.02775       5.122231      327.4596 11.65763  309.7791 12.43417  17.68048       17.04432  
1 1 1 15 16 6  o 101.9109 9.070418  7.032303       1.218891      13.51470       3.388359      6.068762       1.306341      138.7852 18.80539  94.32499 10.57525  44.46023       21.57495  
1 1 1 15 16 7  o 141.2538 6.352985  13.37827       1.192720      13.30013       1.510912      13.50749       1.942939      140.5619 8.101056  141.1929 10.39995  -0.6309814     13.18279  
1 1 1 15 16 8  o 348.6031 7.567499  81.49493       3.515258      78.66354       4.635562      85.32651       5.392509      341.4447 10.19989  355.0659 11.41229  -13.62115      15.30615  
1 1 1 15 16 9  o 232.4648 9.338654  36.44189       2.886889      30.96475       8.737951      37.11300       3.058644      200.3667 33.93746  234.4533 9.812057  -34.08656      35.32744  
1 1 1 15 16 10 f 95.05412 2.116954  6.023367       0.2681365     6.043137       0.2688280     2.195572       3.740629      95.20994 2.118940  68.31529 27.26246  26.89465       27.34468  
1 1 1 15 16 11 o 152.9735 8.000729  15.77562       1.625201      15.20401       2.047283      16.74961       2.672431      149.5833 10.33473  156.1921 12.95675  -6.608810      16.57360  
1 1 1 15 16 12 o 51.62427 10.96649  1.875355       0.7310808     1.104081       1.044911      2.614966       1.023238      42.32726 14.90944  60.73633 13.03337  -18.40907      19.80303  
1 1 1 15 16 13 o 291.5436 12.61433  58.32963       4.888912      58.37818       6.248877      58.25303       7.849660      288.8748 16.29987  284.3122 20.86493  4.562683       26.47700  
1 1 1 15 16 14 o 282.2946 11.43267  54.57505       4.291652      61.08800       6.389010      49.22010       5.793254      294.5936 16.33960  264.1785 16.54003  30.41510       23.24984  
1 1 1 15 16 15 o 57.66097 21.25388  2.127282       2.152453      3.928198       3.715966      1.217917       2.640548      74.41552 27.83153  54.90462 22.54012  19.51090       35.81412  
1 1 1 15 16 16 o 141.4935 7.470000  13.57335       1.403425      13.09292       1.547134      15.80500       3.334438      138.6381 8.414366  147.4805 17.29560  -8.842453      19.23381  
1 1 1 15 16 17 o 113.8588 6.698463  8.786445       1.011795      8.928714       1.066585      7.507451       3.197969      114.6871 7.012749  95.60446 24.87022  19.08267       25.84001  
1 1 1 15 16 18 f 76.00944 6.502444  3.935480       0.6522738     3.951840       0.6693350     3.626785       2.907483      76.12638 6.665522  67.90041 24.75492  8.225975       25.63660  
1 1 1 15 16 19 o 20.87876 10.07926  -1.237312      0.8443948     -1.544375      0.8816838     2.164243       2.934523      20.30572 9.915524  58.42022 23.84677  -38.11450      25.82608  
1 1 1 15 16 20 o 61.25666 9.319215  2.656387       0.7367391     2.804485       0.7470093     -2.618769      4.458303      63.03143 9.162050  49.70764 23.77738  13.32379       25.48150  
1 1 1 15 16 21 o 95.96832 9.728479  6.503443       1.226905      6.425728       1.255130      8.173368       5.818150      95.21447 10.04379  81.41197 33.44409  13.80250       34.91970  
1 1 1 15 16 22 o 53.98532 21.32836  2.189521       2.267600      1.175484       2.417289      9.624834       6.545627      48.88403 20.90334  81.72115 34.65169  -32.83711      40.46837  
1 1 1 15 16 23 o 74.14709 26.11639  5.772282       3.206116      5.595725       3.413743      7.092705       9.335651      72.19915 26.73866  69.58871 33.57428  2.610443       42.92072  
1 1 1 15 16 24 f 43.53978 19.88946  0.6992693E-01  2.572336      0.4980865      2.620624      -11.22819      13.46186      45.41413 20.47819  56.80132 29.05498  -11.38719      35.54642  
1 1 1 15 17 0  o 127.3404 9.130829  11.01696       1.530686      11.01696       1.530686      11.01696       1.530686      127.3404 9.130829  127.3404 9.130829  0.000000       0.000000  
1 1 1 15 17 1  o 48.64041 14.77749  1.625313       1.042154      -0.3199935     1.694063      2.809757       1.321882      38.94651 17.06977  62.89266 15.79655  -23.94614      23.25743  
1 1 1 15 17 2  o 417.5423 12.49465  118.2401       6.943991      112.8692       7.977716      135.0295       14.10509      406.5325 14.75130  435.6785 24.39350  -29.14600      28.50691  
1 1 1 15 17 3  o 136.2840 1.470634  12.37763       0.2670687     12.42336       0.2688102     8.882524       2.350040      136.5353 1.477499  112.8206 16.08710  23.71478       16.15481  
1 1 1 15 17 4  o 336.1876 7.107636  75.73596       3.184054      78.48299       3.618049      66.30194       6.704877      341.9876 7.939451  310.4212 16.26612  31.56647       18.10032  
1 1 1 15 17 5  o 57.17008 2.444640  2.183125       0.1858034     1.325115       0.8016382     2.231836       0.1910047     43.78664 12.88114  57.80309 2.485626  -14.01645      13.11876  
1 1 1 15 17 6  f 203.9840 6.912220  27.91723       1.876114      25.82129       3.716023      28.63424       2.173455      193.8755 14.48886  206.3666 7.918524  -12.49117      16.51151  
1 1 1 15 17 7  o 281.6721 7.062383  53.23459       2.648659      55.39571       4.080250      51.66072       3.482017      286.0337 10.72422  276.7035 9.457614  9.330170       14.29879  
1 1 1 15 17 8  o 124.8091 4.299281  10.41733       0.7139482     10.85554       0.7610321     7.201005       2.061771      127.3889 4.490322  101.1462 15.81498  26.24277       16.44009  
1 1 1 15 17 9  o 165.5663 1.943073  18.27390       0.4286814     18.33410       0.4353025     16.34002       2.467221      165.8375 1.969858  154.4970 12.08033  11.34053       12.23988  
1 1 1 15 17 10 o 262.1821 14.00306  47.37877       4.874402      47.88449       5.765503      46.11146       9.126960      261.8211 16.61132  246.5358 28.29482  15.28534       32.81056  
1 1 1 15 17 11 o 134.2042 7.856061  12.17223       1.398754      12.21491       1.498664      11.88372       3.896138      134.3003 8.416720  125.5876 24.15869  8.712685       25.58288  
1 1 1 15 17 12 o 133.9289 5.301055  12.03607       0.9441725     12.29148       0.9548084     0.7629875      6.343393      135.3439 5.304515  73.67808 32.63069  61.66587       33.05903  
1 1 1 15 17 13 o 261.6306 14.24673  47.79290       4.948065      47.24533       5.339506      51.12206       13.16580      259.0050 15.54254  230.4654 44.48268  28.53966       47.11984  
1 1 1 15 17 14 o 243.9153 13.28764  41.52616       4.302464      42.64319       4.921782      37.90659       8.859666      245.5599 15.11475  211.1600 32.53010  34.39990       35.87009  
1 1 1 15 17 15 o 96.49901 30.69135  8.220145       4.438947      8.229938       6.344664      8.210756       6.212657      93.86863 36.07259  93.86179 35.78840  0.6835938E-02  50.81379  
1 1 1 15 17 16 o 100.5002 9.856315  7.007278       1.302985      7.628160       1.422520      3.771760       3.247327      104.6957 10.33111  69.89618 26.04207  34.79955       28.01645  
1 1 1 15 17 17 o 145.7346 6.894083  14.44123       1.334995      15.05292       1.612194      13.10681       2.381210      148.1847 8.196630  135.1114 13.40259  13.07335       15.71032  
1 1 1 15 17 18 o 19.31011 9.511413  -1.748086      0.8677530     -1.783950      0.9331928     -1.518943      2.358827      20.31318 9.977360  38.77210 18.16793  -18.45893      20.72731  
1 1 1 15 17 19 o 67.55981 12.92669  3.378532       1.121339      4.310313       1.198344      -3.180481      3.179392      76.96138 12.08276  40.55329 19.57248  36.40809       23.00163  
1 1 1 15 17 20 o 45.92153 14.70132  1.580035       1.017184      1.870750       1.081616      -0.6442596     2.991820      49.44353 15.06140  45.59221 21.05411  3.851318       25.88670  
1 1 1 15 17 21 o 80.35753 20.06441  5.502637       2.141775      5.498626       2.247693      5.542208       7.060253      79.50588 20.93251  70.40451 32.45157  9.101372       38.61702  
1 1 1 15 17 22 o 54.49912 23.46185  2.073071       3.083687      1.917535       3.356084      2.916204       7.813882      54.58946 23.97285  63.53430 30.66883  -8.944836      38.92653  
1 1 1 15 17 23 o 47.57557 19.50029  1.553068       1.972352      1.435640       1.983862      11.58496       18.33658      46.90189 19.42391  67.24846 34.35914  -20.34657      39.46947  
1 1 1 15 18 0  o 72.23869 15.80700  3.980002       1.332372      3.980002       1.332372      3.980002       1.332372      72.23869 15.80700  72.23869 15.80700  0.000000       0.000000  
1 1 1 15 18 1  o 159.2455 5.388551  16.97967       1.141791      16.66413       1.215121      19.35986       3.337286      157.6964 5.792457  167.3342 15.13033  -9.637772      16.20122  
1 1 1 15 18 2  o 118.4742 14.84688  9.762123       2.292536      10.26822       2.358902      1.145620       9.733270      121.5384 14.87512  90.91788 40.33476  30.62049       42.99025  
1 1 1 15 18 3  o 259.5985 9.631703  45.53040       3.326023      44.66165       3.385247      69.70938       17.85925      257.0049 9.903506  278.6781 49.92731  -21.67325      50.90006  
1 1 1 15 18 4  o 59.43457 2.317310  2.358893       0.1831740     2.354302       0.1832377     8.956595       6.946864      59.37645 2.320406  107.0096 38.36564  -47.63317      38.43575  
1 1 1 15 18 5  o 270.3241 5.637405  48.91351       2.030662      47.78524       2.387396      51.86547       3.861661      266.8457 6.719489  276.5976 10.49642  -9.751892      12.46300  
1 1 1 15 18 6  f 83.17157 7.830218  4.692284       0.8575948     4.579917       0.8675771     9.491201       5.669699      82.12297 8.030636  108.4192 34.70848  -26.29627      35.62541  
1 1 1 15 18 7  f 146.5407 7.052286  14.45619       1.373045      14.41854       1.462863      14.73487       3.979799      146.2436 7.532148  142.0984 21.70581  4.145218       22.97554  
1 1 1 15 18 8  o 157.4470 2.918329  16.54090       0.6122687     16.57272       0.6272932     15.90051       2.814353      157.5927 2.987176  151.2776 14.12471  6.315109       14.43713  
1 1 1 15 18 9  o 94.08146 2.269588  5.903050       0.2845277     5.910191       0.2848574     2.823215       5.915867      94.13830 2.270846  78.55231 33.10698  15.58599       33.18477  
1 1 1 15 18 10 f 73.60314 7.762397  3.693393       0.7498655     3.542562       0.7961001     4.879961       2.232891      71.91112 8.470325  80.58396 20.68956  -8.672844      22.35630  
1 1 1 15 18 11 o 164.0988 6.660385  18.15188       1.453366      18.01153       1.543936      19.24392       4.306707      163.3299 7.111025  161.4915 20.47288  1.838409       21.67269  
1 1 1 15 18 12 o 43.98298 19.65570  -0.5137101     2.355195      -0.9501568E-01 2.606606      -2.375487      5.496555      47.99170 21.09957  60.13736 28.03259  -12.14566      35.08587  
1 1 1 15 18 13 o 101.6071 18.47395  7.716296       2.409142      7.563209       2.635939      8.492829       5.936702      99.31794 20.59390  95.52190 35.28196  3.796043       40.85249  
1 1 1 15 18 14 o 99.11977 20.44158  7.615268       2.610205      10.24789       3.006123      -0.4511476     5.262023      115.5090 20.26960  61.78442 28.30776  53.72461       34.81646  
1 1 1 15 18 15 o 35.58400 16.46063  -1.095031      1.840264      3.862124       3.731478      -2.688198      2.115414      70.35490 27.49061  33.26298 16.03172  37.09192       31.82372  
1 1 1 15 18 16 f 161.3921 8.968163  17.98611       1.921092      20.10472       2.518972      15.04070       2.970091      168.9879 11.25057  142.2905 15.93820  26.69743       19.50901  
1 1 1 15 18 17 o 93.17432 9.225499  6.065483       1.130385      6.706886       1.208053      1.552982       3.204271      97.94654 9.370102  55.92147 23.99280  42.02507       25.75759  
1 1 1 15 18 18 o 66.54002 9.831882  3.151111       0.8455341     3.126542       0.8718331     3.540009       3.468671      66.10887 10.22676  64.93153 26.13583  1.177338       28.06543  
1 1 1 15 18 19 o 43.98383 14.45252  1.430032       0.9793780     1.226418       1.027098      3.469759       3.250827      41.79532 14.77653  63.42844 25.38045  -21.63313      29.36857  
1 1 1 15 18 20 o 37.16690 12.35741  0.9858736      0.7153527     1.039849       0.7495879     0.4351407      2.394397      38.05804 12.64954  45.10947 20.00926  -7.051430      23.67238  
1 1 1 15 18 21 o 17.81655 8.786075  -1.501740      0.7478457     -1.505522      0.7611187     -1.396144      4.021979      18.04736 8.892976  47.44564 22.66498  -29.39828      24.34721  
1 1 1 15 18 22 o 20.94619 9.669154  -0.4079106     0.6301582     -0.3121032     0.6335412     -9.307293      6.105976      21.70313 9.897550  44.35072 22.34903  -22.64759      24.44260  
1 1 1 15 19 0  o 59.73489 27.52227  3.647446       2.405257      3.647446       2.405257      3.647446       2.405257      59.73489 27.52227  59.73489 27.52227  0.000000       0.000000  
1 1 1 15 19 1  o 179.2410 21.13861  23.26033       4.951793      27.92265       7.314056      19.31485       6.728339      189.5465 29.95191  154.0863 33.70924  35.46024       45.09357  
1 1 1 15 19 2  o 185.5127 13.14318  23.71470       3.227947      22.19501       5.320426      24.59995       4.060697      173.2682 23.66132  187.2431 16.44178  -13.97496      28.81302  
1 1 1 15 19 3  o 135.0391 12.96287  12.61151       2.303954      13.17266       2.329278      -12.77565      15.66714      138.0952 12.80393  86.21818 42.03474  51.87701       43.94155  
1 1 1 15 19 4  o 148.4436 5.213954  14.77178       1.029739      14.80995       1.032477      7.602310       14.14929      148.6343 5.221112  108.2005 48.27769  40.43385       48.55919  
1 1 1 15 19 5  o 140.9438 9.118258  13.49730       1.703312      12.62777       1.762384      25.81984       6.634520      136.1089 9.782434  182.3886 28.20793  -46.27972      29.85605  
1 1 1 15 19 6  o 170.9171 7.000688  19.68550       1.591035      21.46107       1.786376      12.87277       3.499159      178.3135 7.535206  132.4025 20.49484  45.91107       21.83616  
1 1 1 15 19 7  o 26.58091 11.49625  -0.6288615E-01 0.7471282     -0.1328802E-01 0.8104966     -0.3433779     1.927430      28.11106 12.06395  40.83124 18.03967  -12.72018      21.70181  
1 1 1 15 19 8  o 135.0292 2.384026  12.16350       0.4289553     12.21406       0.4323081     8.941932       3.450897      135.3085 2.397700  106.9441 24.71216  28.36440       24.82821  
1 1 1 15 19 9  o 181.6862 10.45840  22.65440       2.521284      20.52268       2.824078      31.02678       5.596757      171.8742 12.41449  204.4085 20.83888  -32.53430      24.25651  
1 1 1 15 19 10 o 265.8497 11.30457  48.78156       3.995502      48.03296       4.885785      50.29300       6.942307      261.3172 14.08317  260.3716 20.16661  0.9455566      24.59732  
1 1 1 15 19 11 o 108.6481 5.575419  7.957385       0.8044862     8.292408       0.8396756     4.209771       2.808352      110.8882 5.701819  73.11818 24.48841  37.77001       25.14345  
1 1 1 15 19 12 o 139.7205 11.92449  13.69775       2.198905      13.19303       2.383043      16.59025       5.704809      136.2850 13.29100  134.6930 32.21883  1.591995       34.85260  
1 1 1 15 19 13 o 103.5036 17.97051  8.129707       2.388643      8.450134       2.618744      6.542979       5.827463      104.4531 19.53264  83.43169 33.77128  21.02144       39.01311  
1 1 1 15 19 14 o 246.8792 8.138659  41.75003       2.673726      40.45000       3.169743      44.95647       4.978026      241.4514 9.872742  248.0628 15.13189  -6.611404      18.06779  
1 1 1 15 19 15 o 80.91313 26.12180  5.972753       3.206728      11.25817       5.651035      3.462466       3.894486      99.41576 34.69855  66.56444 27.35538  32.85133       44.18491  
1 1 1 15 19 16 o 47.28497 1.629540  1.493386       0.1025208     1.493083       0.1025636     1.855359       3.549238      47.28011 1.630391  58.05550 25.08281  -10.77539      25.13575  
1 1 1 15 19 17 o 15.11766 6.814177  -0.1379889     0.2898375     -0.1270600     0.2910183     -1.476544      3.220696      15.28252 6.863347  44.74703 21.05003  -29.46452      22.14067  
1 1 1 15 19 18 o 29.11284 7.472848  0.6045393      0.2913444     0.5945086      0.2921848     2.340714       3.844039      28.87455 7.520514  59.17135 25.82858  -30.29680      26.90119  
1 1 1 15 19 19 o 85.14333 2.163424  4.847477       0.2452527     4.869576       0.2461427     1.808244       2.886630      85.33688 2.166347  53.26979 22.81217  32.06710       22.91480  
1 1 1 15 19 20 f 138.6303 5.820581  13.12678       1.072829      13.66267       1.135689      8.684038       3.270025      141.3001 6.045728  92.71579 25.61802  48.58430       26.32173  
1 1 1 15 19 21 o 32.98573 14.63468  -0.2351266E-01 1.281544      0.1957391      1.297683      -8.674008      8.151123      34.50416 15.03497  50.61160 25.54333  -16.10744      29.63970  
1 1 1 15 20 0  o 36.34928 22.61610  0.7505040      2.210162      0.7505040      2.210162      0.7505040      2.210162      36.34928 22.61610  36.34928 22.61610  0.000000       0.000000  
1 1 1 15 20 1  o 182.3901 23.17371  25.04955       5.505120      23.17821       7.293269      27.52770       8.392850      164.6494 34.35470  176.9865 36.78920  -12.33711      50.33578  
1 1 1 15 20 2  o 176.1602 20.93558  22.93317       4.818346      20.87158       5.296448      32.83056       11.60497      164.7691 24.89921  176.5167 48.05692  -11.74762      54.12428  
1 1 1 15 20 3  o 124.1661 23.25994  11.80251       3.707062      6.939933       6.256504      14.43318       4.601841      92.21690 35.71910  135.1384 26.50265  -42.92146      44.47746  
1 1 1 15 20 4  o 82.05310 13.89015  4.802742       1.464581      4.124968       1.838772      5.978894       2.422240      74.28696 18.61515  88.68486 20.85053  -14.39790      27.95118  
1 1 1 15 20 5  o 47.19165 15.07347  1.554979       1.069799      1.239303       1.121573      4.739345       3.562202      43.91962 15.44865  78.21189 27.53016  -34.29227      31.56851  
1 1 1 15 20 6  f 151.6657 6.527640  15.52419       1.316131      15.53558       1.593786      15.49975       2.333652      151.2617 7.935039  149.4027 11.81827  1.858994       14.23504  
1 1 1 15 20 7  o 178.8616 4.213986  21.42006       1.004347      21.59350       1.052870      19.66737       3.346918      179.5443 4.400779  165.9136 15.31135  13.63066       15.93124  
1 1 1 15 20 8  o 77.46408 3.854130  4.025474       0.3965830     3.995821       0.3998365     5.825374       3.115100      77.17110 3.900902  84.20286 25.54202  -7.031754      25.83818  
1 1 1 15 20 9  o 231.9673 8.635554  36.75826       2.664598      38.37096       3.466397      34.42899       4.165926      235.1367 11.09458  219.8250 14.29962  15.31174       18.09886  
1 1 1 15 20 10 f 71.59077 12.05884  3.670486       1.109527      3.417835       1.157773      6.513794       3.883960      68.60343 13.14330  85.50766 28.80012  -16.90423      31.65743  
1 1 1 15 20 11 o 68.42146 19.48701  3.691425       1.862154      7.967075       3.116275      1.316765       2.322392      97.41020 24.13323  51.49621 21.13951  45.91399       32.08257  
1 1 1 15 20 12 o 94.36815 15.44252  6.639664       1.874754      8.725258       2.636653      4.507068       2.666198      105.3702 19.49645  72.89616 23.83992  32.47401       30.79697  
1 1 1 15 20 13 o 47.01050 20.13844  0.7136717      2.251004      2.483403       2.826468      -2.355311      3.722095      59.27565 23.68374  46.57340 22.12255  12.70225       32.40874  
1 1 1 15 20 14 o 82.45354 23.76563  6.010878       2.753737      5.592697       4.804010      6.215525       3.360658      75.07285 30.56134  81.02884 26.77883  -5.955994      40.63374  
1 1 1 15 20 15 o 54.02557 21.52735  2.016474       2.328871      7.246622       5.102574      0.6403057      2.617388      80.26991 31.90411  48.32682 21.19829  31.94308       38.30456  
1 1 1 15 20 16 o 43.01544 20.86072  -3.464638      3.722412      -18.87378      12.16838      -1.873778      3.909847      56.62895 28.84960  47.46297 22.58177  9.165981       36.63654  
1 1 1 15 20 17 o 79.73383 12.76657  4.734987       1.310662      4.361718       1.357879      9.823984       5.013794      75.70002 13.97618  88.25208 32.45380  -12.55206      35.33529  
1 1 1 15 20 18 o 75.13786 9.232821  4.022240       0.9050031     4.275783       0.9331582     0.9785618E-02  3.712231      77.50602 9.215606  49.78547 23.14993  27.72055       24.91679  
1 1 1 15 20 19 o 81.51076 27.40146  7.403749       3.515949      13.57613       4.699258      -0.4453699     5.299239      106.7115 31.13128  53.34322 25.62358  53.36829       40.32027  
1 1 1 15 21 0  o 18.71142 13.58629  -3.789116      1.878151      -3.789116      1.878151      -3.789116      1.878151      18.71142 13.58629  18.71142 13.58629  0.000000       0.000000  
1 1 1 15 21 1  o 184.8460 23.90255  26.80496       5.749755      26.45526       6.791661      27.68972       10.80284      176.5646 29.93505  150.5113 47.88004  26.05327       56.46774  
1 1 1 15 21 2  o 58.84965 23.77487  1.889430       2.881868      2.144772       3.023422      -0.6475087     9.529977      60.87745 24.43663  76.40685 36.02550  -15.52940      43.53143  
1 1 1 15 21 3  o 140.7502 12.77424  13.95414       2.369771      5.024232       6.395543      15.37530       2.551382      81.55153 34.39985  147.5824 13.11009  -66.03082      36.81337  
1 1 1 15 21 4  o 97.66412 25.74711  7.955368       3.397687      8.352671       6.426740      7.801243       4.002830      92.73700 36.12321  94.23320 29.02539  -1.496201      46.33961  
1 1 1 15 21 5  o 150.1146 12.55805  15.88500       2.488997      15.53652       2.776683      17.31011       5.615179      147.2496 14.33252  139.1350 31.07270  8.114609       34.21891  
1 1 1 15 21 6  o 38.66243 11.53837  1.059190       0.6394935     1.141462       0.6688724     0.1838845      2.181710      40.01851 11.76449  44.81816 19.51245  -4.799652      22.78462  
1 1 1 15 21 7  o 88.72601 1.914280  5.252040       0.2263236     5.258387       0.2271841     4.418910       2.602861      88.77922 1.920406  73.34476 23.52070  15.43446       23.59897  
1 1 1 15 21 8  o 102.3521 1.527360  6.986031       0.2083106     7.000551       0.2088973     4.411843       2.781439      102.4582 1.530074  72.63464 24.37136  29.82357       24.41934  
1 1 1 15 21 9  o 52.58882 7.137613  1.913291       0.4872738     2.149481       0.5061036     -1.084820      1.803152      55.84103 6.951729  34.98734 16.22262  20.85368       17.64936  
1 1 1 15 21 10 o 85.27127 8.615182  5.048199       0.9654939     5.233496       0.9711385     -10.75272      8.967851      86.88276 8.496794  57.53098 28.71458  29.35178       29.94532  
1 1 1 15 21 11 o 155.4682 14.77087  17.85085       3.023284      20.13129       3.365061      8.304362       6.885037      164.3017 15.55537  83.57088 35.49154  80.73077       38.75072  
1 1 1 15 21 12 f 89.71905 23.09303  6.989829       2.777019      4.195608       3.514440      11.63446       4.531077      68.74437 26.73105  107.1701 30.35569  -38.42573      40.44771  
1 1 1 15 21 13 o 71.90374 18.43028  4.190555       1.773884      2.584428       2.802649      5.263992       2.291223      58.68574 23.53761  78.50293 21.34550  -19.81719      31.77498  
1 1 1 15 21 14 o 40.82357 19.42317  -2.012728      2.892776      -1.708498      5.525570      -2.127593      3.395236      54.76966 26.27111  43.93522 20.94265  10.83444       33.59711  
1 1 1 15 21 15 o 88.60111 25.93493  7.706473       3.256618      12.30297       5.972242      5.761367       3.885039      93.78956 35.24049  73.49988 28.23194  20.28968       45.15456  
1 1 1 15 21 16 o 51.37172 22.59619  1.308510       2.992726      -6.993321      9.726283      2.176691       3.145321      56.84919 28.58964  55.49220 23.78914  1.356991       37.19262  
1 1 1 15 21 17 o 85.21169 13.57416  5.529646       1.489632      5.370205       1.608530      6.490107       3.947927      82.72837 15.14965  74.47971 28.49699  8.248657       32.27368  
1 1 1 15 22 0  o 59.62315 28.97237  4.012589       2.698139      4.012589       2.698139      4.012589       2.698139      59.62315 28.97237  59.62315 28.97237  0.000000       0.000000  
1 1 1 15 22 1  o 67.88535 27.95402  3.300013       4.077416      4.375045       4.579731      -0.8099774     8.954675      73.30552 29.84034  70.49234 33.71377  2.813179       45.02293  
1 1 1 15 22 2  o 66.61954 18.24704  3.460306       1.667233      7.160771       4.537882      2.882849       1.792605      86.14642 30.99300  60.92297 19.51764  25.22344       36.62655  
1 1 1 15 22 3  o 49.10958 20.74728  0.9078581      2.332256      -4.558905      6.207592      1.806368       2.516631      55.93937 27.08323  55.09059 22.23116  0.8487816      35.03892  
1 1 1 15 22 4  f 74.31891 21.98809  4.566046       2.330335      0.4841893      5.408413      5.496605       2.582338      62.36566 28.62040  80.88503 22.91837  -18.51937      36.66577  
1 1 1 15 22 5  o 86.08091 10.39226  5.225733       1.167943      5.523103       1.304911      4.028108       2.618747      88.05630 11.38747  69.36758 23.64612  18.68871       26.24526  
1 1 1 15 22 6  o 23.69568 11.09139  -0.7669156     0.8751519     -1.211074      0.9299701     2.670835       2.587242      22.48329 10.78266  59.96281 23.03718  -37.47952      25.43575  
1 1 1 15 22 7  o 25.90861 12.04655  -0.7535857     1.004963      0.1341214      1.098462      -5.312242      2.489251      32.85287 14.07063  30.84095 15.35064  2.011913       20.82366  
1 1 1 15 22 8  o 67.63924 5.016480  3.100522       0.4489199     3.028730       0.4530772     6.958810       3.321474      66.82209 5.127545  86.64369 26.39334  -19.82160      26.88680  
1 1 1 15 22 9  o 56.95034 2.730407  2.173688       0.2066000     2.105999       0.2074049     10.84336       2.347261      56.04773 2.785806  120.5753 14.92785  -64.52760      15.18557  
1 1 1 15 22 10 o 117.8523 4.210200  9.348913       0.6601092     9.388948       0.6654361     6.878294       5.227452      118.0974 4.235417  78.92975 31.97224  39.16769       32.25156  
1 1 1 15 22 11 o 49.10284 20.91942  1.102982       2.405108      0.9636042      2.606914      1.900088       6.234298      49.52963 21.44796  64.19155 29.89974  -14.66192      36.79687  
1 1 1 15 22 12 o 48.18212 22.04769  -0.9612267E-01 3.178615      -1.137213      3.385628      7.644618       9.231799      46.25481 21.70345  75.13720 35.43621  -28.88239      41.55436  
1 1 1 15 22 13 o 69.39272 19.30386  4.081697       1.849821      5.087987       2.196219      1.624856       3.431647      76.19955 20.97130  54.75389 24.13587  21.44566       31.97398  
1 1 1 15 22 14 o 53.57034 21.37174  2.211525       2.298071      -8.204194      6.177667      3.884357       2.475746      46.84396 23.44831  64.70558 22.93522  -17.86163      32.80011  
1 1 1 15 22 15 o 51.86948 24.11228  0.4180872      4.022936      -1.897755      6.146174      2.153943       5.321171      53.80868 26.25450  59.30285 27.62289  -5.494171      38.10935  
1 1 1 15 23 0  o 30.23418 20.14374  -0.2879051     2.195883      -0.2879051     2.195883      -0.2879051     2.195883      30.23418 20.14374  30.23418 20.14374  0.000000       0.000000  
1 1 1 15 23 1  o 56.57086 17.58684  2.493640       1.465624      4.240466       4.147909      2.244437       1.566683      69.86320 28.41372  54.16351 18.29147  15.69969       33.79227  
1 1 1 15 23 2  o 54.05954 23.72418  1.025676       3.281814      3.866421       3.814325      -7.071051      6.439562      67.79546 27.36521  51.96137 25.65391  15.83409       37.50970  
1 1 1 15 23 3  o 156.6559 19.43704  19.42717       3.970439      10.50317       8.230713      22.13361       4.532698      87.05761 37.90083  165.0780 21.08680  -78.02041      43.37196  
1 1 1 15 23 4  o 106.4298 10.60810  8.022987       1.484422      9.446865       1.800922      5.005582       2.621654      114.6725 11.96154  75.43700 23.53237  39.23554       26.39794  
1 1 1 15 23 5  f 122.8791 7.835550  10.40366       1.276300      10.57844       1.378770      9.357161       3.373703      123.5969 8.421958  102.2282 24.98176  21.36874       26.36318  
1 1 1 15 23 6  o 25.48886 11.51092  -0.3294092     0.8316742     -0.5753958     0.8420674     9.451538       5.309842      24.09700 11.14262  89.69271 33.32326  -65.59571      35.13684  
1 1 1 15 23 7  o 109.3435 2.930865  8.007298       0.4266489     8.060955       0.4303648     4.940259       3.253704      109.7065 2.946622  72.38204 26.21670  37.32443       26.38177  
1 1 1 15 23 8  f 64.49522 10.54841  3.000273       0.8752337     3.078377       0.9205208     2.264570       2.825182      65.14136 10.99586  56.66113 23.29381  8.480225       25.75870  
1 1 1 15 23 9  o 42.62261 14.29395  1.327246       0.9567968     0.6729543      1.025763      5.708012       2.654217      36.08302 14.31653  78.95166 23.49347  -42.86864      27.51192  
1 1 1 15 23 10 o 50.41638 7.073598  1.774734       0.4621553     1.691325       0.4635195     15.88166       6.028085      49.12393 7.302937  109.7848 35.84301  -60.66085      36.57943  
1 1 1 15 23 11 o 124.5686 1.603040  10.35527       0.2660887     10.34867       0.2662874     14.76995       6.889361      124.5287 1.604751  95.59526 37.35350  28.93345       37.38795  
1 1 1 15 23 12 o 30.15469 12.41932  0.3301200      0.8049901     0.2481301      0.8199531     2.515286       4.233027      29.58477 12.38813  58.95406 26.34834  -29.36929      29.11530  
1 1 1 15 23 13 o 98.19015 25.30317  9.475427       3.331341      12.10805       7.062707      8.722117       3.778017      83.13632 35.64402  88.65998 28.32741  -5.523659      45.52953  
1 1 1 15 24 0  o 40.36340 20.14225  1.775014       1.318404      1.775014       1.318404      1.775014       1.318404      40.36340 20.14225  40.36340 20.14225  0.000000       0.000000  
1 1 1 15 24 1  o 214.8195 14.98905  34.65240       4.263715      23.12952       8.596272      38.41210       4.910276      118.7871 42.66702  223.3816 16.61523  -104.5945      45.78799  
1 1 1 15 24 2  o 78.57352 27.03232  6.163520       3.424369      12.77319       4.641942      -1.728189      5.072188      109.9482 30.57707  53.06881 25.37879  56.87936       39.73714  
1 1 1 15 24 3  o 90.51398 22.50104  7.218059       2.702240      7.735524       4.931364      6.996002       3.230421      81.02741 31.61966  84.86967 26.06300  -3.842255      40.97661  
1 1 1 15 24 4  o 38.33781 14.38949  0.9295946      0.9951605     0.8794825      1.026430      1.714681       4.062716      38.06356 14.53864  57.63576 25.78215  -19.57220      29.59884  
1 1 1 15 24 5  o 114.8135 6.932441  9.060052       1.055662      9.700327       1.094716      0.5636250      3.987828      118.8075 6.945153  53.64478 24.60255  65.16275       25.56405  
1 1 1 15 24 6  o 101.6547 3.577525  6.946293       0.4838449     6.956206       0.4944101     6.721763       2.353041      101.7079 3.653972  88.85500 20.31686  12.85294       20.64282  
1 1 1 15 24 7  o 43.98506 11.55528  1.444910       0.6859117     1.638731       0.7084828     -1.452414      2.739227      46.86949 11.44477  40.73940 19.24056  6.130089       22.38710  
1 1 1 15 24 8  o 44.36872 11.93914  1.479775       0.7212828     1.420848       0.7398465     2.610036       3.240194      43.44697 12.25247  57.82045 24.44226  -14.37348      27.34131  
1 1 1 15 24 9  o 38.21947 13.45208  1.024947       0.8504996     0.9304659      0.9562512     1.382639       1.860602      37.78441 14.12108  46.75723 19.02499  -8.972816      23.69293  
1 1 1 15 24 10 o 24.82378 12.32151  -3.205238      1.560223      -2.930763      1.636016      -5.963313      5.186075      26.35720 12.99732  45.28082 22.47359  -18.92361      25.96136  
1 1 1 15 25 0  o 57.05198 28.48568  4.014258       2.637537      4.014258       2.637537      4.014258       2.637537      57.05198 28.48568  57.05198 28.48568  0.000000       0.000000  
1 1 1 15 25 1  o 44.07241 17.13099  1.284529       1.442984      1.437784       1.537993      0.1578218      4.170171      45.76918 17.71474  52.42514 24.43077  -6.655952      30.17738  
1 1 1 15 25 2  o 88.06556 21.28391  6.831723       2.469664      7.548480       3.619068      6.207056       3.378586      83.78011 27.79306  76.86089 26.82942  6.919228       38.62994  
1 1 1 15 25 3  o 94.87900 26.67050  9.120506       3.511445      5.691500       4.561143      14.11007       5.502003      70.67596 29.37681  103.8884 34.26117  -33.21246      45.13120  
1 1 1 15 25 4  o 48.84660 22.94890  -0.6051760     3.806337      -1.970087      4.854042      1.574253       6.133703      50.24729 24.23442  60.26415 28.55960  -10.01686      37.45607  
1 1 1 16 0  0  o 836.8660 59.88484  483.2126       65.97891      483.2126       65.97891      483.2126       65.97891      836.8660 59.88484  836.8660 59.88484  0.000000       0.000000  
1 1 1 16 0  1  o 471.7882 22.60090  150.1901       14.13381      150.1901       14.13381      150.1901       14.13381      471.7882 22.60090  471.7882 22.60090  0.000000       0.000000  
1 1 1 16 0  2  o 819.9175 38.85604  458.7830       42.23428      458.7830       42.23428      458.7830       42.23428      819.9175 38.85604  819.9175 38.85604  0.000000       0.000000  
1 1 1 16 0  3  o 305.9465 17.67569  63.21474       7.150517      63.21474       7.150517      63.21474       7.150517      305.9465 17.67569  305.9465 17.67569  0.000000       0.000000  
1 1 1 16 0  4  o 466.6133 40.04485  150.9629       24.45987      150.9629       24.45987      150.9629       24.45987      466.6133 40.04485  466.6133 40.04485  0.000000       0.000000  
1 1 1 16 0  5  o 80.33277 35.13257  6.236581       3.914599      6.236581       3.914599      6.236581       3.914599      80.33277 35.13257  80.33277 35.13257  0.000000       0.000000  
1 1 1 16 0  6  o 106.9604 17.68447  8.246045       2.313624      8.246045       2.313624      8.246045       2.313624      106.9604 17.68447  106.9604 17.68447  0.000000       0.000000  
1 1 1 16 0  7  o 675.3386 18.79506  306.0368       16.88409      306.0368       16.88409      306.0368       16.88409      675.3386 18.79506  675.3386 18.79506  0.000000       0.000000  
1 1 1 16 0  8  o 320.5382 16.45470  69.25991       6.985687      69.25991       6.985687      69.25991       6.985687      320.5382 16.45470  320.5382 16.45470  0.000000       0.000000  
1 1 1 16 0  9  o 924.8630 44.09742  591.0932       54.06285      591.0932       54.06285      591.0932       54.06285      924.8630 44.09742  924.8630 44.09742  0.000000       0.000000  
1 1 1 16 0  10 o 87.89852 7.464859  5.262941       0.8592644     5.262941       0.8592644     5.262941       0.8592644     87.89852 7.464859  87.89852 7.464859  0.000000       0.000000  
1 1 1 16 0  11 o 643.9207 19.07169  278.9139       16.33171      278.9139       16.33171      278.9139       16.33171      643.9207 19.07169  643.9207 19.07169  0.000000       0.000000  
1 1 1 16 0  12 f 499.6460 12.61786  167.2252       8.388711      167.2252       8.388711      167.2252       8.388711      499.6460 12.61786  499.6460 12.61786  0.000000       0.000000  
1 1 1 16 0  13 o 13.28411 9.581883  -1.578317      0.8588808     -1.578317      0.8588808     -1.578317      0.8588808     13.28411 9.581883  13.28411 9.581883  0.000000       0.000000  
1 1 1 16 0  14 o 221.4639 9.486750  32.94082       2.787870      32.94082       2.787870      32.94082       2.787870      221.4639 9.486750  221.4639 9.486750  0.000000       0.000000  
1 1 1 16 0  15 o 38.07809 17.31194  1.413783       0.9504759     1.413783       0.9504759     1.413783       0.9504759     38.07809 17.31194  38.07809 17.31194  0.000000       0.000000  
1 1 1 16 0  16 o 104.6120 13.67478  7.702469       1.816139      7.702469       1.816139      7.702469       1.816139      104.6120 13.67478  104.6120 13.67478  0.000000       0.000000  
1 1 1 16 0  17 o 143.8996 10.67116  14.08713       2.019730      14.08713       2.019730      14.08713       2.019730      143.8996 10.67116  143.8996 10.67116  0.000000       0.000000  
1 1 1 16 0  18 o 142.3306 8.882825  13.70422       1.669487      13.70422       1.669487      13.70422       1.669487      142.3306 8.882825  142.3306 8.882825  0.000000       0.000000  
1 1 1 16 0  19 o 131.6946 7.861982  11.71583       1.368298      11.71583       1.368298      11.71583       1.368298      131.6946 7.861982  131.6946 7.861982  0.000000       0.000000  
1 1 1 16 0  20 o 134.2277 6.268825  12.11052       1.115658      12.11052       1.115658      12.11052       1.115658      134.2277 6.268825  134.2277 6.268825  0.000000       0.000000  
1 1 1 16 0  21 o 212.5916 6.004573  30.25939       1.697921      30.25939       1.697921      30.25939       1.697921      212.5916 6.004573  212.5916 6.004573  0.000000       0.000000  
1 1 1 16 0  22 o 51.33152 15.21628  2.186072       0.9052382     2.186072       0.9052382     2.186072       0.9052382     51.33152 15.21628  51.33152 15.21628  0.000000       0.000000  
1 1 1 16 0  23 o 62.47726 11.01674  2.857597       0.8320300     2.857597       0.8320300     2.857597       0.8320300     62.47726 11.01674  62.47726 11.01674  0.000000       0.000000  
1 1 1 16 0  24 o 154.7721 11.17350  16.45734       2.276228      16.45734       2.276228      16.45734       2.276228      154.7721 11.17350  154.7721 11.17350  0.000000       0.000000  
1 1 1 16 0  25 o 155.0489 10.32235  16.49874       2.110639      16.49874       2.110639      16.49874       2.110639      155.0489 10.32235  155.0489 10.32235  0.000000       0.000000  
1 1 1 16 0  26 o 82.94527 16.01582  5.255021       1.580006      5.255021       1.580006      5.255021       1.580006      82.94527 16.01582  82.94527 16.01582  0.000000       0.000000  
1 1 1 16 0  27 o 47.35504 21.01964  2.338537       1.400362      2.338537       1.400362      2.338537       1.400362      47.35504 21.01964  47.35504 21.01964  0.000000       0.000000  
1 1 1 16 0  28 o 94.63435 14.85116  6.722565       1.735137      6.722565       1.735137      6.722565       1.735137      94.63435 14.85116  94.63435 14.85116  0.000000       0.000000  
1 1 1 16 0  29 o 26.69000 18.12572  -0.5981445     1.944297      -0.5981445     1.944297      -0.5981445     1.944297      26.69000 18.12572  26.69000 18.12572  0.000000       0.000000  
1 1 1 16 0  30 o 47.15407 28.67416  2.973827       3.367872      2.973827       3.367872      2.973827       3.367872      47.15407 28.67416  47.15407 28.67416  0.000000       0.000000  
1 1 1 16 0  31 o 34.01454 21.79596  0.8769698      2.229665      0.8769698      2.229665      0.8769698      2.229665      34.01454 21.79596  34.01454 21.79596  0.000000       0.000000  
1 1 1 16 1  0  o 377.3632 26.20471  96.98610       13.02841      96.98610       13.02841      96.98610       13.02841      377.3632 26.20471  377.3632 26.20471  0.000000       0.000000  
1 1 1 16 1  1  o 526.8351 5.217882  185.0418       3.663047      204.0165       6.308071      175.3883       4.499376      552.8894 8.562189  512.8120 6.584468  40.07745       10.80122  
1 1 1 16 1  2  o 189.2150 8.767857  23.94788       2.204652      23.91422       2.383463      24.14730       5.801423      189.0175 9.493479  187.7067 23.72322  1.310852       25.55225  
1 1 1 16 1  3  o 375.6316 10.77947  94.34659       5.389936      79.72912       12.06491      97.99139       6.024554      342.0461 26.68169  382.6858 11.82853  -40.63971      29.18607  
1 1 1 16 1  4  o 379.5870 12.90856  96.49852       6.519741      96.09851       7.941639      97.32540       11.41830      378.3135 15.78849  379.1738 22.70298  -0.8603516     27.65324  
1 1 1 16 1  5  o 527.9422 14.68182  186.8481       10.31853      192.4788       13.27585      178.2562       16.39936      534.8414 18.65647  512.9986 24.05740  21.84283       30.44375  
1 1 1 16 1  6  o 684.3316 14.63025  313.7572       13.34111      290.8247       20.25738      331.3220       17.72879      655.6969 23.22164  701.6487 18.97951  -45.95178      29.99110  
1 1 1 16 1  7  o 407.9294 11.78648  111.3868       6.400102      112.4056       9.431812      110.5174       8.713076      408.6889 17.35877  405.5067 16.15735  3.182190       23.71470  
1 1 1 16 1  8  o 509.4096 15.95539  174.3472       10.81714      177.0758       14.69346      171.1186       15.98328      511.6172 21.60149  502.0474 23.96090  9.569885       32.26064  
1 1 1 16 1  9  o 675.9733 19.53840  308.3908       17.58069      287.5559       27.27124      323.2069       22.99727      645.9409 31.78147  689.1920 25.08347  -43.25110      40.48756  
1 1 1 16 1  10 o 58.89755 7.441041  2.352319       0.5709784     5.630638       1.068853      1.043223       0.6754265     91.37611 8.890602  39.34734 11.88455  52.02878       14.84201  
1 1 1 16 1  11 o 215.2719 1.624159  30.87898       0.4658966     30.94282       1.605939      30.87311       0.4868335     215.3011 5.602456  215.2504 1.697317  0.5064392E-01  5.853921  
1 1 1 16 1  12 o 67.24489 6.230949  3.043670       0.5519754     1.478310       0.6586929     6.735085       1.011515      46.06687 10.90142  100.1246 7.639226  -54.05774      13.31160  
1 1 1 16 1  13 o 284.8594 9.468343  54.36780       3.589006      55.47392       5.483773      53.53899       4.746851      286.7013 14.40021  282.0555 12.66211  4.645844       19.17538  
1 1 1 16 1  14 o 19.63915 9.041574  -0.4223370     0.5457834     -0.3716280     0.5596995     -1.404209      2.462862      20.35990 9.291844  43.20082 19.62862  -22.84092      21.71684  
1 1 1 16 1  15 o 122.6842 4.951712  10.06062       0.8078382     10.12492       0.9099770     9.821434       1.754976      123.0243 5.565345  120.4351 11.05901  2.589211       12.38042  
1 1 1 16 1  16 o 300.0884 8.334603  60.35498       3.329561      58.97252       5.010179      61.44845       4.455838      295.4601 12.75573  302.1139 11.08721  -6.653839      16.90074  
1 1 1 16 1  17 o 67.68661 10.06561  3.143961       0.8802655     3.003398       0.9258034     4.468273       2.841702      65.96167 10.91440  79.57888 24.44585  -13.61721      26.77169  
1 1 1 16 1  18 o 206.0703 7.912693  28.50413       2.168730      27.84006       2.722518      29.65723       3.587519      203.1806 10.08731  208.9215 12.95024  -5.740875      16.41531  
1 1 1 16 1  19 o 233.2868 4.272124  36.33060       1.328029      36.06721       1.569298      36.99514       2.492663      232.3471 5.068675  234.7080 7.981686  -2.360825      9.455092  
1 1 1 16 1  20 o 95.15482 4.596832  6.062012       0.5811341     6.440208       0.6995722     5.219979       1.043851      97.99980 5.377763  87.62569 9.070936  10.37411       10.54525  
1 1 1 16 1  21 o 88.93618 5.461452  5.311655       0.6441107     6.817587       0.9484445     4.022569       0.8775059     100.5514 7.124792  76.81382 8.727641  23.73755       11.26652  
1 1 1 16 1  22 o 158.2724 4.513299  16.76088       0.9508875     12.73849       7.416077      16.82812       0.9588016     120.7507 39.77461  158.5856 4.541917  -37.83486      40.03310  
1 1 1 16 1  23 o 55.23579 12.54491  2.177856       0.9022197     -3.365112      1.397235      6.141765       1.181572      23.23878 11.55586  94.68095 9.493279  -71.44217      14.95528  
1 1 1 16 1  24 o 153.9661 2.066116  15.81148       0.4238901     15.53203       1.782240      15.82824       0.4364134     150.8991 8.903079  154.0426 2.126100  -3.143539      9.153421  
1 1 1 16 1  25 o 150.7407 7.137949  15.42235       1.429690      18.60236       2.087695      12.61393       1.961935      164.4129 9.570603  134.5600 11.03893  29.85294       14.61008  
1 1 1 16 1  26 o 71.70433 9.220809  3.596031       0.8606544     2.683621       1.388460      4.165358       1.096779      59.14504 16.82092  76.50058 11.08156  -17.35554      20.14310  
1 1 1 16 1  27 o 57.08431 11.67424  2.390720       0.8580314     3.401355       1.019283      -0.6715831E-01 1.589563      68.40201 11.59666  36.96831 16.35538  31.43370       20.04947  
1 1 1 16 1  28 o 76.17990 18.55651  4.791412       1.866008      4.557948       1.915323      9.150787       8.276441      73.65936 19.28925  77.49654 35.50481  -3.837181      40.40627  
1 1 1 16 1  29 o 20.69838 9.989306  -1.146561      0.8279349     1.013165       2.069866      -1.557924      0.9033486     45.46557 19.38946  20.35490 9.960226  25.11068       21.79811  
1 1 1 16 1  30 o 64.85031 18.56282  3.699926       1.685566      4.116147       2.334375      3.246528       2.436398      64.71629 22.31698  58.35196 22.37149  6.364323       31.59955  
1 1 1 16 1  31 o 36.85667 17.24115  -0.7021032     2.109281      -0.5122155     3.109220      -0.8640029     2.870953      43.41475 20.50250  41.24213 19.54321  2.172619       28.32472  
1 1 1 16 2  0  o 321.9789 11.20515  69.42387       4.794275      69.42387       4.794275      69.42387       4.794275      321.9789 11.20515  321.9789 11.20515  0.000000       0.000000  
1 1 1 16 2  1  o 202.2708 6.350977  27.31184       1.709657      27.98454       1.835180      22.89285       4.703562      204.7247 6.736382  183.5318 19.53248  21.19290       20.66148  
1 1 1 16 2  2  o 166.6533 4.793002  18.52966       1.063270      23.27359       4.076396      18.18335       1.101397      185.5554 16.66381  165.0765 5.012895  20.47888       17.40148  
1 1 1 16 2  3  o 477.9305 12.19966  152.8302       7.763024      149.9723       9.733308      157.8263       12.86926      472.8311 15.46913  483.9768 19.99825  -11.14572      25.28288  
1 1 1 16 2  4  o 268.0299 10.82517  48.07973       3.858311      48.45568       5.493825      47.71383       5.419878      268.4615 15.42236  266.4058 15.33242  2.055664       21.74700  
1 1 1 16 2  5  o 582.9669 14.84370  227.8452       11.52143      232.3625       13.81461      217.5244       20.88122      587.9669 17.65243  565.2013 27.81089  22.76563       32.94016  
1 1 1 16 2  6  o 489.0036 7.910071  159.5838       5.154256      171.4795       11.84140      156.8032       5.725056      504.9437 17.62598  484.6217 8.865502  20.32199       19.72998  
1 1 1 16 2  7  o 544.6183 9.836411  198.1532       7.138426      193.2187       8.702430      208.3025       12.48058      537.4130 12.15231  556.6943 16.84396  -19.28131      20.77011  
1 1 1 16 2  8  o 704.6063 17.42166  333.7678       16.35723      357.4859       20.94049      296.6449       26.19798      727.1409 21.63606  657.8985 29.96242  69.24237       36.95762  
1 1 1 16 2  9  o 585.6373 17.27542  230.9154       13.46654      211.8136       20.00622      246.7402       18.20945      556.6559 27.05248  603.1249 22.69822  -46.46899      35.31353  
1 1 1 16 2  10 o 565.6682 12.92203  214.4696       9.740155      205.2343       19.91760      217.3724       11.16643      547.0441 27.41114  568.7847 14.74549  -21.74066      31.12556  
1 1 1 16 2  11 o 111.9451 1.841862  8.350492       0.2747487     7.897397       1.062670      8.382949       0.2844192     108.5048 7.393980  112.1619 1.903006  -3.657051      7.634944  
1 1 1 16 2  12 o 430.4714 9.838514  124.0041       5.643485      126.7749       6.425082      114.6487       11.80610      434.8564 11.09722  409.9326 21.69047  24.92380       24.36442  
1 1 1 16 2  13 o 104.2670 5.719822  7.277280       0.7916557     6.470891       3.921548      7.311539       0.8082972     95.76017 28.57163  104.5037 5.827598  -8.743484      29.15988  
1 1 1 16 2  14 o 208.9004 9.666603  29.29687       2.683538      31.29539       3.252062      25.03197       4.750723      215.6183 11.35885  190.9526 18.91916  24.66573       22.06713  
1 1 1 16 2  15 o 353.8869 7.936414  83.79218       3.742504      83.57497       5.990761      83.93121       4.792830      352.0221 12.79268  353.5565 10.18386  -1.534393      16.35126  
1 1 1 16 2  16 o 227.0800 7.556169  34.54267       2.283225      32.84243       2.592728      40.41596       4.818851      221.1972 8.814026  243.8123 14.90370  -22.61511      17.31495  
1 1 1 16 2  17 o 92.91706 8.294529  5.831589       1.016190      5.210408       1.060329      12.83018       3.559069      87.63909 9.217477  135.0083 20.42077  -47.36926      22.40468  
1 1 1 16 2  18 o 124.3059 4.791659  10.33328       0.7922039     9.632909       0.8462044     15.30126       2.253732      119.9612 5.306854  150.1938 11.34488  -30.23258      12.52473  
1 1 1 16 2  19 o 159.3303 3.888456  16.94154       0.8255609     16.65205       0.8733236     19.37302       2.531034      157.8906 4.154540  168.9903 11.30493  -11.09969      12.04415  
1 1 1 16 2  20 o 63.02048 8.937967  2.723537       0.7295439     0.6520705      0.9359356     5.930910       1.164613      36.52261 13.89912  93.36980 9.492379  -56.84719      16.83125  
1 1 1 16 2  21 o 46.56571 9.259518  1.512491       0.5543165     4.161125       0.7712492     -1.317673      0.7972407     78.36904 7.475927  19.95490 9.671828  58.41415       12.22431  
1 1 1 16 2  22 o 92.09731 6.960993  5.730010       0.8479384     1.938640       1.447599      7.710327       1.046207      53.32800 17.57321  106.8244 7.395417  -53.49644      19.06593  
1 1 1 16 2  23 o 203.7979 5.281189  27.85448       1.432976      35.91822       3.277789      25.94915       1.593302      229.1473 10.76486  196.4855 6.092832  32.66179       12.36951  
1 1 1 16 2  24 o 80.68668 9.450403  4.495638       0.9968451     8.734735       1.736275      2.411276       1.217498      111.8993 11.82297  57.36127 15.54438  54.53802       19.52973  
1 1 1 16 2  25 o 134.2006 3.863768  12.06858       0.6902186     11.10092       1.434692      12.35999       0.7873184     127.2942 8.507001  135.7065 4.359535  -8.412308      9.559007  
1 1 1 16 2  26 o 17.27360 8.599694  -1.914909      0.7831075     -2.059207      0.8825144     -1.380459      1.698426      18.58966 9.233898  32.62449 15.32817  -14.03483      17.89462  
1 1 1 16 2  27 o 93.84037 9.088805  6.165015       1.122290      5.181970       1.623029      7.065711       1.553563      82.43397 15.34004  98.79980 12.04943  -16.36584      19.50656  
1 1 1 16 2  28 o 129.4918 17.88592  13.39726       3.003893      12.69574       3.104445      23.70344       11.89905      124.3331 19.36876  94.15137 42.92046  30.18177       47.08837  
1 1 1 16 2  29 o 35.10223 15.53778  0.2497401E-01  1.436405      1.348674       3.030658      -0.3585249     1.631264      51.23616 22.62944  35.06360 15.94834  16.17255       27.68467  
1 1 1 16 2  30 o 19.59211 9.724073  -2.089597      0.9711258     2.168174       2.893566      -2.630060      1.030920      52.76727 22.72180  19.05597 9.544543  33.71130       24.64505  
1 1 1 16 3  0  o 440.7390 14.89917  130.2073       8.727495      130.2073       8.727495      130.2073       8.727495      440.7390 14.89917  440.7390 14.89917  0.000000       0.000000  
1 1 1 16 3  1  o 191.6349 12.82842  24.67315       3.256963      25.26755       4.709336      24.12817       4.509258      193.0813 18.53123  188.7036 18.15679  4.377762       25.94370  
1 1 1 16 3  2  o 699.8440 13.62182  327.7953       12.70311      323.6316       15.47402      336.4009       22.24608      694.5948 16.71853  705.3827 23.70131  -10.78790      29.00451  
1 1 1 16 3  3  o 461.8113 8.564589  142.3497       5.270412      144.9513       6.019720      133.8078       10.90791      465.8938 9.696519  445.9206 18.39688  19.97318       20.79585  
1 1 1 16 3  4  o 278.8348 11.09424  52.04375       4.113865      49.66513       5.440161      55.22062       6.287072      271.8340 15.07784  286.4333 16.54257  -14.59933      22.38298  
1 1 1 16 3  5  o 225.1289 10.46030  33.93684       3.129392      31.52825       4.356668      36.50420       4.497972      216.3587 15.20835  232.9816 14.56124  -16.62296      21.05525  
1 1 1 16 3  6  o 558.0050 8.420792  207.8572       6.261300      195.6577       15.44596      210.2561       6.849288      538.0590 21.58708  561.1156 9.160508  -23.05658      23.45030  
1 1 1 16 3  7  f 540.3748 11.06736  195.2370       7.969161      183.9577       10.98112      207.7870       11.58316      523.3564 15.76416  556.2834 15.64187  -32.92706      22.20759  
1 1 1 16 3  8  o 503.9212 13.23909  170.2225       8.882146      147.8946       14.24983      184.4092       11.35868      466.8010 22.97953  523.7023 16.29666  -56.90131      28.17162  
1 1 1 16 3  9  o 164.2553 3.445829  17.98274       0.7541999     14.23607       3.747769      18.14088       0.7699516     143.8697 20.09684  164.9748 3.502453  -21.10507      20.39976  
1 1 1 16 3  10 o 250.9633 2.190759  41.97026       0.7326195     33.58887       8.073135      42.03986       0.7356549     219.6641 28.23304  251.1712 2.198016  -31.50706      28.31848  
1 1 1 16 3  11 o 657.7307 21.82198  294.2234       19.09915      326.6462       25.30219      251.2819       29.11869      688.8793 27.61994  596.6549 36.80391  92.22437       46.01509  
1 1 1 16 3  12 o 295.0727 8.203592  58.23816       3.222441      60.63082       4.818239      56.30183       4.334489      300.4007 12.06140  289.6194 11.25288  10.78125       16.49560  
1 1 1 16 3  13 o 217.5058 4.570103  31.55524       1.324556      31.73876       1.365281      28.61602       5.463851      218.1304 4.697127  204.0423 20.36764  14.08820       20.90224  
1 1 1 16 3  14 o 379.4904 6.729342  96.21511       3.402883      97.17240       4.527178      94.97179       5.159363      380.9771 8.917748  376.1969 10.30188  4.780182       13.62552  
1 1 1 16 3  15 o 220.5018 9.827483  32.67326       2.880284      32.44732       4.079181      32.89790       4.067518      218.7613 14.06816  220.3190 13.92618  -1.557709      19.79524  
1 1 1 16 3  16 o 152.8651 4.636605  15.60945       0.9433647     15.48818       0.9866759     16.90041       3.219370      152.2492 4.869729  157.0544 15.58874  -4.805206      16.33166  
1 1 1 16 3  17 o 190.3087 10.03135  24.41161       2.534866      24.94524       2.970945      22.98347       4.860227      191.9964 11.66764  181.3688 20.46747  10.62762       23.55952  
1 1 1 16 3  18 o 86.33735 5.174575  4.997382       0.5925834     4.945546       0.6058510     6.142158       2.847157      85.87147 5.320863  91.84393 23.24708  -5.972458      23.84823  
1 1 1 16 3  19 o 141.9069 2.627044  13.42711       0.4967574     13.43707       0.5081162     13.21184       2.362572      141.9570 2.686165  138.9781 12.90491  2.978897       13.18151  
1 1 1 16 3  20 o 20.79195 9.610990  -0.5066110     0.6256796     -0.9567752E-01 0.9690676     -0.8003750     0.8193464     30.26515 13.09129  22.94955 10.73883  7.315596       16.93235  
1 1 1 16 3  21 o 134.0016 6.848884  12.07704       1.218879      16.11397       1.857301      9.023156       1.615411      154.3282 9.071583  114.9463 10.66839  39.38188       14.00387  
1 1 1 16 3  22 o 91.71108 5.942688  5.662357       0.7223267     6.965195       1.029931      4.401206       1.013320      101.4324 7.677052  80.05366 9.696727  21.37873       12.36785  
1 1 1 16 3  23 o 66.10394 10.08009  3.039354       0.8598524     1.177797       1.373432      4.239330       1.102695      45.33562 16.92731  78.06280 10.89734  -32.72718      20.13171  
1 1 1 16 3  24 o 137.1216 3.970514  12.59190       0.7247170     16.37820       1.518861      11.47577       0.8246434     155.4709 7.352377  130.7534 4.740883  24.71747       8.748339  
1 1 1 16 3  25 o 24.64289 11.96321  -1.943480      1.232592      2.034296       2.977453      -2.766160      1.354068      59.30364 24.09026  23.90726 11.79586  35.39637       26.82318  
1 1 1 16 3  26 o 154.7877 2.378721  16.00211       0.4906295     19.39371       2.212111      15.82664       0.5031613     166.7858 9.999383  153.9248 2.453155  12.86096       10.29590  
1 1 1 16 3  27 o 33.52711 14.16217  0.2758374      1.086458      -0.3592149     1.396659      1.249021       1.728952      33.19088 14.95961  46.16557 18.49701  -12.97469      23.78927  
1 1 1 16 3  28 o 48.70845 21.18581  1.001769       2.566769      1.001769       2.566769      0.000000       0.000000      48.70845 21.18581  ?        ?         0.000000       21.18581  
1 1 1 16 3  29 o 47.29197 14.26498  1.745504       0.9735618     0.8877905      2.780319      1.865368       1.039365      48.22953 21.46754  48.66930 14.75179  -0.4397659     26.04747  
1 1 1 16 3  30 o 32.90800 13.59628  0.4677515      0.9688866     -0.2388493     2.597527      0.5819507      1.044250      42.08081 19.49749  34.62232 14.18976  7.458488       24.11434  
1 1 1 16 4  0  o 509.8632 12.76622  173.8760       8.661113      173.8760       8.661113      173.8760       8.661113      509.8632 12.76622  509.8632 12.76622  0.000000       0.000000  
1 1 1 16 4  1  o 338.0621 9.944471  76.39730       4.474860      66.27360       7.640108      81.68379       5.520951      313.5514 18.36636  349.3302 11.87781  -35.77881      21.87248  
1 1 1 16 4  2  o 187.2305 12.21398  23.54208       3.030610      26.55735       3.451067      13.38011       6.335476      198.7959 13.10086  137.0494 34.67162  61.74657       37.06419  
1 1 1 16 4  3  o 207.8495 22.98854  29.51271       6.260701      0.000000       0.000000      29.51271       6.260701      ?        ?         207.8495 22.98854  0.000000       22.98854  
1 1 1 16 4  4  o 369.1725 14.50730  91.44460       7.122675      103.2393       11.30630      83.68355       9.171426      390.6192 21.80825  352.0940 19.62577  38.52518       29.33889  
1 1 1 16 4  5  o 347.5040 11.60189  80.84278       5.364791      82.02728       11.62406      80.52219       6.047374      346.9697 25.31580  346.5834 13.11808  0.3862305      28.51269  
1 1 1 16 4  6  o 427.1707 7.387724  121.7647       4.205190      118.9167       7.480290      123.0806       5.084737      421.1983 13.34463  429.3236 8.888126  -8.125244      16.03365  
1 1 1 16 4  7  o 300.0829 8.379974  60.17075       3.347589      60.82150       4.936471      59.61672       4.554924      301.1978 12.32565  298.3183 11.47992  2.879517       16.84370  
1 1 1 16 4  8  o 472.4488 10.62064  149.2627       6.686193      145.5518       17.87744      149.8662       7.209393      460.1289 29.31000  473.2651 11.43196  -13.13620      31.46054  
1 1 1 16 4  9  o 317.5629 6.531426  67.29241       2.763830      38.66383       13.12784      68.62019       2.827196      229.6638 44.50440  320.6743 6.616348  -91.01045      44.99353  
1 1 1 16 4  10 o 90.58970 7.921143  5.522653       0.9465718     6.100921       3.379285      5.473417       0.9860453     93.12066 26.15938  90.13722 8.302780  2.983437       27.44538  
1 1 1 16 4  11 o 353.3958 10.32809  83.67074       4.858351      87.06923       7.755163      81.47536       6.233065      359.0578 16.25101  348.0508 13.46498  11.00702       21.10452  
1 1 1 16 4  12 o 432.1578 12.54521  125.5107       7.216623      122.6055       9.523640      129.4285       11.05937      425.6630 16.82363  436.4186 19.06350  -10.75565      25.42541  
1 1 1 16 4  13 o 205.8663 5.010201  28.27675       1.374403      28.80339       1.486871      25.18532       3.602407      207.6830 5.377300  192.8442 14.11666  14.83878       15.10614  
1 1 1 16 4  14 o 77.52055 3.245855  4.013559       0.3345473     3.929760       0.3396953     6.715690       1.928953      76.70053 3.331614  98.58128 15.16994  -21.88075      15.53148  
1 1 1 16 4  15 o 114.7404 8.442138  8.863506       1.281713      8.688723       1.396246      9.799664       3.231371      113.4682 9.316495  117.6943 21.39205  -4.226028      23.33274  
1 1 1 16 4  16 o 173.4508 5.804177  20.12198       1.339610      19.34399       1.427164      25.88537       3.884433      170.0006 6.311090  194.7570 15.08543  -24.75638      16.35238  
1 1 1 16 4  17 o 285.1626 5.998597  54.35837       2.279375      53.96170       2.423458      57.39982       6.710641      284.0548 6.402651  288.9781 17.50928  -4.923218      18.64320  
1 1 1 16 4  18 o 226.9228 3.917054  34.36243       1.184435      34.32416       1.222284      34.95178       4.796689      226.7845 4.044690  225.5442 16.06531  1.240372       16.56664  
1 1 1 16 4  19 o 221.1590 1.973351  32.60215       0.5815439     32.63873       0.5831071     25.80826       7.947396      221.2829 1.977548  183.2953 33.78307  37.98755       33.84090  
1 1 1 16 4  20 o 180.0120 8.064445  21.81562       1.929503      24.40042       2.571419      18.48492       2.918960      189.8212 10.20361  164.1212 13.46550  25.70007       16.89478  
1 1 1 16 4  21 o 72.33638 7.584054  3.554668       0.7201682     3.169018       0.8797469     4.338079       1.253880      67.74176 10.05031  78.89542 12.33028  -11.15366      15.90737  
1 1 1 16 4  22 o 103.5761 7.365016  7.255559       1.009867      8.169396       1.554839      6.588774       1.328141      109.0348 10.84519  97.95995 10.33006  11.07483       14.97759  
1 1 1 16 4  23 o 151.3347 5.671019  15.39345       1.141575      12.52803       1.520899      19.09088       1.727654      135.7591 8.449203  167.9427 7.740906  -32.18352      11.45909  
1 1 1 16 4  24 o 111.3500 8.635278  8.485230       1.271261      8.433831       2.985139      8.496617       1.405038      103.9076 22.23178  111.0878 9.585461  -7.180183      24.21019  
1 1 1 16 4  25 o 174.6062 5.299685  20.53584       1.231630      20.98162       3.744220      20.48175       1.304208      168.4243 16.91197  174.2565 5.624110  -5.832138      17.82261  
1 1 1 16 4  26 o 70.99515 10.17361  3.574453       0.9349764     3.153845       1.197793      4.230422       1.495837      64.83939 14.25268  74.65137 15.54326  -9.811981      21.08867  
1 1 1 16 4  27 o 25.43409 12.10395  -1.206638      1.124720      -0.1095639     2.227040      -1.582254      1.303113      42.19616 18.96528  26.49709 12.72236  15.69907       22.83725  
1 1 1 16 4  28 o 68.61916 23.94237  4.452147       2.690423      4.312553       2.770359      6.766924       11.28124      67.45650 24.22271  71.25645 34.93642  -3.799950      42.51227  
1 1 1 16 4  29 o 32.05683 14.64791  -0.4443411     1.396430      4.682207       2.818191      -2.112657      1.607671      67.92130 24.42579  28.10832 13.64953  39.81298       27.98087  
1 1 1 16 4  30 o 21.10487 10.55171  -2.947345      1.234017      5.788722       6.187961      -3.309161      1.259312      63.87745 29.76514  20.64010 10.36744  43.23735       31.51900  
1 1 1 16 5  0  f 67.99947 22.22837  3.942297       1.784316      3.942297       1.784316      3.942297       1.784316      67.99947 22.22837  67.99947 22.22837  0.000000       0.000000  
1 1 1 16 5  1  o 220.8018 7.316193  32.56340       2.149617      33.11309       3.070590      32.03508       3.010341      222.3810 10.39090  218.7267 10.35800  3.654312       14.67171  
1 1 1 16 5  2  o 409.4323 10.11120  111.9903       5.516431      119.4610       8.080748      105.4702       7.549176      422.0440 14.38984  396.5453 14.31021  25.49869       20.29408  
1 1 1 16 5  3  o 371.8721 14.15057  92.76670       6.999192      93.27610       9.488759      92.15875       10.36602      371.8324 19.21606  369.1049 21.16476  2.727570       28.58678  
1 1 1 16 5  4  o 320.2345 12.63262  68.73302       5.379999      69.99376       8.597501      67.92160       6.897317      321.7020 20.15734  317.6999 16.34754  4.002106       25.95304  
1 1 1 16 5  5  o 393.5351 11.20685  103.6402       5.870810      98.73122       10.67493      105.7688       7.029315      381.9597 21.05511  397.2036 13.29962  -15.24399      24.90376  
1 1 1 16 5  6  o 102.6629 14.51300  7.204220       1.930081      3.719755       4.270905      8.098468       2.163619      81.65884 29.96586  108.8149 15.34743  -27.15605      33.66744  
1 1 1 16 5  7  o 264.3848 11.88138  46.87724       4.175090      54.49196       6.594728      41.78362       5.393657      284.0548 17.50801  248.8270 16.35790  35.22777       23.96062  
1 1 1 16 5  8  o 291.6008 5.450254  56.71170       2.117771      51.52399       7.826361      57.12157       2.199840      275.0657 21.52384  292.6418 5.641326  -17.57602      22.25085  
1 1 1 16 5  9  o 230.2631 12.85137  35.65704       3.927543      34.50215       7.655467      36.06960       4.575603      223.2389 26.23545  231.2228 14.93042  -7.983902      30.18635  
1 1 1 16 5  10 o 381.6506 11.41013  97.66697       5.796185      102.9287       10.42903      95.31530       6.972156      389.2069 20.17786  376.4375 13.92354  12.76941       24.51553  
1 1 1 16 5  11 o 65.99420 19.82027  2.987383       1.882462      -1.876906      6.484010      3.435122       1.967192      73.62612 32.77702  70.25637 20.03546  3.369751       38.41552  
1 1 1 16 5  12 o 224.9526 10.17552  33.96961       3.042252      36.62090       3.929803      30.00415       4.806057      233.1077 12.69942  209.8531 17.34166  23.25455       21.49438  
1 1 1 16 5  13 o 308.6449 7.062742  63.65933       2.904732      57.36805       4.408458      68.48631       3.861490      292.0923 11.34802  319.6953 9.073705  -27.60294      14.52961  
1 1 1 16 5  14 o 299.9652 6.606940  60.12640       2.640856      58.97494       2.738042      75.48827       10.00085      297.0370 6.917610  330.1051 22.87737  -33.06818      23.90037  
1 1 1 16 5  15 o 201.4962 1.514444  27.05534       0.4066244     27.05458       0.4073591     27.26376       6.773730      201.4933 1.517201  195.5601 26.68983  5.933228       26.73292  
1 1 1 16 5  16 o 231.2030 5.320415  35.70146       1.639127      36.53334       1.705895      25.69407       5.916730      233.8645 5.474120  190.5337 23.82355  43.33087       24.44437  
1 1 1 16 5  17 o 276.3500 4.945067  51.00136       1.820980      50.80181       1.834319      64.57256       15.12736      275.8028 4.991172  287.9229 40.55061  -12.12009      40.85662  
1 1 1 16 5  18 o 155.8989 1.967654  16.19977       0.4087572     16.18373       0.4099098     19.04033       5.454431      155.8215 1.974183  161.6195 26.22497  -5.798019      26.29917  
1 1 1 16 5  19 o 188.3918 8.372475  23.89004       2.096539      24.30916       2.223446      20.52972       6.295743      189.9373 8.809010  165.2683 29.67870  24.66905       30.95842  
1 1 1 16 5  20 o 28.90535 11.83327  0.2092316      0.7251778     -0.2951455     0.7482113     8.024929       2.945306      24.84845 11.09342  104.6935 21.82087  -79.84500      24.47885  
1 1 1 16 5  21 o 166.7344 7.167780  18.71142       1.588795      22.42527       2.013633      12.58592       2.586060      182.2521 8.313417  134.3832 14.68026  47.86887       16.87078  
1 1 1 16 5  22 o 165.6806 6.243433  18.45655       1.375913      18.32433       1.639628      18.77132       2.529801      164.7579 7.487936  165.2924 11.55861  -0.5344391     13.77210  
1 1 1 16 5  23 f 65.33987 14.48778  3.096014       1.228306      -3.543257      3.525020      4.013562       1.310436      44.79365 21.34829  74.90818 13.63042  -30.11453      25.32859  
1 1 1 16 5  24 o 149.8102 7.730902  15.26462       1.538061      12.25766       3.420638      16.02662       1.721949      126.2857 21.06912  153.2039 8.467780  -26.91817      22.70707  
1 1 1 16 5  25 o 37.58370 13.93209  0.8438059      0.9271918     -1.215312      2.008262      1.401623       1.045263      36.83361 17.09308  44.65277 14.93966  -7.819160      22.70169  
1 1 1 16 5  26 o 30.20526 12.24785  0.3432121      0.7680218     1.304908       1.596106      0.5345128E-01  0.8761180     46.18135 17.99824  29.12502 12.52161  17.05633       21.92550  
1 1 1 16 5  27 o 115.7478 9.384217  9.418419       1.434982      7.393188       3.395900      9.858650       1.583283      86.54150 26.74821  117.9040 10.17711  -31.36250      28.61888  
1 1 1 16 5  28 o 57.34285 22.25992  2.761230       2.433900      3.126273       2.634634      0.6357930      6.357287      59.72819 23.16692  59.20029 28.33836  0.5279007      36.60285  
1 1 1 16 5  29 f 41.44409 14.89019  1.259474       1.047028      -0.4167444     3.333876      1.442894       1.102826      45.99896 21.56859  43.58855 15.32007  2.410416       26.45578  
1 1 1 16 5  30 o 31.00000 14.26986  -0.4921376     1.358778      -2.380878      1.867575      1.632150       1.980608      29.73818 14.50169  47.26289 19.47453  -17.52471      24.28078  
1 1 1 16 6  0  f 268.7108 8.513380  48.30065       3.041386      48.30065       3.041386      48.30065       3.041386      268.7108 8.513380  268.7108 8.513380  0.000000       0.000000  
1 1 1 16 6  1  o 592.6094 15.71122  235.7571       12.39563      237.7845       15.51573      232.1801       20.60945      593.9017 19.63276  584.0298 26.55188  9.871887       33.02192  
1 1 1 16 6  2  o 233.1752 9.363375  36.37268       2.903382      40.16553       4.071301      32.44771       4.141607      244.6725 12.52919  219.6045 14.22980  25.06799       18.95964  
1 1 1 16 6  3  o 705.5231 19.82235  335.6542       18.61698      351.5229       24.93440      315.6640       27.98578      718.9032 26.07203  678.3008 31.04521  40.60242       40.54079  
1 1 1 16 6  4  o 361.2571 13.79652  87.57011       6.629193      80.10600       10.32357      92.80754       8.647680      343.4051 22.68767  371.1232 17.53631  -27.71808      28.67494  
1 1 1 16 6  5  o 376.8935 14.45765  95.39883       7.247426      0.000000       0.000000      95.39883       7.247426      ?        ?         376.8935 14.45765  0.000000       14.45765  
1 1 1 16 6  6  o 550.7704 17.72452  204.4115       12.99130      202.7303       20.42257      205.5543       16.83713      543.7976 28.28099  550.1924 23.01655  -6.394836      36.46335  
1 1 1 16 6  7  o 169.8206 10.89396  19.37346       2.452184      20.40213       4.101084      18.80102       3.059325      173.0896 18.04563  166.8497 13.88602  6.239944       22.76985  
1 1 1 16 6  8  o 502.5884 12.40844  169.2828       8.310039      173.8254       10.07487      159.6145       14.69806      508.4233 14.88705  484.1519 22.84713  24.27142       27.26931  
1 1 1 16 6  9  o 59.49347 7.691343  2.403112       0.5954862     2.813809       2.342492      2.374738       0.6157131     66.36970 22.36643  59.08586 8.027705  7.283836       23.76344  
1 1 1 16 6  10 o 74.10729 23.13384  3.733570       2.533134      4.484012       4.385559      3.357846       3.103136      85.58258 30.50592  73.61304 25.71136  11.96954       39.89593  
1 1 1 16 6  11 o 216.2596 10.70965  31.42095       3.076598      31.15345       4.624226      31.63340       4.121051      214.1626 16.32705  216.2746 14.38147  -2.111908      21.75774  
1 1 1 16 6  12 o 161.5872 8.102943  17.50580       1.739143      18.08974       2.613416      17.04166       2.329957      163.6543 12.06907  158.9923 11.06669  4.662018       16.37480  
1 1 1 16 6  13 o 256.0079 7.350919  43.85528       2.505063      45.23851       3.217890      41.72750       3.991053      259.6816 9.314522  248.8018 12.07422  10.87973       15.24949  
1 1 1 16 6  14 o 181.4008 4.216861  21.95232       1.019300      22.13758       1.054463      19.31270       3.980242      182.1575 4.344211  167.3690 18.13630  14.78853       18.64934  
1 1 1 16 6  15 o 91.59741 2.937868  5.599633       0.3581186     5.533259       0.3612130     9.423816       2.741808      91.05002 2.981232  116.0616 18.33697  -25.01157      18.57773  
1 1 1 16 6  16 o 192.0573 4.365700  24.61827       1.117270      24.72089       1.129049      19.77666       7.755019      192.4543 4.402624  159.9038 37.11261  32.55051       37.37284  
1 1 1 16 6  17 o 226.1752 3.099274  34.11570       0.9340680     34.22591       0.9524614     31.34447       4.775988      226.5362 3.155267  213.2173 16.94937  13.31892       17.24056  
1 1 1 16 6  18 o 108.8820 2.912680  7.911817       0.4222136     7.971179       0.4240343     1.043590       4.561101      109.2899 2.914305  68.67328 29.01327  40.61665       29.15927  
1 1 1 16 6  19 o 84.72339 9.261770  4.889699       1.028599      4.922486       1.051703      4.167933       4.934405      84.97275 9.447932  82.90539 31.82413  2.067360       33.19697  
1 1 1 16 6  20 o 104.4679 9.131790  7.414151       1.258428      7.500046       1.286597      5.516684       6.047080      105.0412 9.287576  90.98940 35.15060  14.05182       36.35690  
1 1 1 16 6  21 o 138.4489 7.082523  12.91680       1.302283      13.33749       1.481722      11.48858       2.730105      140.4878 7.947480  127.4010 16.46650  13.08679       18.28409  
1 1 1 16 6  22 o 117.4639 11.04529  9.510790       1.708552      7.739716       3.021757      10.34307       2.071460      100.4949 23.05595  121.7951 12.96251  -21.30023      26.45002  
1 1 1 16 6  23 o 132.6078 10.80444  12.15162       1.892639      10.32043       3.552833      12.87719       2.236380      114.4630 24.05882  135.7254 12.50600  -21.26241      27.11507  
1 1 1 16 6  24 o 114.0601 9.573935  8.986812       1.441700      6.187064       2.768488      10.02857       1.688753      87.17030 23.36167  120.0295 10.66963  -32.85922      25.68284  
1 1 1 16 6  25 o 59.76486 11.11230  2.569139       0.8523955     3.347182       1.393600      2.104072       1.077443      66.29773 15.96639  52.98432 14.72994  13.31341       21.72319  
1 1 1 16 6  26 o 49.54800 15.06316  1.861683       1.082594      1.426369       1.612302      2.219083       1.460906      46.99974 18.15199  53.53727 17.65433  -6.537529      25.32134  
1 1 1 16 6  27 o 59.32171 12.34970  2.626789       0.9444296     1.721480       2.972492      2.728440       0.9960409     53.99828 23.13707  60.26526 12.79900  -6.266979      26.44122  
1 1 1 16 6  28 o 38.42364 18.92240  -4.476262      3.429027      -4.240875      3.876351      -5.323212      7.352949      41.49994 20.37394  53.13384 26.43615  -11.63390      33.37615  
1 1 1 16 6  29 o 30.43038 14.48981  -1.372843      1.616428      -0.8763753     4.573238      -1.443722      1.727964      49.43629 23.76159  31.35616 14.94486  18.08014       28.07066  
1 1 1 16 6  30 o 23.19714 11.60426  -3.484471      1.502000      -2.812810      7.423291      -3.513143      1.533723      52.10729 26.02564  23.50159 11.75202  28.60570       28.55598  
1 1 1 16 7  0  o 309.9622 12.77098  64.49514       5.254403      64.49514       5.254403      64.49514       5.254403      309.9622 12.77098  309.9622 12.77098  0.000000       0.000000  
1 1 1 16 7  1  o 91.66486 18.18349  5.849158       2.142583      3.786717       2.577489      10.46140       3.854449      74.94596 23.32618  122.1017 24.54225  -47.15570      33.85901  
1 1 1 16 7  2  o 193.7846 9.804975  25.15820       2.523630      25.29615       4.250091      25.08308       3.136404      193.3208 16.66096  193.1969 12.24613  0.1238403      20.67741  
1 1 1 16 7  3  o 326.2981 8.255892  71.13589       3.586766      69.66341       4.130396      75.65129       7.232932      322.7397 9.615022  335.1797 16.24269  -12.43997      18.87521  
1 1 1 16 7  4  o 542.2856 15.94701  197.7375       11.51089      230.1537       31.63427      192.7904       12.35805      570.1823 41.92940  535.0011 17.35789  35.18115       45.38029  
1 1 1 16 7  5  o 78.39359 7.798152  4.143425       0.8038117     0.000000       0.000000      4.143425       0.8038117     ?        ?         78.39359 7.798152  0.000000       7.798152  
1 1 1 16 7  6  o 155.8536 3.586152  16.19128       0.7447646     27.74953       8.844121      16.10874       0.7474194     197.1662 34.94170  155.4553 3.608155  41.71085       35.12749  
1 1 1 16 7  7  o 368.5045 10.82005  90.96622       5.307317      88.64259       7.160659      93.79869       7.905915      362.8997 14.83918  373.0334 15.94166  -10.13376      21.77929  
1 1 1 16 7  8  o 563.7495 12.14741  213.0734       9.125222      223.2603       11.99251      199.0643       14.06353      575.6823 15.64792  541.9108 19.50753  33.77148       25.00802  
1 1 1 16 7  9  o 223.9434 9.213026  33.60122       2.743379      37.71283       11.52001      33.35402       2.824641      227.2258 39.47901  223.0739 9.524491  4.151917       40.61168  
1 1 1 16 7  10 o 89.16601 11.84732  5.426950       1.372844      8.386189       2.778415      4.471100       1.579072      109.5089 19.76753  80.13392 15.34672  29.37502       25.02553  
1 1 1 16 7  11 o 121.4634 12.82917  10.02850       2.045094      11.11651       5.316792      9.839572       2.215551      123.3422 32.05860  120.0493 14.11964  3.292969       35.03024  
1 1 1 16 7  12 o 315.1502 8.822129  66.55023       3.701153      67.43505       5.273236      65.69112       5.196058      316.3304 12.53498  312.2126 12.51500  4.117706       17.71301  
1 1 1 16 7  13 o 181.1342 6.560120  21.95405       1.580767      23.93288       1.841978      16.42338       3.079422      189.0337 7.326470  155.0750 15.09305  33.95871       16.77729  
1 1 1 16 7  14 o 324.5608 8.555826  70.63372       3.697026      72.79568       4.297078      64.47353       7.253484      329.1659 9.807753  306.8110 17.81866  22.35495       20.33953  
1 1 1 16 7  15 o 313.6837 6.827595  65.82497       2.853863      67.60260       3.188928      58.67441       6.395799      317.7514 7.531538  292.8889 16.45387  24.86255       18.09569  
1 1 1 16 7  16 o 257.2672 3.452265  44.14814       1.183483      43.75420       1.202627      56.22671       6.659275      256.1106 3.523952  285.7759 17.57248  -29.66528      17.92234  
1 1 1 16 7  17 o 104.3326 2.242495  7.256303       0.3117633     7.259699       0.3127957     6.744454       3.840250      104.3568 2.249399  95.47977 28.22087  8.877045       28.31038  
1 1 1 16 7  18 o 291.4301 8.363647  57.10136       3.244548      57.04301       3.451771      57.54401       9.507325      291.1045 8.909042  282.2769 25.55256  8.827637       27.06112  
1 1 1 16 7  19 o 314.6804 9.151368  66.78040       3.833255      67.16369       4.493639      65.75618       7.345579      314.8762 10.72554  306.9864 18.03645  7.889740       20.98454  
1 1 1 16 7  20 o 120.8341 6.822113  9.830907       1.093993      9.981137       1.130938      7.643576       4.315357      121.7229 7.002117  98.84112 30.07915  22.88180       30.88341  
1 1 1 16 7  21 o 93.59146 6.740561  5.916800       0.8350009     5.971702       0.8707155     5.288446       2.945692      93.97618 7.003560  83.16508 24.75049  10.81110       25.72230  
1 1 1 16 7  22 o 160.6685 15.17909  18.26727       3.211227      17.12290       3.841906      20.92016       5.849548      152.8505 19.29170  161.4960 28.20835  -8.645569      34.17427  
1 1 1 16 7  23 o 120.3624 11.71310  10.11977       1.854874      7.128551       3.130988      11.73728       2.302401      93.67893 24.72517  128.6889 13.63373  -35.01002      28.23495  
1 1 1 16 7  24 o 63.98729 14.13403  3.022123       1.172929      2.531882       3.082926      3.105096       1.268309      62.01204 24.74897  64.53614 15.02969  -2.524105      28.95520  
1 1 1 16 7  25 o 33.27858 13.76398  0.3496962      0.9943680     -0.5632995     1.316682      1.561619       1.516994      31.41581 14.30438  48.05027 17.81904  -16.63446      22.85024  
1 1 1 16 7  26 o 44.01447 14.86642  1.411174       1.034897      5.661625       2.002280      -0.1382173     1.208893      83.75425 18.44093  32.14556 14.24038  51.60869       23.29927  
1 1 1 16 7  27 o 41.45183 16.51470  0.9919494      1.370385      1.475558       3.374648      0.8964533      1.499596      54.07274 23.88087  41.63991 17.02800  12.43283       29.33000  
1 1 1 16 7  28 o 58.00340 24.99121  2.797912       3.504412      1.472667       4.357805      5.223584       5.895706      55.38825 25.51755  66.50867 30.27752  -11.12043      39.59639  
1 1 1 16 7  29 o 76.83281 7.872751  4.161942       0.7946357     8.245097       6.345998      4.096899       0.8009397     69.93157 31.66819  76.15081 8.013124  -6.219238      32.66626  
1 1 1 16 8  0  o 415.1053 13.14068  115.4863       7.252069      115.4863       7.252069      115.4863       7.252069      415.1053 13.14068  415.1053 13.14068  0.000000       0.000000  
1 1 1 16 8  1  o 345.9769 8.396221  79.94421       3.870834      74.26458       5.465368      85.66064       5.483047      332.7691 12.34686  357.5692 11.52274  -24.80011      16.88841  
1 1 1 16 8  2  o 264.0726 9.694819  46.67617       3.405640      43.78722       4.723546      49.80375       4.914748      255.1205 13.94776  272.1951 13.59327  -17.07468      19.47606  
1 1 1 16 8  3  f 226.8607 9.130086  34.44675       2.754354      34.97206       3.439720      33.50798       4.598257      228.3060 11.34212  222.7656 15.58911  5.540329       19.27859  
1 1 1 16 8  4  o 190.8211 6.548961  24.32726       1.662755      11.35039       5.197901      25.80655       1.754970      125.8694 31.15895  196.5306 6.711255  -70.66118      31.87352  
1 1 1 16 8  5  o 331.5357 7.038071  73.37338       3.109263      41.88163       11.39848      75.90500       3.231824      242.2966 36.43074  337.1924 7.192775  -94.89581      37.13401  
1 1 1 16 8  6  o 315.6766 5.978711  66.49176       2.514916      0.000000       0.000000      66.49176       2.514916      ?        ?         315.6766 5.978711  0.000000       5.978711  
1 1 1 16 8  7  o 194.4230 12.29343  25.45273       3.168581      27.02108       8.096970      25.16912       3.443171      194.6790 32.34731  193.1298 13.46369  1.549225       35.03740  
1 1 1 16 8  8  f 364.1213 7.729820  88.58810       3.750498      94.20917       5.196847      82.47827       5.418077      374.9186 10.41238  350.5241 11.61593  24.39456       15.59960  
1 1 1 16 8  9  o 329.5623 11.22668  72.92305       4.922977      71.88731       6.449497      74.36898       7.620351      326.2669 14.87384  331.0744 17.33370  -4.807526      22.84050  
1 1 1 16 8  10 o 683.3654 3.433131  311.3460       3.126201      291.3267       18.86566      311.9113       3.170027      652.1312 21.74058  683.9793 3.478136  -31.84808      22.01704  
1 1 1 16 8  11 f 375.1010 10.96078  94.53279       5.472642      95.24236       8.324257      93.99265       7.262838      374.4426 16.72570  372.8069 14.64857  1.635712       22.23352  
1 1 1 16 8  12 o 299.5450 8.528098  60.13070       3.400522      51.33057       4.380902      73.46980       5.393644      275.9554 11.94209  330.1303 12.28234  -54.17490      17.13095  
1 1 1 16 8  13 o 144.5365 6.162402  13.98429       1.184140      13.88540       1.250368      14.84435       3.687360      143.9816 6.534176  146.0032 19.43537  -2.021652      20.50437  
1 1 1 16 8  14 o 168.3029 4.108904  18.89952       0.9214910     18.74667       0.9549138     20.96910       3.513746      167.5563 4.280412  175.0690 15.21306  -7.512695      15.80377  
1 1 1 16 8  15 o 250.1049 6.130364  41.82315       2.043064      41.04598       2.128557      50.91902       7.281965      247.6397 6.455977  270.5708 20.34639  -22.93112      21.34608  
1 1 1 16 8  16 o 257.5792 3.603161  44.26334       1.236710      44.17862       1.247404      49.14150       9.465098      257.3293 3.637848  260.3925 27.70344  -3.063263      27.94127  
1 1 1 16 8  17 o 274.5931 11.03240  51.00877       4.028543      50.23146       4.670781      53.26666       7.960615      271.7206 12.93727  274.6254 21.93588  -2.904755      25.46676  
1 1 1 16 8  18 o 127.1693 5.969900  10.84748       1.008809      10.65584       1.024138      17.10562       5.852549      126.0173 6.117219  149.6139 30.39430  -23.59663      31.00377  
1 1 1 16 8  19 o 157.5341 7.653924  16.71691       1.601882      15.82387       1.658169      29.20504       6.200741      153.1448 8.154960  200.1231 23.71294  -46.97836      25.07603  
1 1 1 16 8  20 o 27.79959 11.59310  0.1264907      0.7137202     -0.1490006E-01 0.7293019     3.329722       3.471291      26.74276 11.45960  71.76433 26.88742  -45.02157      29.22765  
1 1 1 16 8  21 o 103.7269 13.83468  7.575859       1.864566      9.332397       2.452653      5.170568       2.870060      114.0398 16.62933  81.84257 24.44852  32.19724       29.56797  
1 1 1 16 8  22 o 34.91265 15.79702  -0.6630864     1.575206      -1.933648      1.779810      3.929553       3.383818      32.23854 15.30892  72.79808 26.67970  -40.55954      30.75986  
1 1 1 16 8  23 o 71.97256 25.42886  4.109281       3.041332      2.925735       3.434304      8.411263       6.547574      66.00374 26.19339  92.47399 36.33165  -26.47025      44.78931  
1 1 1 16 8  24 o 69.31177 14.96270  3.594610       1.341402      3.359186       1.373561      8.446378       6.235515      66.61845 15.72717  88.58527 35.24920  -21.96682      38.59858  
1 1 1 16 8  25 o 56.31426 13.60716  2.383979       1.009588      2.715887       1.482789      2.097134       1.378460      58.68770 17.58278  52.38272 17.14241  6.304977       24.55639  
1 1 1 16 8  26 o 43.84142 16.43350  1.296811       1.297060      -0.7572443     2.353530      2.192818       1.554424      40.49814 18.69171  52.87466 18.21198  -12.37652      26.09706  
1 1 1 16 8  27 o 24.69786 12.07130  -2.111481      1.315479      -5.086115      5.390223      -1.923092      1.356496      47.62943 23.50688  25.83005 12.54198  21.79938       26.64348  
1 1 1 16 8  28 o 57.64091 23.49862  3.015473       2.845048      7.053758       4.369753      0.4403978E-01  3.748361      73.99617 29.48704  49.04741 22.95677  24.94876       37.36976  
1 1 1 16 8  29 o 27.44127 12.78250  -0.6825070     1.139650      4.750993       3.182871      -1.481550      1.220574      64.96827 25.38840  25.15908 12.13881  39.80919       28.14110  
1 1 1 16 9  0  o 522.7347 25.60029  185.6651       17.73402      185.6651       17.73402      185.6651       17.73402      522.7347 25.60029  522.7347 25.60029  0.000000       0.000000  
1 1 1 16 9  1  o 217.3375 6.565323  31.55298       1.899180      36.60529       7.726226      31.22808       1.959294      230.1431 25.62819  216.1933 6.809668  13.94980       26.51746  
1 1 1 16 9  2  o 356.4853 9.596536  85.04043       4.554434      83.63963       6.335983      86.53804       6.551299      352.7810 13.50324  358.7986 13.72793  -6.017578      19.25600  
1 1 1 16 9  3  o 239.2514 7.501729  38.26276       2.388649      38.23413       3.818254      38.28116       3.061764      238.5468 12.05111  239.0559 9.631385  -0.5091248     15.42701  
1 1 1 16 9  4  o 120.4582 4.581658  9.690168       0.7340747     8.811110       1.941863      9.836734       0.7929128     113.8607 13.03345  121.3460 4.913892  -7.485260      13.92900  
1 1 1 16 9  5  o 150.8749 1.804539  15.16844       0.3627912     25.26916       8.209559      15.14868       0.3631459     187.4163 34.12999  150.7766 1.807482  36.63971       34.17782  
1 1 1 16 9  6  f 608.1457 15.12520  249.0756       12.25695      0.000000       0.000000      249.0756       12.25695      ?        ?         608.1457 15.12520  0.000000       15.12520  
1 1 1 16 9  7  o 116.9823 16.15447  9.405731       2.451031      8.941137       6.020295      9.498039       2.683499      112.4444 35.74014  117.2096 17.73547  -4.765244      39.89867  
1 1 1 16 9  8  o 94.80750 19.41714  6.324009       2.370424      7.379869       2.992813      4.546674       3.882944      101.9316 22.62479  83.77666 28.78685  18.15495       36.61371  
1 1 1 16 9  9  o 240.4812 5.991266  38.61238       1.919876      38.67408       3.925096      38.59297       2.201159      239.5440 12.33836  240.2418 6.882991  -0.6978149     14.12836  
1 1 1 16 9  10 o 423.0484 10.72415  120.1969       6.040545      114.4665       8.500902      126.0412       8.584957      411.0321 15.54889  431.6091 14.94962  -20.57700      21.56987  
1 1 1 16 9  11 o 137.3307 8.044827  12.66503       1.465722      12.44272       2.010457      12.91724       2.141424      135.6100 11.22625  138.0900 11.74916  -2.479919      16.25028  
1 1 1 16 9  12 o 70.49135 9.096533  3.385781       0.8345477     2.898585       0.9062162     6.105586       2.141158      64.80885 10.87867  93.11909 17.90606  -28.31023      20.95167  
1 1 1 16 9  13 o 470.8871 9.490723  148.8585       5.955108      141.3155       6.706996      176.9557       12.94459      458.2137 10.98466  507.1935 19.18779  -48.97974      22.10959  
1 1 1 16 9  14 o 140.6702 2.944792  13.19461       0.5519889     13.03662       0.5571713     21.56954       4.056549      139.8237 2.990434  176.6664 17.45980  -36.84267      17.71404  
1 1 1 16 9  15 o 166.6540 5.721822  18.58716       1.268759      18.63447       1.311475      17.89613       5.012024      166.8417 5.908375  157.5883 24.67723  9.253372       25.37469  
1 1 1 16 9  16 o 155.2933 3.671240  16.09146       0.7596946     16.07381       0.7756466     16.50753       3.765234      155.2030 3.750508  153.4286 18.80975  1.774445       19.18001  
1 1 1 16 9  17 o 307.8958 6.702286  63.51197       2.749794      63.84199       2.865004      59.65435       9.795221      308.6262 6.966569  286.6803 25.92125  21.94583       26.84110  
1 1 1 16 9  18 o 28.67506 11.74316  0.2048802      0.7144944     0.2583366      0.7209063     -2.760229      5.369070      29.34039 11.87746  61.42249 28.30708  -32.08209      30.69796  
1 1 1 16 9  19 o 147.2560 5.018124  14.52467       0.9832250     14.38168       0.9947765     20.57488       6.470619      146.5152 5.103086  161.4216 31.21140  -14.90637      31.62582  
1 1 1 16 9  20 o 146.6084 10.60651  14.71292       2.058063      16.86695       3.008182      12.81750       2.821829      155.1819 14.72368  134.4790 16.06455  20.70297       21.79121  
1 1 1 16 9  21 o 53.39140 19.01343  1.880532       1.703254      3.756911       2.146142      -1.312425      2.799592      70.51844 21.15925  45.08646 20.65377  25.43198       29.56843  
1 1 1 16 9  22 o 160.0324 12.76722  17.97891       2.700003      18.70103       3.365410      16.67457       4.523018      161.0404 15.88984  145.1084 24.24661  15.93196       28.98940  
1 1 1 16 9  23 o 65.36664 24.12855  3.258598       2.775769      5.968606       3.586296      -0.7906252     4.383759      82.37962 27.67407  55.75990 25.65416  26.61972       37.73579  
1 1 1 16 9  24 o 105.4547 10.59309  7.843266       1.468405      7.781478       1.501185      9.211911       7.065252      104.8665 10.90190  87.39983 36.46371  17.46662       38.05856  
1 1 1 16 9  25 o 26.84523 13.13665  -2.582073      1.571860      1.620304       3.483452      -3.656507      1.761376      56.30643 24.58250  26.44428 13.11997  29.86215       27.86455  
1 1 1 16 9  26 o 23.29231 11.29554  -1.600163      1.091219      0.3930215      4.639180      -1.716899      1.122720      55.37375 25.79252  23.34856 11.35384  32.02519       28.18091  
1 1 1 16 9  27 o 34.65356 13.90349  0.6072107      0.9782395     8.091680       4.205090      0.1789938      1.005835      81.84489 29.78102  31.34621 13.44559  50.49869       32.67558  
1 1 1 16 9  28 o 45.81340 21.73622  -0.7565119     3.572740      1.873281       6.730191      -1.788386      4.215800      58.23492 28.19596  46.29212 22.38999  11.94279       36.00450  
1 1 1 16 10 0  o 197.3576 16.94600  26.68409       4.377872      26.68409       4.377872      26.68409       4.377872      197.3576 16.94600  197.3576 16.94600  0.000000       0.000000  
1 1 1 16 10 1  o 128.9837 14.90991  11.34120       2.515490      12.19769       5.159048      11.07406       2.881188      130.1422 30.31530  126.8938 17.50540  3.248322       35.00652  
1 1 1 16 10 2  o 409.8200 8.675243  112.2915       4.737491      103.6888       7.952363      117.0243       5.898402      392.0965 15.24960  417.8758 10.60143  -25.77933      18.57258  
1 1 1 16 10 3  o 403.0009 9.766134  108.7011       5.244477      136.6598       12.63889      102.8859       5.764142      447.6116 21.25083  391.6696 11.05544  55.94199       23.95455  
1 1 1 16 10 4  o 401.1546 8.297724  107.5851       4.435517      103.6309       10.30990      108.4833       4.913477      390.0857 19.90025  402.6758 9.157141  -12.59015      21.90601  
1 1 1 16 10 5  o 210.4767 9.777729  29.72477       2.734810      30.67771       6.076285      29.48269       3.062536      210.9157 21.94029  209.4181 11.01344  1.497574       24.54938  
1 1 1 16 10 6  o 262.8553 7.616306  46.21859       2.664872      0.000000       0.000000      46.21859       2.664872      ?        ?         262.8553 7.616306  0.000000       7.616306  
1 1 1 16 10 7  f 214.9945 12.09075  31.15312       3.449853      0.000000       0.000000      31.15312       3.449853      ?        ?         214.9945 12.09075  0.000000       12.09075  
1 1 1 16 10 8  o 129.5355 20.75391  11.74033       3.461394      22.37834       8.642768      9.708059       3.777584      172.5880 38.55466  116.3869 25.09688  56.20111       46.00342  
1 1 1 16 10 9  o 375.3907 14.32683  95.30445       7.153349      95.32343       7.668775      95.17730       19.84710      375.0049 15.37935  355.3024 42.78018  19.70255       45.46062  
1 1 1 16 10 10 o 78.32427 10.07936  4.183398       1.027609      4.369269       1.257989      3.810643       1.781487      79.66116 12.24221  73.33665 18.29214  6.324501       22.01077  
1 1 1 16 10 11 o 133.1084 8.101566  11.90854       1.430166      10.56102       1.850041      13.90972       2.254533      124.7947 11.24582  143.2163 11.92185  -18.42161      16.38899  
1 1 1 16 10 12 o 335.2933 9.201265  75.49934       4.107100      74.48469       4.741359      78.54903       8.219983      332.5635 10.71326  338.0945 18.31402  -5.530975      21.21738  
1 1 1 16 10 13 o 47.42802 9.295214  1.562090       0.5664322     1.043321       0.5852905     9.225491       2.249547      38.81823 10.88040  115.5813 14.95642  -76.76305      18.49533  
1 1 1 16 10 14 o 194.8748 1.918956  25.31136       0.4983039     25.39216       0.5011972     18.37303       4.644258      195.1853 1.927028  160.8206 22.26900  34.36476       22.35222  
1 1 1 16 10 15 o 155.4866 7.615776  16.24773       1.573104      16.41157       1.604903      12.23562       7.941952      156.2498 7.732268  123.8808 41.17436  32.36901       41.89410  
1 1 1 16 10 16 o 166.8005 4.226099  18.58892       0.9385571     18.45655       0.9569922     21.92584       4.804840      166.1942 4.325023  175.7692 20.92489  -9.575089      21.36719  
1 1 1 16 10 17 o 181.0849 2.024230  21.86014       0.4884451     21.86132       0.4897218     21.63333       6.768785      181.0896 2.029469  167.3217 31.51471  13.76787       31.57999  
1 1 1 16 10 18 o 71.63169 7.746400  3.490503       0.7276492     3.322929       0.7423390     7.599373       3.675863      69.79610 8.134007  99.33372 27.04787  -29.53762      28.24446  
1 1 1 16 10 19 o 22.01909 10.91004  -2.750292      1.202854      -2.846294      1.238870      -1.170813      5.025073      22.30190 11.05404  62.15480 28.15998  -39.85290      30.25188  
1 1 1 16 10 20 o 43.36798 19.20570  -0.3636898     2.197170      -0.6656199     3.959310      -0.2293326     2.641172      56.21050 25.27382  48.00152 21.16625  8.208984       32.96629  
1 1 1 16 10 21 o 100.5053 17.76687  7.476062       2.292419      8.040031       2.862053      6.466662       3.828965      101.9472 21.73274  87.81593 28.55929  14.13126       35.88795  
1 1 1 16 10 22 o 57.40704 20.49978  2.355210       1.981294      2.119130       2.203579      3.351449       4.526691      56.49503 21.36687  70.71494 29.31824  -14.21991      36.27813  
1 1 1 16 10 23 o 48.48101 20.79555  0.7096524      2.406107      0.3239295      2.688456      2.262080       5.393504      48.63407 21.40348  67.00681 29.85807  -18.37274      36.73708  
1 1 1 16 10 24 o 80.68546 18.03987  5.170791       1.890802      6.035056       1.983073      -3.473479      6.271613      87.69958 17.58212  55.80249 27.06555  31.89710       32.27499  
1 1 1 16 10 25 o 63.41311 26.35886  3.396416       3.672302      3.149073       3.776671      7.686911       15.72944      62.50151 26.40303  74.76939 37.42513  -12.26788      45.80131  
1 1 1 16 10 26 o 54.70575 21.61792  2.352886       2.330075      -0.5671517     3.106683      6.107683       3.522865      45.58897 21.19152  75.76237 27.30122  -30.17340      34.56062  
1 1 1 16 10 27 o 31.57105 14.05738  -0.9778977E-01 1.193198      1.611978       4.203545      -0.2476249     1.244383      54.80091 25.17940  31.29862 14.11241  23.50229       28.86455  
1 1 1 16 10 28 o 50.93026 8.645329  1.872682       0.5657635     -2.900703      6.998622      1.904081       0.5676212     51.98929 25.85421  51.38740 8.592654  0.6018867      27.24470  
1 1 1 16 11 0  o 65.32655 33.39647  4.297268       3.671969      4.297268       3.671969      4.297268       3.671969      65.32655 33.39647  65.32655 33.39647  0.000000       0.000000  
1 1 1 16 11 1  o 203.8095 12.82396  28.02794       3.465077      23.68583       7.037479      29.41748       3.981094      182.1158 30.04679  208.4794 14.41948  -26.36365      33.32763  
1 1 1 16 11 2  o 573.5920 10.89117  220.6276       8.324363      210.4680       15.08706      225.0742       9.981176      555.3937 20.42068  578.5732 12.94643  -23.17957      24.17879  
1 1 1 16 11 3  o 294.9854 5.904706  58.08869       2.320985      65.44546       4.952337      56.01797       2.627403      311.9492 11.93589  289.5869 6.808856  22.36221       13.74140  
1 1 1 16 11 4  o 250.0322 10.30013  41.97667       3.424375      38.27780       5.654033      44.11948       4.303440      236.8258 18.05265  255.8460 12.66237  -19.02019      22.05071  
1 1 1 16 11 5  o 220.2664 6.558324  32.43746       1.922785      27.80818       3.364119      34.68345       2.343252      202.9706 12.49904  227.6193 7.736920  -24.64877      14.69986  
1 1 1 16 11 6  o 199.4528 10.55473  26.76390       2.795193      0.000000       0.000000      26.76390       2.795193      ?        ?         199.4528 10.55473  0.000000       10.55473  
1 1 1 16 11 7  o 154.8766 9.889564  16.14946       2.030306      0.000000       0.000000      16.14946       2.030306      ?        ?         154.8766 9.889564  0.000000       9.889564  
1 1 1 16 11 8  o 297.0778 17.14234  60.20570       6.757182      48.10252       12.25950      65.48713       8.098381      254.6566 37.22794  308.6948 19.79199  -54.03816      42.16210  
1 1 1 16 11 9  o 41.90428 19.42506  -2.078653      2.582941      -4.227326      3.960512      -0.4883547     3.407261      48.84939 23.09025  55.46367 24.26123  -6.614277      33.49279  
1 1 1 16 11 10 o 147.2970 7.767735  14.56613       1.519232      12.10184       2.294552      16.48968       2.027231      133.2332 13.09340  156.4151 9.775240  -23.18193      16.33990  
1 1 1 16 11 11 o 226.4784 6.360428  34.32217       1.917593      36.29380       2.541603      31.71666       2.921729      232.5665 8.214282  216.9779 10.13333  15.58859       13.04449  
1 1 1 16 11 12 o 190.8542 4.906669  24.33985       1.246814      23.61567       1.294760      33.57833       4.624492      187.9606 5.174427  221.3859 15.77964  -33.42529      16.60638  
1 1 1 16 11 13 o 50.95648 8.324056  1.786379       0.5457118     1.868376       0.5622519     0.4538879      2.266536      52.12951 8.378001  49.34409 20.62459  2.785423       22.26128  
1 1 1 16 11 14 o 48.48764 15.72047  1.567146       1.160660      0.9635705      1.243797      5.634692       3.228865      42.90392 16.09037  87.75295 25.86147  -44.84903      30.45843  
1 1 1 16 11 15 o 295.7950 7.858148  58.77127       3.094566      62.82500       3.524065      45.11526       6.468126      305.5675 8.663669  253.9387 19.25867  51.62880       21.11766  
1 1 1 16 11 16 o 108.2756 4.929590  7.852958       0.7093723     7.931888       0.7156336     3.401370       5.374367      108.8173 4.948314  80.89376 32.54246  27.92355       32.91652  
1 1 1 16 11 17 o 258.5062 5.401069  44.72783       1.860477      44.99706       1.901585      38.70199       8.996308      259.2602 5.504353  223.4828 31.04703  35.77733       31.53119  
1 1 1 16 11 18 o 30.67549 13.52513  -0.2557131     1.078202      -0.6725059E-01 1.127260      -2.280650      3.695024      32.69345 14.13052  50.16276 23.24644  -17.46931      27.20420  
1 1 1 16 11 19 o 167.3994 9.621145  19.11026       2.137081      19.33480       2.199951      15.34927       9.003602      168.2890 9.853445  123.0577 43.72603  45.23128       44.82250  
1 1 1 16 11 20 o 77.32404 22.64968  4.661270       2.483078      7.728933       3.925569      2.615253       3.205925      95.93597 28.57715  64.82901 25.43699  31.10696       38.25826  
1 1 1 16 11 21 o 85.95039 18.84905  5.644211       2.099226      10.36757       2.963488      0.8871343      2.974047      116.6215 19.77580  54.14172 23.16959  62.47981       30.46166  
1 1 1 16 11 22 o 95.97385 17.54103  7.008970       2.160632      7.008134       2.332758      7.014012       5.731126      94.89968 19.10900  84.26275 33.70541  10.63693       38.74543  
1 1 1 16 11 23 o 118.8829 13.09017  10.25647       2.039383      9.561782       2.115632      19.37620       7.665436      113.9123 14.24865  120.8839 40.45747  -6.971512      42.89325  
1 1 1 16 11 24 o 41.94528 19.64380  -1.304098      2.751112      -3.268128      3.690197      1.153356       4.127797      43.42652 20.99034  56.81660 25.65289  -13.39008      33.14612  
1 1 1 16 11 25 o 44.19885 20.00607  -0.2863847E-01 2.529196      -0.2656412     2.692084      1.753954       7.383086      44.38183 20.30176  63.72018 30.51195  -19.33835      36.64888  
1 1 1 16 11 26 o 67.00822 7.575778  3.143013       0.6645903     2.676597       3.294084      3.162803       0.6785436     57.35836 24.46078  67.15917 7.722660  -9.800812      25.65091  
1 1 1 16 11 27 o 75.97691 9.948868  4.190582       0.9830548     -1.517382      4.859601      4.434128       1.003808      49.11026 23.82084  78.24407 9.845233  -29.13382      25.77520  
1 1 1 16 12 0  o 678.1786 39.48058  324.2543       35.39891      324.2543       35.39891      324.2543       35.39891      678.1786 39.48058  678.1786 39.48058  0.000000       0.000000  
1 1 1 16 12 1  o 275.4449 10.53351  50.97429       3.859050      37.86116       10.11292      53.20920       4.174973      228.1224 34.33186  281.2843 11.16086  -53.16194      36.10043  
1 1 1 16 12 2  o 394.0311 8.916145  103.9665       4.681458      97.56445       14.26785      104.7389       4.955819      371.8960 29.02108  395.3797 9.406489  -23.48367      30.50746  
1 1 1 16 12 3  o 270.9791 3.911921  48.97176       1.412536      49.95981       3.444199      48.77197       1.548779      272.8783 9.486516  270.3980 4.298456  2.480255       10.41493  
1 1 1 16 12 4  o 399.7700 9.659556  107.1421       5.145658      105.9270       8.970464      107.7379       6.281935      394.5510 17.10295  400.1040 11.79564  -5.552979      20.77614  
1 1 1 16 12 5  o 321.6275 9.009093  69.36084       3.857267      74.39513       6.073732      65.95799       4.993539      331.7146 13.77092  312.8615 12.00021  18.85306       18.26590  
1 1 1 16 12 6  o 249.8324 8.786402  41.86892       2.920497      42.09428       13.50006      41.85786       2.991332      232.1033 45.27615  249.7572 9.002935  -17.65398      46.16256  
1 1 1 16 12 7  o 326.2080 23.81538  74.30077       10.28071      0.000000       0.000000      74.30077       10.28071      ?        ?         326.2080 23.81538  0.000000       23.81538  
1 1 1 16 12 8  o 110.3614 26.98326  8.909498       3.934409      3.826626       5.429689      14.52876       5.709001      85.33342 33.21336  139.7976 31.41454  -54.46422      45.71652  
1 1 1 16 12 9  o 156.5384 12.17079  16.62907       2.518775      15.93571       2.632603      24.13090       8.659431      153.0146 13.03557  177.1719 37.83018  -24.15733      40.01310  
1 1 1 16 12 10 o 134.2327 14.34282  12.36083       2.525757      7.059601       6.352447      13.35626       2.752697      101.5349 36.65149  139.3906 15.05888  -37.85570      39.62450  
1 1 1 16 12 11 o 141.7195 7.100267  13.48011       1.336572      11.72078       1.542919      18.76966       2.675339      131.8474 8.833055  166.2300 12.16219  -34.38264      15.03136  
1 1 1 16 12 12 o 162.9949 3.939990  17.72925       0.8557417     17.40315       0.8949882     21.20466       2.921798      161.4204 4.164358  176.5550 12.50011  -15.13452      13.17553  
1 1 1 16 12 13 f 114.1022 3.595540  8.695406       0.5459955     8.766076       0.5507132     4.623486       4.180285      114.5641 3.611989  83.18954 29.76880  31.37455       29.98712  
1 1 1 16 12 14 o 87.82870 9.361699  5.251785       1.078764      5.670528       1.149781      2.172765       3.117793      91.25161 9.599470  64.87436 25.19106  26.37725       26.95810  
1 1 1 16 12 15 o 185.7960 8.410153  23.27049       2.076760      21.97963       2.480313      26.29786       3.798388      180.0061 10.38468  195.2689 14.70604  -15.26285      18.00304  
1 1 1 16 12 16 o 104.9291 8.322334  7.461201       1.154105      7.166054       1.174171      15.87576       6.269433      102.7486 8.656379  139.7295 33.99969  -36.98086      35.08435  
1 1 1 16 12 17 o 70.76423 6.045015  3.382796       0.5645594     3.413608       0.5672925     0.2081367      5.758308      71.08788 6.046087  70.05219 31.05381  1.035690       31.63691  
1 1 1 16 12 18 o 32.29840 12.08123  0.5552878      0.7002430     0.4566144      0.7034776     11.21122       7.310484      31.14010 11.99987  110.1620 39.37307  -79.02191      41.16109  
1 1 1 16 12 19 o 39.85584 12.73572  1.089218       0.7636369     1.309967       0.7938480     -1.646568      2.794661      43.07273 12.85595  43.74200 20.25205  -0.6692734     23.98794  
1 1 1 16 12 20 f 130.6616 14.01851  12.17771       2.402632      13.03731       3.168006      11.01388       3.686244      132.1888 18.49042  116.7973 24.46996  15.39151       30.67042  
1 1 1 16 12 21 o 63.95688 17.88200  3.152044       1.583027      6.279418       2.450413      0.9119388      2.073880      88.57528 21.06949  47.62428 19.80320  40.95100       28.91523  
1 1 1 16 12 22 o 36.52401 17.76121  -3.625717      2.747952      -13.06076      7.385345      -2.109584      2.960518      50.02796 25.12581  42.00492 19.88726  8.023033       32.04387  
1 1 1 16 12 23 o 62.77144 23.81956  3.295024       2.743903      3.579178       3.083919      2.215368       6.011309      64.67478 25.07032  64.98443 29.94995  -0.3096466     39.05791  
1 1 1 16 12 24 o 88.46706 6.039732  5.346985       0.7077179     2.850787       2.263088      5.617562       0.7450881     58.61531 21.75912  90.62487 6.207508  -32.00956      22.62725  
1 1 1 16 12 25 o 66.33969 10.51149  3.201169       0.8982641     2.591093       2.972433      3.262483       0.9423222     56.98283 23.70259  66.74084 10.97711  -9.758011      26.12106  
1 1 1 16 12 26 o 61.70343 24.77421  3.822538       3.108330      -0.8888575     4.220597      9.406652       4.594903      48.56265 23.20386  83.60744 31.01076  -35.04480      38.73095  
1 1 1 16 12 27 o 22.62232 10.54023  -0.5576376     0.7756104     -2.541540      4.894512      -0.5065361     0.7855361     47.14602 23.09386  23.10176 10.71019  24.04426       25.45652  
1 1 1 16 13 0  o 164.8649 7.627770  18.26316       1.667514      18.26316       1.667514      18.26316       1.667514      164.8649 7.627770  164.8649 7.627770  0.000000       0.000000  
1 1 1 16 13 1  o 157.1050 2.598980  16.45272       0.5440848     19.19281       1.983486      16.22977       0.5657873     169.0177 8.837612  156.0332 2.721213  12.98448       9.247074  
1 1 1 16 13 2  o 125.7869 1.594354  10.54378       0.2672352     6.796219       4.251125      10.55864       0.2677648     97.29747 29.90177  125.8755 1.596389  -28.57807      29.94436  
1 1 1 16 13 3  o 159.0047 6.333472  16.92219       1.339232      18.06631       3.029330      16.64426       1.493059      162.8730 14.09667  157.5949 7.128318  5.278076       15.79648  
1 1 1 16 13 4  o 121.9944 11.36635  10.09846       1.826452      7.264393       2.413203      13.89898       2.794539      101.6207 18.50269  142.4719 14.94203  -40.85118      23.78264  
1 1 1 16 13 5  o 110.0919 13.38234  8.305730       1.922908      14.97698       3.657761      5.757871       2.260473      146.6556 19.17620  89.98384 19.42227  56.67180       27.29379  
1 1 1 16 13 6  o 272.8091 7.782718  49.87702       2.826309      53.96280       5.351495      48.29656       3.328356      281.8542 14.29544  268.1060 9.330657  13.74829       17.07105  
1 1 1 16 13 7  o 114.9287 15.80433  9.147853       2.356328      -1.497842      8.283474      10.08513       2.457869      82.32414 36.82101  120.8146 15.63361  -38.49044      40.00246  
1 1 1 16 13 8  o 145.0598 18.97097  14.69815       3.579206      0.000000       0.000000      14.69815       3.579206      ?        ?         145.0598 18.97097  0.000000       18.97097  
1 1 1 16 13 9  o 237.5964 9.087167  37.96364       2.871711      35.00927       4.806869      39.60328       3.580999      225.9185 16.07246  242.1248 11.12895  -16.20639      19.54937  
1 1 1 16 13 10 o 376.6689 10.80740  95.72347       5.418828      98.51833       6.892828      91.20121       8.767903      380.7488 13.60769  363.5464 18.15679  17.20242       22.69004  
1 1 1 16 13 11 o 167.5018 4.908483  18.75776       1.094389      18.63920       1.136192      20.28058       4.072011      166.9467 5.113436  170.5856 18.19453  -3.638977      18.89943  
1 1 1 16 13 12 o 99.79583 5.274162  6.675355       0.6988672     6.636063       0.7188510     7.352731       2.984689      99.48143 5.443542  100.2314 22.85575  -0.7499771     23.49505  
1 1 1 16 13 13 o 152.8853 1.826412  15.57978       0.3720816     15.55112       0.3737276     18.81233       3.968887      152.7443 1.836186  163.5619 18.53655  -10.81763      18.62727  
1 1 1 16 13 14 o 151.4733 8.464509  15.49111       1.701691      14.74774       2.076483      17.01128       2.969426      147.2127 10.65762  156.8773 14.36418  -9.664612      17.88615  
1 1 1 16 13 15 o 213.5418 8.637040  30.80072       2.452587      29.22113       2.870934      35.06706       4.718232      207.3400 10.42467  224.3387 15.88619  -16.99872      19.00118  
1 1 1 16 13 16 o 91.88170 6.194678  5.690560       0.7540071     5.372222       0.7688641     13.68973       3.854145      89.20762 6.512936  135.9923 22.02105  -46.78465      22.96399  
1 1 1 16 13 17 o 222.0771 5.761931  33.12096       1.703642      33.36375       1.762875      29.68914       6.627831      222.8341 5.942294  196.0413 26.01314  26.79286       26.68322  
1 1 1 16 13 18 o 125.3767 5.046773  10.55914       0.8414257     10.76074       0.8486915     -1.063815      6.444137      126.5707 5.042118  67.37314 31.03591  59.19759       31.44282  
1 1 1 16 13 19 o 199.6236 7.800164  27.08627       2.070868      27.20740       2.502501      26.82312       3.688516      199.1493 9.457244  194.1479 14.35920  5.001358       17.19378  
1 1 1 16 13 20 o 60.20290 19.63019  2.770256       1.808373      5.554677       2.675429      0.4280922      2.453775      81.85273 23.37282  47.93597 20.78299  33.91676       31.27653  
1 1 1 16 13 21 o 90.72714 4.990259  5.559981       0.6009772     4.969196       4.107440      5.572905       0.6075152     74.16430 28.88149  90.82056 5.039712  -16.65627      29.31790  
1 1 1 16 13 22 o 20.35552 9.768766  -1.014566      0.7661780     -0.3951443     2.724031      -1.067778      0.7984100     45.06147 20.53967  20.70721 9.946557  24.35426       22.82130  
1 1 1 16 13 23 o 20.64037 10.01669  -1.332699      0.8621625     -2.118274      1.318864      -0.7464619     1.139312      24.87086 12.14091  27.73546 12.87220  -2.864605      17.69450  
1 1 1 16 13 24 o 34.12981 11.97934  0.7869103      0.6741405     0.1194818      2.443494      0.8418980      0.7013613     43.97040 19.80531  35.06566 12.22509  8.904739       23.27452  
1 1 1 16 13 25 o 49.90928 16.37802  2.007511       1.257893      11.19590       3.403502      0.5538586      1.353744      108.1586 24.21896  37.50516 15.82376  70.65344       28.93008  
1 1 1 16 13 26 o 78.22431 26.67979  6.977565       3.333869      10.59667       4.364510      1.907755       5.165719      90.33434 30.52986  56.23855 26.51843  34.09579       40.43884  
1 1 1 16 14 0  o 103.4760 2.955848  7.153902       0.4068114     7.153902       0.4068114     7.153902       0.4068114     103.4760 2.955848  103.4760 2.955848  0.000000       0.000000  
1 1 1 16 14 1  o 209.9583 1.284821  29.37448       0.3594588     31.34628       2.736118      29.33985       0.3626016     215.8699 9.535471  209.8342 1.296821  6.035706       9.623250  
1 1 1 16 14 2  f 40.98014 11.31112  1.165648       0.6378642     1.853436       0.9464342     0.5932204      0.8634223     51.42387 13.60391  35.13352 13.35472  16.29035       19.06345  
1 1 1 16 14 3  o 107.2036 15.79703  7.978133       2.189056      7.947975       4.961008      7.985425       2.439377      103.9971 32.36059  106.7095 17.78081  -2.712364      36.92377  
1 1 1 16 14 4  o 73.29659 15.66318  3.790534       1.483386      4.118875       2.819438      3.664857       1.744329      76.88426 24.46087  71.75507 18.21446  5.129189       30.49755  
1 1 1 16 14 5  o 349.0284 10.41722  82.04092       4.839493      84.13313       8.816960      81.13880       5.789573      349.1533 19.02273  346.2613 12.56870  2.891968       22.79992  
1 1 1 16 14 6  o 163.6162 9.603711  18.05121       2.084611      18.23249       3.736355      17.96927       2.511912      162.2200 17.56492  162.7861 11.65730  -0.5660248     21.08125  
1 1 1 16 14 7  o 101.2118 16.19139  7.159767       2.110110      0.000000       0.000000      7.159767       2.110110      ?        ?         101.2118 16.19139  0.000000       16.19139  
1 1 1 16 14 8  o 78.47431 23.84775  4.397578       2.713848      0.000000       0.000000      4.397578       2.713848      ?        ?         78.47431 23.84775  0.000000       23.84775  
1 1 1 16 14 9  o 508.6220 13.83732  176.0415       9.369511      167.0571       17.07974      179.9091       11.20619      481.9705 26.69854  511.9818 16.44726  -30.01135      31.35801  
1 1 1 16 14 10 o 174.6829 7.324341  20.49096       1.701092      19.55197       1.892676      24.43740       3.880154      170.4228 8.359927  188.3076 15.60345  -17.88478      17.70187  
1 1 1 16 14 11 o 115.5010 4.377578  8.922147       0.6725218     9.036246       0.6763626     -1.038854      6.319572      116.2385 4.374532  71.77498 32.12770  44.46355       32.42416  
1 1 1 16 14 12 o 54.42468 7.051072  2.019341       0.4993502     2.004474       0.5012373     3.982555       5.760039      54.21043 7.110059  84.60036 33.80720  -30.38993      34.54678  
1 1 1 16 14 13 o 237.8943 10.82874  38.45457       3.423696      38.13866       4.240153      39.04638       5.803453      235.6178 13.56247  235.3000 18.66209  0.3178406      23.06977  
1 1 1 16 14 14 o 326.7059 10.25900  72.47390       4.460639      75.61952       6.053246      68.73599       6.598566      331.2792 13.74247  314.1370 15.81452  17.14224       20.95124  
1 1 1 16 14 15 o 84.34866 10.88129  4.924888       1.194552      5.223634       1.221889      -1.528406      5.678986      86.93599 10.77843  64.65048 29.54047  22.28551       31.44541  
1 1 1 16 14 16 o 193.8170 7.144567  25.35186       1.842033      23.00361       2.213620      30.63895       3.321541      183.8920 9.061631  210.7873 11.87356  -26.89536      14.93635  
1 1 1 16 14 17 o 193.7848 5.687271  25.25661       1.466989      25.65622       1.594729      23.05775       3.740832      195.1621 6.139862  179.6021 15.79150  15.55997       16.94312  
1 1 1 16 14 18 o 65.33586 10.90382  3.019547       0.9158663     3.254071       0.9548333     0.3208820      3.238982      67.87119 10.92871  53.55478 23.53362  14.31641       25.94740  
1 1 1 16 14 19 o 81.65716 3.416712  4.469430       0.3709501     5.403374       0.4720984     2.962337       0.5997115     89.71006 3.959030  65.74931 6.950140  23.96075       7.998648  
1 1 1 16 14 20 o 125.6501 7.688343  10.82562       1.281106      6.259021       3.892216      11.38046       1.356702      81.23927 28.76099  128.7163 7.948796  -47.47703      29.83920  
1 1 1 16 14 21 o ?        ?         -1.873315      0.1617028     -2.412929      1.236520      -1.863927      0.1631035     22.96693 11.32055  ?        ?         0.000000       11.32055  
1 1 1 16 14 22 o 67.73552 14.90223  3.531166       1.308460      0.4894600      4.042098      3.887206       1.382921      54.26315 24.84247  71.05012 15.07436  -16.78696      29.05830  
1 1 1 16 14 23 f 114.9120 11.08336  9.525113       1.676079      8.625094       2.282802      10.57775       2.468774      104.2380 17.02188  116.2200 16.39645  -11.98205      23.63447  
1 1 1 16 14 24 o 44.22378 18.45090  1.080651       1.809080      2.125558       2.093554      -1.999654      3.594530      52.01494 20.51101  43.91256 21.09612  8.102386       29.42360  
1 1 1 16 14 25 o 41.28550 18.88608  -0.9426010E-01 2.329998      0.2755385      3.411210      -0.4176769     3.190121      48.02274 22.28273  45.05998 21.11875  2.962761       30.70051  
1 1 1 16 15 0  o 154.3428 1.439853  15.87715       0.2960689     15.87715       0.2960689     15.87715       0.2960689     154.3428 1.439853  154.3428 1.439853  0.000000       0.000000  
1 1 1 16 15 1  o 116.0208 1.468972  8.970259       0.2271030     9.012153       0.2323967     8.081973       1.070114      116.2909 1.499722  109.6091 7.369560  6.681808       7.520610  
1 1 1 16 15 2  o 457.7000 11.47094  141.4386       6.990545      134.8260       11.06063      145.8369       9.020620      441.9642 18.82413  462.8542 14.64419  -20.89005      23.84953  
1 1 1 16 15 3  o 106.4710 12.80278  7.778800       1.779990      0.9732593      4.597103      8.979047       1.930582      69.01482 29.14103  114.4752 12.87941  -45.46040      31.86030  
1 1 1 16 15 4  o 109.0808 16.96371  8.330536       2.385604      11.32695       2.996237      3.141482       3.942930      127.1398 18.20454  74.85792 28.51860  52.28185       33.83365  
1 1 1 16 15 5  o 200.3993 11.38735  27.19814       3.028316      26.37420       3.801461      28.62912       5.009776      196.2955 14.63878  202.8819 18.74290  -6.586426      23.78215  
1 1 1 16 15 6  o 277.1140 10.65615  51.85784       3.927553      53.10413       10.25034      51.64338       4.252068      269.3286 29.01901  276.2064 11.57863  -6.877747      31.24368  
1 1 1 16 15 7  o 174.6045 10.39256  20.62693       2.407034      20.47103       4.098591      20.70900       2.973918      171.2768 18.23837  174.2401 12.90027  -2.963242      22.33955  
1 1 1 16 15 8  o 401.1031 11.06108  108.8148       5.906256      99.31560       15.09462      110.5321       6.417954      364.6281 31.37165  403.7602 11.94200  -39.13211      33.56773  
1 1 1 16 15 9  o 194.6257 9.253521  25.56517       2.392958      24.91875       2.603649      29.08133       6.072357      191.8734 10.22030  201.2464 23.06014  -9.372986      25.22350  
1 1 1 16 15 10 o 151.4055 4.620648  15.33165       0.9311282     15.15658       0.9405483     23.94044       6.595500      150.5285 4.694834  178.2837 28.73971  -27.75525      29.12065  
1 1 1 16 15 11 o 49.94777 23.29176  -2.853607      3.800480      5.294317       10.43220      -4.100449      4.080919      100.9601 43.30356  49.08237 23.27070  51.87768       49.16019  
1 1 1 16 15 12 o 168.0199 1.745758  18.81848       0.3908575     18.84565       0.3915314     10.94734       6.664454      168.1411 1.747508  113.8827 37.71331  54.25843       37.75378  
1 1 1 16 15 13 o 233.6123 9.906544  37.08857       3.076836      36.59031       4.274550      37.62430       4.432345      229.7907 14.02679  232.8134 14.35721  -3.022659      20.07188  
1 1 1 16 15 14 o 138.6064 14.50584  13.49374       2.639537      12.38555       3.386655      15.20865       4.212916      129.6842 20.26027  142.0966 23.03797  -12.41243      30.67942  
1 1 1 16 15 15 o 124.0426 6.219374  10.37267       1.024715      10.86696       1.061342      3.579579       3.934584      126.9531 6.293533  72.87305 28.29849  54.08005       28.98988  
1 1 1 16 15 16 o 102.5180 4.785970  7.062170       0.6519939     4.547958       1.355049      7.819599       0.7437474     79.79678 13.20518  107.8081 5.192535  -28.01132      14.18940  
1 1 1 16 15 17 o 106.4461 4.929390  7.624578       0.6972932     6.101316       0.9394882     9.492890       1.040468      94.55079 7.518679  118.3489 6.624114  -23.79810      10.02045  
1 1 1 16 15 18 o 131.1015 4.561621  11.55556       0.7956797     11.42262       0.8115490     14.85554       4.043295      130.3131 4.681223  135.1870 23.28560  -4.873932      23.75149  
1 1 1 16 15 19 o ?        ?         -1.534510      0.3902778     -2.812482      1.774113      -1.469520      0.4000784     28.86954 14.09037  10.66963 5.415203  18.19991       15.09513  
1 1 1 16 15 20 o 54.99638 17.36717  2.360733       1.423586      3.871953       3.706609      2.099245       1.541837      67.06008 27.00867  52.52339 18.13607  14.53669       32.53284  
1 1 1 16 15 21 o 113.0085 11.11691  9.152066       1.652403      12.06918       1.944203      1.562675       3.135944      129.6921 11.36478  54.42463 23.54574  75.26750       26.14499  
1 1 1 16 15 22 o 41.98143 19.39478  -0.6429249     2.542672      5.309174       4.019606      -4.613335      3.282964      70.85505 28.26585  37.59767 18.51551  33.25738       33.79028  
1 1 1 16 15 23 o 68.14567 17.64144  3.877985       1.614328      4.125251       1.738833      2.334491       4.344385      69.68227 18.44194  57.97984 26.23433  11.70243       32.06782  
1 1 1 16 15 24 o 62.60927 22.73774  3.805635       2.449637      4.057660       2.553076      0.8831149      8.694022      64.03577 23.21899  59.53753 29.46966  4.498245       37.51776  
1 1 1 16 16 0  f 125.3382 6.696682  10.58164       1.111111      10.58164       1.111111      10.58164       1.111111      125.3382 6.696682  125.3382 6.696682  0.000000       0.000000  
1 1 1 16 16 1  o 230.6309 13.87206  36.31543       4.243456      40.47026       8.966747      35.11637       4.817010      234.2322 29.37275  225.8307 16.11328  8.401489       33.50218  
1 1 1 16 16 2  o 180.1737 3.404434  21.65652       0.8173531     21.28020       0.8644271     24.83209       2.511093      178.5854 3.632528  191.7722 9.859709  -13.18677      10.50757  
1 1 1 16 16 3  o 280.5157 10.62504  53.17427       3.964381      54.29762       4.380436      48.08916       9.319852      283.0722 11.63788  256.5909 27.69633  26.48129       30.04209  
1 1 1 16 16 4  o 185.9808 12.94645  23.60283       3.188396      25.56343       4.220976      20.99769       4.865558      192.1410 16.65034  171.7103 21.75225  20.43071       27.39332  
1 1 1 16 16 5  o 238.9629 11.36720  38.72422       3.609196      40.50648       5.489108      37.36686       4.790307      241.7554 17.15066  232.9744 15.51904  8.780991       23.12976  
1 1 1 16 16 6  o 216.2798 9.721719  31.59871       2.794608      37.97115       5.797129      29.66949       3.189704      232.9075 18.83978  208.9867 11.49833  23.92081       22.07145  
1 1 1 16 16 7  f 169.8844 11.64233  19.66290       2.619591      15.93884       4.286995      21.88202       3.309287      148.4794 22.36094  178.3884 14.03472  -29.90903      26.40047  
1 1 1 16 16 8  o 121.7633 12.66615  10.20453       2.025107      10.00123       2.054228      17.22303       12.06987      120.4278 13.00726  135.7490 50.27705  -15.32121      51.93237  
1 1 1 16 16 9  o 85.27226 7.373676  4.920594       0.8296236     4.896005       0.8709656     5.161315       2.725129      84.98378 7.777281  83.22241 23.53082  1.761368       24.78277  
1 1 1 16 16 10 o 121.3439 4.536837  9.857746       0.7322833     10.73861       0.7898142     4.463573       1.954485      126.6363 4.688604  78.05834 18.97734  48.57800       19.54796  
1 1 1 16 16 11 o 265.0775 5.118647  47.04258       1.808013      47.50912       1.863433      39.54727       7.469046      266.3552 5.250237  230.0588 24.75323  36.29643       25.30391  
1 1 1 16 16 12 o 287.7130 10.51588  56.48110       4.024827      62.18874       6.113430      52.11462       5.347152      297.9169 15.45266  273.2710 14.73892  24.64594       21.35463  
1 1 1 16 16 13 o 197.7838 7.821900  26.47097       2.057403      28.14245       3.171830      25.25688       2.703238      201.9642 11.83778  191.9493 10.61004  10.01495       15.89673  
1 1 1 16 16 14 o 49.24240 12.89083  1.746882       0.8555952     10.19552       7.523479      1.636184       0.8611822     102.4386 39.30267  47.71231 13.13250  54.72626       41.43866  
1 1 1 16 16 15 o 123.6692 9.824447  10.54480       1.605690      14.56981       3.395437      9.385407       1.822332      139.8897 18.68191  115.6756 11.99655  24.21412       22.20205  
1 1 1 16 16 16 o 35.49570 11.42339  0.8635038      0.6135784     -0.3251319     0.8191115     2.383193       0.9261815     25.59027 11.50174  57.28746 12.48622  -31.69719      16.97632  
1 1 1 16 16 17 o 127.0555 7.166979  11.00798       1.208478      10.99891       1.349928      11.04456       2.711837      126.6295 8.041772  120.9522 17.31953  5.677315       19.09545  
1 1 1 16 16 18 o 55.89122 13.38163  2.330066       0.9833888     2.556837       1.015167      -1.122894      3.961318      58.62077 13.30212  51.05019 23.79707  7.570580       27.26255  
1 1 1 16 16 19 o 39.99813 17.28246  0.3095558      1.685229      -0.5525908     2.087831      1.921428       2.854762      39.45951 17.98454  55.63483 23.19221  -16.17532      29.34829  
1 1 1 16 16 20 o 33.19288 15.90983  -2.072441      2.018286      -1.609568      2.742813      -2.619035      2.980559      40.86464 19.28560  39.97083 19.20445  0.8938065      27.21664  
1 1 1 16 16 21 o 77.43841 25.75081  5.969094       3.106299      5.385495       4.054381      6.798563       4.833565      71.11642 28.38196  75.65532 30.70818  -4.538902      41.81540  
1 1 1 16 16 22 f 22.85731 10.45327  -0.3704409     0.7131675     -0.6306359     0.7520916     1.949889       2.245929      21.92237 10.26802  51.45434 20.91492  -29.53197      23.29949  
1 1 1 16 16 23 o 75.46980 16.70841  4.685973       1.635868      4.910000       1.643773      -18.43816      16.70030      77.56992 16.41556  57.21840 29.46539  20.35152       33.72951  
1 1 1 16 17 0  o 345.8229 18.75245  82.22798       8.582975      82.22798       8.582975      82.22798       8.582975      345.8229 18.75245  345.8229 18.75245  0.000000       0.000000  
1 1 1 16 17 1  o 130.3224 4.676506  11.36343       0.8107922     11.30840       0.9920360     11.47414       1.407111      129.8671 5.746876  130.4056 8.138205  -0.5385742     9.962779  
1 1 1 16 17 2  o 81.67210 8.188687  4.528408       0.8791634     4.611133       0.8828368     -5.350245      9.647388      82.43017 8.143790  78.23467 36.68581  4.195496       37.57885  
1 1 1 16 17 3  o 126.9581 1.394912  10.74191       0.2359830     10.73735       0.2360162     26.98106       14.07896      126.9311 1.395405  163.4824 54.83125  -36.55128      54.84901  
1 1 1 16 17 4  o 292.3364 10.53222  57.91402       4.096057      59.06789       4.236697      41.39463       16.03045      295.1143 10.79184  201.0637 57.14608  94.05058       58.15615  
1 1 1 16 17 5  o 177.1066 9.203966  21.21730       2.164665      20.66331       2.707671      22.19847       3.603426      173.9525 11.75026  178.8671 15.26433  -4.914581      19.26313  
1 1 1 16 17 6  o 112.4639 10.43021  8.640384       1.545265      9.474152       2.963508      8.329038       1.810942      114.2452 20.20586  109.7802 12.60821  4.465004       23.81688  
1 1 1 16 17 7  o 34.59857 13.35885  0.5553553      0.8730725     0.2641436      1.093689      1.066943       1.449604      34.79502 14.41713  45.35265 17.28857  -10.55762      22.51107  
1 1 1 16 17 8  o 119.1431 6.948614  9.570653       1.098377      10.67758       1.274556      6.376300       2.165163      125.7150 7.644626  93.81528 17.97395  31.89967       19.53210  
1 1 1 16 17 9  o 65.28934 9.885864  2.954842       0.8331786     3.953359       1.019809      0.9504750      1.444873      75.58122 10.40138  44.16961 17.14960  31.41161       20.05735  
1 1 1 16 17 10 o 137.9756 2.841180  12.70542       0.5223656     12.80081       0.5440400     11.57937       1.869266      138.4835 2.948216  129.7855 10.90954  8.697983       11.30089  
1 1 1 16 17 11 o 82.01917 4.320188  4.513838       0.4704976     5.001418       0.5197625     2.301390       1.107181      86.31715 4.534824  56.34408 14.62186  29.97308       15.30893  
1 1 1 16 17 12 o 195.1306 8.178132  25.85215       2.121725      29.98147       2.942589      21.38053       3.062124      208.8526 10.60818  174.7629 13.24791  34.08974       16.97176  
1 1 1 16 17 13 o 166.0541 8.238235  18.77774       1.817185      17.83187       2.020571      22.77931       4.155985      161.2602 9.444491  176.1607 17.95557  -14.90045      20.28795  
1 1 1 16 17 14 o 42.35432 19.61866  -1.426691      2.627120      -2.352658      5.713479      -1.178428      2.958413      59.38943 27.96872  45.93646 21.11272  13.45297       35.04277  
1 1 1 16 17 15 o 61.99317 21.97597  2.928498       2.273031      3.607310       2.933172      1.908024       3.596367      67.58315 24.82791  60.77906 25.72452  6.804089       35.75159  
1 1 1 16 17 16 o 57.78248 15.69446  2.541078       1.239437      2.477123       1.344019      2.904710       3.204813      56.87064 16.66504  63.11970 25.21928  -6.249065      30.22806  
1 1 1 16 17 17 o 93.39886 9.882719  6.137362       1.211326      6.742100       1.358561      3.792246       2.675333      97.54529 10.62344  66.78553 23.82426  30.75976       26.08549  
1 1 1 16 17 18 o 66.28219 22.62047  3.786514       2.396616      4.380718       3.653671      3.337767       3.175139      69.14404 27.14771  63.51791 25.19249  5.626137       37.03592  
1 1 1 16 17 19 o 48.05835 18.47470  1.586657       1.664616      2.240900       2.125131      0.5479033      2.677767      54.36787 20.88100  47.83227 21.19156  6.535606       29.75061  
1 1 1 16 17 20 o 18.38961 9.226595  -2.675351      0.9834602     -2.824346      1.037624      -1.358958      3.084241      18.85468 9.462352  43.30806 20.44238  -24.45337      22.52614  
1 1 1 16 17 21 o 19.99030 9.962365  -2.486104      1.062148      -3.248375      1.115319      4.941642       3.481552      18.97408 9.560114  68.06084 26.56565  -49.08675      28.23348  
1 1 1 16 17 22 o 54.19665 13.79762  2.307279       0.9988840     2.174248       1.026456      4.684174       4.338789      52.35494 14.30828  64.49369 27.79778  -12.13875      31.26410  
1 1 1 16 18 0  o 49.76339 33.09098  -0.6851150     5.877265      -0.6851150     5.877265      -0.6851150     5.877265      49.76339 33.09098  49.76339 33.09098  0.000000       0.000000  
1 1 1 16 18 1  o 64.58622 18.77657  3.018005       1.712143      2.139827       1.989553      5.524920       3.361508      57.68296 20.54856  85.35487 26.64995  -27.67191      33.65209  
1 1 1 16 18 2  o 47.33429 9.647903  1.569819       0.5878626     1.969713       0.7021303     0.6322867      1.075074      53.02368 10.30880  37.75241 14.75454  15.27127       17.99911  
1 1 1 16 18 3  o 188.3652 9.763289  24.09895       2.442225      25.64298       2.866117      20.00622       4.666299      193.7678 11.14745  165.5027 21.67968  28.26509       24.37774  
1 1 1 16 18 4  o 103.7534 1.381226  7.174625       0.1909592     7.094823       0.2015741     7.873022       0.5963203     103.1725 1.466214  108.4578 4.133718  -5.285347      4.386047  
1 1 1 16 18 5  o 62.50897 6.611705  2.653477       0.5423809     3.536767       0.7393553     1.624269       0.7980925     72.03093 7.828794  47.79657 12.41952  24.23436       14.68109  
1 1 1 16 18 6  o 75.81976 10.71005  3.989478       1.051952      8.090186       3.923753      3.671906       1.091926      100.6077 28.16142  72.40205 11.71812  28.20567       30.50213  
1 1 1 16 18 7  o 78.00846 9.565644  4.190852       0.9735411     5.075905       1.217161      2.619110       1.622012      85.56958 10.92341  60.17783 18.46583  25.39175       21.45478  
1 1 1 16 18 8  o 48.00696 11.98774  1.646198       0.7644895     2.611623       0.8632399     -1.864072      1.646048      60.89865 11.04436  30.93464 14.69914  29.96401       18.38593  
1 1 1 16 18 9  o 84.87435 6.860895  4.885854       0.7693362     4.926162       0.8133951     4.543727       2.369720      85.14174 7.237988  76.83691 22.01511  8.304825       23.17442  
1 1 1 16 18 10 o 130.9669 2.784524  11.45182       0.4859439     11.47416       0.4917681     10.52517       3.166826      131.0916 2.815217  117.7086 20.95870  13.38301       21.14693  
1 1 1 16 18 11 o 33.47889 14.82541  -0.2712860     1.309046      -0.8228410     1.360835      6.564187       4.790660      31.20499 14.33363  86.82107 31.75688  -55.61608      34.84182  
1 1 1 16 18 12 o 86.76342 6.446993  5.110939       0.7400357     5.055593       0.7502623     7.099689       4.497416      86.25716 6.577054  88.48684 30.95000  -2.229675      31.64112  
1 1 1 16 18 13 o 38.90780 14.85900  0.8412946      1.072065      0.5405244      1.084273      13.97240       7.164271      36.25013 14.60500  109.7605 39.00442  -73.51038      41.64914  
1 1 1 16 18 14 o 65.25418 29.21301  1.797820       5.226923      -5.405675      8.836863      5.674262       6.482509      63.44669 31.06853  78.67602 33.94473  -15.22933      46.01628  
1 1 1 16 18 15 o 156.7883 15.05831  18.17468       3.107399      19.94522       3.728378      14.14717       5.623212      161.4652 17.61406  114.1869 34.24748  47.27822       38.51162  
1 1 1 16 18 16 f 51.77071 15.95447  2.050027       1.209227      1.993786       1.315552      2.356371       3.070345      51.20498 16.74606  58.69418 24.22222  -7.489204      29.44735  
1 1 1 16 18 17 o 60.21367 15.07888  2.800416       1.207077      2.495520       1.344140      4.070857       2.743759      56.28729 16.71108  67.54652 24.12354  -11.25924      29.34630  
1 1 1 16 18 18 o 47.60178 18.97963  1.449951       1.811380      3.844668       2.957515      0.1240922E-01  2.291448      65.04475 24.71834  42.92714 19.27026  22.11760       31.34229  
1 1 1 16 18 19 f 67.76597 18.16408  3.833735       1.673482      4.387050       2.037883      2.687953       2.932539      70.68202 20.46630  57.59963 23.71147  13.08239       31.32257  
1 1 1 16 18 20 o 18.87074 9.459374  -2.692316      1.022345      -2.947793      1.081125      -0.5326707     3.143341      19.13531 9.610826  45.21915 21.11837  -26.08384      23.20245  
1 1 1 16 18 21 o 25.06360 11.83524  -0.9104627     1.035678      -1.040598      1.091524      0.2645505      3.279869      25.29219 12.00410  47.82065 22.06935  -22.52845      25.12279  
1 1 1 16 19 0  o 26.01999 17.64841  -0.8421131     1.831447      -0.8421131     1.831447      -0.8421131     1.831447      26.01999 17.64841  26.01999 17.64841  0.000000       0.000000  
1 1 1 16 19 1  o 89.31686 13.97494  5.657125       1.608763      7.130614       1.970964      2.715876       2.784653      99.94869 15.28368  64.57191 24.10428  35.37679       28.54132  
1 1 1 16 19 2  o 81.55512 9.802624  4.586910       1.043959      5.297899       1.186313      2.146283       2.197953      87.56116 10.36847  58.10239 21.46660  29.45877       23.83947  
1 1 1 16 19 3  o 177.7576 9.250544  21.52022       2.183595      21.54173       2.202513      20.28422       16.69594      177.8142 9.328252  123.2544 53.81428  54.55975       54.61678  
1 1 1 16 19 4  o 54.54061 9.099462  2.071730       0.6380312     2.191292       0.6395965     -22.26736      9.125597      56.19252 8.833018  53.92163 27.19077  2.270885       28.58952  
1 1 1 16 19 5  o 54.12542 6.803314  2.004005       0.4798625     1.939559       0.4836795     6.039049       3.827195      53.19551 6.992698  86.18652 28.58071  -32.99101      29.42371  
1 1 1 16 19 6  o 71.14848 7.218519  3.451762       0.6749023     3.508861       0.6874993     1.936347       3.541816      71.72300 7.294903  63.07507 26.02141  8.647934       27.02461  
1 1 1 16 19 7  o 63.74271 8.927210  2.816299       0.7375017     2.955443       0.7586196     0.4209334      3.147593      65.31879 8.951097  53.91892 23.45631  11.39986       25.10618  
1 1 1 16 19 8  o 146.9992 6.722919  14.61816       1.313395      14.34714       1.472755      15.67109       2.902905      145.3105 7.632829  147.9793 14.92544  -2.668762      16.76392  
1 1 1 16 19 9  o 172.6353 3.730550  19.94468       0.8581752     20.22461       0.8710355     10.67424       5.012578      173.8364 3.760293  107.0123 32.38763  66.82411       32.60519  
1 1 1 16 19 10 o 22.29585 10.78286  -1.480752      0.9772605     -1.464347      0.9847974     -2.540267      7.914208      22.48801 10.86324  66.83766 31.89140  -44.34966      33.69082  
1 1 1 16 19 11 o 110.3514 8.464323  8.378224       1.235139      8.784533       1.427057      7.165027       2.465921      112.5051 9.611051  95.45000 20.02771  17.05510       22.21444  
1 1 1 16 19 12 o 112.5903 9.444287  8.811901       1.403869      8.691250       1.451293      10.56803       5.536910      111.6058 9.860080  98.84660 34.35595  12.75917       35.74286  
1 1 1 16 19 13 o 182.1364 7.186028  22.64896       1.740628      22.81179       1.790349      19.83893       7.437496      182.6768 7.370097  126.3140 39.67049  56.36285       40.34930  
1 1 1 16 19 14 o 105.3176 20.80369  9.088883       2.815940      8.777896       3.424210      9.738564       4.949239      98.15235 25.83391  94.02499 32.49201  4.127357       41.51050  
1 1 1 16 19 15 o 43.32565 19.09019  0.2325635      2.144708      -0.2506138     3.700091      0.4770394      2.631948      51.16634 23.55100  47.75637 21.09065  3.409969       31.61432  
1 1 1 16 19 16 o 48.35888 18.19658  1.655249       1.593580      1.045109       2.034694      2.623363       2.562995      46.48326 19.49275  57.87266 22.73291  -11.38940      29.94583  
1 1 1 16 19 17 o 59.71991 21.56992  3.058987       2.200559      4.738047       2.696358      -0.2899249     3.807995      70.84321 23.99610  50.23862 23.38966  20.60459       33.50953  
1 1 1 16 19 18 o 79.07781 13.19193  4.723598       1.341130      3.924668       1.476541      8.489809       3.205852      69.88954 16.17518  92.98819 25.23432  -23.09865      29.97345  
1 1 1 16 19 19 o 50.42326 11.65059  1.917196       0.7670735     2.095308       0.7919451     -0.7855896     3.084993      52.79756 11.57630  44.07936 20.69372  8.718204       23.71161  
1 1 1 16 20 0  o 140.2058 30.99737  16.24477       5.064428      16.24477       5.064428      16.24477       5.064428      140.2058 30.99737  140.2058 30.99737  0.000000       0.000000  
1 1 1 16 20 1  o 47.75177 20.29151  0.5395640      2.252800      -0.4091843     5.887004      0.7023336      2.438403      65.57876 30.00695  50.03179 21.17920  15.54697       36.72840  
1 1 1 16 20 2  o 157.0543 29.71039  20.91832       5.990042      15.48347       6.975203      36.18552       11.69076      123.7615 38.34905  175.6486 48.40191  -51.88705      61.75269  
1 1 1 16 20 3  o 113.3702 13.96336  9.172090       2.064899      9.095063       2.123046      10.52078       8.883716      112.6123 14.48311  99.50114 41.14569  13.11117       43.62028  
1 1 1 16 20 4  o 49.07892 13.83766  1.750297       0.9437779     5.830007       2.290731      0.9162161      1.035770      86.78090 20.19083  39.58641 14.71570  47.19449       24.98442  
1 1 1 16 20 5  o 64.15508 3.009953  2.756240       0.2565972     2.721371       0.2578572     6.297967       2.598748      63.74332 3.044587  88.95142 22.03884  -25.20810      22.24815  
1 1 1 16 20 6  o 172.9973 1.676580  19.95884       0.3864889     20.04231       0.3893166     14.27506       3.212497      173.3578 1.685334  138.3501 17.84055  35.00772       17.91998  
1 1 1 16 20 7  f 49.95211 7.366613  1.728738       0.4756373     1.748457       0.4790868     0.3741101      3.970804      50.23928 7.375941  57.15158 25.53262  -6.912292      26.57666  
1 1 1 16 20 8  o 225.5520 5.776464  34.34708       1.734701      34.27390       1.874152      34.78469       4.582838      225.0560 6.255501  217.8400 15.89729  7.216003       17.08377  
1 1 1 16 20 9  o 102.6806 8.023327  7.248218       1.089072      8.142651       1.138135      -2.460115      3.749664      108.9165 7.895605  47.09919 22.32335  61.81731       23.67853  
1 1 1 16 20 10 o 55.95104 7.507547  2.171578       0.5456188     2.190183       0.5542725     1.589666       3.099826      56.16706 7.600604  56.20435 23.83963  -0.3728485E-01 25.02193  
1 1 1 16 20 11 o 89.51675 8.131280  5.541872       0.9593499     5.706371       0.9693676     -2.293802      6.690296      90.86142 8.090905  59.84122 28.75684  31.02020       29.87338  
1 1 1 16 20 12 o 51.02785 11.85378  1.918681       0.7905631     2.098470       0.8308190     0.1971249      2.570901      53.36177 11.97875  46.50436 20.67481  6.857410       23.89432  
1 1 1 16 20 13 o 40.45861 16.40585  0.7926087      1.378044      0.3110933      1.541127      2.713352       3.077995      38.63082 16.60781  60.13998 24.47002  -21.50916      29.57366  
1 1 1 16 20 14 o 32.15620 15.14553  -1.301026      1.676399      -1.383458      2.088403      -1.151677      2.811059      36.09728 16.97149  42.76345 19.97133  -6.666172      26.20851  
1 1 1 16 20 15 o 99.70912 15.51436  7.663017       1.994287      8.596083       2.469352      5.912985       3.381814      102.6796 18.73808  76.24549 26.82520  26.43406       32.72166  
1 1 1 16 20 16 o 35.70651 16.62921  -0.9306237     1.927246      -0.4916492     2.327762      -1.887365      3.436498      40.70338 18.71492  43.87931 20.95835  -3.175922      28.09806  
1 1 1 16 20 17 o 76.37371 23.48121  5.627432       2.621170      6.158320       3.153611      4.441156       4.714109      76.69543 25.95129  64.95266 28.47125  11.74277       38.52378  
1 1 1 16 21 0  o 270.2525 22.55845  54.17353       7.988739      54.17353       7.988739      54.17353       7.988739      270.2525 22.55845  270.2525 22.55845  0.000000       0.000000  
1 1 1 16 21 1  o 69.76316 30.13952  3.031705       5.124016      3.045769       6.049889      2.996014       9.637840      71.95866 31.86814  78.09309 36.63479  -6.134422      48.55601  
1 1 1 16 21 2  o 237.0651 25.65974  46.99833       7.976697      43.03006       9.328388      57.79267       15.38523      211.4794 34.27504  188.5994 56.66743  22.88000       66.22670  
1 1 1 16 21 3  o 122.8162 23.13588  12.32441       3.647436      12.92810       5.492325      11.84811       4.878557      112.6673 33.85908  110.7711 31.53925  1.896210       46.27269  
1 1 1 16 21 4  o 59.87945 22.01351  2.675448       2.306541      1.627349       5.996201      2.857467       2.498811      67.35080 30.61151  61.56553 22.86239  5.785271       38.20671  
1 1 1 16 21 5  o 58.76130 19.13703  2.668962       1.718917      2.735788       1.938761      2.423416       3.716369      59.51484 20.34450  62.60141 26.30381  -3.086567      33.25341  
1 1 1 16 21 6  o 16.82112 8.259565  -1.247184      0.6379403     -1.201331      0.6503672     -2.412791      3.279044      17.27308 8.452005  43.75871 20.77940  -26.48563      22.43256  
1 1 1 16 21 7  o 130.0310 1.602544  11.27803       0.2776711     11.31914       0.2789328     6.764422       2.922612      130.2674 1.606905  88.15805 24.16413  42.10938       24.21750  
1 1 1 16 21 8  o 21.89071 10.36329  -0.8580174     0.8035940     -0.9411349     0.8289373     0.4392847      3.274884      21.93063 10.42371  51.99209 23.21030  -30.06146      25.44350  
1 1 1 16 21 9  o 121.7320 4.494607  9.981667       0.7278193     10.40338       0.7454882     1.400138       3.362900      124.2758 4.509217  55.79847 24.25994  68.47736       24.67544  
1 1 1 16 21 10 o 200.9697 11.13792  28.64499       2.971025      29.71500       3.266046      23.51202       7.153384      203.6062 12.09256  142.0402 37.31725  61.56598       39.22763  
1 1 1 16 21 11 o 42.96904 11.22266  1.358461       0.6494657     1.474380       0.6554592     -4.893256      4.813585      44.78855 11.05142  46.89627 22.95699  -2.107727      25.47857  
1 1 1 16 21 12 o 120.3426 6.691750  9.916920       1.068855      10.76302       1.128540      2.546489       3.330825      125.3396 6.782281  59.16282 24.88312  66.17679       25.79086  
1 1 1 16 21 13 o 36.72902 16.91121  -0.6885860     1.910012      -4.562123      2.740672      2.969378       2.663317      33.71123 16.66070  59.44885 23.22619  -25.73763      28.58382  
1 1 1 16 21 14 o 54.87286 26.77053  -2.219719      6.384707      -3.842273      6.692074      14.23623       21.31192      53.56574 26.39003  72.66962 37.12173  -19.10387      45.54620  
1 1 1 16 21 15 o 84.49097 17.75434  5.873689       1.935264      6.855006       2.112966      0.7647059      4.821199      91.20537 18.02525  55.30824 25.93480  35.89713       31.58360  
1 1 1 16 21 16 o 45.48412 21.46128  -0.9179193     3.393375      -2.650741      6.818197      -0.3473784     3.912335      54.16207 26.67488  49.29209 23.19196  4.869980       35.34708  
1 1 1 16 22 0  o 72.84724 35.77020  6.661839       4.128779      6.661839       4.128779      6.661839       4.128779      72.84724 35.77020  72.84724 35.77020  0.000000       0.000000  
1 1 1 16 22 1  o 88.80779 36.17456  9.691336       6.735656      9.691336       6.735656      0.000000       0.000000      88.80779 36.17456  ?        ?         0.000000       36.17456  
1 1 1 16 22 2  f 52.40329 22.39217  1.195935       2.770308      1.011093       2.835387      5.084503       13.00490      51.90882 22.42301  78.44640 38.25705  -26.53757      44.34404  
1 1 1 16 22 3  o 136.5600 14.42333  13.73048       2.584989      13.26253       4.634392      13.94183       3.114496      117.2230 29.65275  134.4087 17.82878  -17.18575      34.59987  
1 1 1 16 22 4  o 53.05372 23.15389  1.011280       3.087879      2.585593       5.394488      0.2440595      3.765866      66.05413 29.61624  53.66235 24.33838  12.39178       38.33377  
1 1 1 16 22 5  f 48.88895 22.86453  -1.248581      3.706099      7.403138       8.992399      -3.018821      4.067621      79.41539 36.61173  46.82827 22.48244  32.58712       42.96369  
1 1 1 16 22 6  o 58.19026 12.05335  2.491732       0.9038445     2.694616       0.9938447     1.521296       2.173592      60.25499 12.77497  50.63578 20.57788  9.619209       24.22084  
1 1 1 16 22 7  o 159.8880 7.527137  17.55952       1.599184      17.69932       1.822996      17.09275       3.331128      159.8025 8.592678  148.9144 17.09707  10.88811       19.13489  
1 1 1 16 22 8  o 123.1767 3.956015  10.20258       0.6484800     10.15281       0.6605539     11.52667       3.407266      122.8513 4.040604  115.6506 22.92016  7.200668       23.27359  
1 1 1 16 22 9  o 205.9120 1.851777  28.30281       0.5080938     28.36014       0.5097646     19.59863       6.280758      206.1196 1.855995  128.9280 35.45717  77.19162       35.50571  
1 1 1 16 22 10 o 33.11522 10.62796  0.7722996      0.5313603     0.7497256      0.5322162     7.774162       9.373254      32.74522 10.64745  74.57096 35.32948  -41.82574      36.89906  
1 1 1 16 22 11 o 30.57488 13.94803  -0.4807582     1.259513      -0.3649748     1.272973      -5.869025      8.684015      31.36324 14.19499  56.70049 28.29327  -25.33725      31.65449  
1 1 1 16 22 12 o 74.55825 8.296915  3.907501       0.8103548     3.883819       0.8132498     7.216041       9.612441      74.30116 8.358844  70.92539 34.18143  3.375771       35.18864  
1 1 1 16 22 13 o 56.59468 23.14163  2.630311       2.769431      1.901597       3.203971      4.783524       5.507487      54.21959 23.62519  66.30685 29.81131  -12.08725      38.03766  
1 1 1 16 23 0  o 40.55766 26.28339  0.9269552      3.363580      0.9269552      3.363580      0.9269552      3.363580      40.55766 26.28339  40.55766 26.28339  0.000000       0.000000  
1 1 1 16 23 1  o 58.12952 27.31144  -0.4252927E-01 5.392149      0.9510685      5.877738      -5.321467      13.54809      61.58276 28.79901  67.07419 33.73321  -5.491425      44.35440  
1 1 1 16 23 2  o 87.19062 20.38480  6.353616       2.325744      -12.59387      15.07236      6.815762       2.353937      64.65976 32.85985  90.76744 20.00241  -26.10768      38.46902  
1 1 1 16 23 3  o 43.69196 20.12795  -0.6598442     2.710855      8.268882       8.213989      -1.751226      2.871758      78.24300 35.66527  41.49168 19.62720  36.75132       40.70919  
1 1 1 16 23 4  o 150.6282 16.29265  17.43706       3.218189      11.60449       6.651673      19.21959       3.677219      90.24325 36.23834  155.9538 18.02643  -65.71056      40.47431  
1 1 1 16 23 5  o 66.62234 20.08463  3.767342       1.930346      4.861961       8.727332      3.711036       1.979370      70.92199 33.74158  65.93633 20.42823  4.985664       39.44372  
1 1 1 16 23 6  o 120.5360 10.41503  10.35153       1.656432      11.81492       1.942203      6.447157       3.172416      127.9222 11.51716  80.96175 25.96724  46.96042       28.40673  
1 1 1 16 23 7  o 86.57315 22.54822  6.730669       2.626571      -4.089530      6.658453      8.724658       2.858361      53.87916 26.50129  99.71246 22.09428  -45.83329      34.50327  
1 1 1 16 23 8  o 13.20343 6.675253  -1.883961      0.5711095     -2.114424      0.5965859     0.6428543      1.975418      13.11131 6.650025  43.33140 18.71700  -30.22009      19.86326  
1 1 1 16 23 9  o 23.24539 8.814948  0.2856725      0.3756360     0.2200018      0.3789554     3.985135       2.844276      22.24538 8.740352  64.85391 24.32996  -42.60853      25.85228  
1 1 1 16 23 10 o 76.61858 7.954937  4.110424       0.8003585     4.220257       0.8924037     3.658875       1.809453      77.22196 8.831184  65.12340 19.40248  12.09856       21.31775  
1 1 1 16 24 0  o 221.4520 17.12194  36.12781       4.981181      36.12781       4.981181      36.12781       4.981181      221.4520 17.12194  221.4520 17.12194  0.000000       0.000000  
1 1 1 16 24 1  o 38.43436 16.61864  0.3438712      1.560462      4.028504       4.050177      -0.2984298     1.691010      64.99978 27.39419  36.23443 16.38393  28.76535       31.91982  
1 1 1 16 24 2  o 76.73015 30.03769  6.908017       4.461850      3.668335       6.258662      10.25624       6.362641      65.33083 30.26825  83.02889 34.61879  -17.69807      45.98508  
1 1 1 16 24 3  o 102.8302 23.17780  9.579854       3.099673      14.00427       4.910794      6.649753       3.996363      110.6893 31.68472  76.97329 28.84722  33.71606       42.84954  
1 1 1 16 24 4  o 66.55636 24.02819  4.203986       2.730341      0.000000       0.000000      4.203986       2.730341      ?        ?         66.55636 24.02819  0.000000       24.02819  
1 1 1 16 24 5  o 89.04758 13.99106  6.029154       1.605462      5.761785       1.816869      6.981667       3.429285      84.90495 16.65421  81.38348 27.05628  3.521461       31.77114  
1 1 1 16 24 6  o 86.89855 11.56330  5.532336       1.305759      5.391216       1.369534      6.942561       4.329348      85.19209 12.43032  76.53442 29.69419  8.657661       32.19096  
1 1 1 17 0  1  o 268.4897 11.72158  48.39615       4.175367      48.39615       4.175367      48.39615       4.175367      268.4897 11.72158  268.4897 11.72158  0.000000       0.000000  
1 1 1 17 0  2  o 344.0639 13.22737  79.41982       6.043988      79.41982       6.043988      79.41982       6.043988      344.0639 13.22737  344.0639 13.22737  0.000000       0.000000  
1 1 1 17 0  3  o 326.5339 28.22167  73.43199       12.05986      73.43199       12.05986      73.43199       12.05986      326.5339 28.22167  326.5339 28.22167  0.000000       0.000000  
1 1 1 17 0  4  f 212.4053 20.30912  31.05848       5.619865      31.05848       5.619865      31.05848       5.619865      212.4053 20.30912  212.4053 20.30912  0.000000       0.000000  
1 1 1 17 0  5  o 364.2679 20.94333  89.89861       10.08824      89.89861       10.08824      89.89861       10.08824      364.2679 20.94333  364.2679 20.94333  0.000000       0.000000  
1 1 1 17 0  6  o 225.2030 16.12097  34.45326       4.779623      34.45326       4.779623      34.45326       4.779623      225.2030 16.12097  225.2030 16.12097  0.000000       0.000000  
1 1 1 17 0  7  f 649.6038 11.71420  282.1299       10.13249      282.1299       10.13249      282.1299       10.13249      649.6038 11.71420  649.6038 11.71420  0.000000       0.000000  
1 1 1 17 0  8  o 338.8171 17.57917  77.56194       7.887601      77.56194       7.887601      77.56194       7.887601      338.8171 17.57917  338.8171 17.57917  0.000000       0.000000  
1 1 1 17 0  9  o 632.8699 28.33195  273.0688       23.78334      273.0688       23.78334      273.0688       23.78334      632.8699 28.33195  632.8699 28.33195  0.000000       0.000000  
1 1 1 17 0  10 o ?        ?         -5.645913      1.099699      -5.645913      1.099699      -5.645913      1.099699      ?        ?         ?        ?         0.000000       0.000000  
1 1 1 17 0  11 o 397.4995 10.42296  105.7946       5.512211      105.7946       5.512211      105.7946       5.512211      397.4995 10.42296  397.4995 10.42296  0.000000       0.000000  
1 1 1 17 0  12 o 452.1332 11.69679  137.0262       7.036380      137.0262       7.036380      137.0262       7.036380      452.1332 11.69679  452.1332 11.69679  0.000000       0.000000  
1 1 1 17 0  13 o 223.5015 13.00191  33.80203       3.841979      33.80203       3.841979      33.80203       3.841979      223.5015 13.00191  223.5015 13.00191  0.000000       0.000000  
1 1 1 17 0  14 o 238.3049 10.03809  38.17749       3.174661      38.17749       3.174661      38.17749       3.174661      238.3049 10.03809  238.3049 10.03809  0.000000       0.000000  
1 1 1 17 0  15 o 53.86209 11.86019  2.199931       0.7447892     2.199931       0.7447892     2.199931       0.7447892     53.86209 11.86019  53.86209 11.86019  0.000000       0.000000  
1 1 1 17 0  16 o 43.50743 20.42581  1.876581       1.328714      1.876581       1.328714      1.876581       1.328714      43.50743 20.42581  43.50743 20.42581  0.000000       0.000000  
1 1 1 17 0  17 o 329.7580 11.59630  73.21270       5.081209      73.21270       5.081209      73.21270       5.081209      329.7580 11.59630  329.7580 11.59630  0.000000       0.000000  
1 1 1 17 0  18 o 59.71062 18.97830  3.033663       1.328834      3.033663       1.328834      3.033663       1.328834      59.71062 18.97830  59.71062 18.97830  0.000000       0.000000  
1 1 1 17 0  19 o 208.8602 14.48459  29.86556       3.985912      29.86556       3.985912      29.86556       3.985912      208.8602 14.48459  208.8602 14.48459  0.000000       0.000000  
1 1 1 17 0  20 o 208.3327 9.121472  29.26381       2.521112      29.26381       2.521112      29.26381       2.521112      208.3327 9.121472  208.3327 9.121472  0.000000       0.000000  
1 1 1 17 0  21 o 58.49697 14.15651  2.673839       0.9564368     2.673839       0.9564368     2.673839       0.9564368     58.49697 14.15651  58.49697 14.15651  0.000000       0.000000  
1 1 1 17 0  22 o 91.56133 8.729783  5.781585       1.041471      5.781585       1.041471      5.781585       1.041471      91.56133 8.729783  91.56133 8.729783  0.000000       0.000000  
1 1 1 17 0  23 o 112.5231 5.975097  8.547738       0.8900962     8.547738       0.8900962     8.547738       0.8900962     112.5231 5.975097  112.5231 5.975097  0.000000       0.000000  
1 1 1 17 0  24 o 82.77371 12.47773  4.970459       1.283933      4.970459       1.283933      4.970459       1.283933      82.77371 12.47773  82.77371 12.47773  0.000000       0.000000  
1 1 1 17 0  25 o 35.86608 16.54008  1.309289       0.8687940     1.309289       0.8687940     1.309289       0.8687940     35.86608 16.54008  35.86608 16.54008  0.000000       0.000000  
1 1 1 17 0  26 o 24.37465 16.77751  -1.023985      1.793535      -1.023985      1.793535      -1.023985      1.793535      24.37465 16.77751  24.37465 16.77751  0.000000       0.000000  
1 1 1 17 0  27 o 53.47281 33.13699  3.711195       4.697661      3.711195       4.697661      3.711195       4.697661      53.47281 33.13699  53.47281 33.13699  0.000000       0.000000  
1 1 1 17 0  28 o 25.89957 15.87170  0.4990405      1.049675      0.4990405      1.049675      0.4990405      1.049675      25.89957 15.87170  25.89957 15.87170  0.000000       0.000000  
1 1 1 17 0  29 o 142.1528 12.87252  14.61766       2.390041      14.61766       2.390041      14.61766       2.390041      142.1528 12.87252  142.1528 12.87252  0.000000       0.000000  
1 1 1 17 1  0  o 677.6431 35.70299  314.0084       32.03322      314.0084       32.03322      314.0084       32.03322      677.6431 35.70299  677.6431 35.70299  0.000000       0.000000  
1 1 1 17 1  1  o 342.4594 7.179587  78.25397       3.276288      91.03891       7.245285      74.96772       3.673304      368.1994 14.79736  335.1138 8.226044  33.08563       16.93014  
1 1 1 17 1  2  o 403.9752 8.160342  108.9422       4.392751      111.2682       5.004205      101.1305       9.170568      408.1577 9.200969  387.4131 17.81197  20.74457       20.04805  
1 1 1 17 1  3  o 388.0226 10.19723  100.6951       5.267884      0.000000       0.000000      100.6951       5.267884      ?        ?         388.0226 10.19723  0.000000       10.19723  
1 1 1 17 1  4  o 634.0833 15.41302  269.8635       13.02290      268.6130       14.82483      274.0901       27.25419      631.6579 17.63028  630.2935 32.56054  1.364380       37.02722  
1 1 1 17 1  5  o 178.5606 11.20572  21.41263       2.652794      22.28999       3.369411      19.98195       4.302653      181.7983 14.01699  171.1227 19.20003  10.67557       23.77219  
1 1 1 17 1  6  o 344.9365 11.29999  79.70507       5.186854      72.92398       6.670245      90.07732       8.249521      329.1769 15.24827  365.4999 16.98467  -36.32303      22.82517  
1 1 1 17 1  7  o 565.7269 7.816687  213.7146       5.892547      207.8461       7.899375      221.0767       8.847657      557.3725 10.63589  574.6237 11.55503  -17.25116      15.70481  
1 1 1 17 1  8  o 693.9712 15.65695  324.0000       14.47845      334.5674       22.41244      316.4317       18.96731      700.2245 24.05602  682.9600 20.86636  17.26453       31.84489  
1 1 1 17 1  9  o 661.3478 20.10984  296.8369       17.70139      311.5052       24.54136      280.9299       25.55657      672.2413 27.45458  636.0819 30.23857  36.15942       40.84269  
1 1 1 17 1  10 o 249.4958 9.021348  41.69010       2.994282      45.72318       5.127772      39.60338       3.688444      260.1751 14.85243  242.7771 11.43362  17.39806       18.74360  
1 1 1 17 1  11 o 373.0131 8.314670  93.04765       4.132782      92.04102       6.890368      93.61326       5.164968      369.4719 14.02091  373.6159 10.38461  -4.143982      17.44781  
1 1 1 17 1  12 o 231.4691 1.428030  35.70119       0.4404575     32.14762       1.661956      35.96964       0.4567914     219.3743 5.690194  232.3367 1.475457  -12.96246      5.878374  
1 1 1 17 1  13 o 144.9802 1.957970  14.00787       0.3782581     14.01720       0.3867591     13.80264       1.814087      145.0276 2.001319  143.1831 9.562900  1.844513       9.770073  
1 1 1 17 1  14 o 115.3180 5.309304  8.897363       0.8136566     6.410375       1.365194      10.26747       1.013291      97.09855 10.73014  123.8127 6.161157  -26.71411      12.37319  
1 1 1 17 1  15 f 128.8397 8.059819  11.16227       1.376790      10.54947       1.503204      14.35281       3.429978      125.0812 9.080715  143.7169 18.32697  -18.63572      20.45329  
1 1 1 17 1  16 o 428.9784 8.511604  123.4333       4.865420      125.3639       6.950942      121.5787       6.812629      430.6759 12.12417  424.1481 12.06605  6.527832       17.10512  
1 1 1 17 1  17 o 180.6100 8.642184  21.94870       2.073848      21.18563       2.284912      25.51605       4.940356      177.2057 9.713651  191.0489 19.68776  -13.84325      21.95366  
1 1 1 17 1  18 o 241.9193 8.060769  39.32375       2.594859      38.34582       2.888006      43.42049       5.911055      238.6133 9.099689  250.2235 17.84528  -11.61026      20.03143  
1 1 1 17 1  19 o 135.9066 8.049534  12.45191       1.451227      11.69510       1.787766      13.91411       2.484981      131.2007 10.30863  142.3274 13.25509  -11.12674      16.79182  
1 1 1 17 1  20 o 190.5169 6.984219  24.39479       1.770065      25.34009       2.179453      22.56304       3.033870      193.7881 8.460473  181.4257 12.62828  12.36247       15.20043  
1 1 1 17 1  21 o 168.6941 4.768835  19.05415       1.070902      20.07612       1.284156      16.72048       1.940521      173.0071 5.577611  156.9105 9.322988  16.09662       10.86406  
1 1 1 17 1  22 o 45.81339 9.433999  1.476214       0.5567284     1.415185       0.6785587     1.601904       0.9737983     44.60438 11.38094  47.58593 14.24713  -2.981556      18.23476  
1 1 1 17 1  23 o 30.76851 12.13925  0.3988953      0.7336633     0.4977181      1.160633      0.3331287      0.9468240     37.11572 15.05403  33.05045 13.52469  4.065266       20.23712  
1 1 1 17 1  24 o 63.05537 7.309133  2.731269       0.6027693     4.211535       0.8566396     1.279647       0.8483105     78.16622 8.353783  42.54243 13.40280  35.62379       15.79306  
1 1 1 17 1  25 o 166.6347 4.928956  18.70766       1.093242      17.60946       2.288185      19.03249       1.244469      158.2814 10.91580  167.8183 5.572806  -9.536819      12.25605  
1 1 1 17 1  26 o 26.42454 11.61524  -0.1037156     0.7895604     -0.1615232     1.236368      -0.6390382E-01 1.026032      32.41213 14.37762  30.28944 13.27971  2.122686       19.57209  
1 1 1 17 1  27 o 66.21528 26.61140  4.143886       3.590103      4.656895       5.187014      3.672143       4.974026      68.35059 29.91543  65.18754 28.88134  3.163055       41.58202  
1 1 1 17 1  28 o 19.11616 9.661645  -3.704379      1.191018      -5.006856      1.808967      -2.707744      1.582390      24.09513 12.14478  26.28001 12.92485  -2.184875      17.73548  
1 1 1 17 1  29 o 35.49952 13.42665  0.8142217      0.8701439     -0.1375741     1.277973      1.636825       1.188078      32.14351 14.41326  45.61200 15.91062  -13.46849      21.46835  
1 1 1 17 2  0  o 430.5057 15.21420  124.3593       8.702985      124.3593       8.702985      124.3593       8.702985      430.5057 15.21420  430.5057 15.21420  0.000000       0.000000  
1 1 1 17 2  1  o 346.0865 6.825608  79.91134       3.147745      84.80655       4.293977      74.22511       4.627924      356.2299 9.053321  333.0787 10.44005  23.15115       13.81873  
1 1 1 17 2  2  o 86.02654 23.35373  5.176244       2.745225      6.142755       3.231044      2.667494       5.205569      93.56229 25.30926  81.66145 32.29874  11.90084       41.03374  
1 1 1 17 2  3  o 67.03988 14.60872  3.130066       1.268062      4.465664       1.814555      1.855235       1.772795      79.96548 17.51500  55.60838 19.43289  24.35710       26.16128  
1 1 1 17 2  4  f 444.5536 20.91035  133.7830       12.35208      136.1262       22.34117      132.7514       14.82383      440.3380 38.46119  441.2175 25.31989  -0.8795776     46.04737  
1 1 1 17 2  5  o 551.2086 12.84133  203.5415       9.431905      204.4243       11.56734      201.7903       16.29250      551.4225 15.75873  545.3337 22.46896  6.088806       27.44434  
1 1 1 17 2  6  o 250.3588 12.24971  42.08125       4.074194      44.28094       6.763315      40.82838       5.104244      255.2420 20.04613  245.9995 15.65244  9.242523       25.43317  
1 1 1 17 2  7  o 141.7193 11.24999  13.52851       2.107069      16.82680       3.968613      12.23378       2.486472      156.6664 19.42624  134.2821 14.10645  22.38429       24.00772  
1 1 1 17 2  8  o 472.9781 13.72397  150.3151       8.640422      153.9991       14.10439      148.1019       10.93186      475.4737 22.32381  468.2280 17.55225  7.245728       28.39778  
1 1 1 17 2  9  o 501.4219 14.33043  169.1922       9.565121      178.7224       14.73662      162.2542       12.57365      512.1389 21.64296  489.0374 19.33315  23.10147       29.02048  
1 1 1 17 2  10 o 197.6357 4.912067  26.05522       1.293609      27.02308       4.427117      25.96487       1.352643      199.3182 16.82565  197.2140 5.151623  2.104263       17.59664  
1 1 1 17 2  11 o 533.7679 12.88876  191.5548       9.167212      199.6569       18.74309      189.0072       10.51010      536.7593 26.28516  529.1923 14.91947  7.566956       30.22417  
1 1 1 17 2  12 o 283.6677 8.076227  53.86944       3.049648      51.93523       3.284370      65.96902       8.214587      278.3876 8.865080  310.3010 19.97292  -31.91345      21.85194  
1 1 1 17 2  13 o 155.4084 2.239798  16.09684       0.4638278     16.46301       0.4954705     13.50167       1.319050      157.1630 2.365887  141.9484 6.995148  15.21457       7.384410  
1 1 1 17 2  14 o 261.6362 4.557376  45.67971       1.588862      45.09991       1.630088      56.70924       7.109743      259.9569 4.705830  287.4128 18.66507  -27.45587      19.24915  
1 1 1 17 2  15 o 273.2895 7.941272  50.06923       2.888855      47.30024       6.004727      50.90313       3.295269      262.6213 17.25449  275.3192 8.994232  -12.69785      19.45800  
1 1 1 17 2  16 o 60.15316 9.501941  2.489076       0.7363690     1.690064       0.8050317     6.582696       1.822175      49.06933 12.32902  97.44920 14.47140  -48.37987      19.01121  
1 1 1 17 2  17 o 161.6407 7.674121  17.55291       1.648204      17.36448       1.930909      18.05878       3.163865      160.5069 9.064907  162.1736 14.80384  -1.666718      17.35875  
1 1 1 17 2  18 o 36.71231 14.43848  0.5482864      1.034995      0.1579019      1.055286      10.40821       5.303476      33.58287 14.05750  115.9756 32.83833  -82.39277      35.72071  
1 1 1 17 2  19 o 105.7794 8.745225  7.579737       1.221662      7.413176       1.238397      13.61785       7.456315      104.5569 8.975360  128.0793 39.64329  -23.52234      40.64661  
1 1 1 17 2  20 o 69.14742 8.386280  3.265798       0.7569391     3.249566       0.9288565     3.297887       1.306012      68.50531 10.51041  67.97048 14.83697  0.5348282      18.18253  
1 1 1 17 2  21 o 76.77801 5.649310  3.971856       0.5739235     3.593443       0.6400781     5.523869       1.296276      72.84158 6.668374  89.38980 11.12259  -16.54822      12.96839  
1 1 1 17 2  22 o 179.4992 4.249403  21.55552       1.016398      20.61490       1.094121      27.47935       2.745749      175.3998 4.685455  200.4162 10.31617  -25.01637      11.33035  
1 1 1 17 2  23 o 113.1084 2.549663  8.539422       0.3842830     8.284178       0.4041121     10.95050       1.242023      111.3909 2.722568  127.0296 7.369184  -15.63876      7.856033  
1 1 1 17 2  24 o 119.2384 6.252570  9.627031       0.9899833     12.14682       1.904930      8.694659       1.158754      131.9056 10.93603  112.8100 7.755696  19.09561       13.40700  
1 1 1 17 2  25 o 71.89961 7.498345  3.563313       0.7078530     -0.1577412     1.061363      6.544367       0.9499831     30.36865 13.40324  97.71368 7.349909  -67.34504      15.28621  
1 1 1 17 2  26 o 27.26309 13.22657  -2.138479      1.500210      -2.548092      4.232410      -2.079621      1.604379      48.17685 23.07785  28.72763 13.87451  19.44922       26.92747  
1 1 1 17 2  27 o 19.62630 9.986443  -5.208700      1.424311      -5.519671      1.520474      -2.980930      4.069620      20.28958 10.32337  45.53625 22.01810  -25.24667      24.31807  
1 1 1 17 2  28 o 32.27561 13.84214  0.2082468      1.065740      1.484573       1.265570      -2.903497      1.976092      44.80307 16.33254  30.01041 14.69471  14.79265       21.97012  
1 1 1 17 2  29 o 40.14354 16.73432  0.8422520      1.486269      1.538580       4.053069      0.7340690      1.597558      53.30257 24.57557  40.18649 17.08259  13.11608       29.92947  
1 1 1 17 3  0  o 139.0556 11.62591  13.17693       2.118309      13.17693       2.118309      13.17693       2.118309      139.0556 11.62591  139.0556 11.62591  0.000000       0.000000  
1 1 1 17 3  1  o 510.2054 10.65872  174.0391       7.246425      178.0477       8.934715      166.3338       12.38729      515.4454 13.01884  496.6350 18.75195  18.81036       22.82818  
1 1 1 17 3  2  o 292.3904 10.27882  57.21753       3.998563      57.76891       5.960180      56.76625       5.392049      292.9975 15.31910  290.6814 13.96158  2.316071       20.72681  
1 1 1 17 3  3  o 248.4750 11.35085  41.38885       3.748315      42.72964       4.880308      39.46024       5.853165      251.9770 14.59742  241.4013 18.33316  10.57567       23.43479  
1 1 1 17 3  4  o 458.7228 12.60678  141.0400       7.698674      145.6233       8.548082      121.3551       17.71508      465.8517 13.78560  418.6605 31.99710  47.19116       34.84045  
1 1 1 17 3  5  o 641.2975 15.69021  276.3489       13.40793      287.1051       17.17985      259.5889       21.44500      651.7355 19.80517  616.3983 26.16860  35.33722       32.81829  
1 1 1 17 3  6  o 364.2730 10.39529  88.83108       5.040723      95.78262       6.906493      80.90712       7.373744      377.6069 13.74896  346.4892 16.01404  31.11768       21.10648  
1 1 1 17 3  7  o 340.1875 9.434620  77.43242       4.272644      85.75111       8.356332      74.48782       4.971667      356.1624 17.66245  333.3597 11.20814  22.80273       20.91853  
1 1 1 17 3  8  o 326.9974 12.23219  71.79391       5.320542      0.000000       0.000000      71.79391       5.320542      ?        ?         326.9974 12.23219  0.000000       12.23219  
1 1 1 17 3  9  o 195.4501 5.717214  25.51208       1.487397      34.92982       10.73889      25.32788       1.501873      219.0953 38.16996  194.7364 5.794231  24.35889       38.60724  
1 1 1 17 3  10 o 298.3246 6.260452  59.41571       2.488676      57.50226       6.884406      59.70334       2.669181      290.8724 17.84788  299.0019 6.699318  -8.129486      19.06378  
1 1 1 17 3  11 o 110.6382 7.475697  8.218501       1.095653      7.332454       1.734889      8.806358       1.413120      103.6537 12.83465  114.3058 9.359518  -10.65211      15.88486  
1 1 1 17 3  12 o 210.8351 6.225481  29.71452       1.747083      31.61381       2.588596      28.12561       2.367657      217.0954 8.967598  204.7895 8.696156  12.30588       12.49163  
1 1 1 17 3  13 f 204.2682 4.368277  27.83723       1.189007      28.60130       1.446720      26.24699       2.087136      206.9249 5.251088  197.8878 7.931198  9.037109       9.511984  
1 1 1 17 3  14 o 240.2298 3.823176  38.49411       1.223840      38.70887       1.252485      33.95955       5.755283      240.8932 3.901886  221.6314 19.69257  19.26181       20.07541  
1 1 1 17 3  15 o 387.0423 9.252249  100.5526       4.771768      99.57446       9.067464      100.9272       5.611673      380.9074 17.91478  387.0617 10.89107  -6.154236      20.96556  
1 1 1 17 3  16 o 96.86505 7.671462  6.325534       0.9821104     6.024406       1.029032      9.403484       3.289908      94.42639 8.261403  114.3264 22.39700  -19.90002      23.87209  
1 1 1 17 3  17 o 191.1696 11.70284  24.79067       2.966862      24.14330       4.200893      25.43489       4.190680      186.7923 17.06586  191.9703 16.54361  -5.178024      23.76836  
1 1 1 17 3  18 f 78.43593 8.727910  4.185441       0.8967866     4.341688       0.9159958     0.5769018      4.402043      79.90034 8.746154  65.77377 28.16888  14.12656       29.49544  
1 1 1 17 3  19 o 194.9115 4.989272  25.41360       1.294765      24.95612       1.362416      29.67993       4.160568      193.0982 5.299916  207.3461 15.16339  -14.24791      16.06292  
1 1 1 17 3  20 o 130.0633 4.373629  11.31791       0.7569236     11.19975       0.7662201     16.09866       4.873873      129.3722 4.451297  146.2148 25.96672  -16.84262      26.34548  
1 1 1 17 3  21 o 79.48922 8.833866  4.323086       0.9199064     3.731215       1.135002      5.456244       1.570465      72.92197 12.10483  87.93363 13.86146  -15.01167      18.40291  
1 1 1 17 3  22 o 139.8673 2.176460  13.04854       0.4056396     13.17813       0.4122076     9.079178       2.281404      140.5583 2.200828  112.6537 15.61740  27.90456       15.77171  
1 1 1 17 3  23 o 114.3047 7.306779  8.874889       1.107092      9.386551       1.848716      8.588808       1.382369      115.6644 12.17740  111.7548 9.369080  3.909584       15.36453  
1 1 1 17 3  24 o 133.2955 6.665436  12.05649       1.180150      11.68676       1.713613      12.39006       1.627671      129.7807 9.985703  134.0627 9.166550  -4.281982      13.55507  
1 1 1 17 3  25 o 141.1744 6.187240  13.53017       1.161102      12.81333       1.927163      13.93866       1.454788      134.8347 10.81681  142.5807 7.685526  -7.746017      13.26916  
1 1 1 17 3  26 o 23.48304 10.94920  -0.6661251     0.8393947     -3.192537      5.140260      -0.5969093     0.8508155     51.06805 24.70560  24.08171 11.15819  26.98634       27.10852  
1 1 1 17 3  27 o 53.06819 14.78832  2.195480       1.084601      1.920299       1.098772      12.65792       6.775091      49.71149 15.18774  90.35712 36.47137  -40.64563      39.50732  
1 1 1 17 3  28 o 100.9674 8.042601  7.133780       1.073123      1.563696       4.150222      7.532869       1.110901      55.16535 25.22420  103.7321 8.101105  -48.56679      26.49318  
1 1 1 17 3  29 o 32.09037 11.99179  0.6510109      0.6895744     3.377416       1.460387      -0.1312889     0.7822748     63.14886 16.98664  25.60629 11.39304  37.54257       20.45354  
1 1 1 17 4  0  o 130.7671 12.12296  11.70989       2.068379      11.70989       2.068379      11.70989       2.068379      130.7671 12.12296  130.7671 12.12296  0.000000       0.000000  
1 1 1 17 4  1  o 283.3642 10.33330  53.75284       3.895198      56.91735       5.517801      50.60925       5.499529      290.9805 14.27434  274.1912 15.11057  16.78931       20.78669  
1 1 1 17 4  2  o 266.4051 11.62386  47.58411       4.116420      45.37405       4.544402      57.68736       9.716383      259.8997 13.16480  290.1649 25.38503  -30.26514      28.59566  
1 1 1 17 4  3  o 525.8704 17.78777  186.4129       12.44653      163.2906       22.93188      196.0691       14.81928      483.5709 35.84303  538.2335 20.70110  -54.66263      41.39152  
1 1 1 17 4  4  o 270.0738 12.68140  48.97664       4.551020      52.85629       6.932201      46.03795       6.033256      279.3433 18.73169  260.9126 17.45372  18.43069       25.60290  
1 1 1 17 4  5  o 327.8784 10.93601  72.01817       4.771305      67.09779       6.362757      78.33975       7.212054      315.6631 15.17125  340.9626 15.91765  -25.29953      21.98950  
1 1 1 17 4  6  o 382.9905 10.58968  98.22606       5.399172      96.83631       8.183905      99.29710       7.184506      378.9721 16.24383  384.3363 14.05218  -5.364166      21.47850  
1 1 1 17 4  7  o 430.9886 11.55057  124.5346       6.627521      121.1536       9.899752      127.2806       8.921808      423.3565 17.58698  434.6613 15.42829  -11.30478      23.39517  
1 1 1 17 4  8  o 109.4093 7.006380  8.025631       1.016092      10.44017       4.408420      7.890162       1.044207      120.7714 27.94760  108.4521 7.267569  12.31931       28.87708  
1 1 1 17 4  9  o 186.0408 4.117611  23.07938       1.020768      17.66957       5.929152      23.24462       1.036240      157.2775 29.37112  186.7038 4.165180  -29.42624      29.66498  
1 1 1 17 4  10 o 298.6932 5.676598  59.54584       2.259368      53.83623       6.865938      60.23920       2.392623      281.1162 18.43072  300.3988 5.977267  -19.28253      19.37574  
1 1 1 17 4  11 o 122.4001 5.892144  10.02554       0.9581888     8.194912       1.843606      10.70305       1.121572      109.6344 12.86409  126.4012 6.682644  -16.76681      14.49629  
1 1 1 17 4  12 o 190.7973 5.902241  24.33312       1.498788      27.17814       2.381880      22.46823       1.928429      201.2508 8.903998  183.0898 7.923101  18.16101       11.91875  
1 1 1 17 4  13 f 215.8808 14.11306  31.63054       4.037580      34.44640       7.200673      30.33920       4.876282      221.2446 24.85387  210.3557 17.55641  10.88882       30.42930  
1 1 1 17 4  14 o 175.7139 7.935417  20.71751       1.853221      22.11165       5.569261      20.54392       1.965214      176.5840 24.31328  174.8906 8.457839  1.693359       25.74239  
1 1 1 17 4  15 o 163.0236 1.759312  17.71194       0.3821791     17.79831       0.3857907     13.16379       2.799584      163.4203 1.771627  138.2738 15.45849  25.14650       15.55968  
1 1 1 17 4  16 o 122.4693 6.625202  10.06560       1.077159      10.41157       1.118572      5.651149       3.995627      124.5433 6.765566  89.06970 29.18769  35.47355       29.96154  
1 1 1 17 4  17 o 34.29300 11.87336  0.7201291      0.6610260     0.6161429      0.6727385     3.628727       3.557954      32.99624 11.92513  75.58923 27.40989  -42.59298      29.89165  
1 1 1 17 4  18 o 73.12505 10.95603  3.691080       1.034730      3.796725       1.055782      1.120957       5.207458      74.17125 11.01644  72.24903 30.78122  1.922218       32.69321  
1 1 1 17 4  19 o 147.3555 4.379273  14.51887       0.8589342     14.31784       0.8696166     22.55067       5.496817      146.3206 4.465370  175.6715 24.11804  -29.35092      24.52793  
1 1 1 17 4  20 o 205.1777 4.583817  28.14721       1.253230      28.01872       1.280984      31.01653       6.053308      204.6909 4.696471  206.3562 22.37159  -1.665298      22.85924  
1 1 1 17 4  21 o 169.2969 2.119355  19.11339       0.4781083     19.23034       0.4810573     9.662486       4.324527      169.8136 2.125940  109.3004 29.15563  60.51311       29.23303  
1 1 1 17 4  22 o 40.70709 14.47043  1.034427       0.9861439     2.388716       1.540187      0.9349621E-01  1.283798      57.45017 18.05401  35.67878 15.24447  21.77139       23.62924  
1 1 1 17 4  23 o 77.64672 8.262683  4.143685       0.8417904     3.188072       1.123841      5.365094       1.270558      66.41907 13.16349  87.46589 11.15488  -21.04682      17.25424  
1 1 1 17 4  24 o 65.24635 11.11004  3.039162       0.9313474     6.873666       1.624129      1.160431       1.136837      97.93643 12.74743  42.55396 15.48457  55.38248       20.05664  
1 1 1 17 4  25 o 96.60831 7.110021  6.396266       0.9088783     8.689376       1.482507      5.015387       1.150436      111.1915 10.11644  84.08750 10.49519  27.10401       14.57709  
1 1 1 17 4  26 o 148.3932 7.157609  15.11396       1.411150      8.655306       4.496055      15.81973       1.486253      88.00437 30.93289  151.6895 7.375086  -63.68516      31.79993  
1 1 1 17 4  27 o 42.38256 19.90669  -1.180551      2.860743      -1.972721      3.200305      1.969437       6.381701      42.46799 20.26802  62.15763 29.35961  -19.68964      35.67603  
1 1 1 17 4  28 o 32.08417 12.76736  0.5220244      0.8180839     0.3401662      0.9161727     1.237502       1.817225      31.47494 13.13101  45.11910 18.62885  -13.64416      22.79161  
1 1 1 17 4  29 o 89.95825 8.414642  5.737026       0.9969676     5.121010       1.910301      5.967616       1.168761      76.23860 18.89920  90.80502 9.815024  -14.56641      21.29588  
1 1 1 17 5  0  o 170.8007 11.09057  19.72206       2.499418      19.72206       2.499418      19.72206       2.499418      170.8007 11.09057  170.8007 11.09057  0.000000       0.000000  
1 1 1 17 5  1  o 550.9269 11.14674  203.0988       8.183054      207.6373       9.806187      192.6905       14.85020      556.5605 13.22252  533.3360 20.93641  23.22449       24.76224  
1 1 1 17 5  2  o 52.41380 21.05034  0.8906050      2.244790      0.2507458      2.628007      2.617288       4.317085      52.42423 22.07884  76.27480 29.63581  -23.85057      36.95614  
1 1 1 17 5  3  f 323.9606 14.93741  70.63390       6.430884      69.96238       8.773085      71.41375       9.454369      320.9602 20.62204  323.8527 22.03977  -2.892487      30.18311  
1 1 1 17 5  4  o 318.2235 12.58673  67.97396       5.326738      63.00410       7.181499      74.05228       7.942081      305.2235 17.73364  330.8907 18.08131  -25.66718      25.32619  
1 1 1 17 5  5  o 113.0000 17.25568  8.796617       2.516012      11.23787       4.480072      7.671938       3.040835      125.7106 27.51066  104.3446 22.53047  21.36602       35.55923  
1 1 1 17 5  6  o 46.34843 11.47116  1.495947       0.7046021     -1.561437      5.584704      1.545401       0.7102779     68.92603 30.56689  47.10001 11.43361  21.82602       32.63529  
1 1 1 17 5  7  o 336.7797 8.094684  75.79008       3.632615      80.21341       6.262097      73.54665       4.459667      345.2755 13.63753  331.3333 10.11283  13.94223       16.97797  
1 1 1 17 5  8  f 456.8907 11.19610  139.9283       6.816362      140.7467       8.244787      138.1606       12.11642      457.3898 13.54247  450.4893 20.23609  6.900543       24.34949  
1 1 1 17 5  9  o 245.9054 3.092130  40.30871       1.013210      41.90786       7.562487      40.27948       1.022428      246.2814 23.32194  245.8150 3.121409  0.4664154      23.52990  
1 1 1 17 5  10 o 287.2961 17.06033  56.10332       6.501757      69.89523       12.96529      51.46974       7.514982      313.7610 31.43340  273.8294 20.75005  39.93161       37.66462  
1 1 1 17 5  11 o 410.0117 13.17209  113.3520       7.187216      101.5398       17.94895      115.6077       7.843485      373.5478 36.52570  413.6575 14.25095  -40.10971      39.20735  
1 1 1 17 5  12 o 323.3659 10.58527  70.28582       4.554954      77.98975       7.213511      65.17707       5.874187      338.7533 16.02591  310.2676 14.24618  28.48575       21.44256  
1 1 1 17 5  13 o 163.4674 7.132637  17.90706       1.549916      19.71883       1.796494      12.63254       3.065255      171.4458 7.884782  135.0852 17.43504  36.36063       19.13506  
1 1 1 17 5  14 o 325.7877 6.676348  70.98488       2.898326      77.17546       3.581229      59.23263       4.934316      339.4348 7.917759  295.9270 12.54165  43.50775       14.83185  
1 1 1 17 5  15 o 324.6386 6.483232  70.49564       2.804564      71.71854       3.075713      64.46286       6.831375      327.3241 7.051709  306.5823 16.78602  20.74173       18.20706  
1 1 1 17 5  16 o 197.6676 7.570234  26.22369       1.990283      25.63080       2.200125      28.89458       4.669697      195.2359 8.477159  204.4607 17.30206  -9.224777      19.26717  
1 1 1 17 5  17 o 297.5951 8.450562  59.53276       3.347687      57.62831       3.605614      71.43347       9.013231      292.5319 9.261473  318.6607 21.34969  -26.12878      23.27196  
1 1 1 17 5  18 o 156.7399 4.084885  16.41455       0.8524378     16.39566       0.8595157     17.54711       6.656059      156.6457 4.121347  149.0799 34.23001  7.565857       34.47723  
1 1 1 17 5  19 o 68.81065 11.85744  3.306867       1.047986      3.765007       1.068913      -8.050947      5.322187      73.68443 11.24205  50.54586 24.61105  23.13857       27.05712  
1 1 1 17 5  20 o 75.49011 7.186864  3.865477       0.7142290     4.059227       0.7209916     -6.317785      5.227008      77.39679 7.068861  52.32100 25.21292  25.07579       26.18511  
1 1 1 17 5  21 o 134.6523 9.379860  12.36602       1.672475      14.93989       1.841542      0.2477152      3.995857      148.0604 9.382286  59.74416 26.19973  88.31625       27.82899  
1 1 1 17 5  22 o 153.1545 10.38861  16.14199       2.107574      17.14488       2.172133      0.1901438E-01  8.709274      157.8619 10.38374  77.16363 35.73486  80.69827       37.21293  
1 1 1 17 5  23 o 98.75106 9.409362  6.739337       1.223208      7.117969       1.864589      6.453280       1.620694      99.17204 14.54161  95.03217 13.15047  4.139870       19.60595  
1 1 1 17 5  24 o 109.1842 8.018616  8.188303       1.158492      8.738526       1.546269      7.484235       1.749133      111.6367 10.51849  101.8093 13.20395  9.827400       16.88144  
1 1 1 17 5  25 o 77.62799 8.674433  4.207569       0.8819702     5.750892       1.211714      2.468661       1.286204      90.12440 10.27305  56.41302 16.23665  33.71138       19.21366  
1 1 1 17 5  26 o 33.55599 13.92196  0.3883401      1.021717      1.253645       3.914049      0.3250657      1.058414      55.90236 25.13264  33.46233 14.04737  22.44003       28.79198  
1 1 1 17 5  27 o 60.18612 23.79599  3.186661       2.824598      3.185506       3.084447      3.192660       7.030959      60.35293 24.51825  64.59695 30.60244  -4.244022      39.21293  
1 1 1 17 5  28 o 20.11073 9.689957  -1.037099      0.7714979     1.426078       1.288916      -2.412307      0.9630776     44.01212 16.40513  18.63256 9.316545  25.37956       18.86601  
1 1 1 17 5  29 o 29.41048 14.10731  -1.550720      1.593414      -3.302105      2.309978      0.3907758E-01  2.200837      31.62985 15.56775  40.57538 18.48219  -8.945528      24.16498  
1 1 1 17 6  0  o 24.93350 17.66368  -3.129756      2.437369      -3.129756      2.437369      -3.129756      2.437369      24.93350 17.66368  24.93350 17.66368  0.000000       0.000000  
1 1 1 17 6  1  o 448.4413 8.844368  134.3796       5.285012      135.8104       8.021863      133.2823       7.025182      449.7715 13.39968  445.9348 11.83305  3.836700       17.87659  
1 1 1 17 6  2  o 511.7000 10.13341  175.1382       6.909466      185.1636       10.45005      167.3510       9.209937      524.7220 14.96094  499.1555 13.86015  25.56659       20.39445  
1 1 1 17 6  3  o 147.2991 16.41507  14.78356       3.167248      16.04340       3.675183      11.14725       6.243842      153.1098 18.38072  124.5902 35.74744  28.51965       40.19615  
1 1 1 17 6  4  o 208.9669 13.57350  29.43400       3.759123      26.38391       4.527413      36.20398       6.745089      197.0350 17.42318  229.7607 22.31180  -32.72569      28.30872  
1 1 1 17 6  5  o 297.9983 11.69585  59.60507       4.635270      73.98154       9.288960      54.83820       5.348817      329.3769 21.27798  285.3290 14.11198  44.04782       25.53234  
1 1 1 17 6  6  o 287.9780 6.909179  55.37413       2.651302      61.04642       6.207236      54.10835       2.932241      300.6556 15.54651  284.4841 7.742337  16.17148       17.36772  
1 1 1 17 6  7  o 415.4433 7.212587  115.2851       3.992789      121.5874       9.886142      114.0567       4.364595      423.6578 17.55010  413.1146 7.928662  10.54321       19.25798  
1 1 1 17 6  8  o 288.1285 4.978472  55.38384       1.911419      63.22431       4.241024      53.38525       2.141222      307.0059 10.38188  282.8262 5.681571  24.17966       11.83485  
1 1 1 17 6  9  o 363.7402 10.44743  88.77295       5.058527      91.01866       14.09706      88.44105       5.419459      359.6190 29.68201  362.8638 11.22176  -3.244812      31.73247  
1 1 1 17 6  10 o 158.2994 6.832698  16.77505       1.437875      10.24646       4.991410      17.36585       1.501526      118.3277 31.21247  161.0477 7.013701  -42.72000      31.99079  
1 1 1 17 6  11 o 151.8995 13.12481  15.66414       2.630544      3.242765       7.286154      17.52588       2.820799      91.81725 37.53912  160.6974 13.29194  -68.88014      39.82287  
1 1 1 17 6  12 o 275.0925 10.61188  50.91678       3.882661      51.64504       4.980067      49.78799       6.200079      276.2042 13.57261  269.8373 17.33505  6.366913       22.01635  
1 1 1 17 6  13 o 97.38810 8.173596  6.397614       1.050923      6.441947       1.211789      6.263100       2.110814      97.52852 9.442405  94.39119 17.42377  3.137329       19.81784  
1 1 1 17 6  14 o 45.63325 14.10245  1.410938       0.9439988     1.559763       1.082539      0.9385594      1.928635      48.11635 15.13800  49.27859 19.60529  -1.162243      24.76947  
1 1 1 17 6  15 o 239.9203 4.906024  38.44227       1.568448      38.48885       1.585919      36.36312       10.59572      240.0595 4.957796  216.6609 38.09064  23.39862       38.41193  
1 1 1 17 6  16 o 160.0271 1.915708  17.06879       0.4085042     17.10862       0.4115438     14.40222       3.367318      160.2133 1.927720  143.5411 17.99964  16.67227       18.10257  
1 1 1 17 6  17 o 116.1038 5.441829  9.032804       0.8395657     9.000806       0.8545506     9.921277       4.502920      115.8842 5.550144  114.1239 29.42245  1.760262       29.94135  
1 1 1 17 6  18 o 245.6375 4.655764  40.32030       1.523910      40.47145       1.590322      38.62308       5.328996      246.0664 4.850194  235.5455 17.09475  10.52095       17.76949  
1 1 1 17 6  19 o 175.2881 2.041466  20.48521       0.4768349     20.49459       0.4777604     18.07170       7.664261      175.3280 2.044962  145.1218 38.86033  30.20625       38.91410  
1 1 1 17 6  20 o 68.40066 16.17300  3.395698       1.450737      3.683340       1.515146      0.2266384      5.029144      71.23698 16.31354  66.14223 29.18464  5.094749       33.43464  
1 1 1 17 6  21 o 24.33877 11.77028  -1.791743      1.164068      -2.023316      1.205195      1.428671       4.494364      24.16773 11.75475  66.26556 28.42274  -42.09784      30.75755  
1 1 1 17 6  22 o 71.78675 7.778923  3.531294       0.7322332     3.258336       0.7517831     8.575712       3.231841      68.77044 8.376439  103.7116 23.87959  -34.94112      25.30612  
1 1 1 17 6  23 o 100.3327 10.21004  7.014932       1.346037      7.491724       1.399032      1.076670       4.937338      103.6944 10.25942  63.85048 28.50190  39.84387       30.29214  
1 1 1 17 6  24 o 69.66058 10.29437  3.442057       0.9268202     1.475881       1.134044      7.396851       1.608351      45.60027 15.56032  101.6221 12.11567  -56.02184      19.72088  
1 1 1 17 6  25 o 69.18571 12.96649  3.549413       1.151487      -0.9412038     2.894703      4.393578       1.255060      44.30886 20.54811  77.34802 12.61115  -33.03916      24.10946  
1 1 1 17 6  26 o 104.2342 11.25408  7.839504       1.538372      9.795665       4.545650      7.586479       1.634840      92.42118 31.15702  101.7847 12.30301  -9.363533      33.49812  
1 1 1 17 6  27 o 27.96732 13.71077  -2.739329      1.736168      -2.537828      1.797704      -5.532365      6.692957      29.16261 14.22251  51.09700 25.38916  -21.93440      29.10136  
1 1 1 17 6  28 o 28.52572 13.36927  -0.8645096     1.278381      1.666758       4.151917      -1.129615      1.343658      54.22876 24.95584  28.21798 13.37103  26.01078       28.31216  
1 1 1 17 6  29 o 29.60382 13.37464  -0.2396025     1.124108      -1.801533      2.716975      0.8298305E-01  1.234745      38.12455 18.32211  32.82060 14.47221  5.303955       23.34833  
1 1 1 17 7  0  o 225.5538 11.46021  34.24960       3.424026      34.24960       3.424026      34.24960       3.424026      225.5538 11.46021  225.5538 11.46021  0.000000       0.000000  
1 1 1 17 7  1  o 673.5376 14.99399  305.1147       13.45714      319.3492       19.88733      293.0921       18.27702      685.1660 21.81025  656.9172 20.90617  28.24878       30.21184  
1 1 1 17 7  2  o 271.5747 10.42796  49.43927       3.766644      54.86897       7.499414      47.60745       4.355924      283.8970 19.95111  266.1671 12.31490  17.72989       23.44576  
1 1 1 17 7  3  o 435.7787 12.25523  127.4594       7.109343      122.7686       8.985672      135.3100       11.62465      426.6306 15.83358  446.4935 19.58616  -19.86292      25.18571  
1 1 1 17 7  4  o 213.5835 11.47736  30.66206       3.254507      30.38168       3.955149      31.24995       5.727202      212.1351 14.07144  213.6538 20.36275  -1.518738      24.75170  
1 1 1 17 7  5  o 340.7369 12.40086  78.02383       5.621078      90.87920       11.21132      73.70717       6.496630      363.9690 23.23769  330.5628 14.78636  33.40619       27.54317  
1 1 1 17 7  6  o 226.4977 4.927366  34.22204       1.487141      46.29880       6.788951      33.61334       1.524158      260.3542 19.71536  224.4647 5.095754  35.88951       20.36325  
1 1 1 17 7  7  o 544.4677 11.67548  198.9582       8.470717      198.2247       20.33339      199.1122       9.317760      533.0699 28.73161  544.2606 12.84787  -11.19073      31.47337  
1 1 1 17 7  8  o 176.7533 7.616508  20.92315       1.789684      13.82821       4.538085      22.22984       1.947528      139.5657 25.33451  182.1457 8.043845  -42.58003      26.58083  
1 1 1 17 7  9  f 444.2253 11.75417  132.7007       6.951634      137.0732       10.11519      128.7872       9.569667      449.2803 16.92624  435.6689 16.51405  13.61136       23.64765  
1 1 1 17 7  10 o 242.9677 7.064374  39.49695       2.284727      38.44609       5.855553      39.68567       2.481408      236.7504 18.71317  243.4587 7.658432  -6.708313      20.21966  
1 1 1 17 7  11 o 433.3271 15.11361  127.3507       8.713490      137.6166       13.15655      119.3293       11.62969      445.9762 22.20882  416.0089 21.04774  29.96729       30.59802  
1 1 1 17 7  12 o 181.8855 9.758244  22.27175       2.356408      23.89396       4.525756      21.66842       2.760035      186.0014 18.50525  179.0071 11.63402  6.994308       21.85851  
1 1 1 17 7  13 o 277.2093 8.687526  51.58815       3.205095      52.96700       4.423254      50.06389       4.650669      279.9790 11.88315  271.8531 12.87489  8.125885       17.52062  
1 1 1 17 7  14 o 260.5638 8.195440  45.57032       2.841969      44.68971       3.243748      48.47921       5.895456      257.7153 9.461742  265.7147 16.73555  -7.999359      19.22507  
1 1 1 17 7  15 o 199.7461 4.549767  26.64005       1.210991      26.92518       1.268243      23.69424       4.076505      200.7937 4.740006  185.2293 16.69498  15.56444       17.35483  
1 1 1 17 7  16 f 55.25716 9.700038  2.114711       0.6881849     2.302378       0.7022569     -2.427706      3.454980      57.76401 9.450042  48.73601 22.54797  9.028000       24.44819  
1 1 1 17 7  17 o 330.3705 7.871036  73.30030       3.465027      74.78671       3.761037      64.95693       8.910670      333.3892 8.472950  302.0345 22.29735  31.35468       23.85294  
1 1 1 17 7  18 o 303.9627 5.506329  61.83729       2.230262      62.52364       2.364860      56.31750       6.706477      305.5673 5.807980  283.5815 17.83811  21.98572       18.75982  
1 1 1 17 7  19 o 229.0671 2.190492  34.98937       0.6686177     35.04570       0.6712959     27.97266       7.492588      229.2508 2.197504  188.3568 30.92449  40.89397       31.00247  
1 1 1 17 7  20 o 123.4493 9.789592  10.41997       1.597198      9.937729       1.671832      15.46226       5.405962      120.2984 10.53564  137.7640 30.27628  -17.46559      32.05702  
1 1 1 17 7  21 o 90.46175 7.347498  5.562309       0.8780636     5.750848       0.8954332     0.8434967      4.479704      91.98685 7.366759  63.56352 27.81111  28.42332       28.77024  
1 1 1 17 7  22 o 150.7776 7.766690  15.47098       1.555179      16.82064       1.743627      10.22001       3.439220      156.9725 8.366196  113.0203 23.59949  43.95218       25.03855  
1 1 1 17 7  23 o 174.7545 7.210073  20.78513       1.675358      21.73846       1.720682      3.400570       7.347847      178.7074 7.240769  75.11471 34.03971  103.5927       34.80130  
1 1 1 17 7  24 o 42.85344 19.72408  -0.8560743     2.595001      -1.692257      2.780833      4.780427       7.219868      41.62994 19.57624  74.40537 33.72770  -32.77543      38.99727  
1 1 1 17 7  25 o 142.4590 12.42998  14.73128       2.335969      17.84019       3.509833      12.25910       3.129843      150.6934 17.82369  122.6077 19.83408  28.08574       26.66598  
1 1 1 17 7  26 o 67.49002 14.86227  3.539199       1.300375      2.787105       3.987802      3.628687       1.375564      60.45480 26.34935  67.92943 15.53524  -7.474625      30.58810  
1 1 1 17 7  27 o 48.09858 22.24533  0.9990794E-01  3.358548      0.3881288      3.434216      -6.225241      16.08793      49.29092 22.68825  62.03550 31.73476  -12.74458      39.01092  
1 1 1 17 7  28 o 109.8218 8.528032  8.533987       1.238215      6.249484       2.367558      9.394109       1.452730      81.66798 21.47465  114.3578 9.622529  -32.68982      23.53197  
1 1 1 17 8  0  o 107.2082 16.99051  8.256680       2.244961      8.256680       2.244961      8.256680       2.244961      107.2082 16.99051  107.2082 16.99051  0.000000       0.000000  
1 1 1 17 8  1  o 240.2511 7.108468  38.58276       2.273196      40.69139       2.644656      32.61809       4.447977      246.6214 8.058393  219.5291 15.30115  27.09230       17.29343  
1 1 1 17 8  2  o 232.5030 9.182644  36.21890       2.839324      42.53962       5.144348      33.44993       3.404915      250.7756 15.47002  223.0644 11.49396  27.71121       19.27258  
1 1 1 17 8  3  o 207.1562 8.488894  28.74163       2.338307      30.68204       2.648785      21.88960       4.977477      213.9347 9.313950  178.0535 21.40795  35.88127       23.34630  
1 1 1 17 8  4  o 239.6105 14.86688  38.82766       4.723401      49.19143       7.518583      32.07047       6.070995      267.8664 21.23787  215.9072 21.38233  51.95914       30.13721  
1 1 1 17 8  5  o 96.75753 14.21038  6.434298       1.777609      11.71344       6.215018      5.963953       1.855107      126.4263 35.46207  92.80689 15.55044  33.61939       38.72176  
1 1 1 17 8  6  f 95.95921 3.444914  6.147036       0.4397779     2.457486       6.930834      6.161951       0.4406658     88.37202 36.42347  96.07556 3.447685  -7.703537      36.58628  
1 1 1 17 8  7  o 242.5913 16.25253  39.99950       5.223444      36.50683       10.27363      41.21712       6.066000      223.5651 35.68533  245.5037 18.68291  -21.93860      40.28020  
1 1 1 17 8  8  o 150.3136 6.739372  15.12722       1.346435      3.967104       4.361852      16.30263       1.415565      82.14228 30.25950  156.0460 6.824252  -73.90369      31.01947  
1 1 1 17 8  9  o 268.0822 7.905895  48.12864       2.821096      49.63136       4.490638      47.14893       3.625911      271.2209 12.45871  264.8667 10.29304  6.354126       16.16063  
1 1 1 17 8  10 o 313.1654 11.24486  66.03394       4.684852      72.62547       7.592176      61.98080       5.953451      326.0383 17.53984  302.2164 14.82878  23.82196       22.96821  
1 1 1 17 8  11 o 474.1450 10.97382  151.2236       6.933340      157.5920       13.02973      148.7082       8.188944      477.9973 20.50443  469.0551 13.11466  8.942200       24.33980  
1 1 1 17 8  12 o 222.4947 20.91405  34.50028       6.127855      34.50028       6.127855      0.000000       0.000000      222.4947 20.91405  ?        ?         0.000000       20.91405  
1 1 1 17 8  13 o 175.3822 8.820090  20.69475       2.054641      17.15712       2.626641      26.27203       3.298042      158.8338 12.51130  196.7079 12.64937  -37.87410      17.79155  
1 1 1 17 8  14 o 296.0524 10.14066  59.07441       3.994539      61.79413       4.985081      54.19545       6.676877      301.9391 12.41672  280.1081 17.98352  21.83102       21.85365  
1 1 1 17 8  15 o 194.9366 7.496529  25.51328       1.943645      28.46467       2.215991      15.67126       4.046662      205.7905 8.096881  148.5083 21.03721  57.28215       22.54160  
1 1 1 17 8  16 o 279.5288 5.067993  52.22480       1.887714      52.17804       1.949112      52.93222       7.580709      279.3738 5.235732  273.8578 20.93220  5.515991       21.57706  
1 1 1 17 8  17 o 120.2160 1.783230  9.633034       0.2856558     9.660464       0.2867320     5.999357       3.300190      120.3869 1.787406  89.42666 26.08865  30.96026       26.14981  
1 1 1 17 8  18 o 128.3274 2.108503  10.97997       0.3605513     10.95323       0.3609998     21.72230       7.235834      128.1708 2.113704  163.4654 34.31426  -35.29456      34.37930  
1 1 1 17 8  19 o 88.60868 10.60607  5.416759       1.227441      5.594047       1.246977      -0.1086174     6.961451      90.06966 10.59202  74.19904 33.42437  15.87061       35.06251  
1 1 1 17 8  20 o 112.6303 7.036568  8.581908       1.050787      8.839823       1.079691      3.957301       4.571923      114.2949 7.124659  76.73138 30.29410  37.56352       31.12063  
1 1 1 17 8  21 o 69.76946 12.06530  3.461322       1.081127      3.129727       1.110988      9.382380       4.694666      65.91866 13.10977  102.6950 31.39723  -36.77631      34.02428  
1 1 1 17 8  22 o 183.9820 6.398842  22.89827       1.566349      24.26891       1.728174      16.59070       3.707293      189.1996 6.866169  147.8250 19.27966  41.37466       20.46581  
1 1 1 17 8  23 o 167.9966 14.00464  20.46259       3.106570      17.79743       3.822182      25.65004       5.332446      151.2084 19.41740  176.6432 23.21601  -25.43481      30.26580  
1 1 1 17 8  24 o 34.12531 16.63355  -3.382905      2.449234      -3.707833      2.573406      -0.2576118     7.981051      34.50739 16.86962  64.94686 31.26112  -30.43948      35.52241  
1 1 1 17 8  25 o 66.71560 22.26013  3.930689       2.320837      3.930689       2.320837      0.000000       0.000000      66.71560 22.26013  ?        ?         0.000000       22.26013  
1 1 1 17 8  26 o 78.56239 29.31780  7.135847       4.118880      7.479856       4.734671      6.065371       8.352057      77.72559 30.78386  69.68635 33.11209  8.039246       45.21125  
1 1 1 17 8  27 o 93.23222 16.19592  6.991259       1.939108      7.071942       1.953023      1.389559       16.27335      93.75481 16.21977  63.63301 32.49993  30.12179       36.32253  
1 1 1 17 8  28 o 96.58038 11.14559  6.894102       1.408102      2.920041       2.133266      9.962384       1.874457      56.24030 21.07646  114.9397 12.43646  -58.69940      24.47208  
1 1 1 17 9  0  o 470.3889 11.93889  148.2686       7.472432      148.2686       7.472432      148.2686       7.472432      470.3889 11.93889  470.3889 11.93889  0.000000       0.000000  
1 1 1 17 9  1  o 385.0054 6.115631  98.95874       3.137485      104.0785       17.24947      98.78356       3.190709      382.0796 34.24311  384.6505 6.225114  -2.570953      34.80435  
1 1 1 17 9  2  o 185.2078 13.16952  23.18342       3.228943      25.12249       4.848919      21.63848       4.328155      191.3404 19.28064  177.6413 18.55804  13.69911       26.76087  
1 1 1 17 9  3  o 189.8216 7.583538  24.12220       1.914326      29.98296       3.667526      21.92750       2.244318      210.7251 13.12639  180.7344 9.350808  29.99074       16.11644  
1 1 1 17 9  4  o 222.6882 7.892606  33.20018       2.338320      40.84671       6.265361      31.96274       2.520433      244.2342 19.41114  218.3824 8.678601  25.85178       21.26289  
1 1 1 17 9  5  o 423.0021 17.47448  121.6068       9.828428      126.8588       15.76763      118.2696       12.56897      425.6369 27.95531  414.2668 22.85771  11.37006       36.11059  
1 1 1 17 9  6  o 538.3200 5.456832  193.4370       3.914305      229.9967       25.09860      192.5257       3.962794      567.1946 33.35534  537.0353 5.537646  30.15930       33.81189  
1 1 1 17 9  7  o 116.1917 6.095114  9.041678       0.9403920     0.000000       0.000000      9.041678       0.9403920     ?        ?         116.1917 6.095114  0.000000       6.095114  
1 1 1 17 9  8  o 434.3597 13.78440  127.5112       7.968212      111.4618       18.56334      131.1362       8.822314      390.2374 36.10819  439.8882 15.07332  -49.65079      39.12807  
1 1 1 17 9  9  o 230.8752 8.930070  35.78087       2.742116      35.20016       3.890046      36.35441       3.865943      228.0818 12.85142  231.8818 12.55854  -3.799973      17.96874  
1 1 1 17 9  10 o 400.3792 9.608669  107.6068       5.126351      99.56190       9.142255      111.2964       6.191262      381.1494 18.05180  406.3958 11.44430  -25.24634      21.37380  
1 1 1 17 9  11 o 93.11068 16.66995  6.082814       1.992319      8.567018       4.289903      5.399657       2.249645      107.5698 29.19034  86.89546 19.86307  20.67432       35.30747  
1 1 1 17 9  12 o 181.5357 8.178939  22.13916       1.973402      20.87215       2.995863      23.11028       2.622818      175.1667 12.92609  184.9509 10.68789  -9.784195      16.77244  
1 1 1 17 9  13 o 243.5730 11.95948  40.19141       3.869771      42.11641       5.785864      38.63327       5.205407      246.9673 17.69881  236.9947 16.58798  9.972580       24.25714  
1 1 1 17 9  14 o 238.2628 7.835498  38.11796       2.484307      39.09053       2.636903      30.43696       7.410409      241.1940 8.216536  203.7343 28.03918  37.45967       29.21827  
1 1 1 17 9  15 o 68.34254 6.943837  3.161712       0.6235894     3.107390       0.6316108     5.259757       3.925263      67.72164 7.104861  85.84386 28.95293  -18.12222      29.81193  
1 1 1 17 9  16 o 159.4277 4.724883  17.00089       1.002649      17.32095       1.029528      11.11035       4.416723      160.9118 4.806888  120.7689 27.99271  40.14283       28.40243  
1 1 1 17 9  17 o 176.5349 2.404609  20.78267       0.5656509     20.79461       0.5677156     19.15068       6.638423      176.5850 2.412701  154.5818 33.21796  22.00320       33.30547  
1 1 1 17 9  18 o 168.1770 6.486497  19.01872       1.450893      18.99353       1.480591      19.62785       7.280528      168.0321 6.625544  151.6398 36.47768  16.39233       37.07450  
1 1 1 17 9  19 o 150.7369 8.339784  15.41568       1.668599      15.56916       1.731325      13.41192       6.255645      151.3959 8.617637  122.5627 35.96387  28.83320       36.98194  
1 1 1 17 9  20 o 98.20938 5.851766  6.506771       0.7623243     6.458200       0.7666889     10.73629       7.154521      97.82902 5.908911  104.7343 38.72354  -6.905289      39.17178  
1 1 1 17 9  21 o 87.80682 8.766556  5.311044       1.012029      5.099728       1.028196      11.87254       5.729426      85.91038 9.120874  110.1162 34.84984  -24.20581      36.02363  
1 1 1 17 9  22 o 31.65023 15.02985  -1.736519      1.715680      -2.930023      2.094920      0.6945072      2.989856      32.30138 15.66124  52.41359 22.83043  -20.11221      27.68579  
1 1 1 17 9  23 o 83.15005 20.96425  5.727688       2.321892      6.531452       2.671278      3.243813       4.695910      87.45526 22.72006  66.87236 28.87166  20.58290       36.73927  
1 1 1 17 9  24 f 39.66587 17.97739  -0.3750440     2.050168      -0.5580450     2.060374      17.95961       20.62318      38.99051 17.80719  80.86369 40.78902  -41.87318      44.50663  
1 1 1 17 9  25 o 121.6286 23.47490  13.20829       3.666822      13.43658       3.945862      11.76330       9.927270      119.8990 25.48361  79.46872 37.24838  40.43027       45.13155  
1 1 1 17 9  26 o 98.41975 13.88842  7.383369       1.770844      7.164297       1.780531      27.35407       17.00015      96.61680 14.25796  78.61865 39.28505  17.99815       41.79240  
1 1 1 17 9  27 o 65.68689 18.39171  3.758352       1.673297      3.810076       1.716149      2.761264       7.534846      65.88448 18.68852  60.29018 29.33934  5.594299       34.78588  
1 1 1 17 10 0  o 419.0141 24.65984  120.3276       13.65853      120.3276       13.65853      120.3276       13.65853      419.0141 24.65984  419.0141 24.65984  0.000000       0.000000  
1 1 1 17 10 1  o 375.3161 13.69430  95.05254       6.837257      66.27276       15.96690      101.5148       7.566040      298.2602 41.28004  387.5185 14.67873  -89.25833      43.81218  
1 1 1 17 10 2  o 341.7221 8.140277  78.12212       3.706686      81.42176       5.047964      74.26129       5.460384      348.1334 10.89512  332.0600 12.36209  16.07343       16.47801  
1 1 1 17 10 3  o 196.4262 6.755188  25.81096       1.765483      29.02467       4.806205      25.30968       1.898188      205.9778 17.68181  194.4358 7.339554  11.54202       19.14459  
1 1 1 17 10 4  o 433.2314 8.854841  125.6896       5.111805      137.6589       10.99753      122.3909       5.773386      449.2572 18.40974  427.1696 10.14278  22.08765       21.01891  
1 1 1 17 10 5  o 178.6650 15.78422  21.78524       3.719213      18.78703       5.024495      25.41907       5.531506      163.3209 23.78580  191.0370 22.13903  -27.71608      32.49463  
1 1 1 17 10 6  o 174.1344 10.93607  20.45163       2.524764      15.16090       10.03947      20.80883       2.608600      140.3772 46.27975  175.6013 11.20672  -35.22408      47.61728  
1 1 1 17 10 7  o 256.9491 9.096985  44.31446       3.109799      0.000000       0.000000      44.31446       3.109799      ?        ?         256.9491 9.096985  0.000000       9.096985  
1 1 1 17 10 8  o 441.1806 14.39882  131.9309       8.453466      127.4546       19.14684      133.0147       9.421447      416.9276 34.78032  442.0976 16.01933  -25.16998      38.29217  
1 1 1 17 10 9  o 452.0202 12.20620  137.9354       7.345380      141.1388       9.638660      133.4979       11.34441      455.1693 15.91619  440.3310 19.38181  14.83826       25.07947  
1 1 1 17 10 10 o 116.3713 10.61679  9.186750       1.628202      6.568140       2.540167      11.01293       2.121281      95.80956 20.51524  127.0492 12.70007  -31.23968      24.12814  
1 1 1 17 10 11 o 244.4356 10.77933  40.32492       3.502356      36.75434       6.054029      42.12107       4.293837      229.7741 19.97105  249.1197 12.97969  -19.34564      23.81838  
1 1 1 17 10 12 o 165.6003 9.123653  18.48031       2.005497      17.25155       2.636290      20.16819       3.089791      159.1775 12.53001  171.8667 13.60246  -12.68912      18.49400  
1 1 1 17 10 13 o 122.6539 16.03663  10.46449       2.558293      14.42357       4.260337      8.231812       3.199339      141.3827 23.43398  106.1986 23.25410  35.18417       33.01370  
1 1 1 17 10 14 o 123.5149 5.099372  10.21354       0.8374804     10.89610       0.8750017     2.763030       2.890890      127.5752 5.157811  67.22868 24.65650  60.34653       25.19020  
1 1 1 17 10 15 o 25.71795 10.51241  0.1654197      0.5712408     0.1152122      0.5738327     5.685730       6.017040      25.19432 10.44140  92.26061 35.21014  -67.06629      36.72569  
1 1 1 17 10 16 o 70.68557 7.056495  3.387052       0.6557779     3.440544       0.6595557     -1.242363      6.135746      71.24995 7.038798  69.17694 31.25083  2.073006       32.03372  
1 1 1 17 10 17 o 71.94067 14.93955  3.706745       1.385254      4.242918       1.462251      -0.9859712     4.325955      77.14136 14.76290  58.58307 26.37274  18.55828       30.22358  
1 1 1 17 10 18 o 124.1686 8.999787  10.50048       1.478972      10.76566       1.546779      7.673277       5.050484      125.6413 9.304982  96.20863 32.83732  29.43270       34.13023  
1 1 1 17 10 19 o 224.9979 7.767183  34.28054       2.325218      34.12587       2.469016      35.49362       6.914367      224.2450 8.277011  214.1833 24.67719  10.06163       26.02830  
1 1 1 17 10 20 o 42.92264 13.39478  1.296944       0.8493177     1.385903       0.8626041     -1.524264      4.857749      44.15648 13.45028  57.63705 26.69067  -13.48058      29.88815  
1 1 1 17 10 21 f 119.0552 17.33294  10.61445       2.669079      8.541398       3.700838      12.86154       3.853056      98.61092 27.25586  125.4402 23.92411  -26.82927      36.26630  
1 1 1 17 10 22 o 104.0624 15.51919  8.086937       2.086274      8.484141       2.637384      7.422826       3.410251      103.2497 19.89091  90.31940 26.56737  12.93034       33.18846  
1 1 1 17 10 23 o 113.9554 13.33765  9.524362       1.987021      9.211263       2.144309      11.42676       5.285631      110.8436 14.89449  99.37449 33.59735  11.46912       36.75089  
1 1 1 17 10 24 o 55.56767 26.37846  -0.7035627     5.275776      0.5530927      5.459948      -18.39376      20.48551      58.71540 27.55377  65.88887 33.85138  -7.173470      43.64775  
1 1 1 17 10 25 o 45.86298 20.91094  0.3331533E-01  2.825956      0.5522838      2.971965      -4.862426      9.128144      48.49861 21.84383  57.76858 28.85426  -9.269966      36.19007  
1 1 1 17 10 26 o 36.28517 17.67600  -2.959802      2.754581      -2.960744      2.811221      -2.937135      13.79196      36.69202 17.87030  61.05873 31.06919  -24.36671      35.84190  
1 1 1 17 10 27 o 68.80860 22.02464  4.618075       2.283063      4.882953       2.428431      2.602237       6.699314      69.92616 22.74436  58.84597 28.40366  11.08018       36.38783  
1 1 1 17 11 0  o 51.81352 30.86928  2.071860       3.745679      2.071860       3.745679      2.071860       3.745679      51.81352 30.86928  51.81352 30.86928  0.000000       0.000000  
1 1 1 17 11 1  o 315.1991 12.67160  67.03743       5.311335      56.99884       12.89102      69.09002       5.829101      278.8804 35.49230  319.6519 13.71711  -40.77155      38.05079  
1 1 1 17 11 2  o 108.7675 6.338086  7.930998       0.9146298     6.272894       1.710619      8.594780       1.082330      95.43782 13.85573  113.1435 7.216494  -17.70570      15.62239  
1 1 1 17 11 3  o 306.0942 6.489136  62.61335       2.646766      63.50901       6.321166      62.42293       2.914563      305.7142 15.56827  305.5284 7.158934  0.1858215      17.13538  
1 1 1 17 11 4  o 166.5252 1.735358  18.47992       0.3850724     11.47959       4.581600      18.52972       0.3864397     125.4048 28.11388  166.7493 1.739178  -41.34451      28.16762  
1 1 1 17 11 5  o 184.5238 8.700848  22.86641       2.133352      24.31787       3.377333      21.90277       2.751863      189.2792 13.47871  180.0428 11.53098  9.236389       17.73808  
1 1 1 17 11 6  o 410.7049 6.388881  112.7504       3.496457      0.000000       0.000000      112.7504       3.496457      ?        ?         410.7049 6.388881  0.000000       6.388881  
1 1 1 17 11 7  o 411.4124 13.59415  114.6349       7.442286      102.8580       32.46031      115.2883       7.645959      317.2505 77.46733  412.4156 13.93309  -95.16516      78.71034  
1 1 1 17 11 8  o 144.0695 11.88437  14.09174       2.261234      0.000000       0.000000      14.09174       2.261234      ?        ?         144.0695 11.88437  0.000000       11.88437  
1 1 1 17 11 9  o 119.1135 31.91733  10.70688       5.168101      3.208602       9.419824      13.93585       6.181510      98.06774 41.57544  134.9640 34.30429  -36.89623      53.90085  
1 1 1 17 11 10 o 393.7071 14.19256  105.4342       7.433550      99.28452       8.792708      120.8426       13.91793      380.0786 17.40726  412.3901 25.45155  -32.31155      30.83494  
1 1 1 17 11 11 o 115.7725 6.983287  9.007404       1.072296      7.892275       1.619350      9.878181       1.430974      107.5189 11.48012  120.9398 8.942767  -13.42095      14.55219  
1 1 1 17 11 12 o 248.2061 7.839344  41.36869       2.589529      42.84275       3.389278      39.30146       4.013689      251.9445 10.11609  240.4442 12.57092  11.50029       16.13577  
1 1 1 17 11 13 o 186.0217 16.15217  23.95239       3.964115      24.82172       4.949321      22.39676       6.620729      187.5052 20.12331  172.4190 29.90022  15.08626       36.04124  
1 1 1 17 11 14 o 229.9340 5.327052  35.36123       1.632164      34.94168       1.693697      40.82247       6.110694      228.5262 5.561940  240.9043 19.19447  -12.37811      19.98407  
1 1 1 17 11 15 o 292.2839 6.010332  57.23766       2.340868      56.59180       2.432357      65.34181       8.616155      290.5552 6.282393  301.8564 21.56301  -11.30124      22.45956  
1 1 1 17 11 16 o 316.5901 5.703452  67.16705       2.406072      67.92888       2.540236      60.52113       7.502800      318.2859 5.989399  291.1894 19.44782  27.09644       20.34922  
1 1 1 17 11 17 o 135.2286 4.238900  12.24131       0.7628838     12.24075       0.7687033     12.27768       6.211622      135.2206 4.271571  117.8991 36.12861  17.32151       36.38025  
1 1 1 17 11 18 o 63.05966 8.701372  2.746298       0.7116934     2.662923       0.7183552     7.179145       5.237963      62.01527 8.951750  92.06245 33.27484  -30.04718      34.45792  
1 1 1 17 11 19 o 28.71169 13.05096  -0.5552999     1.090239      -0.1659816     1.124688      -6.620121      4.439034      31.63722 13.88608  44.94334 22.01035  -13.30612      26.02458  
1 1 1 17 11 20 o 21.68272 10.19101  -0.7420919     0.7519462     -0.7836987     0.7677921     0.2348147      3.720388      21.75592 10.24789  55.53410 24.76862  -33.77818      26.80492  
1 1 1 17 11 21 o 118.6980 17.19835  10.67217       2.641059      14.36021       4.037846      7.914664       3.491485      131.1064 23.99683  93.84199 26.66909  37.26438       35.87601  
1 1 1 17 11 22 o 96.35509 14.74318  6.942387       1.832849      6.463364       2.154389      8.197555       3.487364      90.15269 18.55278  93.59826 26.67107  -3.445564      32.48925  
1 1 1 17 11 23 o 55.27618 22.47303  2.138534       2.593655      2.996331       2.793165      -3.230678      6.988107      60.57621 23.75062  57.17219 27.91726  3.404018       36.65331  
1 1 1 17 11 24 o 94.77589 25.62132  8.681413       3.312468      11.29135       3.656612      -3.258957      7.821186      109.0731 25.60074  57.63347 28.41994  51.43961       38.25037  
1 1 1 17 11 25 o 56.69848 25.03012  2.360886       3.703606      1.350837       3.874766      13.04194       12.60031      53.79273 24.51076  72.73452 35.90525  -18.94179      43.47372  
1 1 1 17 11 26 o 41.52553 17.68002  0.8100913      1.716006      0.9444741      1.819878      -0.2673268     5.153028      42.94587 18.24315  52.23995 25.13831  -9.294079      31.06038  
1 1 1 17 12 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 17 12 1  o 183.7199 7.582845  22.62908       1.852368      0.000000       0.000000      22.62908       1.852368      ?        ?         183.7199 7.582845  0.000000       7.582845  
1 1 1 17 12 2  o 289.4498 6.250375  55.99561       2.410754      31.91721       11.25426      57.15358       2.468042      201.4836 43.21436  292.4150 6.334018  -90.93141      43.67608  
1 1 1 17 12 3  o 154.1540 1.839363  15.83703       0.3778293     15.49238       2.505276      15.84505       0.3822008     151.0138 12.56358  154.1926 1.860179  -3.178787      12.70055  
1 1 1 17 12 4  o 344.6740 13.37952  80.45485       6.133337      68.69907       16.69833      82.28817       6.594266      296.7539 43.52103  348.2110 14.24190  -51.45703      45.79205  
1 1 1 17 12 5  f 112.1537 5.619815  8.424291       0.8371885     8.155261       3.207499      8.443958       0.8672507     106.2824 23.29259  112.2641 5.817203  -5.981644      24.00801  
1 1 1 17 12 6  o 132.3141 11.26335  11.87868       1.966995      13.78490       4.944774      11.52034       2.143921      136.9940 28.03309  130.0091 12.53052  6.984848       30.70615  
1 1 1 17 12 7  o 109.9365 15.13438  8.367062       2.158305      0.000000       0.000000      8.367062       2.158305      ?        ?         109.9365 15.13438  0.000000       15.13438  
1 1 1 17 12 8  o 206.1149 19.69171  29.60113       5.342700      6.860296       10.94061      36.72244       6.122348      111.6447 45.86233  229.4834 20.22819  -117.8387      50.12517  
1 1 1 17 12 9  o 305.6621 16.98025  64.25459       6.888888      81.02053       14.69218      59.52988       7.799378      328.7260 34.03290  292.3235 20.14590  36.40244       39.54865  
1 1 1 17 12 10 f 205.2314 9.797939  28.41670       2.671751      33.15262       8.757772      27.93070       2.805490      209.8843 32.35230  203.3073 10.39022  6.577042       33.97982  
1 1 1 17 12 11 o 218.8267 13.91170  32.74392       4.035522      29.70024       4.294432      55.72679       11.80074      207.6647 15.63401  270.9270 33.39347  -63.26230      36.87203  
1 1 1 17 12 12 o 93.11086 7.794621  5.860506       0.9582276     6.254564       1.037930      3.586285       2.493471      96.14336 8.179258  71.39243 23.03305  24.75092       24.44221  
1 1 1 17 12 13 o 57.29759 19.91914  2.131551       1.861301      2.701410       4.209783      1.993084       2.075151      72.75271 28.95846  57.35796 20.91322  15.39475       35.72051  
1 1 1 17 12 14 o 17.35963 8.650190  -2.046814      0.7996562     -1.946214      0.8049092     -9.678775      7.010781      17.76831 8.824667  58.14231 28.29559  -40.37400      29.63976  
1 1 1 17 12 15 o 82.15581 13.13259  4.741114       1.389288      4.587079       1.428864      7.406798       5.944083      80.57435 13.80461  96.83147 35.38091  -16.25713      37.97862  
1 1 1 17 12 16 o 128.2317 6.159345  11.06775       1.049377      11.49244       1.074400      2.267567       4.890784      130.6680 6.188120  71.82047 30.17613  58.84754       30.80409  
1 1 1 17 12 17 o 132.6297 9.133079  12.01247       1.604249      11.95803       1.638823      13.26202       7.851488      132.2468 9.360275  115.1369 40.84056  17.10991       41.89948  
1 1 1 17 12 18 o 53.97404 16.30540  2.126317       1.271298      1.927921       1.291147      8.430795       7.278371      51.84629 16.55954  94.48694 37.91925  -42.64064      41.37739  
1 1 1 17 12 19 o 72.88529 8.338195  3.666697       0.7952567     3.712206       0.7976903     -3.757731      10.18863      73.35078 8.307314  71.59667 34.67180  1.754105       35.65312  
1 1 1 17 12 20 o 41.39989 12.63707  1.231120       0.7609231     1.003936       0.7880684     4.359492       2.924379      38.38836 12.97296  71.81593 24.96765  -33.42757      28.13684  
1 1 1 17 12 21 o 148.3845 6.511909  14.99012       1.284433      16.05871       1.366572      6.894019       3.761542      153.4976 6.697365  84.15141 28.34261  69.34615       29.12315  
1 1 1 17 12 22 o 40.81211 17.19590  0.5975208      1.595253      1.684914       1.869014      -2.320320      3.061612      49.93117 19.47151  41.46344 19.79833  8.467728       27.76894  
1 1 1 17 12 23 o 67.18553 21.40294  3.964836       2.157995      3.158202       2.768852      5.212992       3.444261      60.79419 23.70201  72.01930 26.82264  -11.22511      35.79441  
1 1 1 17 12 24 o 68.83690 24.22778  4.645650       2.758801      4.783034       3.377619      4.370290       4.781808      67.94946 26.26484  65.15773 28.61457  2.791733       38.84116  
1 1 1 17 12 25 o 51.39587 16.38157  2.162702       1.264061      2.209888       1.273660      -0.9327146     10.31587      51.88700 16.43254  59.55389 29.88025  -7.666889      34.10070  
1 1 1 17 13 0  o 21.97021 12.68822  0.4021046      0.6002676     0.4021046      0.6002676     0.4021046      0.6002676     21.97021 12.68822  21.97021 12.68822  0.000000       0.000000  
1 1 1 17 13 1  o 203.8513 5.318235  27.77576       1.443389      0.000000       0.000000      27.77576       1.443389      ?        ?         203.8513 5.318235  0.000000       5.318235  
1 1 1 17 13 2  o 161.6279 1.942612  17.41105       0.4183849     9.905178       5.706151      17.45162       0.4195141     114.5479 34.53145  161.8161 1.945590  -47.26814      34.58622  
1 1 1 17 13 3  o 397.4149 9.189553  106.0453       4.866448      113.3678       7.123553      99.63751       6.663820      409.0919 13.08462  383.5064 13.05904  25.58551       18.48637  
1 1 1 17 13 4  f 42.09539 12.92256  1.200928       0.7942494     0.5945193      3.432109      1.235241       0.8164112     59.78880 25.20883  42.68096 13.10148  17.10784       28.41010  
1 1 1 17 13 5  o 131.2026 14.10417  11.81402       2.427156      28.95554       7.621173      9.879168       2.560477      198.6026 29.70951  119.1621 16.57329  79.44049       34.01953  
1 1 1 17 13 6  o 243.0314 5.326097  39.46296       1.724825      43.33163       5.385705      39.02082       1.820723      251.3047 16.16885  241.6229 5.654994  9.681778       17.12923  
1 1 1 17 13 7  f 55.08139 18.99758  1.933063       1.691620      0.000000       0.000000      1.933063       1.691620      ?        ?         55.08139 18.99758  0.000000       18.99758  
1 1 1 17 13 8  o 218.3692 19.89663  33.36816       5.726027      0.000000       0.000000      33.36816       5.726027      ?        ?         218.3692 19.89663  0.000000       19.89663  
1 1 1 17 13 9  o 284.8929 17.26123  56.11052       6.522056      44.87121       11.79373      61.06200       7.827960      238.5248 38.41011  295.4314 20.00261  -56.90663      43.30636  
1 1 1 17 13 10 f 50.87675 16.12695  1.761340       1.226489      0.7086442      1.345346      6.941713       2.984442      41.62869 16.43395  97.04753 23.36097  -55.41884      28.56238  
1 1 1 17 13 11 o 149.2782 7.826316  15.00931       1.551342      16.33781       1.721467      9.266942       3.579005      155.6521 8.330188  111.5573 24.72630  44.09480       26.09180  
1 1 1 17 13 12 o 225.5749 8.537489  34.31676       2.561592      35.56725       2.939149      30.36588       5.224316      229.2746 9.641899  207.1810 19.13997  22.09360       21.43139  
1 1 1 17 13 13 o 165.8580 10.31120  18.72079       2.267596      15.42914       3.418919      21.30604       3.029932      147.4599 17.75662  175.9162 13.01792  -28.45625      22.01735  
1 1 1 17 13 14 o 108.2591 5.617516  7.875933       0.8075960     7.907433       0.8270442     7.229702       3.746034      108.4550 5.743234  95.78812 27.75192  12.66691       28.33997  
1 1 1 17 13 15 o 180.1877 1.789326  21.64687       0.4296235     21.62538       0.4321770     23.45002       3.957976      180.0974 1.800864  181.6839 16.52948  -1.586502      16.62729  
1 1 1 17 13 16 o 132.0653 6.594988  11.77534       1.156911      11.37635       1.187588      19.20032       5.123139      129.7236 6.895030  156.4550 25.44756  -26.73146      26.36512  
1 1 1 17 13 17 o 54.51216 14.87608  2.177856       1.110480      1.897909       1.134043      8.705203       5.475958      51.16908 15.38732  96.79671 34.12818  -45.62762      37.43664  
1 1 1 17 13 18 o 139.8076 7.378544  13.30023       1.369729      13.13433       1.384078      21.17718       9.537103      138.8799 7.506974  127.8884 45.04362  10.99158       45.66489  
1 1 1 17 13 19 o 131.2548 3.099620  11.52253       0.5421223     11.55722       0.5430533     1.430863       9.261909      131.4522 3.100282  73.81641 35.01499  57.63577       35.15197  
1 1 1 17 13 20 o 103.7595 7.793562  7.413077       1.069675      7.231678       1.108859      9.844519       4.059671      102.2979 8.203302  101.0660 28.76902  1.231926       29.91573  
1 1 1 17 13 21 o 88.70482 10.90424  5.632302       1.261803      7.247344       1.501029      1.741805       2.329699      100.4365 11.41809  52.37557 21.29694  48.06089       24.16470  
1 1 1 17 13 22 o 121.4766 12.35480  10.76958       1.972074      9.743746       2.296931      13.64636       3.846467      112.5853 15.74018  123.1837 24.29698  -10.59835      28.94990  
1 1 1 17 13 23 o 58.27656 20.48628  2.913721       1.972087      3.140330       2.069478      0.6746808      6.505085      59.96692 20.99326  59.37944 28.48816  0.5874748      35.38774  
1 1 1 17 13 24 o 44.12298 10.98344  1.459940       0.6432289     6.102341       3.815056      1.324110       0.6525711     72.12998 27.90493  41.92765 11.38799  30.20234       30.13920  
1 1 1 17 13 25 o 41.11987 16.75308  1.007082       1.445010      1.033418       1.454236      -1.048955      12.84900      41.36909 16.82442  60.19254 30.56413  -18.82344      34.88878  
1 1 1 17 14 0  o 113.3205 5.514827  8.629320       0.8282323     8.629320       0.8282323     8.629320       0.8282323     113.3205 5.514827  113.3205 5.514827  0.000000       0.000000  
1 1 1 17 14 1  o 206.6005 1.764172  28.44737       0.4856752     27.34684       4.340755      28.46132       0.4887440     199.2691 16.49516  206.6508 1.774887  -7.381699      16.59038  
1 1 1 17 14 2  o 160.1111 8.326766  17.24528       1.770420      17.52261       6.024718      17.21907       1.852197      152.9400 30.63141  159.9141 8.725201  -6.974106      31.84984  
1 1 1 17 14 3  o 152.5519 5.408092  15.57125       1.097609      14.90805       3.298221      15.65384       1.163952      146.4532 17.23009  152.9178 5.722297  -6.464615      18.15546  
1 1 1 17 14 4  o 73.50599 17.81708  3.862699       1.726759      4.599897       3.163847      3.549945       2.060745      80.62281 25.93925  70.63275 20.61825  9.990059       33.13543  
1 1 1 17 14 5  o 84.71851 20.57918  5.189736       2.299839      6.056054       8.115078      5.114079       2.398162      100.9345 40.19620  83.97655 21.37882  16.95799       45.52789  
1 1 1 17 14 6  o 466.4948 10.98916  146.9639       6.831006      143.8706       10.58131      149.1743       8.944637      456.6448 17.42146  467.5586 14.37372  -10.91379      22.58564  
1 1 1 17 14 7  f 99.37518 12.93859  6.815254       1.672675      5.861321       3.803033      7.044051       1.862496      89.42333 28.40417  100.6894 14.28180  -11.26610      31.79255  
1 1 1 17 14 8  o 81.81779 30.03765  4.388911       4.292158      0.000000       0.000000      4.388911       4.292158      ?        ?         81.81779 30.03765  0.000000       30.03765  
1 1 1 17 14 9  o 180.9329 10.84239  22.23224       2.602072      0.000000       0.000000      22.23224       2.602072      ?        ?         180.9329 10.84239  0.000000       10.84239  
1 1 1 17 14 10 o 104.9142 10.37008  7.517591       1.430798      9.675589       1.740132      3.013640       2.513932      118.9508 11.10685  66.84733 23.15430  52.10347       25.68041  
1 1 1 17 14 11 o 126.9822 7.475958  10.87640       1.259382      11.58512       1.315074      3.036533       4.373872      131.0491 7.562954  74.36929 29.54494  56.67979       30.49757  
1 1 1 17 14 12 o 19.42963 9.567114  -1.829049      0.8755278     -1.722964      0.9211850     -2.820351      2.815934      20.62073 10.08346  41.10202 19.44068  -20.48129      21.90014  
1 1 1 17 14 13 o 242.4250 13.37476  40.67765       4.303786      35.30751       6.315954      45.33254       5.880314      219.0414 21.93386  252.5899 17.58045  -33.54857      28.10990  
1 1 1 17 14 14 o 27.86128 12.58323  -0.4677020     0.9940537     -0.2942707     1.052148      -1.909365      3.033508      29.89885 13.26300  45.31038 21.02031  -15.41154      24.85479  
1 1 1 17 14 15 o 38.54339 15.21057  0.6676276      1.152132      0.4786562      1.183347      4.108501       5.049500      37.28041 15.17111  77.59460 31.42627  -40.31419      34.89660  
1 1 1 17 14 16 o 121.4563 6.863253  9.998522       1.106248      10.23605       1.127749      3.946715       5.692407      122.8790 6.915404  76.91168 32.44884  45.96730       33.17755  
1 1 1 17 14 17 o 137.9977 8.141070  13.02428       1.490366      12.96978       1.545686      13.74503       5.621049      137.5604 8.473590  118.5898 33.88342  18.97062       34.92689  
1 1 1 17 14 18 o 58.79364 10.05463  2.456057       0.7594280     2.368508       0.7805510     4.008272       3.286644      57.53574 10.57040  69.64233 26.14788  -12.10658      28.20363  
1 1 1 17 14 19 o 47.86817 12.03761  1.689141       0.7669502     1.059913       0.8118232     6.913553       2.339248      39.06542 13.16705  92.82432 19.53168  -53.75890      23.55542  
1 1 1 17 14 20 o 29.72941 13.06823  -0.9066658E-01 0.9995053     0.4574516      1.054196      -4.965908      3.143998      34.66182 14.23721  36.59395 18.04005  -1.932129      22.98133  
1 1 1 17 14 21 o 107.2177 5.391840  7.803669       0.7678579     15.37576       1.971918      6.450307       0.8336583     147.4320 10.09843  97.04528 6.483938  50.38676       12.00082  
1 1 1 17 14 22 o 81.59468 6.415645  4.576537       0.6919435     2.886363       0.9085106     6.911267       1.067782      62.59203 11.30885  99.50913 8.123412  -36.91711      13.92408  
1 1 1 17 14 23 o 55.33822 15.42703  2.465905       1.180058      -4.364227      3.014147      3.702326       1.282428      35.52712 17.54221  68.74586 14.45866  -33.21874      22.73284  
1 1 1 17 14 24 o 77.50546 15.37580  4.807811       1.531895      3.543381       4.532023      4.970913       1.627701      60.23306 27.06477  78.15855 16.16272  -17.92549      31.52357  
1 1 1 17 15 0  o 188.0934 1.790676  23.58248       0.4487202     23.58248       0.4487202     23.58248       0.4487202     188.0934 1.790676  188.0934 1.790676  0.000000       0.000000  
1 1 1 17 15 1  o 144.7139 10.42663  14.19918       1.997130      28.37491       7.045513      12.96064       2.082548      196.4137 27.68669  137.9799 11.42920  58.43382       29.95295  
1 1 1 17 15 2  o 26.61891 10.34410  0.3006634      0.5260106     -0.6650451     0.6593779     1.990813       0.8723162     20.49688 9.604839  53.13663 12.52579  -32.63976      15.78443  
1 1 1 17 15 3  f 201.3930 7.116105  27.22028       1.906677      26.15092       5.869578      27.34643       2.016008      190.7005 23.60166  201.7765 7.511158  -11.07600      24.76804  
1 1 1 17 15 4  o 132.8346 10.97285  12.00768       1.924937      4.721443       5.966162      12.85430       2.033697      88.86637 34.75011  137.4072 11.20434  -48.54078      36.51175  
1 1 1 17 15 5  o 187.5918 13.04212  24.06183       3.239832      37.31761       7.583942      21.10266       3.583255      226.3270 25.59559  174.6680 15.55805  51.65897       29.95308  
1 1 1 17 15 6  o 189.9824 11.38849  24.54732       2.869822      24.40072       4.691775      24.63496       3.627578      186.0006 19.20582  189.1382 14.50408  -3.137604      24.06724  
1 1 1 17 15 7  o 120.4674 14.34763  10.07722       2.257950      13.26315       5.745959      9.495401       2.455483      129.0025 33.22499  116.2158 16.30398  12.78672       37.00973  
1 1 1 17 15 8  o 180.1382 21.79467  23.43083       5.125293      37.89943       14.45161      21.34917       5.481606      194.7349 53.87402  169.8814 24.95883  24.85347       59.37468  
1 1 1 17 15 9  o 172.4078 10.38725  20.22319       2.375265      18.75068       3.663750      21.29086       3.119717      163.1289 17.10898  175.7181 13.42536  -12.58926      21.74759  
1 1 1 17 15 10 o 219.3398 14.07963  33.31042       4.093385      24.91563       8.577699      35.78593       4.657990      169.7811 38.76899  226.4614 15.52986  -56.68037      41.76376  
1 1 1 17 15 11 o 90.22105 6.976977  5.507045       0.8322685     5.849276       0.8816269     2.704839       2.522756      92.95866 7.172841  63.84116 23.09013  29.11750       24.17858  
1 1 1 17 15 12 o 140.2679 4.903145  13.19360       0.9150360     13.10980       0.9299046     15.75154       5.137481      139.8033 4.999739  140.2389 28.46572  -0.4356689     28.90146  
1 1 1 17 15 13 o 223.4271 18.67774  36.31266       5.509921      37.18036       8.700084      35.73156       7.119759      210.3198 32.05536  214.2769 25.43075  -3.957138      40.91783  
1 1 1 17 15 14 o 210.7988 1.673501  29.62919       0.4700755     29.61933       0.4717442     31.01665       5.593755      210.7631 1.679726  202.9361 20.98826  7.826981       21.05537  
1 1 1 17 15 15 o 153.7612 8.287862  16.14065       1.691822      16.53714       1.916066      14.73796       3.603943      155.1584 9.310307  139.2414 19.99687  15.91705       22.05803  
1 1 1 17 15 16 o 130.8691 8.157696  11.73112       1.415510      11.88655       1.579074      11.09527       3.193774      131.3121 9.080442  118.8520 20.93043  12.46011       22.81528  
1 1 1 17 15 17 o 134.7545 7.375625  12.40887       1.319340      12.58940       1.347217      8.181720       6.519156      135.6857 7.480207  86.15865 35.39862  49.52708       36.18032  
1 1 1 17 15 18 o 19.70960 8.325477  0.3975280E-01  0.3754637     2.451620       1.151358      -0.2472582     0.3971759     56.68019 15.00931  17.08860 7.809731  39.59160       16.91955  
1 1 1 17 15 19 o 57.58120 7.137546  2.298659       0.5359330     2.384667       0.9156650     2.253842       0.6609755     56.64556 12.46945  56.34171 9.115157  0.3038559      15.44582  
1 1 1 17 15 20 o 30.52631 12.26944  0.4002278      0.7632467     0.6823391      1.196063      0.2064322      0.9913241     37.76091 15.29433  31.69875 13.46487  6.062162       20.37693  
1 1 1 17 15 21 o 26.07635 10.86054  0.1786893      0.6252025     -0.8598926     0.9359278     1.015575       0.8401467     23.93453 11.28648  38.12293 13.37379  -14.18840      17.49980  
1 1 1 17 15 22 o 65.69081 11.53745  3.207237       0.9730917     2.360900       1.222738      4.669169       1.607035      53.99440 15.91510  75.97619 16.35790  -21.98178      22.82261  
1 1 1 17 15 23 o 47.82534 17.08780  1.817640       1.376842      -0.1089964     3.047871      2.311608       1.543285      45.45200 21.08048  52.47438 18.14340  -7.022385      27.81312  
1 1 1 17 16 0  o 114.3861 8.209795  8.891604       1.236246      8.891604       1.236246      8.891604       1.236246      114.3861 8.209795  114.3861 8.209795  0.000000       0.000000  
1 1 1 17 16 1  o 86.19927 3.044729  4.963131       0.3491751     5.457173       0.4011027     3.417057       0.7095590     90.37080 3.336570  70.92712 7.627352  19.44367       8.325214  
1 1 1 17 16 2  o 196.6378 11.89723  26.37059       3.102772      29.82157       6.691023      25.42520       3.502076      201.2935 25.51793  192.3234 13.75616  8.970016       28.98960  
1 1 1 17 16 3  o 85.85693 10.25765  5.053777       1.150345      4.783280       1.297302      6.048909       2.488284      83.04390 12.07727  90.76221 20.99231  -7.718307      24.21854  
1 1 1 17 16 4  o 174.8290 15.20568  21.21431       3.507161      21.69860       4.701254      20.60657       5.266483      173.9634 20.68523  167.2892 24.33867  6.674225       31.94135  
1 1 1 17 16 5  o 130.1668 16.04344  11.89711       2.723916      12.83662       3.635181      10.69416       4.113386      132.8752 21.24631  118.3012 26.72627  14.57405       34.14234  
1 1 1 17 16 6  o 142.0614 22.60013  14.83849       4.135029      9.840777       9.289013      16.07359       4.617798      109.9695 43.25342  146.8410 24.46014  -36.87148      49.69061  
1 1 1 17 16 7  o 142.4724 10.50426  13.85533       1.980182      17.11541       3.398795      12.18010       2.436398      155.7956 16.62856  132.2818 14.03608  23.51373       21.76053  
1 1 1 17 16 8  o 242.5482 10.71648  40.11643       3.455016      33.42526       9.260122      41.19854       3.723927      199.5774 36.15092  245.4248 11.41829  -45.84744      37.91130  
1 1 1 17 16 9  o 141.7647 10.66672  13.77187       2.000208      13.42222       2.592614      14.28601       3.143863      138.4578 14.25579  141.4840 17.01683  -3.026230      22.19910  
1 1 1 17 16 10 o 114.9333 7.510709  8.947653       1.143970      9.758306       1.220927      3.118577       3.273950      120.0047 7.675393  68.79326 26.03838  51.21144       27.14606  
1 1 1 17 16 11 o 68.27692 10.26013  3.250851       0.9046290     2.788792       0.9346286     10.10385       3.599404      62.75736 11.60368  113.4453 24.52633  -50.68798      27.13275  
1 1 1 17 16 12 o 150.0655 3.646369  15.05833       0.7291467     15.16605       0.7337170     6.492516       6.542893      150.5998 3.656207  88.45571 35.79175  62.14407       35.97801  
1 1 1 17 16 13 o 139.8984 18.56952  14.57525       3.376271      22.91371       8.741803      13.11336       3.660286      144.6625 42.53154  130.0489 21.89924  14.61357       47.83836  
1 1 1 17 16 14 o 28.05812 13.00619  -0.8425692     1.157826      -0.4912246     1.266418      -2.631712      2.857806      31.47215 14.20950  40.62389 19.32170  -9.151741      23.98412  
1 1 1 17 16 15 o 82.06926 3.414150  4.515624       0.3725521     6.055049       0.8007429     4.090331       0.4208796     94.37129 6.405621  77.99831 4.063491  16.37298       7.585773  
1 1 1 17 16 16 o 81.63033 5.596485  4.520833       0.6050690     4.872838       1.027523      4.333980       0.7486311     83.45144 9.403802  79.46850 7.145904  3.982941       11.81082  
1 1 1 17 16 17 o 32.46079 15.65312  -2.441876      2.022876      -2.272367      2.700276      -2.658675      3.053788      39.18858 18.67913  40.96438 19.61757  -1.775799      27.08798  
1 1 1 17 16 18 o 92.07431 7.853765  5.868371       0.9543946     3.434618       1.138364      11.62631       1.750961      67.94521 13.04747  128.2159 10.33605  -60.27066      16.64543  
1 1 1 17 16 19 o 77.71342 5.220514  4.103767       0.5374722     4.158429       0.5764169     3.739758       1.487469      78.12603 5.573516  68.64524 16.47222  9.480789       17.38959  
1 1 1 17 16 20 o 65.04186 9.098772  3.013436       0.7670408     2.915763       0.8082662     3.898311       2.432810      63.61899 9.852690  65.09951 22.76366  -1.480522      24.80443  
1 1 1 17 16 21 o 32.60227 14.06835  0.1840469      1.113813      -0.7293350E-01 1.165025      2.915775       3.798430      31.48932 13.96308  58.82280 25.67569  -27.33347      29.22685  
1 1 1 17 16 22 o 42.55345 17.06719  1.150746       1.473552      1.410892       1.581117      -0.5683915     4.064532      45.03894 17.80472  48.73758 23.14110  -3.698643      29.19792  
1 1 1 17 17 0  o 140.1061 5.840911  13.18548       1.086144      13.18548       1.086144      13.18548       1.086144      140.1061 5.840911  140.1061 5.840911  0.000000       0.000000  
1 1 1 17 17 1  f 179.9682 9.088902  21.94715       2.172564      20.54294       2.711710      24.46406       3.630465      173.0943 11.82782  187.5972 14.63903  -14.50287      18.82016  
1 1 1 17 17 2  o 135.4357 1.920600  12.22916       0.3466120     12.20603       0.3530084     12.84993       1.829064      135.3058 1.957921  137.2868 10.06833  -1.981049      10.25694  
1 1 1 17 17 3  o 161.1161 4.459757  17.37131       0.9565458     17.46700       0.9618397     8.750523       9.129580      161.5576 4.472185  104.6737 42.30590  56.88393       42.54162  
1 1 1 17 17 4  o 28.76417 12.20080  0.5397942E-01  0.8119439     -0.1519852     0.8228774     7.650551       4.997440      27.23730 11.91834  97.23264 32.66813  -69.99535      34.77433  
1 1 1 17 17 5  o 206.5346 12.30836  29.36586       3.372036      30.81122       4.702694      27.83631       4.837730      208.5379 17.07275  197.0357 18.64755  11.50215       25.28260  
1 1 1 17 17 6  o 317.8427 12.73310  69.67419       5.381954      65.91862       7.082386      74.80668       8.279523      304.5690 17.52500  322.3086 19.36725  -17.73959      26.11926  
1 1 1 17 17 7  o 146.0017 8.502225  14.47495       1.646951      7.184467       4.905570      15.40109       1.748434      93.32529 32.34346  150.5303 8.754468  -57.20506      33.50731  
1 1 1 17 17 8  o 86.00980 16.38995  5.385663       1.809887      5.429132       4.613742      5.377757       1.967599      83.58664 31.06083  85.31936 17.87976  -1.732719      35.83938  
1 1 1 17 17 9  o 98.80005 9.915495  6.728601       1.287777      6.439543       1.617511      7.228996       2.128197      95.48780 13.05374  99.64117 16.61337  -4.153366      21.12827  
1 1 1 17 17 10 o 109.8742 7.062767  8.187829       1.028580      8.597265       1.163036      6.717834       2.203726      112.3795 7.815327  94.94445 18.07875  17.43507       19.69570  
1 1 1 17 17 11 o 104.5224 6.477051  7.399739       0.8976789     8.074522       0.9438563     1.005386       2.905509      109.1901 6.516726  54.44135 23.08559  54.74874       23.98775  
1 1 1 17 17 12 o 40.25580 6.599145  1.122970       0.3417342     -0.3614616     1.110364      1.278289       0.3591677     30.03189 13.45305  43.04037 6.461866  -13.00848      14.92449  
1 1 1 17 17 13 o 93.01469 6.696151  5.891117       0.8243925     1.242879       5.598452      5.994141       0.8334785     65.81213 29.77936  93.82397 6.710958  -28.01185      30.52617  
1 1 1 17 17 14 o ?        ?         -1.241985      0.1516168     -0.8719510     1.048850      -1.249882      0.1532261     26.06077 12.18013  ?        ?         0.000000       12.18013  
1 1 1 17 17 15 o 84.82565 9.215698  5.033198       1.024946      8.797264       1.634140      2.592178       1.315971      111.2762 11.17179  57.89724 16.34552  53.37896       19.79860  
1 1 1 17 17 16 o 127.8412 6.492111  11.14425       1.102316      11.71075       1.278006      9.498245       2.178452      130.6295 7.371981  112.7101 14.86698  17.91940       16.59437  
1 1 1 17 17 17 o 87.15723 11.79021  5.512314       1.334216      5.833752       1.403277      2.485629       4.306047      89.52628 12.07026  61.61056 27.10198  27.91572       29.66831  
1 1 1 17 17 18 f 20.88833 10.04975  -1.104724      0.8226654     -1.249340      0.8579380     0.5463245      2.898863      20.88247 10.10025  48.73825 21.79189  -27.85578      24.01877  
1 1 1 17 17 19 o 30.02157 12.64439  0.2320271      0.8619883     0.4729255      0.8981510     -2.580060      3.068646      32.65473 13.24349  39.91311 19.25483  -7.258381      23.36961  
1 1 1 17 17 20 o 67.72689 11.64949  3.411565       1.013434      3.458783       1.067164      2.977752       3.234634      67.84153 12.25583  58.37626 24.53486  9.465271       27.42562  
1 1 1 17 18 0  o 322.8109 27.72585  76.74371       11.71575      76.74371       11.71575      76.74371       11.71575      322.8109 27.72585  322.8109 27.72585  0.000000       0.000000  
1 1 1 17 18 1  o 135.5144 5.091190  12.32394       0.9177096     12.38033       0.9293985     10.12412       5.804640      135.8142 5.144808  106.9812 35.18653  28.83296       35.56067  
1 1 1 17 18 2  o 105.1292 5.789897  7.442156       0.8079558     7.766716       0.8440679     3.890741       2.792097      107.3780 5.922072  72.23562 24.41867  35.14236       25.12653  
1 1 1 17 18 3  o 189.2521 1.654676  23.87833       0.4172797     23.90531       0.4178357     13.76112       8.090940      189.3589 1.655947  117.5829 41.48181  71.77597       41.51485  
1 1 1 17 18 4  o 186.6153 4.923336  23.35484       1.223209      23.24189       1.226944      41.82058       15.68791      186.1564 4.950613  175.2776 57.85491  10.87885       58.06634  
1 1 1 17 18 5  o 54.96580 13.55790  2.185306       0.9867493     1.778728       1.013847      9.487804       4.296710      49.76377 14.44341  106.2200 29.37180  -56.45623      32.73095  
1 1 1 17 18 6  o 47.48959 17.25452  1.419393       1.410846      3.765370       2.810410      0.6289893      1.631294      70.66455 24.48133  43.04272 17.69836  27.62183       30.20873  
1 1 1 17 18 7  o 146.5101 9.594538  14.73014       1.862811      18.47634       5.952239      14.32338       1.961336      145.8577 31.54450  144.1570 10.27782  1.700607       33.17664  
1 1 1 17 18 8  o 74.09099 2.432809  3.667857       0.2398600     4.799931       1.343745      3.630599       0.2437751     82.09387 12.69287  73.70871 2.485528  8.385162       12.93394  
1 1 1 17 18 9  o 57.20860 13.00446  2.382753       0.9688078     2.622593       1.096272      1.527546       2.070108      59.76101 14.01142  51.92128 20.41977  7.839733       24.76462  
1 1 1 17 18 10 o 91.74395 10.90673  5.914270       1.307287      -0.1121985     9.556579      6.029193       1.319693      74.41679 35.37687  92.64510 10.89820  -18.22831      37.01748  
1 1 1 17 18 11 o 63.61542 6.670855  2.770930       0.5570796     2.438876       0.6210341     4.138605       1.260385      59.25945 8.074572  75.52127 12.99298  -16.26182      15.29759  
1 1 1 17 18 12 o 29.40270 12.70624  0.6447651E-02  0.9111891     -0.2940313     1.024599      1.142829       1.992548      28.97495 12.95544  48.01284 19.63048  -19.03789      23.52018  
1 1 1 17 18 13 o 100.4764 24.90089  8.874787       3.316894      11.89208       7.653790      8.177090       3.680458      93.75827 38.41993  93.21431 27.64695  0.5439606      47.33334  
1 1 1 17 18 14 o 55.31690 9.371607  2.176280       0.6661524     2.111928       0.6763425     4.263738       3.852061      54.36168 9.692353  69.33574 27.66693  -14.97406      29.31553  
1 1 1 17 18 15 o 211.2366 8.569735  30.90479       2.407174      32.12815       2.613241      24.05270       6.184613      214.8135 9.150408  155.1693 30.99650  59.64412       32.31892  
1 1 1 17 18 16 o 65.29153 23.99860  3.805921       2.741076      2.113629       3.290462      7.643093       4.954785      57.12562 24.40685  80.77857 31.64434  -23.65295      39.96321  
1 1 1 17 18 17 o 82.66445 13.03304  5.105442       1.388115      3.808995       1.551441      10.30862       3.108082      68.57869 17.05010  108.2448 22.29097  -39.66611      28.06409  
1 1 1 17 18 18 o 29.94409 12.94633  0.8939810E-01  0.9468402     -0.7498731E-01 0.9806193     2.352912       3.638818      29.20110 12.88584  57.09301 25.02047  -27.89191      28.14371  
1 1 1 17 18 19 o 69.00739 8.495810  3.374709       0.7647487     3.379072       0.7832693     3.285718       3.537639      68.94498 8.720553  59.87665 25.43523  9.068329       26.88864  
1 1 1 17 19 0  o 172.7661 36.41367  25.29819       7.378417      25.29819       7.378417      25.29819       7.378417      172.7661 36.41367  172.7661 36.41367  0.000000       0.000000  
1 1 1 17 19 1  o 57.77950 21.87148  2.152052       2.310053      1.883510       2.600159      3.158052       5.032606      57.51101 22.80160  72.86525 30.61253  -15.35424      38.17120  
1 1 1 17 19 2  o 192.2628 9.945750  25.40754       2.539379      24.88620       4.104660      25.73080       3.232158      185.1261 16.82287  191.6329 12.72970  -6.506836      21.09630  
1 1 1 17 19 3  o 111.6657 3.630022  8.349541       0.5394174     8.608450       0.8656886     8.185213       0.6896724     112.9585 5.770465  110.3731 4.700040  2.585403       7.442355  
1 1 1 17 19 4  o 14.72576 6.757757  -0.2137793     0.3015128     -0.6119127     0.3198065     2.970606       0.9044524     12.11372 5.927318  64.81042 10.85653  -52.69670      12.36921  
1 1 1 17 19 5  o 27.42217 9.824765  0.4465820      0.4554781     0.1267520      0.6578624     0.7410578      0.6312482     26.57335 11.10956  33.82873 11.60742  -7.255375      16.06719  
1 1 1 17 19 6  o 28.36250 9.526724  0.5231662      0.4249992     0.3878714      0.5854205     0.6739289      0.6179795     28.37741 10.94373  32.70155 11.47016  -4.324144      15.85338  
1 1 1 17 19 7  o 150.0175 12.08143  15.86879       2.394685      10.73079       5.517145      17.06145       2.658127      102.7635 34.32192  154.9246 12.99569  -52.16109      36.69989  
1 1 1 17 19 8  o 136.2337 8.551526  12.75737       1.544562      13.80118       2.022744      11.29755       2.392101      140.4010 10.89703  124.5209 14.69964  15.88011       18.29822  
1 1 1 17 19 9  o 61.39370 12.18080  2.741670       0.9613033     2.579949       1.006588      4.418668       3.241423      59.16855 13.11194  72.00891 26.15497  -12.84036      29.25757  
1 1 1 17 19 10 o 90.33815 8.490621  5.651826       1.010096      5.561785       1.016097      13.20685       9.307513      89.55797 8.620853  94.82439 40.79068  -5.266418      41.69171  
1 1 1 17 19 11 o 30.10877 13.52794  -0.3438624     1.132038      -1.479249      1.329990      2.641610       2.156667      27.45181 13.09162  58.50223 21.32160  -31.05042      25.02002  
1 1 1 17 19 12 o 57.28078 8.026396  2.293380       0.5958467     2.280349       0.6027567     2.851919       3.946365      57.07225 8.157599  63.34591 26.88491  -6.273655      28.09529  
1 1 1 17 19 13 o 102.1157 27.47506  9.991590       3.820033      7.738485       4.562692      15.27289       6.985554      84.29671 30.96614  104.9817 38.35598  -20.68496      49.29587  
1 1 1 17 19 14 o 36.88908 15.94328  0.2247924      1.434926      0.2599157      1.465048      -0.6031027     7.112821      37.40621 16.13801  61.20031 29.47148  -23.79410      33.60065  
1 1 1 17 19 15 o 59.18393 13.48416  2.667516       1.039604      2.971946       1.066828      -3.070131      4.631455      62.70785 13.18624  48.12880 23.32358  14.57904       26.79303  
1 1 1 17 19 16 o 66.62238 24.52809  4.281600       2.865300      6.516388       3.356493      -1.721951      5.501382      78.86071 26.77226  53.00394 25.62188  25.85677       37.05718  
1 1 1 17 19 17 o 116.0081 10.73737  9.727094       1.640984      10.88375       1.775901      2.970678       4.292149      122.5261 10.99394  59.99772 26.69135  62.52834       28.86685  
1 1 1 17 20 0  o 158.7422 40.89677  23.70725       7.476018      23.70725       7.476018      23.70725       7.476018      158.7422 40.89677  158.7422 40.89677  0.000000       0.000000  
1 1 1 17 20 1  o 50.51773 22.83947  -0.3424334     3.284894      -0.7132437     5.811751      -0.1683599     3.981965      62.04258 28.88867  55.17599 25.02570  6.866592       38.22095  
1 1 1 17 20 2  o 140.8009 10.12047  13.78348       1.886136      13.81061       2.075033      13.65446       4.524542      140.2955 11.19234  124.4975 27.95911  15.79804       30.11611  
1 1 1 17 20 3  o 45.13479 18.71165  0.8060882      1.843709      0.2510483E-01  1.870837      27.15186       10.86602      40.92268 17.93703  133.7877 47.98060  -92.86502      51.22378  
1 1 1 17 20 4  o 110.7776 7.245142  8.379702       1.063610      8.675970       1.069375      -18.87888      10.25744      112.7604 7.153929  56.36797 28.47328  56.39248       29.35824  
1 1 1 17 20 5  o 169.3486 1.458747  19.12428       0.3291813     19.10695       0.3316959     20.25470       2.678422      169.2706 1.470568  169.1215 11.96240  0.1491241      12.05245  
1 1 1 17 20 6  o 115.0882 2.809721  8.854403       0.4308912     8.919424       0.4328345     1.661970       4.552333      115.5097 2.812094  62.32460 27.62056  53.18509       27.76335  
1 1 1 17 20 7  o 63.77647 21.19867  3.291451       2.105181      4.815593       5.891599      3.068370       2.253983      74.36198 32.22212  62.05311 21.89417  12.30886       38.95664  
1 1 1 17 20 8  o 102.8424 9.944280  7.424065       1.345778      7.465682       1.560526      7.303299       2.658332      102.1796 11.67033  93.71843 21.71296  8.461143       24.65054  
1 1 1 17 20 9  o 53.76126 10.94873  2.098519       0.7576666     2.296221       0.7717482     -3.171240      3.984428      56.40574 10.65830  46.10857 22.16653  10.29716       24.59582  
1 1 1 17 20 10 o 79.37619 7.824586  4.362757       0.8168587     4.692856       0.8288859     -6.765140      4.812596      82.42239 7.633756  44.50834 22.01159  37.91405       23.29774  
1 1 1 17 20 11 o 113.9672 5.615046  8.816074       0.8500950     8.724412       0.8611358     12.32211       5.325795      113.3322 5.720731  103.0214 33.69397  10.31084       34.17617  
1 1 1 17 20 12 o 77.53210 11.34102  4.357766       1.137022      3.774070       1.243194      7.343839       2.811873      70.80231 13.67210  90.81644 23.16530  -20.01413      26.89902  
1 1 1 17 20 13 o 33.18902 15.50416  -1.040786      1.696061      -1.052238      1.889201      -0.9932149     3.850548      35.12577 16.39382  48.80444 22.97666  -13.67867      28.22560  
1 1 1 17 20 14 o 68.99319 12.08826  3.535733       1.070848      3.493573       1.092415      4.571958       5.415808      68.36594 12.45006  66.81032 29.83516  1.555618       32.32864  
1 1 1 17 20 15 o 49.68803 22.47225  0.7017048      3.183412      1.627161       3.872524      -1.227139      5.590681      55.15048 24.87875  53.63550 25.90311  1.514980       35.91550  
1 1 1 17 20 16 o 79.03954 11.90148  4.635101       1.214634      5.189617       1.313262      1.353793       3.194610      83.52688 12.15557  51.76052 23.02703  31.76636       26.03847  
1 1 1 17 21 0  o 148.4545 47.92984  24.56255       8.373629      24.56255       8.373629      24.56255       8.373629      148.4545 47.92984  148.4545 47.92984  0.000000       0.000000  
1 1 1 17 21 1  o 164.0373 22.79554  22.25936       4.848258      25.47499       9.278890      21.05178       5.686195      132.3500 44.51454  150.2627 29.45204  -17.91270      53.37572  
1 1 1 17 21 2  o 84.13278 40.87381  10.31394       14.45992      10.31394       14.45992      0.000000       0.000000      84.13278 40.87381  ?        ?         0.000000       40.87381  
1 1 1 17 21 3  o 58.59540 21.14680  2.662475       2.114551      1.243073       3.409203      3.549947       2.695736      55.70028 24.31846  65.39963 23.83748  -9.699348      34.05309  
1 1 1 17 21 4  o 48.93489 14.89853  1.795216       1.058538      1.763949       1.858546      1.810229       1.287828      51.05220 19.54767  49.41866 16.58344  1.633537       25.63439  
1 1 1 17 21 5  o 59.73341 8.962010  2.515597       0.6913543     2.726003       0.7186963     -0.9291887E-01 2.530540      62.24111 8.920182  45.12361 20.25391  17.11750       22.13121  
1 1 1 17 21 6  o 89.73984 8.904500  5.620584       1.050772      5.562087       1.106730      6.155571       3.346901      89.00410 9.477224  80.66817 26.72643  8.335922       28.35700  
1 1 1 17 21 7  f 34.99473 8.919688  0.8802126      0.4171061     0.8821872      0.4249414     0.8281416      2.182133      35.02353 9.043135  46.67231 19.90635  -11.64878      21.86415  
1 1 1 17 21 8  o 125.4889 5.623647  10.68495       0.9379767     11.45207       0.9842308     3.094026       3.096091      129.8918 5.700337  61.99322 24.78156  67.89858       25.42871  
1 1 1 17 21 9  o 59.69019 23.55348  2.850874       2.762377      7.127859       5.208150      1.176701       3.258478      78.50893 31.87241  53.40765 23.53165  25.10128       39.61804  
1 1 1 17 21 10 o 38.13263 11.79500  1.057685       0.6601833     1.022754       0.6615366     9.568892       10.32623      37.60626 11.83411  77.08683 36.68247  -39.48057      38.54413  
1 1 1 17 21 11 o 28.71493 13.06264  -0.4263929     1.094854      -0.5804445     1.103600      9.178306       8.714055      27.98264 12.87341  76.26719 35.46535  -48.28455      37.72951  
1 1 1 17 21 12 f 26.20378 12.93081  -2.989741      1.629180      -2.756015      1.648806      -12.63274      10.59062      27.01595 13.26811  55.06551 27.93857  -28.04956      30.92905  
1 1 1 17 21 13 o 58.59132 22.41398  3.007483       2.442077      -2.462407      5.128310      4.611598       2.777172      50.16566 24.36478  68.62691 24.29457  -18.46126      34.40739  
1 1 1 17 22 0  o 51.72887 30.40474  3.257313       3.546546      3.257313       3.546546      3.257313       3.546546      51.72887 30.40474  51.72887 30.40474  0.000000       0.000000  
1 1 1 17 22 1  o 51.70956 23.20034  0.5342883      3.316529      -0.2387016E-01 8.583522      0.6322403      3.595783      65.72655 31.82782  53.36470 24.03210  12.36185       39.88173  
1 1 1 17 22 2  o 52.98774 25.28979  -1.892556      4.983867      -4.043981      5.382345      11.04446       13.19853      50.87882 24.76790  80.40611 39.06031  -29.52729      46.25102  
1 1 1 17 22 3  o 79.09563 12.65327  4.602735       1.288680      5.643038       3.715020      4.460434       1.373994      75.30923 27.89304  77.12988 13.87896  -1.820641      31.15521  
1 1 1 17 22 4  o 52.39178 19.73098  2.031130       1.874547      -2.105550      8.359084      2.250177       1.923538      61.98720 30.32498  54.17974 20.07015  7.807461       36.36503  
1 1 1 17 22 5  o 161.1607 11.41587  18.62342       2.435688      19.77556       2.933547      16.06640       4.370243      163.7533 13.56565  132.5098 25.67792  31.24355       29.04104  
1 1 1 17 22 6  o 74.21124 20.50900  4.719433       2.095572      3.434582       2.579910      7.211064       3.592692      62.72348 23.24199  83.83807 27.68706  -21.11459      36.14918  
1 1 1 17 22 7  o 135.2211 6.193687  12.48140       1.113044      12.22133       1.277716      13.29977       2.266566      133.2296 7.224164  134.5215 12.79857  -1.291840      14.69666  
1 1 1 17 22 8  o 111.3448 2.441170  8.290006       0.3621943     8.245525       0.3637330     13.51407       3.941865      111.0429 2.458206  120.0496 25.43344  -9.006645      25.55195  
1 1 1 17 22 9  f 80.19070 6.001637  4.403813       0.6366569     4.212690       0.6427516     14.33880       4.634156      78.34810 6.207295  115.8725 29.83518  -37.52439      30.47406  
1 1 1 17 22 10 o 65.80539 10.69631  3.158139       0.9057466     3.117060       0.9307229     3.892853       3.936150      65.14930 11.11983  63.77233 26.94804  1.376972       29.15214  
1 1 1 17 22 11 o 129.1231 2.123532  11.14134       0.3653728     11.14373       0.3655500     8.676017       11.73658      129.1368 2.124336  71.03948 34.98908  58.09731       35.05351  
1 1 1 17 23 0  o 230.1883 21.33187  40.85695       6.406824      40.85695       6.406824      40.85695       6.406824      230.1883 21.33187  230.1883 21.33187  0.000000       0.000000  
1 1 1 17 23 1  o 71.87685 23.01258  4.764015       2.492359      -1.729559      5.629078      6.347435       2.779672      54.04450 26.07372  82.26735 23.92672  -28.22285      35.38823  
1 1 1 17 23 2  o 68.08371 31.06780  4.711220       6.254345      4.054076       7.292683      6.538654       12.16124      67.21085 31.63549  71.41968 35.25954  -4.208832      47.37130  
1 1 1 17 23 3  o 98.83824 18.32169  7.962353       2.324203      3.166603       3.433205      12.01973       3.157870      60.99982 25.43150  119.0938 20.64696  -58.09398      32.75756  
1 1 1 17 23 4  o 57.51213 22.76757  2.721716       2.588746      0.000000       0.000000      2.721716       2.588746      ?        ?         57.51213 22.76757  0.000000       22.76757  
1 1 1 17 23 5  f 57.79603 25.99242  2.005448       4.190235      9.990433       8.984391      -0.2142828     4.736982      76.13361 35.60426  53.60799 25.31329  22.52562       43.68553  
1 1 1 17 23 6  o 31.05598 14.66459  -1.243818      1.589903      -0.3327183     1.891504      -3.437232      2.934840      37.82227 17.19148  37.16586 18.13589  0.6564026      24.98915  
1 1 1 17 23 7  o 90.18291 9.210282  5.762655       1.091281      6.217379       1.221667      3.966995       2.427678      93.22678 9.989779  65.46459 22.74933  27.76218       24.84608  
1 1 1 18 0  0  f 427.7897 23.47646  123.6830       13.28971      123.6830       13.28971      123.6830       13.28971      427.7897 23.47646  427.7897 23.47646  0.000000       0.000000  
1 1 1 18 0  1  o 213.7868 12.25630  30.84031       3.465044      30.84031       3.465044      30.84031       3.465044      213.7868 12.25630  213.7868 12.25630  0.000000       0.000000  
1 1 1 18 0  2  o 252.9183 9.445134  42.87402       3.173094      42.87402       3.173094      42.87402       3.173094      252.9183 9.445134  252.9183 9.445134  0.000000       0.000000  
1 1 1 18 0  3  o 383.0948 12.50415  98.41174       6.367714      98.41174       6.367714      98.41174       6.367714      383.0948 12.50415  383.0948 12.50415  0.000000       0.000000  
1 1 1 18 0  4  o 273.7273 9.273870  50.18505       3.373806      50.18505       3.373806      50.18505       3.373806      273.7273 9.273870  273.7273 9.273870  0.000000       0.000000  
1 1 1 18 0  5  o 275.4699 15.58630  51.31693       5.679027      51.31693       5.679027      51.31693       5.679027      275.4699 15.58630  275.4699 15.58630  0.000000       0.000000  
1 1 1 18 0  6  o 45.65599 26.25758  1.794238       2.554639      1.794238       2.554639      1.794238       2.554639      45.65599 26.25758  45.65599 26.25758  0.000000       0.000000  
1 1 1 18 0  7  o 70.77431 31.73847  4.924024       3.192738      4.924024       3.192738      4.924024       3.192738      70.77431 31.73847  70.77431 31.73847  0.000000       0.000000  
1 1 1 18 0  8  o 742.2850 23.60096  373.8396       23.29044      373.8396       23.29044      373.8396       23.29044      742.2850 23.60096  742.2850 23.60096  0.000000       0.000000  
1 1 1 18 0  9  f 79.44435 43.50455  6.338988       6.592475      6.338988       6.592475      6.338988       6.592475      79.44435 43.50455  79.44435 43.50455  0.000000       0.000000  
1 1 1 18 0  10 o 664.0510 32.37945  305.7572       28.49530      305.7572       28.49530      305.7572       28.49530      664.0510 32.37945  664.0510 32.37945  0.000000       0.000000  
1 1 1 18 0  11 o 457.1034 22.65169  142.7208       13.71948      142.7208       13.71948      142.7208       13.71948      457.1034 22.65169  457.1034 22.65169  0.000000       0.000000  
1 1 1 18 0  12 o 17.37313 11.35698  -0.8127409E-01 0.6475293     -0.8127409E-01 0.6475293     -0.8127409E-01 0.6475293     17.37313 11.35698  17.37313 11.35698  0.000000       0.000000  
1 1 1 18 0  13 o 412.0995 10.78296  113.9384       5.912090      113.9384       5.912090      113.9384       5.912090      412.0995 10.78296  412.0995 10.78296  0.000000       0.000000  
1 1 1 18 0  14 o 173.3314 9.849362  20.29919       2.257946      20.29919       2.257946      20.29919       2.257946      173.3314 9.849362  173.3314 9.849362  0.000000       0.000000  
1 1 1 18 0  15 o 16.00266 11.35549  -1.351951      1.021832      -1.351951      1.021832      -1.351951      1.021832      16.00266 11.35549  16.00266 11.35549  0.000000       0.000000  
1 1 1 18 0  16 o 51.10116 27.95857  2.577549       2.720199      2.577549       2.720199      2.577549       2.720199      51.10116 27.95857  51.10116 27.95857  0.000000       0.000000  
1 1 1 18 0  17 o 43.12578 22.11177  1.872845       1.612607      1.872845       1.612607      1.872845       1.612607      43.12578 22.11177  43.12578 22.11177  0.000000       0.000000  
1 1 1 18 0  18 o 255.5402 11.85848  44.22157       4.018086      44.22157       4.018086      44.22157       4.018086      255.5402 11.85848  255.5402 11.85848  0.000000       0.000000  
1 1 1 18 0  19 o 167.7134 24.82393  20.78528       5.191128      20.78528       5.191128      20.78528       5.191128      167.7134 24.82393  167.7134 24.82393  0.000000       0.000000  
1 1 1 18 0  20 f 94.09814 15.70883  6.493915       1.804846      6.493915       1.804846      6.493915       1.804846      94.09814 15.70883  94.09814 15.70883  0.000000       0.000000  
1 1 1 18 0  21 o 25.94255 14.70419  0.6126997      0.7847946     0.6126997      0.7847946     0.6126997      0.7847946     25.94255 14.70419  25.94255 14.70419  0.000000       0.000000  
1 1 1 18 0  22 o 54.35905 19.96284  2.729263       1.335782      2.729263       1.335782      2.729263       1.335782      54.35905 19.96284  54.35905 19.96284  0.000000       0.000000  
1 1 1 18 0  23 o 41.75871 28.28254  -0.9127307     4.669522      -0.9127307     4.669522      -0.9127307     4.669522      41.75871 28.28254  41.75871 28.28254  0.000000       0.000000  
1 1 1 18 0  24 o 116.6124 7.543545  9.286580       1.160777      9.286580       1.160777      9.286580       1.160777      116.6124 7.543545  116.6124 7.543545  0.000000       0.000000  
1 1 1 18 0  25 o 94.99355 40.60028  11.26206       5.240568      11.26206       5.240568      11.26206       5.240568      94.99355 40.60028  94.99355 40.60028  0.000000       0.000000  
1 1 1 18 0  26 o 99.99505 11.60466  7.173697       1.492057      7.173697       1.492057      7.173697       1.492057      99.99505 11.60466  99.99505 11.60466  0.000000       0.000000  
1 1 1 18 0  27 o 63.03029 15.01151  3.207613       1.094125      3.207613       1.094125      3.207613       1.094125      63.03029 15.01151  63.03029 15.01151  0.000000       0.000000  
1 1 1 18 0  28 o 83.03728 22.38273  6.144159       2.140088      6.144159       2.140088      6.144159       2.140088      83.03728 22.38273  83.03728 22.38273  0.000000       0.000000  
1 1 1 18 1  0  o 183.6424 17.12138  23.17583       4.101276      23.17583       4.101276      23.17583       4.101276      183.6424 17.12138  183.6424 17.12138  0.000000       0.000000  
1 1 1 18 1  1  o 384.1764 7.998914  98.58765       4.094824      104.1892       5.850361      93.20801       5.733323      394.3079 11.14576  372.8517 11.55370  21.45621       16.05353  
1 1 1 18 1  2  o 226.9644 7.940512  34.45135       2.397785      33.43238       2.901643      36.64540       4.257802      223.3592 9.772800  233.2249 13.76169  -9.865616      16.87874  
1 1 1 18 1  3  o 121.4878 11.42525  9.973372       1.827862      11.78804       2.305889      6.905143       2.998358      131.8694 13.30435  98.77170 23.18175  33.09769       26.72825  
1 1 1 18 1  4  o 67.13747 23.09940  2.819633       2.500448      2.472873       2.813987      4.120747       5.450868      66.46935 24.33473  88.44421 33.56985  -21.97485      41.46220  
1 1 1 18 1  5  o 375.0941 10.61170  94.29752       5.298612      96.20122       6.155710      88.85344       10.40975      378.5008 12.22102  360.6825 21.76038  17.81827       24.95732  
1 1 1 18 1  6  f 205.1940 12.42030  28.36396       3.380120      30.64330       4.425527      25.17259       5.236606      212.6238 15.73137  191.2970 20.88191  21.32684       26.14441  
1 1 1 18 1  7  o 190.0875 10.00479  24.26490       2.525243      27.40363       5.501240      23.42698       2.842398      199.5130 21.00753  186.5313 11.49140  12.98166       23.94512  
1 1 1 18 1  8  o 290.7089 13.63073  57.01069       5.265504      61.75423       7.086900      51.16512       7.867165      301.3240 17.72851  272.7160 21.83099  28.60800       28.12281  
1 1 1 18 1  9  o 125.2603 11.92807  10.63616       1.966930      7.769283       6.221693      10.95451       2.073262      106.5154 36.44419  127.0502 12.40412  -20.53490      38.49729  
1 1 1 18 1  10 o 416.4610 12.80648  116.8966       7.098411      118.2475       11.34551      116.0277       9.099391      415.1319 20.57404  413.3238 16.55495  1.808105       26.40753  
1 1 1 18 1  11 o 340.9190 8.126150  77.79954       3.691557      86.31616       7.702245      75.25974       4.206134      356.2540 16.26791  334.9063 9.434507  21.34766       18.80571  
1 1 1 18 1  12 o 116.4225 2.896013  9.036508       0.4492735     5.047553       0.9040917     10.34457       0.5177223     86.47050 7.934791  124.5184 3.122717  -38.04787      8.527148  
1 1 1 18 1  13 o 240.9910 3.950554  38.74582       1.268622      39.29313       1.342402      34.17333       3.880093      242.6702 4.151380  224.4903 13.02689  18.17992       13.67237  
1 1 1 18 1  14 o 318.6079 9.663567  68.28339       4.097937      74.27613       7.339319      65.56879       4.939636      329.1919 16.78686  311.4285 11.92522  17.76343       20.59149  
1 1 1 18 1  15 o 211.4775 7.017334  29.97827       1.974731      28.56995       3.204297      30.84069       2.507499      205.3190 11.76118  214.1316 8.806722  -8.812607      14.69298  
1 1 1 18 1  16 o 150.5896 6.165786  15.19804       1.234632      13.80732       1.539410      17.70541       2.067014      143.2103 8.099921  161.9054 9.624378  -18.69513      12.57924  
1 1 1 18 1  17 o 203.4242 7.593798  27.80741       2.054812      28.60680       2.873449      26.97081       2.939565      205.5329 10.52683  199.3705 11.10886  6.162354       15.30428  
1 1 1 18 1  18 o 102.5162 14.75619  7.353515       1.957776      4.581879       2.766408      10.13441       2.771025      79.02779 24.09000  119.4499 17.96509  -40.42206      30.05116  
1 1 1 18 1  19 o 122.2328 11.52865  10.26294       1.855578      9.814483       1.908213      18.05739       7.955355      119.3041 12.17363  143.0976 40.11491  -23.79349      41.92139  
1 1 1 18 1  20 o 126.9180 12.54923  11.17274       2.094585      10.93801       2.135959      17.05650       10.69373      125.3995 12.96970  127.6400 47.31486  -2.240425      49.06026  
1 1 1 18 1  21 o 66.50402 9.934648  3.079088       0.8534386     2.225474       1.154364      4.108113       1.267433      55.32549 15.19518  76.03043 12.97549  -20.70494      19.98141  
1 1 1 18 1  22 o 91.30321 6.750913  5.659588       0.8155286     4.456778       0.9490324     9.055411       1.594612      80.34465 9.020015  114.2286 10.59709  -33.88393      13.91614  
1 1 1 18 1  23 o 69.96299 8.982228  3.407622       0.8180911     5.586463       1.083888      0.5231017      1.247120      89.75519 9.192279  37.86306 15.51122  51.89213       18.03042  
1 1 1 18 1  24 o 30.41718 12.71327  0.2236941      0.8611680     0.2112045      0.8747648     0.6161181      4.903376      30.49726 12.78456  59.91478 27.40408  -29.41752      30.23951  
1 1 1 18 1  25 o 82.22438 27.54341  6.718197       3.552740      6.272067       4.507212      7.450166       5.773292      76.87603 30.16174  79.38546 33.02823  -2.509430      44.72800  
1 1 1 18 1  26 f 51.35342 10.33026  1.924029       0.6823780     1.431948       0.9951312     2.360765       0.9375017     43.88189 14.57452  55.89045 12.85615  -12.00856      19.43443  
1 1 1 18 1  27 f 79.15627 11.91426  4.645286       1.217759      2.957925       1.721103      6.336841       1.723241      58.70497 19.15127  90.34973 14.82738  -31.64476      24.22029  
1 1 1 18 1  28 o 21.17571 10.45580  -2.071303      1.070700      -6.645770      1.592614      1.701424       1.446332      ?        ?         46.71294 17.38464  0.000000       17.38464  
1 1 1 18 2  0  o 312.6753 17.14509  66.11105       7.094001      66.11105       7.094001      66.11105       7.094001      312.6753 17.14509  312.6753 17.14509  0.000000       0.000000  
1 1 1 18 2  1  o 309.7970 8.174901  64.16440       3.371736      65.92900       4.902820      62.58092       4.644380      313.4592 11.75877  305.4447 11.43112  8.014496       16.39936  
1 1 1 18 2  2  o 224.7546 10.92500  33.90340       3.262125      33.07924       3.993120      35.55706       5.656261      221.5549 13.59103  228.6025 18.73257  -7.047531      23.14358  
1 1 1 18 2  3  o 155.8691 7.787326  16.26946       1.612294      7.557877       3.905875      18.05873       1.770142      103.0423 27.80710  164.2027 8.115252  -61.16034      28.96708  
1 1 1 18 2  4  o 370.0179 16.86749  92.56387       8.294743      100.3099       18.52726      90.62203       9.276352      374.8299 37.60125  365.3535 19.12074  9.476410       42.18360  
1 1 1 18 2  5  o 155.5383 11.19141  16.29505       2.304000      18.45269       2.825241      12.01102       3.980999      165.2818 12.93080  130.6786 23.73598  34.60316       27.02966  
1 1 1 18 2  6  o 115.3838 13.17861  9.060137       1.989930      8.240414       2.436489      10.70228       3.448551      109.1150 17.33663  123.5987 21.73159  -14.48367      27.79965  
1 1 1 18 2  7  o 513.4406 7.913899  176.2222       5.414448      177.8910       13.12541      175.8799       5.943738      511.3649 19.29693  512.7654 8.698960  -1.400513      21.16703  
1 1 1 18 2  8  o 212.7842 13.03430  30.56796       3.677999      32.06020       11.29666      30.39102       3.889949      206.0533 42.55284  211.9867 13.84667  -5.933426      44.74901  
1 1 1 18 2  9  o 241.6338 9.978042  39.20422       3.205835      22.95156       12.74706      40.30162       3.312298      169.6356 51.71134  244.9615 10.16959  -75.32591      52.70183  
1 1 1 18 2  10 o 285.7910 7.405891  54.65220       2.817950      60.50200       6.927677      53.49240       3.084675      297.8349 17.53331  282.6029 8.200093  15.23196       19.35610  
1 1 1 18 2  11 o 100.7849 2.792445  6.776601       0.3746579     10.46634       1.763113      6.602110       0.3834144     124.3669 10.74429  99.47283 2.895696  24.89405       11.12766  
1 1 1 18 2  12 o 195.2540 8.665100  25.60050       2.248868      26.28910       2.394037      20.43360       6.557865      197.7873 9.108074  166.9563 30.60469  30.83099       31.93124  
1 1 1 18 2  13 o 181.9303 4.443818  22.09004       1.077296      21.90400       1.176034      23.06050       2.685961      181.0656 4.878725  184.7690 10.95852  -3.703430      11.99547  
1 1 1 18 2  14 o 237.8481 3.414705  37.73307       1.082247      37.27314       1.167477      40.54254       2.885453      236.3708 3.706645  245.6193 8.830502  -9.248505      9.576899  
1 1 1 18 2  15 o 121.5010 9.696910  9.991772       1.556935      9.992418       1.722392      9.988882       3.640554      121.2853 10.76922  117.1199 24.13046  4.165337       26.42452  
1 1 1 18 2  16 o 379.7520 9.177732  96.99723       4.644180      91.48402       7.919940      99.88644       5.733355      364.7598 16.33596  384.3214 11.20740  -19.56155      19.81084  
1 1 1 18 2  17 o 219.8383 8.901753  32.57558       2.602276      32.18029       3.104196      33.51017       4.773107      217.9327 10.72232  219.9884 16.40076  -2.055740      19.59472  
1 1 1 18 2  18 o 30.02368 13.20966  -0.2414675     1.023407      -0.5253612     1.124460      1.128446       2.470090      29.80646 13.42956  54.31412 21.98627  -24.50766      25.76333  
1 1 1 18 2  19 o 82.90894 12.11691  4.786657       1.299117      4.603734       1.347052      7.220524       4.913579      81.05058 12.90482  95.74081 32.39322  -14.69022      34.86911  
1 1 1 18 2  20 o 129.1120 8.672503  11.32862       1.483400      10.46501       1.584088      17.48141       4.228206      123.7697 9.681868  153.9282 21.17457  -30.15855      23.28306  
1 1 1 18 2  21 o 143.3141 6.875894  13.87768       1.309251      14.27149       1.473410      12.39989       2.854198      145.1002 7.647478  131.0612 16.72363  14.03902       18.38923  
1 1 1 18 2  22 o 17.01700 8.433718  -1.656183      0.7204706     -3.070421      1.087649      -0.5504476     0.9617295     19.33935 9.703092  26.64730 12.16847  -7.307953      15.56347  
1 1 1 18 2  23 o 93.37220 6.220299  5.918268       0.7695180     6.824676       0.8928568     3.300494       1.517351      100.1432 6.730011  65.62527 17.16059  34.51794       18.43309  
1 1 1 18 2  24 o 44.94000 14.05809  1.480685       0.9349293     1.862307       1.594527      1.280752       1.154137      50.87430 18.36293  43.48888 15.63223  7.385414       24.11563  
1 1 1 18 2  25 f 71.58959 31.58816  5.075223       5.891578      0.000000       0.000000      5.075223       5.891578      ?        ?         71.58959 31.58816  0.000000       31.58816  
1 1 1 18 2  26 o 83.18880 9.741242  4.926297       1.059397      7.231151       2.105275      4.144757       1.225922      95.27345 17.21651  74.53693 12.80413  20.73652       21.45586  
1 1 1 18 2  27 o 15.21391 7.709615  -2.691473      0.7901752     0.2584996      1.441961      -3.957489      0.9446353     36.49680 15.87671  ?        ?         0.000000       15.87671  
1 1 1 18 2  28 o 56.70586 12.02472  2.449435       0.8803917     4.349237       1.112082      -0.7403386     1.440995      76.57246 11.23293  30.95131 14.40268  45.62115       18.26515  
1 1 1 18 3  0  o 41.87473 23.77559  1.550051       2.056611      1.550051       2.056611      1.550051       2.056611      41.87473 23.77559  41.87473 23.77559  0.000000       0.000000  
1 1 1 18 3  1  o 248.4077 6.341674  41.21048       2.097429      42.01255       2.513902      39.37321       3.804774      250.6932 7.533998  242.0833 11.83063  8.609894       14.02586  
1 1 1 18 3  2  o 267.2142 10.43213  47.87198       3.707410      52.02832       5.833176      45.05515       4.802092      277.4861 15.84159  258.5702 13.98939  18.91586       21.13430  
1 1 1 18 3  3  o 525.9510 12.78953  185.6567       8.963412      181.1620       10.98112      194.6304       15.51597      518.2736 15.91949  534.3798 21.83590  -16.10620      27.02289  
1 1 1 18 3  4  o 306.5880 11.48979  63.09681       4.685669      64.09085       5.310455      59.60231       9.956849      308.6896 12.93899  293.6012 25.70932  15.08841       28.78170  
1 1 1 18 3  5  o 111.7461 16.09628  8.590664       2.327759      10.97757       3.530767      6.755588       3.095841      125.1827 21.96742  97.44897 24.00167  27.73375       32.53686  
1 1 1 18 3  6  o 220.0470 9.575883  32.47380       2.801088      32.84330       3.400623      31.69408       4.939949      220.9628 11.59009  215.7790 17.32617  5.183746       20.84529  
1 1 1 18 3  7  o 318.5100 8.989080  67.94401       3.811336      71.78413       7.365299      66.53966       4.454056      325.2306 17.05477  314.8721 10.63093  10.35843       20.09681  
1 1 1 18 3  8  o 102.8093 10.72297  7.165094       1.447429      2.436026       5.335699      7.540744       1.503818      80.20956 32.36942  105.4761 10.85437  -25.26659      34.14083  
1 1 1 18 3  9  o 233.9389 9.791237  36.74710       3.045456      45.87033       9.294808      35.64988       3.223391      254.9319 27.81222  230.2730 10.53290  24.65889       29.73990  
1 1 1 18 3  10 o 387.8881 9.305287  100.8381       4.809609      106.4948       11.86721      99.72633       5.261060      392.2845 22.80079  385.3673 10.25442  6.917145       25.00058  
1 1 1 18 3  11 o 219.4026 1.633379  32.07843       0.4775318     34.11454       3.631047      32.04259       0.4817158     224.7276 12.17098  219.2796 1.648615  5.448029       12.28213  
1 1 1 18 3  12 o 255.0489 10.25677  43.78016       3.478732      42.58154       4.184708      46.46124       6.258632      250.8989 12.55670  260.0133 18.17836  -9.114410      22.09352  
1 1 1 18 3  13 o 73.44334 7.154955  3.643820       0.6913502     2.755908       0.9210321     4.789784       1.046347      63.01657 11.38749  83.92559 9.524614  -20.90902      14.84565  
1 1 1 18 3  14 o 190.0056 3.240790  24.07782       0.8205231     23.89142       0.8320143     30.68664       4.954082      189.2652 3.299031  210.7237 17.80976  -21.45847      18.11273  
1 1 1 18 3  15 o 125.9977 2.198376  10.58252       0.3690951     10.59635       0.3712627     9.408069       3.420639      126.0797 2.209849  113.8069 23.34007  12.27283       23.44445  
1 1 1 18 3  16 o 94.22983 7.140787  5.984318       0.8899447     5.968539       1.006699      6.040753       1.903851      93.94763 8.121228  92.64804 15.99963  1.299591       17.94276  
1 1 1 18 3  17 o 128.4794 7.139287  11.10476       1.217449      11.24697       1.267818      9.421001       4.362535      129.2575 7.391666  110.8613 29.15016  18.39619       30.07272  
1 1 1 18 3  18 o 86.85838 10.12261  5.170093       1.149663      5.659406       1.212296      0.7983512      3.623616      90.91158 10.18199  60.84196 25.78961  30.06962       27.72683  
1 1 1 18 3  19 o 201.8851 8.582735  27.56197       2.303624      27.72771       2.520403      26.72090       5.677633      202.2035 9.379783  190.5893 22.80843  11.61421       24.66181  
1 1 1 18 3  20 o 97.14056 9.013297  6.448798       1.153390      5.967938       1.174725      19.32753       6.079437      93.26208 9.589215  153.8653 30.72798  -60.60325      32.18946  
1 1 1 18 3  21 o 30.57621 13.20399  -0.3390720E-01 0.9825972     0.1143883E-01  1.017659      -0.6581696     3.775864      31.43904 13.50554  54.43140 24.55924  -22.99236      28.02777  
1 1 1 18 3  22 o 143.0523 4.688724  13.74421       0.8925567     14.36020       0.9838203     10.87856       2.121987      146.1306 5.060076  123.8928 13.04929  22.23776       13.99601  
1 1 1 18 3  23 o 81.03130 9.788177  4.595374       1.035496      7.880437       1.493478      1.554156       1.436980      105.9387 10.72732  48.00216 17.41752  57.93657       20.45594  
1 1 1 18 3  24 o 132.9121 9.846927  12.36408       1.731583      10.31405       5.186752      12.62122       1.836975      96.32487 33.26364  133.9449 10.37286  -37.62006      34.84345  
1 1 1 18 3  25 o 81.31844 30.33752  7.261583       4.409752      7.261583       4.409752      0.000000       0.000000      81.31844 30.33752  ?        ?         0.000000       30.33752  
1 1 1 18 3  26 o 38.48638 13.37475  1.040283       0.8391268     -1.413662      1.344984      2.604214       1.073726      27.52172 13.13609  58.11186 14.02720  -30.59014      19.21768  
1 1 1 18 3  27 o 113.4462 8.351583  9.034282       1.253653      4.366439       4.836434      9.370504       1.298018      64.12621 28.44152  115.4451 8.497391  -51.31889      29.68376  
1 1 1 18 3  28 o 57.88003 12.91497  2.597092       0.9707735     4.294302       2.061164      2.113288       1.100473      67.72205 20.82252  51.04002 15.11252  16.68203       25.72869  
1 1 1 18 4  0  o 148.8507 11.54423  15.06992       2.257225      15.06992       2.257225      15.06992       2.257225      148.8507 11.54423  148.8507 11.54423  0.000000       0.000000  
1 1 1 18 4  1  o 110.9237 13.80439  8.392577       1.996373      6.715252       2.399922      12.16063       3.597054      97.97987 19.06810  132.2230 21.12653  -34.24310      28.45914  
1 1 1 18 4  2  f 99.03120 15.31881  6.754488       1.956292      6.846843       2.699065      6.652272       2.839505      98.54785 21.18442  96.93167 22.42896  1.616180       30.85187  
1 1 1 18 4  3  o 162.6401 12.54704  17.85874       2.698200      15.06401       3.401484      22.60171       4.431221      148.2954 17.55336  181.8035 18.55112  -33.50809      25.53946  
1 1 1 18 4  4  o 318.1146 13.14867  68.11275       5.561626      72.10801       8.081319      64.51781       7.665776      325.6670 18.70101  307.9715 18.76892  17.69543       26.49528  
1 1 1 18 4  5  o 473.5702 13.78315  151.0066       8.688487      159.2849       11.36612      139.3689       13.47639      484.7842 17.62438  451.0073 22.49519  33.77695       28.57712  
1 1 1 18 4  6  o 430.8667 12.30137  124.8056       7.055457      128.7091       9.566850      120.1508       10.44699      436.0103 16.49615  420.2885 18.70075  15.72174       24.93674  
1 1 1 18 4  7  o 95.71658 8.876251  6.183668       1.119217      7.550363       2.110090      5.648644       1.320237      104.6253 15.61236  91.09470 11.10568  13.53061       19.15939  
1 1 1 18 4  8  o 239.8638 7.898751  38.52170       2.521181      34.07170       4.204428      41.02026       3.150440      224.3321 14.13696  247.2477 9.580501  -22.91562      17.07746  
1 1 1 18 4  9  o 211.0898 5.749311  29.77458       1.615667      39.10074       9.567585      29.50082       1.639209      232.9821 31.63461  210.1044 5.860708  22.87775       32.17291  
1 1 1 18 4  10 o 376.0304 8.432277  94.68654       4.225142      83.91508       10.98987      96.55479       4.576912      347.1638 23.90251  379.5767 9.048977  -32.41296      25.55805  
1 1 1 18 4  11 o 249.4908 12.70774  42.09537       4.210790      39.18701       5.951046      45.01139       5.958873      238.5649 18.87400  256.3185 17.55253  -17.75366      25.77439  
1 1 1 18 4  12 o 426.7729 12.73096  123.1184       7.231791      121.6474       12.50943      123.8568       8.862917      417.8687 22.54944  426.5091 15.62101  -8.640411      27.43161  
1 1 1 18 4  13 o 110.0922 6.949576  8.142933       1.014300      8.564993       1.152495      6.692842       2.136238      112.8143 7.712977  97.62444 17.04132  15.18982       18.70552  
1 1 1 18 4  14 o 98.04639 6.209905  6.454781       0.8071476     6.474936       0.8371590     6.188685       3.041770      98.17200 6.434986  92.04019 24.40675  6.131813       25.24081  
1 1 1 18 4  15 o 78.00545 4.725488  4.078675       0.4888812     4.044600       0.5203111     4.335443       1.428264      77.64362 5.056532  78.69572 14.13992  -1.052101      15.01685  
1 1 1 18 4  16 o 128.2832 9.415818  11.13862       1.598326      10.78279       1.820593      12.33485       3.338079      125.8551 10.96533  131.8300 19.59766  -5.974846      22.45678  
1 1 1 18 4  17 o 63.41035 10.20718  2.782445       0.8331919     2.978517       0.8908456     1.413037       2.354292      65.57818 10.55257  55.29424 21.76717  10.28394       24.19021  
1 1 1 18 4  18 o 270.0339 8.746708  49.22346       3.143135      46.67935       3.470943      60.81583       7.409113      262.4559 9.942683  293.2503 19.06403  -30.79437      21.50103  
1 1 1 18 4  19 o 134.6600 6.838998  12.21841       1.223152      12.73514       1.250537      0.8067132      5.876804      137.4830 6.847675  72.19084 31.71205  65.29218       32.44294  
1 1 1 18 4  20 o 29.79123 12.65188  0.6473288E-01  0.8749053     -0.4042401E-01 0.8832709     5.537471       6.372024      29.06085 12.53405  87.40286 35.33730  -58.34201      37.49436  
1 1 1 18 4  21 o 79.90882 7.856470  4.365636       0.8257523     4.691377       0.8482873     -1.522077      3.606453      82.88446 7.771257  50.40404 23.21857  32.48042       24.48458  
1 1 1 18 4  22 o 22.89731 11.29058  -2.519544      1.234010      -3.264453      1.357725      1.018223       2.958861      22.72540 11.31544  54.43903 23.19825  -31.71362      25.81081  
1 1 1 18 4  23 o 39.43140 14.14485  1.005299       0.9444200     1.716694       1.162550      -0.3753018     1.619534      48.47733 15.73451  36.17186 16.22206  12.30547       22.59934  
1 1 1 18 4  24 o 187.5180 9.004430  24.40243       2.243374      26.42951       3.385638      22.81580       2.995317      190.6333 13.41372  177.8175 12.72551  12.81581       18.48964  
1 1 1 18 4  25 o 146.6665 27.07633  20.19471       5.096793      20.19471       5.096793      0.000000       0.000000      146.6665 27.07633  ?        ?         0.000000       27.07633  
1 1 1 18 4  26 o 19.80145 9.619043  -1.252509      0.8002729     -1.929917      0.9830408     0.7855301E-01  1.377989      20.44655 10.08120  35.06485 15.38109  -14.61830      18.39044  
1 1 1 18 4  27 o 50.23231 12.11268  1.921592       0.8012709     6.829365       1.934159      0.9048033      0.8803700     92.11671 16.35637  36.76230 13.58521  55.35441       21.26237  
1 1 1 18 4  28 o 19.96552 9.907520  -2.146300      1.006270      -0.4691869     1.495346      -3.534315      1.360371      32.70050 15.02232  21.47981 10.78733  11.22069       18.49423  
1 1 1 18 5  0  o 60.43468 24.66254  3.431580       1.952687      3.431580       1.952687      3.431580       1.952687      60.43468 24.66254  60.43468 24.66254  0.000000       0.000000  
1 1 1 18 5  1  o 265.8854 11.18816  47.47277       3.955079      47.90397       5.743655      47.08393       5.454216      265.9373 16.28634  263.8253 15.58408  2.111938       22.54126  
1 1 1 18 5  2  o 238.2776 9.846568  38.07432       3.119642      40.14698       3.456368      28.96471       7.246122      244.5585 10.63170  203.0935 27.47980  41.46500       29.46477  
1 1 1 18 5  3  o 324.1597 17.47666  71.29270       7.521116      61.82906       12.42358      76.76766       9.449486      295.5571 32.05786  334.9816 21.27965  -39.42456      38.47765  
1 1 1 18 5  4  o 258.2712 14.85462  45.10011       5.090671      43.19441       9.438807      45.88184       6.045269      247.6796 29.15712  259.7590 17.56847  -12.07941      34.04099  
1 1 1 18 5  5  o 216.6311 17.40233  31.98072       4.981217      36.20079       6.730961      26.87121       7.406388      228.9800 22.34397  194.3480 29.52681  34.63199       37.02817  
1 1 1 18 5  6  o 318.0878 13.09040  68.19225       5.536618      58.51675       10.50514      71.91345       6.514884      288.9061 27.62402  326.0765 15.03433  -37.17044      31.45024  
1 1 1 18 5  7  o 365.4135 9.087838  89.41370       4.425055      91.27303       8.340740      88.68536       5.220300      366.4697 17.12758  363.3906 10.79269  3.079041       20.24441  
1 1 1 18 5  8  o 248.6623 6.133551  41.29758       2.032336      47.06507       5.298410      40.30262       2.200665      263.4062 15.15948  245.4957 6.733592  17.91045       16.58768  
1 1 1 18 5  9  o 74.04643 17.50957  3.876341       1.700300      0.8409874      2.621536      6.080389       2.233890      54.97597 22.50162  92.84000 18.70455  -37.86403      29.26060  
1 1 1 18 5  10 f 131.4313 24.30401  12.35434       4.099734      14.40697       6.879173      11.22375       5.105447      137.6785 36.79349  123.0751 31.11790  14.60342       48.18801  
1 1 1 18 5  11 o 67.90670 8.175868  3.132958       0.7249431     2.557960       4.339489      3.149466       0.7352758     74.60892 29.49589  68.07175 8.275901  6.537163       30.63492  
1 1 1 18 5  12 o 140.4360 6.004180  13.20591       1.120991      16.42391       2.368358      12.27684       1.272566      155.6889 11.49717  135.2611 7.085178  20.42787       13.50499  
1 1 1 18 5  13 o 209.2427 8.317200  29.40860       2.314381      29.76112       2.934402      28.82839       3.764626      209.9881 10.52052  205.7077 13.81411  4.280380       17.36407  
1 1 1 18 5  14 o 176.0359 5.532655  20.73195       1.296191      19.85668       1.354564      30.23566       4.463518      172.2255 5.911158  209.6760 16.09867  -37.45045      17.14960  
1 1 1 18 5  15 f 300.5912 6.805869  60.51497       2.726047      60.88664       3.144012      59.38921       5.471750      301.1566 7.841297  295.0228 13.95823  6.133850       16.00994  
1 1 1 18 5  16 o 265.3158 4.847662  47.03880       1.713835      46.90414       1.775395      48.88017       6.565217      264.9058 5.029561  264.4792 18.75033  0.4266357      19.41318  
1 1 1 18 5  17 o 341.1765 11.53297  79.13175       5.235631      72.68728       6.977429      87.43604       7.920511      323.8267 16.22163  354.7326 16.80409  -30.90594      23.35634  
1 1 1 18 5  18 o 184.2385 7.350241  22.85766       1.800873      23.21911       1.868443      18.12964       6.757601      185.6325 7.569449  148.2016 34.81443  37.43091       35.62781  
1 1 1 18 5  19 o 92.32136 8.092406  5.795572       0.9854709     5.723325       1.024379      6.692794       3.609940      91.64849 8.484367  92.06119 27.39967  -0.4126968     28.68320  
1 1 1 18 5  20 o 39.53121 12.56321  1.069371       0.7439077     1.077897       0.7458915     -0.5272081     10.20673      39.66231 12.57698  81.71597 38.12733  -42.05366      40.14815  
1 1 1 18 5  21 o 140.0995 6.859756  13.28684       1.276723      13.35445       1.290928      10.26552       8.629865      140.4370 6.919686  99.58338 40.80038  40.85358       41.38300  
1 1 1 18 5  22 o 115.8991 2.619922  8.971389       0.4046148     8.955831       0.4052538     13.89331       7.208014      115.7978 2.626353  110.3719 39.13311  5.425926       39.22114  
1 1 1 18 5  23 o 166.5151 11.92958  19.68516       2.629451      19.73716       2.881580      19.42640       6.427884      165.6428 13.16342  135.8344 35.22151  29.80835       37.60094  
1 1 1 18 5  24 o 96.78725 10.13713  6.625875       1.288023      8.026204       1.629582      4.294646       2.102585      105.5867 11.78285  71.36166 20.82523  34.22506       23.92751  
1 1 1 18 5  25 f 60.94009 30.11881  -3.243579      8.959616      0.000000       0.000000      -3.243579      8.959616      ?        ?         60.94009 30.11881  0.000000       30.11881  
1 1 1 18 5  26 o 22.31974 10.94904  -1.956641      1.112642      2.676708       1.483893      -7.907011      1.681617      56.95031 17.69471  ?        ?         0.000000       17.69471  
1 1 1 18 5  27 o 44.84679 14.51457  1.565808       0.9896806     3.305236       1.401177      -0.1659114     1.398068      63.22911 16.46922  33.41537 15.02198  29.81374       22.29114  
1 1 1 18 5  28 o 70.72462 8.598562  3.570642       0.7937142     3.927504       1.133309      3.227099       1.111958      71.91507 12.26614  64.28162 13.41583  7.633453       18.17808  
1 1 1 18 6  0  o 337.7044 12.57215  76.61331       5.639615      76.61331       5.639615      76.61331       5.639615      337.7044 12.57215  337.7044 12.57215  0.000000       0.000000  
1 1 1 18 6  1  o 46.99906 15.83607  1.395612       1.174302      0.2716009      1.716413      2.384704       1.610108      43.04866 17.96725  59.38284 18.42886  -16.33418      25.73800  
1 1 1 18 6  2  o 155.8120 17.09278  16.61616       3.490656      14.61935       5.458425      17.99782       4.540442      142.3921 29.72926  160.9878 21.71920  -18.59572      36.81783  
1 1 1 18 6  3  o 351.6689 19.81834  84.42937       9.249405      77.75370       17.12587      87.17848       10.99011      325.5222 40.34488  355.7416 23.31276  -30.21942      46.59607  
1 1 1 18 6  4  f 190.2427 10.95563  24.35662       2.765527      22.57461       3.402231      27.82718       4.747984      182.5189 14.09807  201.8069 17.83985  -19.28799      22.73798  
1 1 1 18 6  5  o 376.8951 24.15056  98.27642       12.06507      105.6018       19.39623      93.65327       15.40893      379.9993 38.85169  362.7422 32.21336  17.25708       50.46934  
1 1 1 18 6  6  o 239.2667 9.348208  38.40696       2.974731      29.18484       8.226414      39.79424       3.190640      201.1102 31.74980  243.4634 9.855282  -42.35321      33.24419  
1 1 1 18 6  7  o 179.9734 6.499243  21.66811       1.556076      19.90339       3.952141      21.99187       1.692811      170.2482 17.67819  181.2537 7.022157  -11.00549      19.02181  
1 1 1 18 6  8  o 244.4013 5.503688  39.88083       1.792383      41.30132       5.187160      39.68822       1.910036      246.3414 15.88695  243.7742 5.880038  2.567139       16.94020  
1 1 1 18 6  9  o 240.0009 2.334702  38.39244       0.7466514     32.33386       8.390414      38.44080       0.7496254     211.2716 30.70153  240.1516 2.342530  -28.88000      30.79077  
1 1 1 18 6  10 o 146.3753 7.386858  14.37351       1.436134      18.35475       3.898838      13.74853       1.544750      162.8757 18.27915  143.0434 8.137897  19.83234       20.00882  
1 1 1 18 6  11 o 137.7921 6.928716  12.73420       1.268103      19.87167       7.883594      12.54462       1.284834      160.4924 37.53648  136.7406 7.075478  23.75183       38.19751  
1 1 1 18 6  12 o 312.3305 10.94548  65.79588       4.548320      65.88905       8.439789      65.75774       5.399491      307.7876 20.69852  311.4469 13.03938  -3.659302      24.46333  
1 1 1 18 6  13 o 137.5021 9.493696  12.76888       1.728796      12.28751       1.976290      14.33783       3.567906      134.5331 11.12355  142.9540 19.21651  -8.420944      22.20377  
1 1 1 18 6  14 o 101.0464 6.627973  6.864010       0.8875052     9.276250       1.098680      2.333980       1.505607      117.4717 7.051280  58.03335 17.78773  59.43835       19.13437  
1 1 1 18 6  15 o 182.1785 5.088808  22.19805       1.234130      21.85089       1.290094      25.94112       4.236106      180.7085 5.363521  193.5266 16.58659  -12.81808      17.43222  
1 1 1 18 6  16 o 125.8846 3.260137  10.58033       0.5464071     10.57427       0.5499478     11.04623       4.823025      125.8467 3.282290  119.4268 30.27209  6.419983       30.44952  
1 1 1 18 6  17 o 75.72408 11.27510  3.975169       1.103056      3.914919       1.146905      4.718220       4.027715      74.98338 11.87364  81.80869 29.22668  -6.825310      31.54651  
1 1 1 18 6  18 o 221.5404 9.450733  33.29017       2.783512      34.45391       3.080981      28.12161       6.493004      225.0127 10.30297  192.8878 25.91722  32.12488       27.89003  
1 1 1 18 6  19 o 100.5078 5.327672  6.790588       0.7109789     6.792309       0.7137639     6.571359       8.056207      100.5172 5.348191  94.08208 39.06847  6.435074       39.43284  
1 1 1 18 6  20 o 21.73481 10.72835  -2.385118      1.124035      -2.523188      1.137437      3.370408       7.343781      21.54664 10.66404  81.05668 35.53289  -59.51004      37.09863  
1 1 1 18 6  21 o 126.2072 4.220357  10.68362       0.7087542     10.71187       0.7160620     9.320483       4.973625      126.3665 4.258591  99.93192 32.55294  26.43462       32.83031  
1 1 1 18 6  22 o 129.0031 10.91005  11.66152       1.857860      12.20356       1.973349      7.433062       5.511623      131.7208 11.35354  86.41096 33.51029  45.30981       35.38138  
1 1 1 18 6  23 o 31.50560 14.17191  -0.3706613     1.246410      1.011610       1.432881      -4.668841      2.526712      42.90874 16.95364  32.34091 15.98597  10.56783       23.30187  
1 1 1 18 6  24 o 135.0927 9.327719  12.77001       1.668808      13.52617       1.714637      -0.8106897     7.266511      139.0653 9.306512  61.74809 29.74864  77.31725       31.17038  
1 1 1 18 6  25 o 69.83006 30.04969  5.143552       5.054645      0.000000       0.000000      5.143552       5.054645      ?        ?         69.83006 30.04969  0.000000       30.04969  
1 1 1 18 6  26 o 78.42491 10.41347  4.454316       1.061367      4.440434       1.302981      4.481688       1.829727      76.49979 13.26261  72.53061 18.78404  3.969185       22.99428  
1 1 1 18 6  27 o 62.65644 13.61391  3.064122       1.104078      6.808543       5.453077      2.904063       1.127429      69.16144 30.45837  60.56530 14.21533  8.596142       33.61231  
1 1 1 18 7  0  o 495.1732 26.54786  168.0533       17.40126      168.0533       17.40126      168.0533       17.40126      495.1732 26.54786  495.1732 26.54786  0.000000       0.000000  
1 1 1 18 7  1  o 283.8712 8.231455  53.94506       3.110373      51.51569       4.401817      56.36764       4.395653      276.6654 11.96829  289.5528 11.41495  -12.88742      16.53908  
1 1 1 18 7  2  o 580.3698 12.80419  226.5869       9.902171      207.8648       22.39070      231.1389       11.04051      542.5477 31.10139  585.5501 14.14984  -43.00238      34.16891  
1 1 1 18 7  3  f 169.9031 13.96461  19.58466       3.133695      19.54367       3.665862      19.69589       6.039048      169.1346 16.47413  165.9853 28.31925  3.149292       32.76243  
1 1 1 18 7  4  o 187.3570 11.79030  23.67950       2.928602      23.78242       3.315010      23.31359       6.250348      187.4392 13.36003  181.4514 26.64364  5.987747       29.80560  
1 1 1 18 7  5  f 444.3194 14.48006  133.4363       8.561676      132.1652       23.87999      133.6238       9.171405      419.3982 43.35442  444.1616 15.51991  -24.76340      46.04860  
1 1 1 18 7  6  o 400.3210 10.43807  107.6262       5.563285      109.2183       15.48290      107.3902       5.961417      392.3761 29.83627  399.6402 11.20562  -7.264099      31.87112  
1 1 1 18 7  7  o 228.8934 5.100296  34.97110       1.555615      33.93184       5.104017      35.07752       1.633326      222.6870 17.33712  229.2205 5.347438  -6.533554      18.14307  
1 1 1 18 7  8  o 270.7775 4.049640  48.91072       1.461176      48.79615       4.712152      48.92290       1.536934      268.5592 13.20809  270.7935 4.259351  -2.234344      13.87789  
1 1 1 18 7  9  o 218.8692 8.782696  32.16462       2.556249      32.41555       4.139091      32.00990       3.250148      218.3428 14.30511  217.8076 11.23640  0.5351410      18.19046  
1 1 1 18 7  10 o 156.7059 7.091151  16.46496       1.476893      21.75404       3.964988      15.61292       1.591413      177.7741 16.94250  152.4776 7.859067  25.29645       18.67654  
1 1 1 18 7  11 o 183.7386 9.459513  22.73590       2.308225      23.56657       4.321414      22.40431       2.730341      184.6349 17.78438  181.9716 11.31603  2.663300       21.07929  
1 1 1 18 7  12 o 66.30011 21.18126  3.021457       2.112329      1.947813       5.382989      3.216872       2.296531      77.01485 31.95432  68.46060 22.10628  8.554245       38.85571  
1 1 1 18 7  13 o 223.5918 8.360674  33.59976       2.486595      31.45473       3.542319      35.68356       3.491386      215.2016 12.40546  229.5712 11.44932  -14.36960      16.88142  
1 1 1 18 7  14 o 185.9228 7.807960  23.23273       1.930083      21.79231       2.347317      26.23938       3.391314      179.5922 9.846357  196.1256 13.05083  -16.53342      16.34854  
1 1 1 18 7  15 o 168.0705 5.425725  18.91098       1.213538      19.64459       1.277112      12.08803       3.894794      171.2756 5.603314  128.5304 23.61057  42.74515       24.26635  
1 1 1 18 7  16 o 304.6339 6.815196  62.25080       2.766497      62.46429       2.869420      59.43402       10.42282      305.0810 7.058387  281.8722 28.12482  23.20874       28.99700  
1 1 1 18 7  17 o 351.8308 11.98080  84.57386       5.608661      81.68045       6.551743      92.51040       10.85094      343.9232 14.32762  356.4509 22.96739  -12.52768      27.06994  
1 1 1 18 7  18 o 106.8699 7.508660  7.731807       1.062475      7.799769       1.068847      2.082422       9.745049      107.3381 7.520463  87.96700 39.59329  19.37112       40.30119  
1 1 1 18 7  19 f 133.6768 3.847586  11.95724       0.6846453     11.95791       0.6880778     11.89092       6.862865      133.6776 3.866892  112.3195 38.27963  21.35809       38.47445  
1 1 1 18 7  20 o 93.92389 8.291165  6.036071       1.027040      6.156811       1.038351      0.5844628      6.977196      94.86338 8.297782  72.10747 32.86936  22.75591       33.90056  
1 1 1 18 7  21 o 77.29865 5.889080  4.050818       0.6020209     4.075206       0.6090397     3.011015       3.976874      77.52046 5.941254  67.56879 27.69185  9.951675       28.32202  
1 1 1 18 7  22 o 97.56429 10.12283  6.672065       1.296928      6.524523       1.325056      10.03703       6.328016      96.29340 10.49649  93.63885 36.01466  2.654549       37.51309  
1 1 1 18 7  23 o 41.34057 13.76738  1.216971       0.8878306     1.567081       0.9208544     -3.403371      3.345228      45.90754 13.87912  41.32968 19.97885  4.577854       24.32662  
1 1 1 18 7  24 o 33.46206 15.64990  -1.126925      1.736386      -1.240575      1.779699      1.123069       7.918689      33.49335 15.72192  65.15350 31.30345  -31.66015      35.02977  
1 1 1 18 7  25 o 60.44865 24.82418  3.112931       3.204143      5.109437       3.852245      -1.369031      5.771821      69.92199 27.74367  54.86768 26.45373  15.05431       38.33420  
1 1 1 18 7  26 o 53.02978 12.44852  2.147132       0.8644866     2.509282       0.9809346     0.8876904      1.829299      57.03426 13.17276  43.09491 18.29775  13.93935       22.54616  
1 1 1 18 7  27 o 22.68324 11.12282  -1.924686      1.144622      -2.063610      3.111791      -1.902948      1.230921      40.29464 19.42661  23.94458 11.69749  16.35006       22.67651  
1 1 1 18 8  0  o 318.0308 12.75026  68.05711       5.383558      68.05711       5.383558      68.05711       5.383558      318.0308 12.75026  318.0308 12.75026  0.000000       0.000000  
1 1 1 18 8  1  o 221.4406 11.48103  33.03088       3.376184      30.92023       5.556251      34.26635       4.250971      211.9078 19.91037  224.8988 14.25835  -12.99095      24.48925  
1 1 1 18 8  2  o 444.1494 12.29640  132.8147       7.270472      127.0607       15.72565      134.3790       8.199409      425.3568 27.89881  446.1547 13.80850  -20.79797      31.12906  
1 1 1 18 8  3  o 166.6399 8.315955  18.63114       1.840730      19.16221       2.177510      17.30145       3.445558      168.7908 9.722529  158.9173 16.51142  9.873489       19.16128  
1 1 1 18 8  4  f 16.96133 8.464854  -2.069909      0.7785330     -0.2282777     2.279441      -2.313112      0.8283454     46.26537 20.04499  17.17915 8.597321  29.08623       21.81090  
1 1 1 18 8  5  o 160.2515 7.470677  17.21387       1.590885      34.96425       11.86654      16.88900       1.605377      212.7119 43.33870  158.7103 7.613193  54.00165       44.00231  
1 1 1 18 8  6  o 292.3770 7.205133  57.17244       2.807106      52.09878       11.47593      57.49533       2.895052      267.6875 32.86119  293.0753 7.419129  -25.38779      33.68830  
1 1 1 18 8  7  o 462.5406 10.59761  143.7758       6.531777      0.000000       0.000000      143.7758       6.531777      ?        ?         462.5406 10.59761  0.000000       10.59761  
1 1 1 18 8  8  o 311.1813 10.28783  65.14366       4.260039      69.08835       7.128270      62.95203       5.313259      317.9171 16.88719  304.9824 13.10471  12.93469       21.37547  
1 1 1 18 8  9  o 221.3089 6.577722  32.78284       1.937607      35.01988       3.731019      31.95671       2.267327      227.4406 12.35721  218.2940 7.807263  9.146545       14.61691  
1 1 1 18 8  10 o 341.7631 11.43332  78.84181       5.199471      76.17748       6.555671      83.35990       8.536908      334.4989 14.74407  347.8425 18.48445  -13.34366      23.64450  
1 1 1 18 8  11 f 205.8298 9.287934  28.52044       2.540859      32.39493       4.299437      26.44103       3.149735      217.6796 14.91255  197.4746 12.02690  20.20496       19.15803  
1 1 1 18 8  12 o 121.6790 9.752116  10.02417       1.567977      14.05801       3.758530      9.174207       1.725280      140.8798 20.63297  116.0475 11.30002  24.83236       23.52466  
1 1 1 18 8  13 o 216.9510 10.41876  31.81526       3.003169      38.43972       5.791584      29.37897       3.512259      234.9587 18.65125  207.7144 12.75101  27.24431       22.59331  
1 1 1 18 8  14 o 217.3868 9.435934  31.89438       2.726817      32.74274       3.522491      30.62578       4.307469      219.3675 12.09731  210.7576 15.44514  8.609955       19.61879  
1 1 1 18 8  15 o 281.8176 8.448444  53.49404       3.169040      59.64554       3.587557      31.64686       6.760924      297.3528 9.064852  207.9662 24.89099  89.38651       26.49024  
1 1 1 18 8  16 o 224.8786 5.739460  33.89458       1.718453      33.59067       1.755624      40.84447       8.395553      223.8319 5.891334  232.6089 27.62517  -8.776978      28.24638  
1 1 1 18 8  17 o 222.8258 6.511429  33.37282       1.931298      33.87557       1.975782      22.58370       9.152876      224.4685 6.612775  155.7321 42.79317  68.73639       43.30108  
1 1 1 18 8  18 o 98.81808 5.430882  6.568036       0.7123727     6.577014       0.7146780     5.183086       8.876441      98.88339 5.444940  91.32542 39.56186  7.557976       39.93479  
1 1 1 18 8  19 o 112.8730 5.475471  8.575251       0.8210843     8.588191       0.8269114     7.666753       6.928524      112.9510 5.510717  93.34489 37.15204  19.60610       37.55851  
1 1 1 18 8  20 o 176.9393 1.894046  20.88260       0.4465688     20.88714       0.4470061     18.56727       10.09705      176.9584 1.895697  119.5592 45.61551  57.39919       45.65489  
1 1 1 18 8  21 o 95.67361 10.77876  6.436111       1.350265      6.773309       1.408318      2.597189       4.751854      98.08804 10.96206  67.23093 29.03487  30.85711       31.03531  
1 1 1 18 8  22 o 76.39746 11.38322  4.188212       1.123498      3.881308       1.139110      15.15510       6.809345      73.16100 12.10769  110.3195 38.11237  -37.15851      39.98935  
1 1 1 18 8  23 o 38.79126 16.35322  0.4835304      1.443977      0.9778935E-02  1.526338      4.521321       4.456023      36.68048 16.13555  69.76563 29.02052  -33.08515      33.20461  
1 1 1 18 8  24 o 123.0959 8.506818  10.56005       1.386771      10.31574       1.466497      12.62551       4.263989      121.2467 9.144304  112.0616 28.49541  9.185036       29.92669  
1 1 1 18 8  25 o 86.54227 38.60950  16.18453       9.046807      0.000000       0.000000      16.18453       9.046807      ?        ?         86.54227 38.60950  0.000000       38.60950  
1 1 1 18 8  26 o 32.21504 15.91256  -3.903515      2.488022      -4.191146      2.684483      -2.151386      6.625605      33.22996 16.43492  53.37891 26.29039  -20.14894      31.00470  
1 1 1 18 9  0  o 41.86744 23.82473  1.563149       2.071472      1.563149       2.071472      1.563149       2.071472      41.86744 23.82473  41.86744 23.82473  0.000000       0.000000  
1 1 1 18 9  1  o 36.47021 16.26737  -0.6123738     1.605149      0.5695501      5.742653      -0.7125407     1.671784      75.33250 32.21597  36.82764 16.50156  38.50486       36.19627  
1 1 1 18 9  2  o 174.0921 14.28067  20.61805       3.283752      18.24327       5.227099      22.16630       4.220553      160.1613 25.33403  179.5361 17.87926  -19.37476      31.00776  
1 1 1 18 9  3  o 170.1587 10.08238  19.50072       2.275830      20.89729       3.250363      18.15758       3.187573      175.3087 14.03114  163.1405 14.82480  12.16824       20.41194  
1 1 1 18 9  4  o 415.9212 11.50350  116.4865       6.369380      92.99374       13.41630      123.3222       7.236936      362.1979 28.01562  427.4600 12.71947  -65.26208      30.76784  
1 1 1 18 9  5  o 693.5699 15.35911  326.3556       14.19482      349.1964       28.78068      319.0136       16.31753      697.8559 31.02765  683.2796 17.93734  14.57629       35.83941  
1 1 1 18 9  6  o 52.69748 13.74725  1.947382       0.9752931     -3.180610      5.727687      2.100504       0.9897471     64.39095 29.51385  54.67967 13.63196  9.711273       32.50996  
1 1 1 18 9  7  o 502.1447 30.74567  181.9451       20.47384      0.000000       0.000000      181.9451       20.47384      ?        ?         502.1447 30.74567  0.000000       30.74567  
1 1 1 18 9  8  o 263.8589 9.585693  46.82469       3.364701      18.03883       10.14317      50.38390       3.566653      148.7016 46.27215  273.6593 9.796666  -124.9577      47.29784  
1 1 1 18 9  9  o 140.2594 14.81140  13.51412       2.726468      12.13731       5.023010      14.08920       3.246318      127.4036 30.07386  142.4316 17.46995  -15.02796      34.77982  
1 1 1 18 9  10 o 399.0289 8.714993  106.8789       4.633881      102.8460       6.666321      110.6494       6.445835      389.5261 12.86092  404.5062 11.97178  -14.98013      17.57062  
1 1 1 18 9  11 o 155.5113 9.662666  16.33125       1.992424      15.11383       3.748759      16.81053       2.352149      146.5158 19.69998  157.4061 11.28921  -10.89027      22.70541  
1 1 1 18 9  12 o 131.2104 13.86096  11.84079       2.386867      7.099530       3.237288      17.48832       3.533165      98.04175 24.77378  158.6291 16.97883  -60.58739      30.03366  
1 1 1 18 9  13 o 206.0149 15.78500  29.30726       4.300276      28.12228       4.661257      36.08111       11.14464      200.9396 17.58567  209.5273 41.38517  -8.587708      44.96653  
1 1 1 18 9  14 o 77.59101 8.491796  4.098052       0.8636578     4.198571       0.8721585     -0.9832642     6.200960      78.55267 8.465742  70.74718 31.73416  7.805489       32.84396  
1 1 1 18 9  15 o 185.0244 6.083634  22.96642       1.497872      23.42931       1.610704      20.00547       4.073745      186.7956 6.480881  167.9504 18.50942  18.84515       19.61123  
1 1 1 18 9  16 o 372.3722 13.29233  95.46211       6.584981      96.88654       9.017735      93.83487       9.638355      369.7966 18.35781  361.8247 20.06947  7.971832       27.19913  
1 1 1 18 9  17 o 210.1512 5.618896  29.64293       1.572051      30.34267       1.646745      22.45034       5.279616      212.5621 5.819368  172.6239 23.56714  39.93819       24.27499  
1 1 1 18 9  18 o 93.56428 5.678021  5.900848       0.7045819     5.863431       0.7103531     8.175591       5.538620      93.25343 5.744457  96.39824 34.29082  -3.144814      34.76866  
1 1 1 18 9  19 o 106.9988 7.777223  7.803513       1.101291      7.821267       1.109590      6.629939       9.021327      107.1052 7.828676  89.57180 39.32069  17.53339       40.09246  
1 1 1 18 9  20 o 44.02863 14.21461  1.370362       0.9495610     1.402308       0.9685031     0.5775421      4.824796      44.49232 14.35493  61.84961 27.84680  -17.35729      31.32904  
1 1 1 18 9  21 o 67.82484 11.20321  3.297721       0.9772034     3.295316       1.009159      3.333905       3.914170      67.62874 11.61680  66.81484 27.43769  0.8138962      29.79559  
1 1 1 18 9  22 o 126.4263 9.657977  11.19187       1.614720      11.74240       1.653377      -0.1697857     7.511079      129.5188 9.649338  64.46270 30.84269  65.05610       32.31689  
1 1 1 18 9  23 o 49.86985 15.84770  1.910060       1.183741      1.409505       1.235890      7.468679       4.118487      44.70584 16.16246  83.43910 29.58083  -38.73326      33.70831  
1 1 1 18 9  24 o 40.76349 14.61401  1.162132       1.007945      1.601339       1.040058      -5.622574      4.087793      45.88976 14.88158  40.95902 20.26175  4.930744       25.13961  
1 1 1 18 9  25 o 64.14029 27.89588  4.314374       4.449496      5.006666       5.061459      1.959534       9.334950      66.18086 29.23661  62.71389 30.94847  3.466972       42.57449  
1 1 1 18 9  26 o 46.55712 20.61021  0.9439192      2.527932      1.291697       2.632523      -3.173722      9.058282      48.49319 21.26572  55.85384 28.02043  -7.360653      35.17635  
1 1 1 18 10 0  o 369.8204 15.57855  92.46889       7.645940      92.46889       7.645940      92.46889       7.645940      369.8204 15.57855  369.8204 15.57855  0.000000       0.000000  
1 1 1 18 10 1  o 294.1414 15.64426  58.91246       6.109701      55.47800       13.00094      59.88594       6.921631      272.7902 36.69608  295.7084 17.64619  -22.91827      40.71843  
1 1 1 18 10 2  o 202.6031 11.57371  27.72781       3.111586      26.45201       4.215843      29.25440       4.611639      196.5699 16.23987  206.5596 16.90236  -9.989731      23.43978  
1 1 1 18 10 3  o 354.2719 10.55808  84.45094       4.978634      80.73087       6.397012      90.16578       7.928726      345.1148 13.93909  363.5748 16.40804  -18.46002      21.52956  
1 1 1 18 10 4  o 241.3622 8.451797  39.09074       2.714071      41.98711       3.732618      35.84151       3.953445      249.4801 11.25704  229.9910 12.95239  19.48920       17.16058  
1 1 1 18 10 5  o 198.4428 2.077136  26.24671       0.5492547     19.93786       4.316296      26.35055       0.5537564     169.2515 19.49404  198.8345 2.090034  -29.58298      19.60576  
1 1 1 18 10 6  o 296.8849 11.53576  59.50393       4.554919      65.75208       12.32743      58.51602       4.901805      300.1943 31.27553  294.0574 12.53858  6.136841       33.69532  
1 1 1 18 10 7  o 106.3111 6.706244  7.590982       0.9451762     0.000000       0.000000      7.590982       0.9451762     ?        ?         106.3111 6.706244  0.000000       6.706244  
1 1 1 18 10 8  o 203.2512 7.799306  27.72463       2.108414      0.000000       0.000000      27.72463       2.108414      ?        ?         203.2512 7.799306  0.000000       7.799306  
1 1 1 18 10 9  f 319.3742 12.78242  69.18414       5.428855      82.61795       10.20959      63.88839       6.410213      342.8834 22.46920  305.4574 15.80256  37.42596       27.46973  
1 1 1 18 10 10 o 103.5495 14.15688  7.422701       1.902296      13.44733       5.242043      6.508986       2.041460      133.4529 30.18692  96.20022 16.52039  37.25266       34.41182  
1 1 1 18 10 11 o 164.1899 8.964238  18.17994       1.953812      22.53733       3.583763      16.33705       2.330638      181.0191 14.99167  155.0444 11.35978  25.97466       18.80944  
1 1 1 18 10 12 o 76.76531 19.47276  4.266431       1.994632      3.595733       2.656393      5.133397       3.020161      71.90235 23.80991  83.66676 25.09986  -11.76441      34.59645  
1 1 1 18 10 13 o 37.33011 14.08843  0.7118921      0.9568396     1.312357       1.027587      -3.203915      2.624129      44.66117 14.80953  38.44078 18.34795  6.220387       23.57901  
1 1 1 18 10 14 f 166.8770 6.820341  18.72056       1.513422      19.40102       1.711905      16.28596       3.238104      169.7094 7.589274  152.4800 16.18378  17.22942       17.87489  
1 1 1 18 10 15 o 253.0515 7.112347  43.08499       2.395876      44.01703       2.637866      38.69284       5.726283      255.5407 7.755720  233.2571 18.57653  22.28362       20.13054  
1 1 1 18 10 16 o 219.3464 6.080669  32.32679       1.775563      32.22046       1.801533      35.93547       10.49494      218.9546 6.180867  198.8575 40.97017  20.09711       41.43377  
1 1 1 18 10 17 o 144.8848 3.858499  14.04629       0.7442656     14.09518       0.7456002     0.4266643      12.44454      145.1369 3.858693  87.94195 41.37236  57.19491       41.55192  
1 1 1 18 10 18 o 162.7313 2.387923  17.67225       0.5178035     17.65141       0.5187885     23.14706       8.406560      162.6346 2.393888  150.4866 40.87345  12.14804       40.94349  
1 1 1 18 10 19 o 110.3330 8.510864  8.354531       1.241609      8.628756       1.272122      2.842899       5.703163      112.1122 8.580547  72.01125 31.44631  40.10098       32.59595  
1 1 1 18 10 20 o 181.6836 7.751058  22.56044       1.872195      22.58766       1.912448      21.93408       9.173471      181.6941 7.918067  125.9283 44.19082  55.76582       44.89459  
1 1 1 18 10 21 o 76.72562 8.379005  4.093588       0.8427477     3.985704       0.8687307     5.816609       3.471783      75.53845 8.794951  78.66959 27.21212  -3.131142      28.59809  
1 1 1 18 10 22 o 100.1981 17.52235  7.886618       2.254368      9.227233       2.394734      -2.553947      6.682935      108.9352 17.05667  57.73951 27.98949  51.19567       32.77715  
1 1 1 18 10 23 o 31.37385 15.24451  -2.656587      2.013459      -1.855958      2.568971      -3.931638      3.241957      38.57716 18.33996  38.76160 18.94620  -0.1844330     26.36878  
1 1 1 18 10 24 o 47.73546 22.17609  -0.2432094     3.394243      -2.518893      5.021866      1.670749       4.605485      49.70540 24.13414  57.20314 26.30970  -7.497734      35.70234  
1 1 1 18 10 25 o 51.44279 21.51624  1.945908       2.469229      1.183022       2.733511      5.328756       5.756155      48.76989 21.51791  65.57423 29.87726  -16.80433      36.81944  
1 1 1 18 11 0  o 68.22683 31.95558  4.710011       3.250662      4.710011       3.250662      4.710011       3.250662      68.22683 31.95558  68.22683 31.95558  0.000000       0.000000  
1 1 1 18 11 1  o 273.4500 15.33405  50.99305       5.564997      47.92219       11.46901      51.93870       6.364420      253.4413 34.88501  275.0540 17.45475  -21.61263      39.00810  
1 1 1 18 11 2  o 201.2223 8.204776  27.18157       2.195354      33.82454       3.459960      22.70485       2.840336      223.6899 11.64796  183.1400 11.70012  40.54996       16.50963  
1 1 1 18 11 3  o 100.8769 18.24764  7.177898       2.362588      3.254776       3.469758      10.56907       3.225955      73.58251 27.00828  122.1808 20.54261  -48.59830      33.93296  
1 1 1 18 11 4  o 435.8892 11.94600  128.3337       6.932060      123.9430       9.375068      133.6298       10.29640      425.7053 16.55849  441.3578 17.54233  -15.65247      24.12296  
1 1 1 18 11 5  o 414.7141 8.887066  115.4364       4.911122      98.71813       11.09631      119.5091       5.476739      375.7330 22.26265  421.6521 9.747523  -45.91907      24.30308  
1 1 1 18 11 6  o 212.9804 11.00481  30.65432       3.112579      33.61578       5.790153      29.45072       3.691289      219.6081 20.00587  208.0422 13.38641  11.56598       24.07137  
1 1 1 18 11 7  o 282.6254 9.601151  53.77163       3.610580      0.000000       0.000000      53.77163       3.610580      ?        ?         282.6254 9.601151  0.000000       9.601151  
1 1 1 18 11 8  o 59.63549 18.72936  2.446041       1.657819      0.000000       0.000000      2.446041       1.657819      ?        ?         59.63549 18.72936  0.000000       18.72936  
1 1 1 18 11 9  o 181.4767 10.62810  22.29214       2.558850      31.42009       10.25703      21.68635       2.642398      197.7623 40.29230  178.8463 11.14314  18.91602       41.80478  
1 1 1 18 11 10 o 319.5390 18.32662  70.96374       7.770598      70.45705       8.785563      72.78445       16.65401      316.3998 20.95627  297.8186 43.22731  18.58124       48.03921  
1 1 1 18 11 11 o 106.5203 15.21914  7.927898       2.098874      0.7039653      4.032092      10.61285       2.458170      63.61246 27.09310  123.5076 15.26064  -59.89509      31.09539  
1 1 1 18 11 12 o 64.40919 15.08890  2.963089       1.272203      0.1426779      3.211379      3.488117       1.385564      55.30510 23.87667  69.91571 15.29842  -14.61061      28.35732  
1 1 1 18 11 13 o 142.1680 9.373971  13.71339       1.765911      14.37024       2.059877      11.89206       3.430056      145.1495 10.72583  127.8937 20.84420  17.25578       23.44193  
1 1 1 18 11 14 o 332.3487 9.704907  74.91470       4.293323      74.22260       5.330435      76.19286       7.243875      329.1489 12.17435  329.7009 16.54119  -0.5520020     20.53839  
1 1 1 18 11 15 o 168.7630 5.641555  19.12285       1.266890      19.41919       1.339052      16.59367       3.911987      170.0011 5.920191  150.6836 19.97461  19.31749       20.83348  
1 1 1 18 11 16 o 33.28735 11.97298  0.6567581      0.6771744     0.6140417      0.6836048     2.895318       4.948710      32.79516 11.99608  73.33399 30.55011  -40.53883      32.82096  
1 1 1 18 11 17 o 99.49397 5.914396  6.682836       0.7805784     6.815229       0.7927815     2.481368       4.466022      100.4705 5.948251  68.76112 28.85990  31.70940       29.46652  
1 1 1 18 11 18 o 27.67870 11.75969  0.6817511E-01  0.7564106     0.8468910E-01  0.7591066     -2.244369      8.983006      27.87373 11.80899  71.08241 33.93330  -43.20867      35.92939  
1 1 1 18 11 19 o 49.77477 11.35010  1.796083       0.7360519     1.871379       0.7393719     -6.532010      7.775864      50.86236 11.21163  59.49788 29.13674  -8.635513      31.21939  
1 1 1 18 11 20 o 169.9021 7.273148  19.72527       1.642815      19.94709       1.714041      17.22133       5.758708      170.6889 7.554744  129.5154 33.21239  41.17348       34.06078  
1 1 1 18 11 21 o 69.04207 10.28341  3.406473       0.9172487     3.736040       0.9361628     -4.503251      4.586278      72.50836 9.951488  46.57072 22.71337  25.93764       24.79776  
1 1 1 18 11 22 o 26.02115 12.07755  -0.6871994     1.003293      -0.4881117     1.015804      -8.620096      6.412152      27.32210 12.48774  48.58341 24.25366  -21.26131      27.27973  
1 1 1 18 11 23 o 53.15327 19.77987  2.246346       1.872262      2.699683       2.323727      1.407473       3.160983      56.95715 21.84521  52.69395 23.19860  4.263195       31.86516  
1 1 1 18 11 24 o 136.9149 14.47635  14.41851       2.601140      13.61094       2.866657      18.18209       6.188525      129.9220 16.96317  111.9312 36.30079  17.99076       40.06864  
1 1 1 18 11 25 o 63.29112 23.48474  4.014668       2.635746      2.782408       2.781363      14.86717       8.254132      55.98916 23.07483  80.39287 36.28862  -24.40371      43.00363  
1 1 1 18 12 0  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 18 12 1  o 294.9185 12.10868  58.86074       4.748405      0.000000       0.000000      58.86074       4.748405      ?        ?         294.9185 12.10868  0.000000       12.10868  
1 1 1 18 12 2  o 263.2420 6.240583  46.34396       2.189041      47.44512       4.033856      45.88432       2.606163      264.9341 11.45344  261.6125 7.483696  3.321686       13.68163  
1 1 1 18 12 3  o 198.5903 12.17926  26.75481       3.207441      29.26872       4.052863      22.54135       5.246944      206.8825 14.79935  178.3173 22.58809  28.56514       27.00450  
1 1 1 18 12 4  f 286.1255 10.79908  55.26015       4.109953      57.23136       6.985750      54.21664       5.082687      287.7514 18.31393  282.3621 13.54823  5.389343       22.78058  
1 1 1 18 12 5  o 123.8564 7.044172  10.30583       1.157785      11.88837       2.604215      9.915981       1.292547      131.2171 15.17330  121.3302 8.040086  9.886864       17.17184  
1 1 1 18 12 6  o 205.1103 7.623625  28.24269       2.080014      36.34415       6.633805      27.35938       2.190474      226.7032 22.24610  201.7608 8.164426  24.94240       23.69698  
1 1 1 18 12 7  o 227.7746 12.75623  35.30094       3.856225      20.04295       14.52093      36.45864       3.999846      148.4077 55.11246  231.3884 13.02522  -82.98071      56.63073  
1 1 1 18 12 8  o 153.6852 11.00147  16.04025       2.238071      0.000000       0.000000      16.04025       2.238071      ?        ?         153.6852 11.00147  0.000000       11.00147  
1 1 1 18 12 9  o 57.00433 22.99040  1.265267       2.689782      0.6806305      6.008393      1.411800       3.008037      74.84940 32.48606  60.02815 24.27581  14.82125       40.55439  
1 1 1 18 12 10 o 87.08603 33.54854  4.826145       5.497315      3.556286       9.061663      5.565658       6.915173      94.07796 40.35545  93.93604 37.20347  0.1419220      54.88771  
1 1 1 18 12 11 o 271.5487 10.99624  50.10377       3.970693      46.37724       11.73762      50.58534       4.219461      237.5713 38.38600  272.5314 11.64580  -34.96007      40.11371  
1 1 1 18 12 12 o 56.59781 19.37789  2.139340       1.759063      6.073328       4.843879      1.541714       1.887954      89.99706 32.06240  52.49028 19.79413  37.50679       37.68031  
1 1 1 18 12 13 o 73.47638 12.35225  3.791952       1.166528      4.843813       1.335857      0.4139217      2.393936      83.23243 12.42452  49.32424 20.93694  33.90819       24.34592  
1 1 1 18 12 14 o 164.0820 7.357776  18.18075       1.604629      18.36030       1.745137      17.19855       4.081754      164.7000 7.975451  152.9107 20.55246  11.78934       22.04567  
1 1 1 18 12 15 o 127.0462 6.322829  10.88551       1.067037      10.76022       1.112135      12.33703       3.785403      126.2340 6.634912  126.5869 23.29968  -0.3528976     24.22596  
1 1 1 18 12 16 o 65.56651 12.68839  3.083524       1.068489      2.786487       1.110559      6.782724       3.919136      61.91488 13.81224  89.39252 28.87962  -27.47764      32.01266  
1 1 1 18 12 17 o 29.07310 12.02383  0.2117857      0.7587643     0.1600857      0.7677677     2.377455       4.969131      28.71663 12.00339  68.69224 29.67869  -39.97561      32.01415  
1 1 1 18 12 18 o 149.1830 11.40012  15.64463       2.249055      15.73339       2.282534      12.68541       13.17980      149.5078 11.54665  93.46737 43.51518  56.04038       45.02106  
1 1 1 18 12 19 f 19.89866 9.555167  -0.9999947     0.7354932     -1.012766      0.7373417     1.537453       10.39338      19.87284 9.549099  73.50161 35.45294  -53.62877      36.71643  
1 1 1 18 12 20 o 84.65892 8.503960  4.990832       0.9463494     5.014326       0.9539843     3.540628       7.495105      84.83775 8.555503  70.63599 32.86189  14.20176       33.95734  
1 1 1 18 12 21 o 28.06202 12.34259  -0.9515153E-01 0.8928022     -0.5239170     0.9046663     15.93121       5.530901      25.39815 11.67386  118.8711 33.49266  -93.47295      35.46882  
1 1 1 18 12 22 o 40.41267 17.61910  0.3472590      1.784152      0.6921784      1.860588      -3.593830      6.289260      42.90141 18.34192  53.27960 26.11489  -10.37819      31.91259  
1 1 1 18 12 23 o 55.42028 19.09581  2.593687       1.709011      2.402411       1.833663      3.858767       4.715725      53.78893 19.65149  63.05056 28.01767  -9.261631      34.22237  
1 1 1 18 12 24 o 42.03433 19.62066  -0.6112018     2.707504      -1.794773      3.084283      3.364678       5.652932      41.06649 19.67947  60.76814 28.36044  -19.70165      34.51950  
1 1 1 18 13 0  o 99.18880 12.83118  6.929573       1.617853      6.929573       1.617853      6.929573       1.617853      99.18880 12.83118  99.18880 12.83118  0.000000       0.000000  
1 1 1 18 13 1  o 414.7359 16.12205  117.9776       8.892777      157.4381       21.49753      109.8312       9.767677      454.8860 35.75319  398.3786 18.45027  56.50735       40.23311  
1 1 1 18 13 2  o 143.3109 3.312908  13.70004       0.6326481     8.349723       10.54989      13.71935       0.6337887     113.3986 45.60284  143.4117 3.316549  -30.01305      45.72328  
1 1 1 18 13 3  o 281.4517 5.268144  52.94027       1.975764      62.65021       4.556299      50.69160       2.192639      304.3175 11.25539  275.2880 5.977317  29.02945       12.74411  
1 1 1 18 13 4  o 111.7891 13.53532  8.614799       1.975223      7.513612       4.964065      8.821944       2.153004      100.2522 32.51171  112.8229 14.66792  -12.57068      35.66734  
1 1 1 18 13 5  o 45.63531 11.60675  1.463244       0.7073324     2.995959       2.887268      1.365382       0.7295642     68.76277 24.72397  44.17974 12.05824  24.58303       27.50774  
1 1 1 18 13 6  o 145.3849 12.75746  14.46756       2.446455      10.41992       4.283264      16.42738       2.980449      117.5094 27.79312  154.3533 14.66682  -36.84395      31.42568  
1 1 1 18 13 7  o 132.1915 11.50932  11.92685       2.007151      0.000000       0.000000      11.92685       2.007151      ?        ?         132.1915 11.50932  0.000000       11.50932  
1 1 1 18 13 8  o 75.77415 26.02856  3.992849       3.174408      -2.846606      9.977111      4.763201       3.348411      83.64292 38.56197  81.17067 26.72574  2.472252       46.91791  
1 1 1 18 13 9  o 233.9187 17.35218  38.27362       5.370179      0.000000       0.000000      38.27362       5.370179      ?        ?         233.9187 17.35218  0.000000       17.35218  
1 1 1 18 13 10 o 73.59370 29.90291  2.654237       4.589032      0.000000       0.000000      2.654237       4.589032      ?        ?         73.59370 29.90291  0.000000       29.90291  
1 1 1 18 13 11 o 107.6459 19.63020  8.458607       2.712046      -12.58101      14.48345      9.223127       2.760880      82.93645 40.43054  112.7837 19.04850  -29.84721      44.69311  
1 1 1 18 13 12 o 91.43288 24.66841  6.466769       3.074329      1.968083       7.501574      7.374872       3.370368      81.11082 35.72236  97.20125 25.65205  -16.09043      43.97857  
1 1 1 18 13 13 o 140.2114 6.945931  13.27122       1.293699      14.90261       1.484201      8.111689       2.639481      148.4336 7.528484  104.5710 19.66395  43.86252       21.05585  
1 1 1 18 13 14 o 180.7140 5.685492  21.95925       1.367391      23.56952       1.492154      13.51999       3.415978      187.1350 5.991632  135.0310 19.55331  52.10405       20.45071  
1 1 1 18 13 15 o 80.96702 6.305990  4.444140       0.6749926     4.515599       0.6803988     0.1011343E-02  5.365131      81.61938 6.304842  64.27599 29.11150  17.34339       29.78641  
1 1 1 18 13 16 o 110.8501 5.485889  8.289001       0.8078027     8.449041       0.8384606     6.219822       3.014861      111.8779 5.642466  86.36720 24.85868  25.51075       25.49101  
1 1 1 18 13 17 o 58.67101 5.953941  2.347737       0.4590418     2.252023       0.4637751     6.965263       3.221237      57.40372 6.159297  89.50018 25.67516  -32.09646      26.40361  
1 1 1 18 13 18 o 79.35258 6.489205  4.300251       0.6801739     4.360007       0.6823975     -4.823859      8.432191      79.91306 6.463461  61.97927 30.34972  17.93379       31.03034  
1 1 1 18 13 19 o 76.41859 10.17092  4.148557       1.010004      4.629179       1.025392      -11.50595      5.852045      81.00468 9.691736  44.27692 22.25485  36.72776       24.27361  
1 1 1 18 13 20 o 64.22596 10.60314  2.976230       0.8758035     3.003825       0.8804194     0.3652467      8.563961      64.52702 10.60768  65.49129 31.73237  -0.9642792     33.45843  
1 1 1 18 13 21 o 35.54377 13.26090  0.7882715      0.8425765     0.5205740      0.8489236     18.48990       6.903242      32.71679 13.01013  113.1365 38.39464  -80.41975      40.53901  
1 1 1 18 13 22 o 29.01847 12.90129  -0.1415793     1.001141      -0.2277840     1.026061      1.568778       4.570368      28.80090 12.91459  56.67455 26.11820  -27.87365      29.13670  
1 1 1 18 13 23 o 36.14312 16.24140  -0.9320053E-01 1.632336      -1.551854      1.938809      3.457974       3.025136      33.23495 15.83755  60.11414 24.33239  -26.87920      29.03263  
1 1 1 18 14 0  o 107.6449 7.062387  7.843063       1.002876      7.843063       1.002876      7.843063       1.002876      107.6449 7.062387  107.6449 7.062387  0.000000       0.000000  
1 1 1 18 14 1  o 106.9870 3.706625  7.648413       0.5276264     4.373218       1.543057      8.082049       0.5614700     78.62942 15.27795  109.9703 3.837458  -31.34090      15.75252  
1 1 1 18 14 2  o 237.7387 1.515235  37.66778       0.4800134     28.81024       14.68834      37.67725       0.4802699     170.6001 55.96528  237.7686 1.515854  -67.16844      55.98581  
1 1 1 18 14 3  o 170.1273 6.780814  19.42924       1.534117      20.68862       2.904718      18.94205       1.806644      173.9966 12.61387  167.7070 8.108429  6.289642       14.99521  
1 1 1 18 14 4  o 109.5796 21.04963  8.713741       2.961924      4.977476       3.777837      14.67444       4.771696      83.43622 28.40184  140.1807 26.51633  -56.74448      38.85589  
1 1 1 18 14 5  o 261.4273 13.86683  46.87546       4.813326      51.42294       7.580251      43.80314       6.230628      268.7247 21.34434  249.6795 18.86692  19.04520       28.48757  
1 1 1 18 14 6  o 38.28125 16.46974  -0.2619510E-01 1.517747      0.9457703      2.797266      -0.4317229     1.806836      55.80584 23.08370  39.46828 17.45053  16.33756       28.93749  
1 1 1 18 14 7  o 75.99714 17.56179  4.180694       1.742744      14.00562       4.630138      2.559055       1.881077      136.0222 26.49828  60.87356 20.03096  75.14862       33.21744  
1 1 1 18 14 8  o 64.72902 21.23407  2.946534       2.114474      0.000000       0.000000      2.946534       2.114474      ?        ?         64.72902 21.23407  0.000000       21.23407  
1 1 1 18 14 9  o 96.55993 28.04068  7.317341       3.820350      14.75042       11.47402      6.390566       4.051521      123.0320 48.16732  90.61153 29.37072  32.42046       56.41569  
1 1 1 18 14 10 f 221.3044 12.12803  33.66771       3.562793      39.72062       12.83668      33.16252       3.708493      199.3120 48.74427  219.2815 12.74672  -19.96944      50.38336  
1 1 1 18 14 11 o 112.2007 11.56409  8.712626       1.704207      5.825322       2.088751      14.46190       2.947452      88.99245 18.22775  142.8237 15.74834  -53.83120      24.08861  
1 1 1 18 14 12 o 85.72464 27.21378  5.905524       3.491373      16.80675       8.415430      3.639058       3.837191      128.1216 42.37710  72.88627 28.04173  55.23528       50.81493  
1 1 1 18 14 13 o 146.8913 8.487313  14.70247       1.654195      13.30112       1.759715      25.34718       4.849929      139.2830 9.538948  184.5219 20.04664  -45.23895      22.20043  
1 1 1 18 14 14 o 81.41136 7.970150  4.541984       0.8535542     4.667112       0.8706940     1.457276       4.323087      82.52109 8.019215  63.68106 27.59775  18.84003       28.73923  
1 1 1 18 14 15 o 137.5350 6.115344  12.79220       1.117944      13.28937       1.168865      7.456152       3.829341      140.1325 6.275601  91.44386 28.42737  48.68861       29.11183  
1 1 1 18 14 16 o 169.5212 1.948840  19.17561       0.4402241     19.18322       0.4413106     17.63543       6.277471      169.5543 1.953269  130.5743 35.25908  38.97998       35.31314  
1 1 1 18 14 17 o 81.91223 8.402487  4.655294       0.9041417     4.391547       0.9245996     10.41824       4.321975      79.34555 8.898073  103.3491 29.76887  -24.00359      31.07027  
1 1 1 18 14 18 o 37.98307 11.90942  1.032598       0.6705803     0.9496656      0.6856689     2.854970       3.214183      36.82301 12.09241  61.49196 25.01094  -24.66895      27.78081  
1 1 1 18 14 19 o 25.09612 11.75979  -0.8284518     0.9883561     -0.7061478     1.018739      -2.787620      4.077353      26.20731 12.16608  46.65789 22.42879  -20.45058      25.51596  
1 1 1 18 14 20 o 33.53862 11.66424  0.7571657      0.6382791     0.8365384      0.6409639     -8.658063      6.980929      34.70524 11.69970  50.05264 25.03542  -15.34740      27.63431  
1 1 1 18 14 21 o 57.33141 13.28724  2.522761       0.9952195     2.427335       1.034458      3.709525       3.648045      55.88774 13.93838  62.64157 26.17298  -6.753822      29.65305  
1 1 1 18 14 22 o 36.65258 14.65309  0.7396859      1.082570      1.460030       1.162993      -3.934938      2.962651      44.04866 15.70853  35.89103 17.65826  8.157627       23.63413  
1 1 1 18 15 0  f 81.02935 5.356359  4.440898       0.5724601     4.440898       0.5724601     4.440898       0.5724601     81.02935 5.356359  81.02935 5.356359  0.000000       0.000000  
1 1 1 18 15 1  o 113.7528 2.029467  8.626608       0.3076221     7.366774       1.126716      8.728084       0.3197712     104.3127 8.171118  114.4174 2.097363  -10.10472      8.436000  
1 1 1 18 15 2  o 125.9893 6.357152  10.66827       1.063810      6.078965       2.033631      12.39721       1.248213      92.13132 17.19733  135.7338 6.924119  -43.60246      18.53893  
1 1 1 18 15 3  o 151.7620 4.800609  15.41614       0.9695858     9.870973       4.683641      15.66442       0.9910544     111.6858 30.58050  152.9704 4.868216  -41.28460      30.96557  
1 1 1 18 15 4  o 121.3511 23.71239  10.98811       3.696820      7.827712       5.966422      12.95748       4.709838      99.84394 35.58267  129.4509 28.11106  -29.60699      45.34709  
1 1 1 18 15 5  o 231.3533 15.62758  37.28592       4.789446      29.15201       6.081064      50.57472       7.772717      199.1779 23.35521  263.8765 22.31439  -64.69867      32.30167  
1 1 1 18 15 6  o 69.05223 25.60152  3.089346       3.131128      -4.939187      3.993413      15.90172       5.044765      46.17362 22.19618  143.5579 27.37057  -97.38428      35.23944  
1 1 1 18 15 7  o 122.2603 15.55029  10.55776       2.476121      15.93123       4.863904      8.677981       2.876806      143.9527 26.32648  108.3671 20.67649  35.58561       33.47537  
1 1 1 18 15 8  o 54.98102 20.73609  1.772997       2.072067      0.000000       0.000000      1.772997       2.072067      ?        ?         54.98102 20.73609  0.000000       20.73609  
1 1 1 18 15 9  o 165.6923 11.47723  18.90391       2.518377      0.000000       0.000000      18.90391       2.518377      ?        ?         165.6923 11.47723  0.000000       11.47723  
1 1 1 18 15 10 o 144.4238 14.82604  14.76204       2.812766      21.00780       6.861780      13.50058       3.083759      155.4455 34.06963  136.6273 17.32743  18.81815       38.22276  
1 1 1 18 15 11 o 207.4185 10.32546  29.54193       2.844873      25.69596       4.070289      33.21515       3.977820      189.2698 16.29732  217.4749 13.79773  -28.20505      21.35369  
1 1 1 18 15 12 o 141.5767 19.13407  14.96785       3.517393      8.670777       7.836861      16.55636       3.936123      94.71431 38.85147  147.8328 20.53502  -53.11845      43.94455  
1 1 1 18 15 13 o 58.28144 14.83277  2.515893       1.154647      2.644216       1.189788      0.4392632      4.786253      59.70788 14.98083  61.86996 27.80581  -2.162083      31.58463  
1 1 1 18 15 14 o 66.75369 7.300747  3.061552       0.6388281     3.031212       0.6481973     4.088369       3.770922      66.37524 7.457570  71.41743 27.71188  -5.042183      28.69780  
1 1 1 18 15 15 o 68.57021 13.11705  3.446970       1.154864      3.795624       1.204168      -0.5509568     4.077631      72.08219 13.01562  53.82144 24.75498  18.26075       27.96811  
1 1 1 18 15 16 o 143.2877 7.939402  14.11651       1.509972      15.43604       1.615147      4.963129       4.253950      149.7443 8.124900  73.34062 29.13683  76.40367       30.24845  
1 1 1 18 15 17 o 58.62848 10.94232  2.491793       0.8234202     2.799431       0.8527118     -1.756666      3.168827      62.34997 10.64528  43.95889 20.74084  18.39108       23.31318  
1 1 1 18 15 18 o 45.09414 13.81610  1.521691       0.9084426     1.568247       0.9804498     1.239206       2.415079      45.74399 14.40856  49.77402 21.07423  -4.030029      25.52899  
1 1 1 18 15 19 o 60.57016 9.689827  2.632964       0.7557256     2.648411       0.7666577     2.102877       4.491102      60.69746 9.813611  59.52129 26.82654  1.176178       28.56519  
1 1 1 18 15 20 o 109.4729 5.314460  8.150602       0.7729291     8.121723       0.7847827     9.084983       4.463975      109.2389 5.408179  86.10317 30.76794  23.13570       31.23963  
1 1 1 18 15 21 o 26.93633 11.02621  0.2635089      0.6295632     2.746497       1.324337      -0.4614398     0.7155911     57.81272 16.42322  22.25746 10.28486  35.55526       19.37784  
1 1 1 18 16 0  o 26.38192 14.35888  0.6682809      0.7136311     0.6682809      0.7136311     0.6682809      0.7136311     26.38192 14.35888  26.38192 14.35888  0.000000       0.000000  
1 1 1 18 16 1  o 168.9933 3.616572  19.07461       0.8144045     19.19595       0.8714479     18.23772       2.288595      169.5011 3.858294  163.4127 10.56682  6.088425       11.24918  
1 1 1 18 16 2  o 99.66142 4.396515  6.654853       0.5824238     6.353705       1.023295      6.799157       0.7083523     96.74242 8.009711  100.6114 5.302304  -3.868927      9.605722  
1 1 1 18 16 3  o 125.2596 8.683454  10.65679       1.440391      10.61632       1.903400      10.71103       2.203415      124.0873 11.64761  123.9158 13.56574  0.1714478      17.88004  
1 1 1 18 16 4  o 68.84223 22.96738  3.432316       2.470665      1.301675       4.002488      4.743951       3.140376      64.05281 27.12542  79.10162 25.87339  -15.04881      37.48627  
1 1 1 18 16 5  o 154.3649 15.78135  16.85140       3.200501      18.90246       4.830929      15.24698       4.272689      158.2724 23.62870  142.0782 23.38098  16.19423       33.24133  
1 1 1 18 16 6  f 135.7227 17.40316  13.26341       3.075079      17.78990       5.313782      10.98425       3.770599      149.8276 27.63356  119.0770 24.57855  30.75055       36.98268  
1 1 1 18 16 7  o 55.80961 19.01537  2.157787       1.693460      4.457236       5.364589      1.903286       1.784716      80.74537 32.50232  54.02822 19.43680  26.71715       37.87070  
1 1 1 18 16 8  o 115.8491 17.78329  9.820864       2.657656      5.414873       4.815804      11.75033       3.186884      83.14201 31.55459  125.7273 19.66629  -42.58526      37.18138  
1 1 1 18 16 9  o 66.52687 20.85638  3.347551       2.056659      0.000000       0.000000      3.347551       2.056659      ?        ?         66.52687 20.85638  0.000000       20.85638  
1 1 1 18 16 10 o 126.5869 11.54017  11.17983       1.925209      11.26748       2.341866      10.99710       3.381315      125.6490 14.23780  118.8554 22.16492  6.793541       26.34385  
1 1 1 18 16 11 f 157.8474 8.369569  17.02667       1.754119      18.08070       1.889023      10.42783       4.726564      162.4813 8.757258  106.4750 31.26586  56.00626       32.46912  
1 1 1 18 16 12 o 112.2609 24.61007  10.47663       3.579681      12.05694       8.125481      10.09605       3.987489      99.90077 40.07438  107.0705 27.72999  -7.169762      48.73304  
1 1 1 18 16 13 o 66.64525 12.04759  3.210877       1.030530      3.444297       1.043012      -6.366352      6.680994      69.21279 11.72744  55.28680 27.06049  13.92599       29.49242  
1 1 1 18 16 14 o 24.98139 12.20256  -2.247962      1.338373      -2.502890      1.355560      7.614558       8.431487      24.46812 12.01957  82.28555 36.94939  -57.81742      38.85521  
1 1 1 18 16 15 o 34.27698 13.47327  0.5848660      0.9008095     0.4645053      0.9168093     3.943256       4.842865      33.28022 13.42229  69.17166 29.58303  -35.89145      32.48559  
1 1 1 18 16 16 o 95.83646 9.218618  6.435231       1.162748      7.189495       1.202014      -4.547024      4.586632      101.4607 8.983488  46.47630 22.67760  54.98436       24.39215  
1 1 1 18 16 17 o 101.9493 6.705973  7.124741       0.9059437     6.905430       0.9182170     15.16443       5.559479      100.2731 6.914402  114.1003 34.01322  -13.82722      34.70890  
1 1 1 18 16 18 o 86.16758 4.994932  5.037701       0.5710595     4.852059       0.9164548     5.155532       0.7301358     83.21967 8.378317  86.69173 6.364882  -3.472054      10.52178  
1 1 1 18 16 19 o 80.82961 5.293558  4.451488       0.5670159     2.969590       0.6557652     8.841793       1.128721      65.09512 7.709571  112.8665 7.548348  -47.77135      10.78958  
1 1 1 18 16 20 o 72.06374 8.254501  3.665534       0.7783614     4.546478       1.098806      2.778267       1.102743      78.93209 10.72418  59.53274 14.11654  19.39935       17.72808  
1 1 1 18 17 0  o 12.79542 9.032214  -0.7351534     0.6185331     -0.7351534     0.6185331     -0.7351534     0.6185331     12.79542 9.032214  12.79542 9.032214  0.000000       0.000000  
1 1 1 18 17 1  o 75.59593 2.588086  3.818027       0.2603213     3.771137       0.2611851     10.87234       3.203564      75.12773 2.612981  120.5329 20.69088  -45.40519      20.85522  
1 1 1 18 17 2  o 126.3599 3.036917  10.66178       0.5113472     10.63924       0.5191174     11.39784       2.966538      126.2217 3.086442  124.7939 18.39018  1.427826       18.64738  
1 1 1 18 17 3  o 38.01763 13.32871  0.9100266      0.8344083     0.5878114      0.8769663     3.990213       2.711430      34.74443 13.39565  72.48524 24.05712  -37.74082      27.53522  
1 1 1 18 17 4  o 24.97708 11.59191  -0.7448663     0.9239162     -1.734850      1.067128      2.218828       1.846372      22.96001 11.14276  56.73478 19.83167  -33.77477      22.74766  
1 1 1 18 17 5  o 111.7992 20.16833  9.419186       2.894046      10.20226       3.842772      8.393022       4.398983      112.2258 26.17876  98.68751 30.43320  13.53827       40.14359  
1 1 1 18 17 6  o 92.04385 27.36604  7.073322       3.602562      5.113812       5.912103      8.230636       4.543534      82.37881 33.76294  96.75391 31.08047  -14.37509      45.89043  
1 1 1 18 17 7  o 123.5430 11.03010  10.60873       1.796734      14.26558       4.044106      9.709394       2.005540      134.7576 23.36805  117.1821 13.06591  17.57554       26.77282  
1 1 1 18 17 8  o 87.61916 12.78610  5.472860       1.448858      4.492735       4.105648      5.612282       1.548482      75.51456 29.01816  88.39277 13.58042  -12.87821      32.03875  
1 1 1 18 17 9  o 160.5314 12.25846  18.14128       2.602389      -8.251067      13.56562      19.14967       2.651638      74.14539 36.72008  165.0354 12.14269  -90.89001      38.67569  
1 1 1 18 17 10 o 61.26895 14.14456  2.780214       1.131420      3.022748       1.196162      0.7199289      3.486322      63.83478 14.40562  55.59063 24.42236  8.244148       28.35442  
1 1 1 18 17 11 o 99.61737 9.580548  6.911002       1.256078      6.808509       1.338385      7.668261       3.637946      98.51951 10.34930  91.86835 27.54473  6.651161       29.42482  
1 1 1 18 17 12 o 111.9139 31.01462  12.33280       4.784946      16.73655       8.117751      9.988111       5.923353      109.9440 41.13237  93.49004 35.10272  16.45395       54.07469  
1 1 1 18 17 13 f 72.23021 7.574315  3.604510       0.7181834     3.770352       0.7453263     1.451179       2.685688      73.85102 7.686172  53.12398 22.34355  20.72704       23.62861  
1 1 1 18 17 14 f 78.60714 9.773240  4.366822       1.001660      4.517134       1.031596      1.889198       4.188240      79.90758 9.899891  60.24939 26.60672  19.65819       28.38882  
1 1 1 18 17 15 o 25.18741 9.860587  0.2908889      0.4808431     0.8987065      1.577785      0.2286562      0.5048594     42.69273 17.46332  24.76280 9.969744  17.92994       20.10879  
1 1 1 18 17 16 o 92.62152 6.370048  5.873833       0.7814035     4.292982       1.131238      7.316430       1.080640      76.82652 11.39502  102.6721 7.960842  -25.84562      13.90041  
1 1 1 18 17 17 o 37.64527 14.00634  0.9201065      0.9387105     1.064113       0.9603639     -2.165764      4.445635      39.36717 14.24534  48.51292 23.34594  -9.145744      27.34891  
1 1 1 18 17 18 o 49.09775 10.35071  1.775276       0.6558105     1.035652       0.7558951     4.026690       1.318816      37.85969 12.70505  72.13921 14.22527  -34.27952      19.07293  
1 1 1 18 17 19 o 49.48871 13.70772  1.910094       0.9349703     3.210801       1.222743      0.7891089E-01  1.450812      63.75264 14.69473  35.45457 15.65824  28.29807       21.47360  
1 1 1 18 18 0  o 52.09200 27.29786  2.971262       2.494837      2.971262       2.494837      2.971262       2.494837      52.09200 27.29786  52.09200 27.29786  0.000000       0.000000  
1 1 1 18 18 1  o 112.1332 8.119188  8.586414       1.204950      10.25299       1.339166      1.500042       2.761427      122.5352 8.249705  56.09073 23.04119  66.44443       24.47354  
1 1 1 18 18 2  o 248.3214 2.722231  41.17747       0.9007675     41.13768       0.9081957     43.57994       7.057259      248.1965 2.746062  237.2363 22.59710  10.96013       22.76334  
1 1 1 18 18 3  f 149.2199 2.689607  14.86897       0.5347971     14.86897       0.5347971     0.000000       0.000000      149.2199 2.689607  ?        ?         0.000000       2.689607  
1 1 1 18 18 4  f 234.3686 9.452671  37.71093       2.946018      36.86660       3.086457      46.36068       9.878825      231.2908 10.03838  225.0351 34.00400  6.255676       35.45478  
1 1 1 18 18 5  o 118.5077 10.28944  9.755222       1.608757      10.52485       1.669417      -0.2613758     6.022624      123.1336 10.26792  64.96026 29.95294  58.17329       31.66400  
1 1 1 18 18 6  o 93.33157 25.99676  7.462543       3.352552      5.098847       4.087122      12.32388       5.861376      77.37610 29.13582  109.5887 35.31044  -32.21255      45.77907  
1 1 1 18 18 7  o 58.53492 15.80681  2.581288       1.261600      7.035916       4.381602      2.178595       1.317390      86.65398 30.53014  54.00795 16.65429  32.64604       34.77721  
1 1 1 18 18 8  o 59.65009 20.67245  2.715880       2.004011      3.384726       5.439734      2.610849       2.155623      71.04640 30.87239  59.12656 21.34950  11.91985       37.53539  
1 1 1 18 18 9  o 75.08994 18.25105  4.421618       1.808095      3.325057       3.940492      4.714065       2.034965      66.91960 27.51053  76.66045 19.78714  -9.740845      33.88746  
1 1 1 18 18 10 o 36.25034 13.06862  0.8343355      0.8073242     0.3793232      0.9311202     2.212342       1.620391      32.76273 13.41010  54.17256 18.59681  -21.40983      22.92754  
1 1 1 18 18 11 o 82.07119 3.238048  4.516594       0.3534226     2.682040       1.030881      4.760941       0.3762235     60.03093 13.24318  84.24519 3.358136  -24.21426      13.66232  
1 1 1 18 18 12 o 141.1797 7.048186  13.63482       1.321745      4.667839       7.287350      13.93984       1.344037      73.04446 33.40892  142.7323 7.088863  -69.68785      34.15271  
1 1 1 18 18 13 o 89.75690 8.296430  5.601478       0.9810510     9.349580       1.631932      3.480401       1.227650      114.6084 10.81376  67.89999 14.03267  46.70837       17.71590  
1 1 1 18 18 14 o 130.7708 2.462857  11.43217       0.4291641     11.33541       0.4362650     14.33224       2.388361      130.2069 2.514450  139.8389 12.96498  -9.632034      13.20656  
1 1 1 18 18 15 o 61.79131 12.09452  2.840849       0.9601742     2.555865       1.340384      3.141224       1.376103      56.41827 16.67195  62.66267 16.32096  -6.244400      23.33083  
1 1 1 18 18 16 o 51.16505 11.21051  1.946399       0.7431451     1.991721       0.7614642     1.038308       3.408468      51.70550 11.36268  51.99372 23.40770  -0.2882156     26.01982  
1 1 1 18 18 17 o 55.60823 14.35157  2.430291       1.070594      2.586194       1.092981      -1.258910      5.316817      57.39657 14.33441  52.45806 25.31624  4.938511       29.09274  
1 1 1 18 19 0  o 147.4784 13.47733  15.33224       2.595025      15.33224       2.595025      15.33224       2.595025      147.4784 13.47733  147.4784 13.47733  0.000000       0.000000  
1 1 1 18 19 1  o 180.6730 14.43981  23.59381       3.447476      23.28356       4.336802      24.12646       5.682389      174.7444 18.92663  169.0686 26.05902  5.675858       32.20699  
1 1 1 18 19 2  o 107.0952 8.043693  7.873067       1.139499      8.509112       1.191323      1.035951       3.905906      111.3421 8.084726  58.53166 25.77743  52.81046       27.01552  
1 1 1 18 19 3  o 38.70214 14.80667  0.8368385      1.065763      0.8446382      1.080966      0.5653914      6.377020      38.91365 14.90584  66.17092 30.62098  -27.25727      34.05625  
1 1 1 18 19 4  o 140.9808 2.027385  13.26427       0.3808639     13.23554       0.3815824     20.87067       6.208950      140.8273 2.033424  147.3239 32.50142  -6.496521      32.56497  
1 1 1 18 19 5  o 37.70800 11.42335  1.012085       0.6233686     0.5150478      0.6718816     4.085826       1.670828      31.01250 11.78245  72.56872 17.48623  -41.55621      21.08540  
1 1 1 18 19 6  o 30.62110 12.48094  0.3273014      0.8024107     0.3315989      0.8465649     0.2892975      2.517468      31.26317 12.79040  47.10083 20.72080  -15.83765      24.35048  
1 1 1 18 19 7  o 58.65119 2.901724  2.306058       0.2260767     3.934939       4.518607      2.301970       0.2263602     69.70204 29.12643  58.59827 2.908042  11.10377       29.27125  
1 1 1 18 19 8  o 26.98793 9.633318  0.4445116      0.4374795     7.932542       4.758229      0.3806736      0.4393404     86.69360 31.65881  25.96564 9.596686  60.72797       33.08136  
1 1 1 18 19 9  o 100.3053 13.45666  7.375623       1.753266      7.442527       1.875214      6.910840       4.942543      100.0731 14.48303  80.77950 31.61686  19.29359       34.77620  
1 1 1 18 19 10 o 94.47008 8.322529  6.193920       1.036966      8.049263       1.371458      3.717438       1.584484      107.0388 9.721337  68.48817 17.34608  38.55058       19.88444  
1 1 1 18 19 11 o 59.73664 20.38736  2.921484       1.946786      -4.694878      10.17068      3.211148       1.983460      63.17591 31.37517  62.13622 20.57416  1.039688       37.51929  
1 1 1 18 19 12 o 49.54282 20.92682  1.272033       2.372149      8.349500       9.921180      0.8428916      2.443008      76.48590 36.26915  47.79826 20.73024  28.68764       41.77552  
1 1 1 18 19 13 o 75.84103 12.50954  4.267190       1.220171      5.119201       1.294726      -2.498165      3.648386      83.53236 11.97383  44.16150 21.22550  39.37086       24.36995  
1 1 1 18 19 14 o 63.83268 6.794671  2.822429       0.5690716     2.812718       0.5698414     6.409591       10.95202      63.71349 6.817823  70.15147 34.40046  -6.437988      35.06956  
1 1 1 18 19 15 o 105.3182 9.001308  7.833685       1.251132      8.151147       1.259056      -17.14863      11.16903      107.5332 8.865443  53.06351 27.08660  54.46974       28.50053  
1 1 1 18 20 0  o 125.6756 42.14259  16.90214       6.296862      16.90214       6.296862      16.90214       6.296862      125.6756 42.14259  125.6756 42.14259  0.000000       0.000000  
1 1 1 18 20 1  o 116.9657 11.00868  9.683649       1.695626      8.139240       2.042205      13.11134       3.042418      104.5367 15.09766  130.3822 17.99063  -25.84552      23.48621  
1 1 1 18 20 2  o 124.6279 4.975552  10.48103       0.8246247     7.140658       2.764301      10.80732       0.8639623     91.78350 22.72383  126.5038 5.135959  -34.72031      23.29701  
1 1 1 18 20 3  o 93.92328 5.979228  5.996936       0.7444424     6.453242       0.8883830     4.920978       1.364174      97.12666 6.909287  82.09997 12.89411  15.02669       14.62861  
1 1 1 18 20 4  o 181.5736 9.463412  22.93774       2.281774      22.11289       2.980407      24.10591       3.546831      175.1812 12.85731  180.6988 14.86154  -5.517563      19.65136  
1 1 1 18 20 5  o 80.59163 18.44920  5.173272       1.938396      1.891174       3.518069      6.604004       2.322778      58.41393 25.10241  90.24096 19.85652  -31.82703      32.00644  
1 1 1 18 20 6  o 86.70164 5.998516  5.119365       0.6887458     5.134717       0.7411687     5.022217       1.864491      86.68211 6.463255  79.54597 18.01047  7.136139       19.13506  
1 1 1 18 20 7  o 58.48932 11.42625  2.497791       0.8585905     2.886789       0.9267393     0.1408860      2.281156      62.96744 11.46741  44.02481 19.52914  18.94263       22.64705  
1 1 1 18 20 8  o 44.12770 19.26309  0.4209399      2.138425      1.738935       3.404557      -0.4378358     2.748170      56.56498 24.50249  44.90325 20.52964  11.66174       31.96621  
1 1 1 18 20 9  f 19.91141 9.767537  -1.634036      0.8854108     -1.975513      0.9159386     3.234068       3.458320      19.29172 9.551865  62.70656 25.77487  -43.41484      27.48785  
1 1 1 18 20 10 o 97.61090 9.387801  6.721431       1.206016      6.903257       1.213100      -8.712315      11.17645      98.97849 9.306979  60.07471 30.26802  38.90378       31.66659  
1 1 1 18 20 11 o 77.71761 32.76656  7.946579       5.798064      3.783594       7.207249      15.58286       9.761311      66.76380 31.43269  86.03829 39.08629  -19.27449      50.15727  
1 1 1 18 20 12 o 73.00216 7.084431  3.694125       0.6804963     3.799558       0.7123067     2.592165       2.302838      73.94796 7.324970  56.14907 21.69151  17.79889       22.89490  
1 1 1 18 20 13 o 38.97219 14.50861  1.013270       1.007527      0.8656811      1.019707      7.080846       6.538161      37.55475 14.45375  71.90299 32.39097  -34.34824      35.46951  
1 1 1 18 21 0  f 87.15733 39.62695  9.744466       4.980034      9.744466       4.980034      9.744466       4.980034      87.15733 39.62695  87.15733 39.62695  0.000000       0.000000  
1 1 1 18 21 1  o 53.40265 22.81302  1.471117       2.874022      4.570813       5.457409      0.2815467      3.380819      70.53545 30.78236  51.19745 23.15637  19.33800       38.51974  
1 1 1 18 21 2  o 131.2389 20.90356  14.19696       3.533069      11.39563       7.053144      15.13533       4.082147      89.87277 36.86070  131.4768 24.19171  -41.60400      44.09025  
1 1 1 18 21 3  o 57.14811 22.92844  2.392102       2.660374      -2.108042      7.619593      3.016853       2.839043      60.77717 29.55989  61.06718 23.94435  -0.2900124     38.04102  
1 1 1 18 21 4  o 65.44601 6.754418  2.952075       0.5805876     2.938706       0.5808653     16.92526       18.77895      65.28966 6.775006  81.02279 40.60402  -15.73313      41.16536  
1 1 1 18 21 5  o 74.06049 5.917662  3.747081       0.5791419     3.552912       0.6090712     5.578374       1.870500      71.94641 6.420490  83.81973 17.32015  -11.87332      18.47188  
1 1 1 18 21 6  o 49.54079 13.03017  1.856156       0.8715170     2.366462       0.9211894     -2.496538      2.690375      56.16710 12.61710  37.92793 18.22880  18.23918       22.16935  
1 1 1 18 21 7  o 28.95654 12.53649  0.3871693E-01  0.8902709     0.1807948      0.9189901     -2.128480      3.589192      30.49723 12.95979  44.77322 21.39451  -14.27600      25.01362  
1 1 1 18 21 8  o 46.26654 9.891802  1.560405       0.5913625     1.326937       0.6082371     5.593751       2.528088      42.38001 10.75454  78.19184 22.84021  -35.81183      25.24549  
1 1 1 18 21 9  o 93.48782 8.369675  6.118766       1.031627      6.812855       1.088683      0.1267223E-01  3.229057      98.68874 8.357162  48.11640 22.09354  50.57234       23.62132  
1 1 1 18 21 10 o 63.94733 8.794252  2.903799       0.7295432     2.802072       0.7348037     9.932434       6.107844      62.68444 9.059553  81.90257 34.01486  -19.21814      35.20066  
1 1 1 18 22 0  o 64.49937 36.66115  6.275996       4.897176      6.275996       4.897176      6.275996       4.897176      64.49937 36.66115  64.49937 36.66115  0.000000       0.000000  
1 1 1 18 22 1  o 83.90244 27.03105  7.200278       3.435006      13.12702       6.551711      4.953540       4.033880      93.51228 36.45917  69.42826 28.09956  24.08401       46.03104  
1 1 1 18 22 2  o 60.01004 24.09159  3.036745       2.939051      16.01864       7.934348      0.9721932      3.164135      95.01491 39.04637  51.40075 22.88888  43.61416       45.26058  
1 1 1 18 22 3  o 40.03321 19.09179  -1.973492      2.828618      -2.417069      4.096626      -1.569325      3.910408      46.61440 22.42682  47.51106 22.59861  -0.8966637     31.83802  
1 1 1 18 22 4  o 55.22465 16.92618  2.458380       1.363306      4.308408       2.807364      1.887461       1.559541      67.39881 24.36039  49.73226 18.13031  17.66655       30.36671  
1 1 1 18 22 5  o 57.45932 19.50772  2.767545       1.782088      3.252976       2.447630      2.219901       2.599749      60.74556 22.61379  54.67228 22.39613  6.073288       31.82719  
1 1 1 18 22 6  o 105.4491 8.957521  7.830164       1.246747      8.854432       1.336915      0.9960160      3.453337      112.1286 9.023896  52.23085 23.53376  59.89772       25.20453  
1 1 1 18 22 7  o 29.95672 11.87685  0.4299766      0.7054484     0.7634170      0.7616533     -1.582426      1.871137      34.46362 12.65325  32.85733 15.62964  1.606285       20.10946  
1 1 1 19 0  1  o 183.7102 22.12726  23.73493       5.208474      23.73493       5.208474      23.73493       5.208474      183.7102 22.12726  183.7102 22.12726  0.000000       0.000000  
1 1 1 19 0  2  o 278.7851 13.21323  52.38702       4.883310      52.38702       4.883310      52.38702       4.883310      278.7851 13.21323  278.7851 13.21323  0.000000       0.000000  
1 1 1 19 0  3  o 94.80412 23.45143  7.052840       2.564298      7.052840       2.564298      7.052840       2.564298      94.80412 23.45143  94.80412 23.45143  0.000000       0.000000  
1 1 1 19 0  4  f 103.2259 24.15297  8.255609       2.887489      8.255609       2.887489      8.255609       2.887489      103.2259 24.15297  103.2259 24.15297  0.000000       0.000000  
1 1 1 19 0  5  o 45.60471 24.60123  2.013374       2.076656      2.013374       2.076656      2.013374       2.076656      45.60471 24.60123  45.60471 24.60123  0.000000       0.000000  
1 1 1 19 0  6  o 37.24147 24.17961  -0.1110203     2.865014      -0.1110203     2.865014      -0.1110203     2.865014      37.24147 24.17961  37.24147 24.17961  0.000000       0.000000  
1 1 1 19 0  7  o 193.0008 25.46046  26.58622       6.231153      26.58622       6.231153      26.58622       6.231153      193.0008 25.46046  193.0008 25.46046  0.000000       0.000000  
1 1 1 19 0  8  o 154.1604 23.65057  17.19331       4.518981      17.19331       4.518981      17.19331       4.518981      154.1604 23.65057  154.1604 23.65057  0.000000       0.000000  
1 1 1 19 0  9  o 46.77617 30.64328  -0.4034098     4.751234      -0.4034098     4.751234      -0.4034098     4.751234      46.77617 30.64328  46.77617 30.64328  0.000000       0.000000  
1 1 1 19 0  10 o 353.1377 17.70753  84.79282       8.284473      84.79282       8.284473      84.79282       8.284473      353.1377 17.70753  353.1377 17.70753  0.000000       0.000000  
1 1 1 19 0  11 o 102.0997 8.528122  7.111585       1.140950      7.111585       1.140950      7.111585       1.140950      102.0997 8.528122  102.0997 8.528122  0.000000       0.000000  
1 1 1 19 0  12 o 194.4954 5.557070  25.30253       1.437561      25.30253       1.437561      25.30253       1.437561      194.4954 5.557070  194.4954 5.557070  0.000000       0.000000  
1 1 1 19 0  13 f 187.8529 2.597018  23.53311       0.6497995     23.53311       0.6497995     23.53311       0.6497995     187.8529 2.597018  187.8529 2.597018  0.000000       0.000000  
1 1 1 19 0  14 o 31.10796 18.31806  0.7650649      1.291408      0.7650649      1.291408      0.7650649      1.291408      31.10796 18.31806  31.10796 18.31806  0.000000       0.000000  
1 1 1 19 0  15 o 238.9544 12.21063  38.69234       3.864711      38.69234       3.864711      38.69234       3.864711      238.9544 12.21063  238.9544 12.21063  0.000000       0.000000  
1 1 1 19 0  16 o 156.3636 26.13050  18.26037       4.987888      18.26037       4.987888      18.26037       4.987888      156.3636 26.13050  156.3636 26.13050  0.000000       0.000000  
1 1 1 19 0  17 o 147.6322 12.04148  14.97807       2.331387      14.97807       2.331387      14.97807       2.331387      147.6322 12.04148  147.6322 12.04148  0.000000       0.000000  
1 1 1 19 0  18 o 95.68655 22.24942  7.224326       2.467101      7.224326       2.467101      7.224326       2.467101      95.68655 22.24942  95.68655 22.24942  0.000000       0.000000  
1 1 1 19 0  19 o 27.76743 18.75001  -0.7914139     2.022213      -0.7914139     2.022213      -0.7914139     2.022213      27.76743 18.75001  27.76743 18.75001  0.000000       0.000000  
1 1 1 19 0  20 o 44.41091 30.86225  -3.647078      6.441148      -3.647078      6.441148      -3.647078      6.441148      44.41091 30.86225  44.41091 30.86225  0.000000       0.000000  
1 1 1 19 0  21 o 67.30271 23.24773  4.151597       1.878276      4.151597       1.878276      4.151597       1.878276      67.30271 23.24773  67.30271 23.24773  0.000000       0.000000  
1 1 1 19 0  22 o 111.3786 13.87754  8.938604       1.973416      8.938604       1.973416      8.938604       1.973416      111.3786 13.87754  111.3786 13.87754  0.000000       0.000000  
1 1 1 19 0  23 o 15.42355 11.34243  -4.406009      1.612320      -4.406009      1.612320      -4.406009      1.612320      15.42355 11.34243  15.42355 11.34243  0.000000       0.000000  
1 1 1 19 0  24 o 29.63091 21.42797  -6.629648      4.431398      -6.629648      4.431398      -6.629648      4.431398      29.63091 21.42797  29.63091 21.42797  0.000000       0.000000  
1 1 1 19 0  25 o 61.40228 19.97592  3.433452       1.446168      3.433452       1.446168      3.433452       1.446168      61.40228 19.97592  61.40228 19.97592  0.000000       0.000000  
1 1 1 19 0  26 o 17.32734 12.44850  -2.110761      1.385566      -2.110761      1.385566      -2.110761      1.385566      17.32734 12.44850  17.32734 12.44850  0.000000       0.000000  
1 1 1 19 0  27 o 65.56060 10.22594  3.163580       0.8285773     3.163580       0.8285773     3.163580       0.8285773     65.56060 10.22594  65.56060 10.22594  0.000000       0.000000  
1 1 1 19 1  0  o 230.4367 13.39029  35.91339       4.079593      35.91339       4.079593      35.91339       4.079593      230.4367 13.39029  230.4367 13.39029  0.000000       0.000000  
1 1 1 19 1  1  o 143.0793 13.60989  13.90343       2.563594      10.48698       2.938135      24.79963       5.247125      122.9813 18.50179  189.4499 21.14527  -66.46866      28.09695  
1 1 1 19 1  2  o 206.7828 11.59969  28.79780       3.183390      25.36545       4.390798      32.60128       4.622089      192.7334 17.27991  219.0506 15.94425  -26.31720      23.51200  
1 1 1 19 1  3  o 236.2468 9.693857  37.45411       3.045177      38.38982       3.250684      30.74783       8.702554      239.0883 10.22698  206.3344 32.74445  32.75388       34.30437  
1 1 1 19 1  4  o 85.70844 12.56201  5.042786       1.392110      4.505138       2.545953      5.272093       1.662683      79.92986 22.79261  87.20923 14.83877  -7.279373      27.19728  
1 1 1 19 1  5  o 297.5517 7.792658  59.25440       3.087078      59.53209       3.303269      57.33888       8.675809      298.1547 8.322500  287.8715 22.80330  10.28320       24.27457  
1 1 1 19 1  6  o 144.0376 11.19575  14.01875       2.131969      13.01973       2.498888      16.69117       4.087073      138.2778 13.74364  154.9887 20.27536  -16.71092      24.49445  
1 1 1 19 1  7  o 109.4254 17.97719  8.354651       2.530333      8.711086       4.435063      8.182640       3.080973      109.1768 29.70257  107.1429 22.30610  2.033829       37.14573  
1 1 1 19 1  8  o 333.9095 12.76318  75.28590       5.668408      81.56828       14.03386      74.06116       6.196342      336.4734 31.67318  330.6971 14.09381  5.776398       34.66736  
1 1 1 19 1  9  o 145.5648 10.40302  14.30828       2.004551      6.809065       5.186498      15.62522       2.173445      98.62725 33.28092  152.0727 10.79585  -53.44547      34.98814  
1 1 1 19 1  10 o 156.0156 7.012042  16.31700       1.454035      13.31044       2.409881      18.03809       1.823318      139.7520 13.09336  163.8462 8.379100  -24.09421      15.54494  
1 1 1 19 1  11 o 180.6467 5.010041  21.80815       1.204828      23.91262       2.414156      21.11013       1.390353      188.4174 9.647596  177.6276 5.882211  10.78981       11.29940  
1 1 1 19 1  12 o 317.0221 7.595771  67.33389       3.208743      75.26877       6.080637      64.27154       3.777516      332.8272 13.74016  309.2030 9.178468  23.62427       16.52381  
1 1 1 19 1  13 f 147.3910 1.763831  14.47857       0.3464188     11.17340       0.8241265     15.18790       0.3817861     129.2581 4.793087  150.9544 1.898020  -21.69632      5.155208  
1 1 1 19 1  14 o 281.6100 4.932635  52.98296       1.850975      54.79752       1.988485      41.20774       5.065480      286.3459 5.211442  244.8819 15.60471  41.46402       16.45194  
1 1 1 19 1  15 o 221.1707 7.107389  32.83229       2.091930      27.78112       3.327129      36.13467       2.690211      201.8779 12.42848  231.6111 8.732367  -29.73317      15.18951  
1 1 1 19 1  16 o 100.8956 24.36757  7.622712       3.238884      11.47356       5.436731      5.504110       4.032593      119.9281 32.99150  86.67003 29.34576  33.25811       44.15442  
1 1 1 19 1  17 o 168.6450 13.46157  19.63325       3.000027      2.894155       11.26268      20.91163       3.112477      96.08096 42.95724  174.0505 13.52626  -77.96953      45.03648  
1 1 1 19 1  18 o 72.61761 15.03193  3.789640       1.406604      5.373085       1.845398      1.594136       2.172980      86.22556 16.66435  54.47378 21.06385  31.75177       26.85864  
1 1 1 19 1  19 o 90.90883 18.71731  6.128455       2.191795      5.633634       3.211988      6.559643       2.998359      84.43391 25.99932  91.50124 24.21716  -7.067329      35.53077  
1 1 1 19 1  20 o 97.57364 15.15466  6.874394       1.906487      7.230959       2.017189      3.890675       5.835207      99.86057 15.67497  78.02423 32.88224  21.83634       36.42728  
1 1 1 19 1  21 o 133.2287 12.09446  12.49333       2.123755      9.574629       2.529360      19.46843       3.910131      113.4134 17.28222  161.1753 18.54372  -47.76186      25.34846  
1 1 1 19 1  22 o 135.2408 8.515863  12.59077       1.526861      11.00414       1.867296      15.79194       2.652342      124.8487 11.34807  147.9956 13.60154  -23.14684      17.71385  
1 1 1 19 1  23 o 28.49135 12.05051  0.1357227      0.7882829     0.5365976      1.174130      -0.1932557     1.063642      36.72330 15.04808  30.03413 13.32846  6.689163       20.10206  
1 1 1 19 1  24 o 95.70047 26.77772  8.836358       3.548354      7.801640       4.794109      10.08993       5.276810      82.59021 31.45079  91.13011 33.32987  -8.539902      45.82611  
1 1 1 19 1  25 o 28.58637 11.99220  0.2035324      0.7705512     -0.1253358     1.085096      0.5380713      1.094411      30.41232 13.48107  35.42909 14.52419  -5.016768      19.81644  
1 1 1 19 1  26 o 57.27417 10.88048  2.425480       0.8000336     3.330630       0.9496673     0.2126723      1.484852      67.29272 10.96826  36.57930 16.00796  30.71342       19.40509  
1 1 1 19 1  27 o 25.43488 12.01430  -0.9192868     1.068790      -0.7798515E-01 1.923567      -1.295012      1.285484      38.42181 17.41353  26.81051 12.80914  11.61130       21.61724  
1 1 1 19 2  0  o 264.5134 14.42550  47.30805       5.049749      47.30805       5.049749      47.30805       5.049749      264.5134 14.42550  264.5134 14.42550  0.000000       0.000000  
1 1 1 19 2  1  o 69.30792 19.04782  3.370820       1.813266      4.123501       2.076147      0.9504083      3.723037      76.40090 20.11922  64.21157 26.60230  12.18933       33.35364  
1 1 1 19 2  2  o 67.18430 15.91352  3.172546       1.402579      3.880462       1.473977      -3.608123      4.561799      74.47263 15.36331  55.53035 25.76691  18.94228       29.99941  
1 1 1 19 2  3  o 287.8743 10.26316  55.63297       3.930630      50.93850       7.883576      57.18603       4.534431      271.7838 21.95511  291.5441 11.69573  -19.76025      24.87603  
1 1 1 19 2  4  o 146.0428 11.18462  14.40199       2.160019      13.49069       2.567246      16.61065       3.996699      140.8068 13.86222  154.8620 19.82179  -14.05518      24.18810  
1 1 1 19 2  5  f 334.3369 12.25156  75.29047       5.448967      75.03061       8.237091      75.49268       7.265957      331.3772 18.73050  333.3621 16.40738  -1.984924      24.90048  
1 1 1 19 2  6  o 149.7682 11.35805  15.15814       2.249816      17.76165       3.012023      11.87233       3.383762      161.6037 14.12926  130.3323 20.13176  31.27136       24.59520  
1 1 1 19 2  7  o 246.5273 12.38716  41.03195       4.056173      37.67246       6.608736      43.06231       5.137692      233.1046 21.51898  251.6802 15.39316  -18.57564      26.45781  
1 1 1 19 2  8  o 203.3911 13.72642  28.07295       3.698381      36.41910       7.492731      25.38452       4.252521      227.2737 25.16197  192.4952 16.74526  34.77855       30.22463  
1 1 1 19 2  9  o 174.9589 10.02417  20.62458       2.327214      28.14604       7.300941      19.77393       2.455289      197.5522 28.56283  171.1419 10.82187  26.41023       30.54420  
1 1 1 19 2  10 o 223.6986 9.296290  33.64392       2.765024      27.91500       6.896993      34.74102       3.018188      197.1723 26.95569  227.1641 9.995342  -29.99181      28.74920  
1 1 1 19 2  11 o 81.57789 5.323251  4.464190       0.5754986     6.008296       1.281357      4.074006       0.6441197     93.94083 10.41083  77.80798 6.265469  16.13285       12.15078  
1 1 1 19 2  12 o 202.7767 9.052671  27.66825       2.439900      30.03320       2.557878      3.790844       8.127607      211.2689 9.107348  94.74421 39.28336  116.5247       40.32525  
1 1 1 19 2  13 o 404.4023 9.994979  110.1063       5.386033      111.4166       5.745872      100.6170       15.46273      406.3960 10.61953  368.5611 31.79554  37.83490       33.52209  
1 1 1 19 2  14 o 185.6088 3.413684  22.98388       0.8442972     22.59240       0.9112282     25.35890       2.244426      183.9984 3.716546  194.0593 8.701686  -10.06090      9.462138  
1 1 1 19 2  15 o 270.3049 5.040224  48.83910       1.815421      48.63040       1.857465      53.29327       8.581074      269.7041 5.168440  272.1865 23.90174  -2.482361      24.45416  
1 1 1 19 2  16 o 140.8351 16.04322  13.86691       2.957139      13.16658       6.588135      14.04361       3.309231      126.1408 36.87794  140.8906 18.04011  -14.74976      41.05396  
1 1 1 19 2  17 o 31.39093 13.71162  -0.1719166     1.084934      -0.2316792     1.281724      -0.2087409E-01 2.037648      33.83834 14.83885  43.93239 18.99314  -10.09405      24.10251  
1 1 1 19 2  18 o 165.1283 10.97971  18.68169       2.402215      18.02166       2.640811      21.84711       5.783245      161.5816 12.35891  168.2687 26.68183  -6.687088      29.40515  
1 1 1 19 2  19 o 47.58605 19.52445  0.8180497      1.979801      1.382823       2.592247      0.2748411E-01  3.066962      55.38456 22.48544  52.32312 22.94912  3.061432       32.12877  
1 1 1 19 2  20 o 187.7278 8.920411  24.06250       2.225066      25.22773       2.439834      18.30430       5.423719      191.8797 9.572629  148.3493 28.47219  43.53041       30.03832  
1 1 1 19 2  21 o 122.5427 10.18714  10.42478       1.648434      10.47016       1.780564      10.15262       4.360579      122.3890 11.03641  106.0471 29.68897  16.34186       31.67392  
1 1 1 19 2  22 o 24.72368 11.86333  -1.457174      1.129024      -1.958021      1.178276      4.160776       3.946241      23.65704 11.53237  70.85028 28.09032  -47.19324      30.36547  
1 1 1 19 2  23 o 39.04536 14.48409  0.9596699      1.002441      1.279760       1.063224      -1.602174      3.007911      42.86588 15.04434  43.38187 20.38746  -0.5159912     25.33734  
1 1 1 19 2  24 o 32.49474 16.15100  -5.268589      2.716706      -9.687304      3.171627      6.905984       5.264546      30.15054 15.29659  77.44714 31.81404  -47.29659      35.30041  
1 1 1 19 2  25 o 77.44859 8.612951  4.221651       0.8738542     5.869635       1.095624      1.340421       1.448685      91.16704 9.142059  44.68990 17.22050  46.47714       19.49674  
1 1 1 19 2  26 o 85.72213 9.711524  5.271595       1.089793      8.296858       1.803131      3.530516       1.367902      104.8486 13.19772  66.19568 15.73948  38.65291       20.54047  
1 1 1 19 2  27 o 27.05366 13.04029  -1.623941      1.400427      -1.649216      1.449226      -1.267491      5.442443      27.55733 13.27866  51.14854 24.90069  -23.59121      28.21997  
1 1 1 19 3  0  o 207.2603 16.29908  29.36845       4.435595      29.36845       4.435595      29.36845       4.435595      207.2603 16.29908  207.2603 16.29908  0.000000       0.000000  
1 1 1 19 3  1  o 91.76627 21.35581  5.985170       2.562203      4.405165       4.789154      6.618759       3.032726      86.23096 31.71709  96.20267 23.79195  -9.971718      39.64885  
1 1 1 19 3  2  o 116.4017 15.01165  9.295266       2.274263      9.407704       2.921314      9.122276       3.623537      116.0003 19.59665  112.8776 24.77222  3.122719       31.58626  
1 1 1 19 3  3  o 138.8918 10.78410  13.02141       1.980249      11.77511       3.913807      13.45025       2.295798      128.8893 23.65978  140.8942 12.35318  -12.00499      26.69057  
1 1 1 19 3  4  o 87.24688 20.26846  5.404193       2.311249      7.401359       2.676619      -0.4498940     4.582570      102.3712 20.33866  64.82095 28.24930  37.55023       34.80925  
1 1 1 19 3  5  o 265.9377 12.56821  47.71511       4.441159      56.33267       6.339234      39.40841       6.223850      287.7086 16.60579  239.4091 19.68313  48.29945       25.75224  
1 1 1 19 3  6  o 380.1933 12.05872  97.36908       6.101401      97.64957       7.514413      96.82635       10.45273      379.6607 14.88223  375.0068 21.00176  4.653900       25.74014  
1 1 1 19 3  7  o 323.0113 10.09721  70.09908       4.340693      66.49226       5.793394      74.71526       6.554080      313.4104 13.90686  331.8955 14.85728  -18.48514      20.35041  
1 1 1 19 3  8  o 141.6564 9.840369  13.53248       1.845920      12.33119       4.911318      13.73010       1.991970      129.5829 29.15090  142.5627 10.56084  -12.97986      31.00494  
1 1 1 19 3  9  f 392.1484 11.53124  103.6661       6.019054      104.7985       10.79826      103.1557       7.249797      389.1625 20.89995  390.1211 13.96865  -0.9585876     25.13824  
1 1 1 19 3  10 o 90.43518 6.005002  5.490080       0.7195436     19.03274       7.802809      5.373929       0.7226228     156.7447 37.80005  89.45857 6.098470  67.28612       38.28884  
1 1 1 19 3  11 o 308.9500 12.50236  64.62477       5.136365      71.79128       5.887478      41.79084       10.50911      325.1785 13.61746  236.0733 34.42004  89.10527       37.01587  
1 1 1 19 3  12 o 264.5204 10.54912  47.20862       3.710879      46.22095       4.448139      49.46964       6.730167      260.9544 12.83140  267.0991 19.03423  -6.144745      22.95532  
1 1 1 19 3  13 o 97.93877 5.461668  6.431021       0.7099534     6.180830       1.031310      6.656382       0.9787985     95.63256 8.171218  99.38358 7.445145  -3.751015      11.05437  
1 1 1 19 3  14 o 187.0889 7.077133  23.49155       1.761145      20.77776       6.749633      23.68981       1.824342      164.9940 31.85359  187.8337 7.302769  -22.83966      32.67999  
1 1 1 19 3  15 o 281.2881 13.08222  54.01673       4.890071      57.28075       9.036411      52.66504       5.815111      281.6068 24.31934  276.1816 15.86798  5.425201       29.03830  
1 1 1 19 3  16 f 140.8682 9.879302  13.47878       1.842683      17.28350       4.551224      12.73281       2.015245      153.8125 22.90310  136.5293 11.17485  17.28316       25.48390  
1 1 1 19 3  17 o 41.20650 15.81684  0.8430620      1.218841      0.1256898      1.339051      4.308984       2.943297      36.90884 15.66246  76.53796 25.04919  -39.62912      29.54276  
1 1 1 19 3  18 f 77.35865 7.154500  4.062622       0.7291463     3.819530       0.7631180     6.612014       2.471297      74.86330 7.762299  94.16481 20.29414  -19.30151      21.72799  
1 1 1 19 3  19 o 101.3176 9.621794  7.053382       1.283445      6.987613       1.332760      7.893084       4.762156      100.6969 10.06741  95.98335 31.88287  4.713547       33.43457  
1 1 1 19 3  20 o 202.2675 9.611837  28.05781       2.583221      28.51311       2.718267      23.81422       8.298769      203.6370 10.04860  153.1474 40.17403  50.48956       41.41168  
1 1 1 19 3  21 o 69.16314 13.36736  3.483880       1.187371      3.365417       1.192279      17.78535       13.10019      67.82980 13.66409  105.0655 46.69220  -37.23566      48.65048  
1 1 1 19 3  22 o 95.11023 7.297928  6.197500       0.9178459     6.374773       0.9323112     0.6173933      5.230722      96.46475 7.307371  61.64769 28.23701  34.81706       29.16721  
1 1 1 19 3  23 o 31.60786 13.65220  0.6731130E-01  1.050850      0.2575444      1.113663      -1.477790      3.173870      33.80616 14.31199  44.77496 21.01057  -10.96880      25.42198  
1 1 1 19 3  24 o 49.66821 22.08061  0.6485769      2.932149      2.823375       4.098855      -1.630778      4.196228      61.90788 26.85069  49.47380 23.49710  12.43408       35.68016  
1 1 1 19 3  25 o 96.40139 8.691060  6.528353       1.104449      7.629905       1.620400      5.572600       1.509359      101.8753 12.17749  85.89952 13.64201  15.97580       18.28649  
1 1 1 19 3  26 o 73.47237 9.693121  3.888573       0.9258618     5.939445       1.129200      -0.3185574     1.617315      91.17702 9.430148  34.95889 15.89261  56.21813       18.47980  
1 1 1 19 3  27 o 34.32623 14.40219  0.4573992      1.111621      2.351907       2.021241      -0.3641019     1.330988      52.54587 20.31598  31.49713 14.35704  21.04874       24.87697  
1 1 1 19 4  0  o 204.2455 9.406703  28.04622       2.547729      28.04622       2.547729      28.04622       2.547729      204.2455 9.406703  204.2455 9.406703  0.000000       0.000000  
1 1 1 19 4  1  o 28.17010 13.62493  -2.510051      1.561109      -1.398762      2.107709      -3.860561      2.323517      39.19539 17.94224  33.94753 16.46740  5.247860       24.35363  
1 1 1 19 4  2  o 162.4109 4.035003  17.59223       0.8732377     23.25802       3.916889      17.29589       0.8957830     184.6702 16.07746  160.9771 4.179581  23.69307       16.61185  
1 1 1 19 4  3  o 282.2487 15.14602  54.01262       5.675584      50.42216       7.348941      59.31929       8.934291      270.7188 20.52489  292.5552 23.10556  -21.83640      30.90531  
1 1 1 19 4  4  o 38.93030 17.50342  -0.8718544     1.898770      2.890270       3.212473      -2.891866      2.353965      70.76706 25.98553  36.89692 17.54532  33.87014       31.35420  
1 1 1 19 4  5  o 201.2721 10.73337  27.28030       2.868269      25.01274       3.042901      45.35212       8.590316      192.4576 11.92387  254.0456 25.73046  -61.58800      28.35905  
1 1 1 19 4  6  o 110.6789 30.87134  8.995917       4.724153      21.63037       10.91038      6.080547       5.240931      164.4576 47.27530  95.41567 33.40787  69.04192       57.88817  
1 1 1 19 4  7  o 167.6518 12.89896  19.06981       2.859480      26.27742       4.198508      12.83397       3.905232      196.0241 16.21858  134.6031 22.57128  61.42093       27.79397  
1 1 1 19 4  8  o 177.0949 7.231709  21.01805       1.702966      18.82983       3.212144      21.87357       2.008464      166.0701 14.66601  180.4923 8.373696  -14.42218      16.88818  
1 1 1 19 4  9  o 338.2095 7.611423  76.58729       3.430245      65.19958       7.401364      79.70245       3.871096      308.0564 18.11040  344.8284 8.424759  -36.77197      19.97406  
1 1 1 19 4  10 o 398.6458 9.562360  106.7572       5.079557      102.7695       17.30007      107.1334       5.313768      371.1337 35.41070  399.0728 10.00044  -27.93912      36.79574  
1 1 1 19 4  11 o 158.3607 1.806806  16.71377       0.3812699     20.25179       7.327279      16.70416       0.3817871     162.6980 34.84750  158.3151 1.809778  4.382904       34.89446  
1 1 1 19 4  12 o 95.68302 6.755704  6.158410       0.8558113     4.486955       1.460401      7.032610       1.056162      80.11732 14.19933  102.1257 7.820576  -22.00836      16.21057  
1 1 1 19 4  13 f 367.2778 11.37988  91.25427       5.562648      92.57667       7.710381      89.81887       8.033083      367.3805 15.78705  361.2194 16.73476  6.161072       23.00616  
1 1 1 19 4  14 o 150.8633 5.864493  15.25065       1.176683      14.61461       1.261168      19.52640       3.269937      147.5938 6.427974  168.3771 14.72207  -20.78331      16.06419  
1 1 1 19 4  15 o 257.2497 15.27216  45.65709       5.211587      30.33430       9.949622      51.45066       6.118014      190.8553 40.38448  272.0630 16.96027  -81.20773      43.80133  
1 1 1 19 4  16 o 145.9339 9.264378  14.43778       1.792248      12.03878       4.439097      14.90499       1.959013      125.2661 27.36187  148.0813 9.986439  -22.81527      29.12733  
1 1 1 19 4  17 o 171.9254 9.734329  20.09876       2.220965      20.37923       2.579734      19.29550       4.365731      172.5325 11.28287  162.9562 20.56229  9.576309       23.45445  
1 1 1 19 4  18 o 159.3431 6.369974  17.09238       1.349796      16.61980       1.418074      21.64834       4.403058      157.0101 6.794023  172.4370 19.50443  -15.42690      20.65385  
1 1 1 19 4  19 o 212.6243 10.33145  31.02099       2.918405      31.22850       3.174397      29.88787       7.417955      212.7750 11.23594  189.5148 30.40194  23.26012       32.41179  
1 1 1 19 4  20 o 18.05031 9.026021  -2.413403      0.9046367     -2.539200      0.9088270     11.13452       9.431509      17.79082 8.918144  99.88360 41.93213  -82.09278      42.87000  
1 1 1 19 4  21 o 121.0709 7.430537  10.00192       1.192989      10.15381       1.203724      1.599983       8.952710      121.9860 7.440705  74.99664 35.22223  46.98937       35.99957  
1 1 1 19 4  22 o 158.9384 6.787124  17.20409       1.434125      17.14335       1.440904      23.61330       14.80219      158.6340 6.832578  100.4551 46.54411  58.17896       47.04294  
1 1 1 19 4  23 o 125.9978 6.270350  10.81479       1.049449      11.10072       1.090212      7.204256       3.874093      127.5829 6.433523  84.23589 28.75962  43.34697       29.47042  
1 1 1 19 4  24 f 40.63428 19.57092  -2.754372      3.139599      -1.637423      3.769553      -5.283946      5.672793      47.12080 22.34789  49.50050 24.36980  -2.379704      33.06531  
1 1 1 19 4  25 o 89.39055 7.412302  5.545168       0.8749823     6.086238       1.016641      3.999299       1.718412      93.23255 8.268936  69.03694 18.36213  24.19561       20.13811  
1 1 1 19 4  26 f 124.2306 10.63545  11.18776       1.743667      11.20277       2.641485      11.17617       2.321268      116.8454 17.50350  119.7766 14.86256  -2.931175      22.96232  
1 1 1 19 4  27 o 27.23914 12.83300  -0.9292580     1.204981      -1.744320      1.635583      0.3828510E-01  1.782019      29.33894 14.12942  37.76752 16.97067  -8.428589      22.08266  
1 1 1 19 5  0  o 28.51418 20.12954  -3.626890      3.074063      -3.626890      3.074063      -3.626890      3.074063      28.51418 20.12954  28.51418 20.12954  0.000000       0.000000  
1 1 1 19 5  1  o 274.2607 9.155643  50.44842       3.341309      49.31646       5.386825      51.15627       4.259783      269.6512 15.05164  275.6263 11.62437  -5.975067      19.01783  
1 1 1 19 5  2  o 347.8485 10.33383  81.26216       4.784572      77.53724       5.325860      96.84353       10.89266      339.3660 11.79529  374.7057 21.91136  -35.33969      24.88447  
1 1 1 19 5  3  o 385.8780 19.16549  101.9238       9.823864      116.7794       18.38346      95.98586       11.62256      401.3470 34.71528  371.9115 23.57380  29.43555       41.96278  
1 1 1 19 5  4  o 192.6983 12.94515  25.13984       3.304696      25.42445       4.914069      24.90485       4.465202      191.8951 19.48780  190.4561 17.80053  1.439041       26.39381  
1 1 1 19 5  5  o 175.4174 18.92615  21.25951       4.353989      19.99017       5.008548      25.18605       8.809027      168.6742 22.87264  182.7088 37.44157  -14.03464      43.87516  
1 1 1 19 5  6  o 302.0952 20.22568  62.94065       8.094894      56.09164       16.67944      65.05088       9.258338      264.6752 49.10015  305.6985 22.89456  -41.02332      54.17551  
1 1 1 19 5  7  o 263.1740 8.999557  46.49744       3.151360      47.70230       6.581544      46.13903       3.589599      263.2292 18.88935  261.8478 10.30796  1.381378       21.51887  
1 1 1 19 5  8  o 200.4585 7.408702  26.93256       1.975570      31.41381       3.750881      25.21218       2.324051      215.1973 13.14314  193.6590 9.030924  21.53833       15.94678  
1 1 1 19 5  9  o 198.1581 4.760560  26.21452       1.257023      22.42995       4.604063      26.51935       1.306668      179.5011 19.56496  199.2932 4.920386  -19.79204      20.17419  
1 1 1 19 5  10 o 152.5304 1.970574  15.50653       0.4005185     20.97339       9.401039      15.49659       0.4008825     160.9473 43.01221  152.4814 1.972998  8.465942       43.05744  
1 1 1 19 5  11 o 178.7002 22.50033  22.64158       5.239300      31.85372       8.449365      16.88676       6.678207      206.8962 31.65246  148.1574 34.47683  58.73883       46.80310  
1 1 1 19 5  12 o 135.7133 7.255120  12.37504       1.307252      14.80237       2.603268      11.55658       1.511666      147.0632 13.43253  130.8875 8.716989  16.17574       16.01308  
1 1 1 19 5  13 o 31.80270 13.06032  0.2394731      0.8868932     -0.1369320     0.9776438     1.989229       2.107859      30.11888 13.08788  57.82317 21.07822  -27.70429      24.81097  
1 1 1 19 5  14 o 322.9927 11.29013  70.73560       4.851732      68.20464       5.574651      78.63980       9.851507      316.1131 13.26380  332.3466 22.37569  -16.23352      26.01153  
1 1 1 19 5  15 o 162.9912 8.840538  17.95360       1.912880      9.949055       6.749308      18.65274       1.994669      110.7736 37.95639  166.0884 9.046922  -55.31483      39.01967  
1 1 1 19 5  16 o 190.4417 14.01110  25.08430       3.530668      25.44181       7.199759      24.97110       4.051232      179.7876 31.18268  188.8250 16.25924  -9.037445      35.16706  
1 1 1 19 5  17 o 84.65755 10.21461  4.938801       1.129024      4.815328       1.145088      9.247189       6.764112      83.49337 10.52576  104.0132 37.78215  -20.51987      39.22094  
1 1 1 19 5  18 o 203.9066 12.37180  28.77469       3.345719      30.01277       3.657858      22.43513       8.277175      207.6729 13.28795  154.4536 39.92716  53.21928       42.08025  
1 1 1 19 5  19 o 76.28996 8.582618  4.002703       0.8573719     3.876573       0.8674197     9.352650       5.649300      74.99004 8.850992  100.5231 34.71509  -25.53309      35.82566  
1 1 1 19 5  20 o 80.15829 9.237902  4.453464       0.9686975     4.786359       1.004021      -0.2946454E-01 3.684424      83.14130 9.217252  54.77727 24.52438  28.36403       26.19929  
1 1 1 19 5  21 o 94.58994 9.137238  6.208824       1.137364      6.257765       1.147414      3.451639       8.612268      94.94601 9.183734  76.52839 35.47356  18.41762       36.64307  
1 1 1 19 5  22 o 67.27251 9.669858  3.200897       0.8419480     3.404040       0.8550977     -3.252133      4.819437      69.48328 9.482719  50.62268 24.34751  18.86059       26.12897  
1 1 1 19 5  23 o 52.72687 16.49792  2.158969       1.287531      1.139027       1.347604      12.83990       4.360929      42.95246 16.59350  114.4977 28.65425  -71.54526      33.11208  
1 1 1 19 5  24 o 52.73309 23.92994  0.7028167      3.646578      0.8888277      4.220158      0.1546389      7.244693      55.40964 25.37350  61.45917 29.63315  -6.049530      39.01202  
1 1 1 19 5  25 o 36.79672 14.39353  0.7881950      1.023841      0.7870001      1.056082      0.8068730      4.175465      37.04837 14.58051  53.58389 24.78977  -16.53552      28.75976  
1 1 1 19 5  26 o 43.86150 15.48833  1.465512       1.128163      -1.112295      1.451837      5.394379       1.792365      29.62762 13.99715  80.63596 17.20564  -51.00834      22.18004  
1 1 1 19 6  0  o 91.43435 24.74319  6.747742       2.605226      6.747742       2.605226      6.747742       2.605226      91.43435 24.74319  91.43435 24.74319  0.000000       0.000000  
1 1 1 19 6  1  o 258.6424 11.42698  45.06593       3.928541      42.57412       7.311184      46.07743       4.658145      247.5327 22.40819  260.9883 13.43952  -13.45561      26.12944  
1 1 1 19 6  2  o 446.0643 12.04884  134.0371       7.155141      134.8764       8.670026      132.2446       12.66994      446.3191 14.59775  437.6691 21.79333  8.649994       26.23059  
1 1 1 19 6  3  o 534.1378 16.79239  194.1793       11.93712      191.4434       20.12247      195.6649       14.82802      519.4534 29.18851  533.0989 20.91439  -13.64557      35.90795  
1 1 1 19 6  4  o 362.3648 14.18363  88.93044       6.835453      79.61436       9.627909      98.39852       9.706145      339.3120 21.40315  378.6131 19.30248  -39.30109      28.82153  
1 1 1 19 6  5  o 147.9017 19.45853  15.23319       3.741989      20.75138       6.569576      12.58310       4.552706      168.4872 30.37889  131.7058 26.85282  36.78143       40.54566  
1 1 1 19 6  6  o 82.34212 11.83330  4.658281       1.261132      6.575110       3.828159      4.424926       1.335693      95.29006 28.17940  79.97241 12.97862  15.31765       31.02455  
1 1 1 19 6  7  o 93.24003 7.873522  5.863354       0.9691048     5.026206       6.700016      5.881243       0.9794042     94.72971 36.88782  93.37254 7.947161  1.357162       37.73418  
1 1 1 19 6  8  o 130.7007 4.474219  11.41497       0.7780864     27.74863       7.433280      11.23402       0.7823845     195.0075 29.52903  129.6541 4.535549  65.35342       29.87532  
1 1 1 19 6  9  o 131.9495 2.456756  11.60655       0.4319597     12.46314       3.843398      11.59559       0.4347139     132.0441 22.65916  131.8866 2.473598  0.1575012      22.79378  
1 1 1 19 6  10 o 156.4992 8.672455  16.48783       1.801466      16.97998       4.571086      16.39734       1.960102      154.2993 22.92809  155.9118 9.479454  -1.612473      24.81043  
1 1 1 19 6  11 o 132.4061 8.598346  11.81912       1.508833      17.80331       5.808496      11.38610       1.562469      154.7238 29.24426  129.8580 9.086961  24.86578       30.62351  
1 1 1 19 6  12 o 94.09693 6.342316  5.952569       0.7905921     3.700079       7.415944      5.978463       0.7951233     90.85548 37.58405  94.29926 6.365091  -3.443779      38.11923  
1 1 1 19 6  13 o 230.8321 9.434102  35.95114       2.895704      40.13326       4.240317      32.29645       3.963927      242.4953 13.17210  217.2197 13.76552  25.27560       19.05239  
1 1 1 19 6  14 o 186.5837 7.777312  23.42909       1.929405      22.30041       2.347259      25.78028       3.387815      181.5083 9.740576  193.9653 13.18596  -12.45700      16.39355  
1 1 1 19 6  15 o 156.4168 13.60592  16.89231       2.807674      18.89124       8.923663      16.67269       2.957894      144.9452 43.06432  155.0312 14.48597  -10.08595      45.43543  
1 1 1 19 6  16 o 48.20247 16.63369  1.509498       1.296892      1.515525       1.336217      1.411595       5.385311      48.49846 16.87620  72.01080 31.00288  -23.51234      35.29851  
1 1 1 19 6  17 f 125.7020 2.359784  10.54006       0.3952647     10.52151       0.3980303     11.86107       3.358897      125.5902 2.378411  126.6243 20.61558  -1.034058      20.75233  
1 1 1 19 6  18 o 70.44403 9.886903  3.447716       0.9025528     3.831865       0.9173192     -8.197116      5.050531      74.45151 9.459702  47.02479 23.12014  27.42672       24.98053  
1 1 1 19 6  19 o 131.3672 6.162433  11.65243       1.075724      11.83013       1.085015      1.410190       8.237352      132.3655 6.168557  76.89540 35.30042  55.47011       35.83533  
1 1 1 19 6  20 f 238.8117 6.800750  38.65049       2.161939      38.07354       2.260550      44.83401       7.400481      236.7968 7.172421  236.1796 23.84097  0.6171875      24.89649  
1 1 1 19 6  21 o 92.78777 7.757079  5.919417       0.9503284     6.020288       0.9586064     0.1544954      7.246943      93.57996 7.757114  66.76100 31.45843  26.81896       32.40070  
1 1 1 19 6  22 o 30.32283 14.31552  -1.333438      1.513709      -0.7620033     1.597926      -6.329895      4.725026      33.71270 15.50260  44.72645 22.06180  -11.01375      26.96393  
1 1 1 19 6  23 o 79.16199 7.464694  4.336063       0.7781159     4.113817       0.7824677     24.14935       7.388016      76.98638 7.732018  137.7979 38.66838  -60.81149      39.43384  
1 1 1 19 6  24 o 66.46928 24.15217  4.136454       2.764372      3.924088       5.251101      4.217872       3.251382      65.55341 29.31857  66.29648 25.73013  -0.7430649     39.00792  
1 1 1 19 6  25 o 153.8434 12.35730  17.50858       2.511948      20.10224       2.805396      7.020172       5.641465      164.1286 12.93173  71.71096 31.29621  92.41767       33.86270  
1 1 1 19 6  26 o 22.12211 11.10969  -3.736962      1.442549      -3.894500      1.499913      -1.794750      5.266495      22.49353 11.30061  50.06500 24.40032  -27.57147      26.89013  
1 1 1 19 7  0  o 71.95450 26.10963  4.658917       2.299932      4.658917       2.299932      4.658917       2.299932      71.95450 26.10963  71.95450 26.10963  0.000000       0.000000  
1 1 1 19 7  1  f 325.8724 8.587007  71.19648       3.725498      70.17281       4.931844      72.55690       5.685460      322.7255 11.48671  327.6426 13.04852  -4.917114      17.38414  
1 1 1 19 7  2  o 227.0803 7.784361  34.55610       2.351979      33.45055       3.015800      36.27242       3.757621      222.9545 10.17794  231.6911 12.21426  -8.736526      15.89901  
1 1 1 19 7  3  o 45.69215 19.20092  0.2671348      1.980604      0.7328343      2.213913      -1.599620      4.432527      50.69738 20.70587  59.68366 26.79618  -8.986286      33.86396  
1 1 1 19 7  4  o 52.25904 18.06493  1.705477       1.529932      1.189118       1.630073      5.524899       4.433327      48.54644 18.37348  90.02136 30.76469  -41.47493      35.83366  
1 1 1 19 7  5  o 206.0287 12.03207  28.71479       3.288876      23.82722       9.198196      29.43125       3.521689      174.8512 40.30460  208.4020 12.74256  -33.55081      42.27096  
1 1 1 19 7  6  o 162.0869 8.571627  17.66293       1.844753      19.48493       6.191464      17.48542       1.932526      162.9710 29.60074  161.1880 9.033590  1.783051       30.94850  
1 1 1 19 7  7  o 58.11313 10.76829  2.344112       0.8031631     5.409618       7.057118      2.303885       0.8084156     96.99670 37.83311  57.57008 10.93794  39.42662       39.38252  
1 1 1 19 7  8  o 237.9821 4.215859  37.79663       1.336915      37.76317       5.170217      37.79903       1.383985      234.5086 16.65372  237.9754 4.364410  -3.466858      17.21612  
1 1 1 19 7  9  o 222.4770 9.903878  33.35871       2.928694      39.11941       5.485092      31.06148       3.463761      238.2178 17.39969  214.0285 12.19562  24.18930       21.24812  
1 1 1 19 7  10 o 210.2884 9.925426  29.82852       2.773388      34.10096       5.481129      28.35825       3.215373      221.5224 18.74436  204.4934 11.85068  17.02904       22.17633  
1 1 1 19 7  11 o 84.53957 7.731322  4.832614       0.8613071     1.494591       4.362666      4.967998       0.8786000     69.25926 28.75434  85.71781 7.776673  -16.45855      29.78740  
1 1 1 19 7  12 o 181.8223 15.11396  22.77802       3.628757      20.71463       7.483254      23.41238       4.149237      161.9563 35.64359  183.4895 17.16945  -21.53320      39.56331  
1 1 1 19 7  13 o 195.4404 9.816390  25.84062       2.548280      22.06832       3.815728      28.87759       3.423687      178.2055 16.24727  205.6660 12.55254  -27.46045      20.53144  
1 1 1 19 7  14 o 51.87176 20.52559  1.200619       2.103144      0.6125010      3.759602      1.468487       2.537291      60.99312 26.07478  56.72278 22.51297  4.270340       34.44892  
1 1 1 19 7  15 o 271.2917 21.12593  53.05540       7.576891      56.02937       9.040592      46.03600       13.88926      274.8080 24.96049  220.0262 48.66526  54.78175       54.69308  
1 1 1 19 7  16 o 247.4669 5.871057  41.08259       1.936007      40.22431       2.042688      48.66159       6.070087      244.6724 6.270492  261.8887 17.49454  -17.21631      18.58434  
1 1 1 19 7  17 o 83.12143 7.811747  4.707751       0.8550943     5.292614       0.9134709     0.5656300      2.430965      88.16328 7.857856  49.91802 21.13968  38.24526       22.55287  
1 1 1 19 7  18 o 167.6674 7.893085  19.08948       1.758523      18.63670       1.805298      27.48908       7.775604      165.5354 8.209976  175.6581 34.45097  -10.12270      35.41571  
1 1 1 19 7  19 o 38.78078 11.82266  1.057594       0.6662836     1.044799       0.6670368     6.713543       14.02484      38.58863 11.84190  91.11079 43.18027  -52.52215      44.77462  
1 1 1 19 7  20 o 31.51377 11.78113  0.5557638      0.6656962     0.4483759      0.6686115     12.78997       7.136480      30.21348 11.68381  103.6956 38.61166  -73.48215      40.34069  
1 1 1 19 7  21 f 22.35777 9.230623  0.1216115      0.4461368     0.6539065E-01  0.4470215     14.28329       7.094749      21.67358 9.115705  104.8242 38.59579  -83.15058      39.65768  
1 1 1 19 7  22 o 73.73113 12.84480  4.012572       1.216139      4.236114       1.274010      1.718341       4.081427      75.65153 13.11307  58.94171 26.13552  16.70982       29.24069  
1 1 1 19 7  23 o 44.67715 20.56393  -0.5129863     2.820920      -1.535771      3.318084      2.153679       5.357713      44.80279 21.16462  62.14447 28.50668  -17.34169      35.50453  
1 1 1 19 7  24 o 30.68547 14.38896  -1.027290      1.484100      -1.988662      1.642096      3.259743       3.467618      29.09075 14.04663  60.94201 25.49412  -31.85126      29.10769  
1 1 1 19 7  25 o 20.65107 10.39321  -3.605397      1.298022      -3.866300      1.341450      0.2294605      5.142920      20.69464 10.43426  53.98201 25.74377  -33.28736      27.77797  
1 1 1 19 7  26 f 55.53758 20.60326  2.754511       2.028433      2.572209       2.141859      4.340264       6.317028      54.22463 20.92719  62.25857 29.34727  -8.033936      36.04455  
1 1 1 19 8  0  o 519.9763 23.26528  185.1891       16.04634      185.1891       16.04634      185.1891       16.04634      519.9763 23.26528  519.9763 23.26528  0.000000       0.000000  
1 1 1 19 8  1  o 408.3367 7.057297  111.5476       3.839992      112.2990       7.795329      111.3069       4.412491      406.8435 14.40188  407.6249 8.123619  -0.7814636     16.53503  
1 1 1 19 8  2  o 349.7203 15.47256  83.26420       7.192502      87.68786       9.269444      76.57096       11.40200      356.6434 19.58012  328.8376 26.23860  27.80585       32.73905  
1 1 1 19 8  3  o 146.8590 12.91291  14.67947       2.501256      16.29021       3.329607      12.59308       3.789461      153.7827 16.50649  133.1924 22.12741  20.59038       27.60591  
1 1 1 19 8  4  o 283.9240 11.26891  54.38139       4.254948      53.93129       5.623135      54.98434       6.508240      281.3881 15.05159  283.1303 17.33365  -1.742188      22.95661  
1 1 1 19 8  5  o 201.8228 8.283240  27.34928       2.222901      27.08646       6.083375      27.38978       2.388038      195.5246 23.84150  201.8525 8.900258  -6.327972      25.44861  
1 1 1 19 8  6  o 325.5748 16.91932  72.65938       7.315007      71.90268       11.05261      73.24918       9.757905      317.6490 26.34910  323.2511 22.80018  -5.602081      34.84427  
1 1 1 19 8  7  o 374.1703 9.269155  94.04190       4.621500      84.66698       15.76363      94.92345       4.833907      335.3588 35.82997  375.6666 9.664580  -40.30783      37.11052  
1 1 1 19 8  8  o 186.4481 1.656941  23.16745       0.4116600     0.000000       0.000000      23.16745       0.4116600     ?        ?         186.4481 1.656941  0.000000       1.656941  
1 1 1 19 8  9  o 173.7954 9.167665  20.35664       2.115591      18.06408       4.036968      21.22463       2.484007      160.5562 19.25277  177.1431 10.57146  -16.58694      21.96418  
1 1 1 19 8  10 o 178.7015 6.933267  21.42262       1.647839      19.23548       5.015409      21.68730       1.744696      163.4809 23.71469  179.7374 7.299826  -16.25650      24.81278  
1 1 1 19 8  11 o 274.1326 13.25416  51.24409       4.827224      54.25225       6.918203      48.38993       6.738783      278.9525 18.72023  262.9793 19.36616  15.97321       26.93501  
1 1 1 19 8  12 o 333.4341 9.942946  75.10938       4.412790      79.50912       9.005938      73.71933       5.062107      335.9535 20.21107  329.5415 11.54567  6.411957       23.27638  
1 1 1 19 8  13 o 157.9897 18.72323  17.69352       3.865161      14.40216       5.790678      20.33819       5.190730      134.5111 32.64225  166.4426 24.10491  -31.93144      40.57787  
1 1 1 19 8  14 o 228.4043 12.11140  35.70523       3.672966      18.71210       8.899604      39.19390       4.032407      143.0642 43.12429  239.0149 12.70660  -95.95067      44.95734  
1 1 1 19 8  15 o 55.70381 21.51481  1.683247       2.265114      1.882918       3.326632      1.510655       3.092840      63.12797 25.52917  59.91732 24.47259  3.210651       35.36448  
1 1 1 19 8  16 o 180.9544 6.644464  22.05807       1.599428      22.41777       1.611055      -2.591495      13.33656      182.4276 6.638520  87.59634 41.68475  94.83121       42.21005  
1 1 1 19 8  17 o 169.7895 6.626134  19.45405       1.496270      20.06314       1.562451      12.71761       5.196144      172.3676 6.816073  120.9209 31.82228  51.44675       32.54407  
1 1 1 19 8  18 o 65.61352 7.980592  2.964045       0.6834200     2.971798       0.6868443     2.192309       6.852619      65.69221 8.011961  74.70400 33.44579  -9.011787      34.39204  
1 1 1 19 8  19 o 158.7951 5.516310  17.00381       1.165465      16.94553       1.184796      18.74624       6.478248      158.4868 5.619073  137.5385 35.20337  20.94838       35.64900  
1 1 1 19 8  20 o 80.06567 7.076653  4.392988       0.7472365     4.353173       0.7483604     17.61959       13.63985      79.68497 7.122952  96.42895 44.67891  -16.74397      45.24314  
1 1 1 19 8  21 o 66.39536 13.33161  3.279000       1.138476      3.087916       1.151216      11.76931       7.673719      64.12614 13.87613  91.27001 38.03392  -27.14388      40.48612  
1 1 1 19 8  22 o 108.7209 3.022765  7.920019       0.4374913     7.909533       0.4392509     9.220995       4.892696      108.6460 3.037048  89.22984 32.17163  19.41615       32.31466  
1 1 1 19 8  23 o 89.82370 22.79605  7.254929       2.732636      6.608822       3.157294      9.183870       5.455347      81.79199 25.86844  83.79086 33.08848  -1.998871      42.00028  
1 1 1 19 8  24 o 91.72422 9.999161  6.038788       1.202375      7.165203       1.286334      -1.754814      3.383559      100.1453 9.763214  43.50412 20.78384  56.64122       22.96276  
1 1 1 19 8  25 o 96.58195 15.03440  7.338004       1.871941      8.687906       2.125625      2.673578       3.951250      104.4395 15.76426  57.24087 25.52799  47.19864       30.00317  
1 1 1 19 9  0  o 492.1577 24.36945  166.7809       15.89193      166.7809       15.89193      166.7809       15.89193      492.1577 24.36945  492.1577 24.36945  0.000000       0.000000  
1 1 1 19 9  1  o 56.33308 19.88988  1.948212       1.860446      -1.215982      4.768838      2.516250       2.020551      62.99937 28.07387  61.86177 20.77223  1.137596       34.92317  
1 1 1 19 9  2  o 171.3309 16.04369  20.17107       3.620198      14.61461       5.244758      25.22758       5.003244      140.7500 28.93174  190.2522 20.03596  -49.50218      35.19212  
1 1 1 19 9  3  o 299.1185 9.880105  60.20607       3.932621      57.24772       5.708755      62.87783       5.425205      289.8783 14.82852  304.4374 13.40636  -14.55911      19.99038  
1 1 1 19 9  4  o 285.4121 11.57718  55.03595       4.393861      49.52087       7.767828      57.63078       5.328176      265.8564 22.12741  291.2453 13.76821  -25.38895      26.06119  
1 1 1 19 9  5  f 168.2309 7.331912  18.98830       1.639655      13.52997       5.490893      19.52267       1.718042      134.0194 31.31405  170.5458 7.578886  -36.52638      32.21815  
1 1 1 19 9  6  o 144.7592 3.989260  13.99406       0.7687724     10.44809       6.686534      14.04156       0.7739044     116.7906 37.72144  145.0032 4.009160  -28.21254      37.93389  
1 1 1 19 9  7  o 218.4359 1.690917  31.79937       0.4921751     39.09898       11.57255      31.78614       0.4926208     222.2672 40.56764  218.3903 1.692801  3.876892       40.60295  
1 1 1 19 9  8  o 127.0031 7.941552  10.86094       1.337254      0.000000       0.000000      10.86094       1.337254      ?        ?         127.0031 7.941552  0.000000       7.941552  
1 1 1 19 9  9  o 201.7925 7.863768  27.36268       2.110460      32.75673       5.559729      26.45458       2.281204      216.3170 19.49713  198.2317 8.656970  18.08527       21.33264  
1 1 1 19 9  10 o 193.1189 7.743876  25.07081       1.988727      24.19198       3.806818      25.40069       2.332289      187.2649 15.39143  194.0754 9.043450  -6.810486      17.85161  
1 1 1 19 9  11 o 359.7540 11.15003  87.74850       5.338638      81.75875       8.428259      91.76205       6.899184      342.0455 18.56140  365.9586 14.17471  -23.91309      23.35483  
1 1 1 19 9  12 o 96.08781 15.88147  6.529919       1.962471      3.178607       4.678637      7.245443       2.161843      76.69674 30.52844  101.0642 16.63087  -24.36751      34.76451  
1 1 1 19 9  13 o 45.73968 14.13785  1.443324       0.9486948     2.036422       4.399509      1.414400       0.9715518     70.04619 28.95947  45.47345 14.34565  24.57274       32.31793  
1 1 1 19 9  14 o 42.81785 19.06157  -0.5465885     2.192865      -9.310002      5.712130      0.9681706      2.374834      50.51464 24.78590  52.15127 21.38914  -1.636627      32.73891  
1 1 1 19 9  15 o 267.8336 9.561229  48.79688       3.406866      50.68399       3.717001      38.88302       8.519515      272.5518 10.25286  220.5386 29.74851  52.01320       31.46578  
1 1 1 19 9  16 o 121.5178 7.379329  10.00762       1.189264      9.862974       1.252975      11.32238       3.777627      120.5007 7.845983  120.2232 24.41512  0.2775879      25.64483  
1 1 1 19 9  17 o 133.1993 4.876752  11.91834       0.8641165     12.09155       0.8709538     1.016316       6.909832      134.1642 4.879879  72.59566 32.94235  61.56855       33.30183  
1 1 1 19 9  18 o 78.48044 7.448181  4.216301       0.7695825     4.211307       0.7716700     5.135624       10.46976      78.42622 7.474367  84.89424 39.26778  -6.468018      39.97280  
1 1 1 19 9  19 o 78.39915 6.550853  4.192770       0.6781071     4.183029       0.6800417     5.897462       8.996314      78.29974 6.578587  81.28285 37.15547  -2.983116      37.73336  
1 1 1 19 9  20 o 48.18261 17.99537  1.570754       1.552438      1.251084       1.570323      15.36542       10.31557      45.70013 17.84034  95.18401 41.90635  -49.48389      45.54580  
1 1 1 19 9  21 f 35.00940 12.63192  0.7854251      0.7544634     0.9366126      0.7622691     -6.483490      5.285488      37.01755 12.75329  47.01801 23.21860  -10.00046      26.49056  
1 1 1 19 9  22 o 84.90735 13.85161  5.415652       1.513200      5.621872       1.590372      3.444121       4.917397      86.19392 14.35115  64.98342 28.75738  21.21050       32.13942  
1 1 1 19 9  23 o 60.40441 21.76837  3.216649       2.239713      6.647736       3.338359      0.4081472      3.020331      79.83970 26.69875  48.22379 21.84173  31.61591       34.49470  
1 1 1 19 9  24 o 43.94419 12.92917  1.479819       0.8075834     1.488578       0.8333613     1.344770       3.272272      44.03096 13.17913  51.63274 23.11461  -7.601772      26.60780  
1 1 1 19 10 0  o 366.7684 13.15658  90.71115       6.411169      90.71115       6.411169      90.71115       6.411169      366.7684 13.15658  366.7684 13.15658  0.000000       0.000000  
1 1 1 19 10 1  o 97.08864 9.741005  6.399421       1.243211      6.551838       1.510557      6.079441       2.188680      97.82681 11.82777  92.52348 18.40030  5.303329       21.87389  
1 1 1 19 10 2  o 182.8331 12.43477  22.70515       3.011439      18.96208       5.812543      24.07850       3.520816      160.7897 28.15434  187.7789 14.17562  -26.98924      31.52166  
1 1 1 19 10 3  o 197.6567 8.798704  26.27876       2.311606      29.57385       3.512430      23.76113       3.070222      208.6669 12.69227  187.0474 12.38792  21.61957       17.73568  
1 1 1 19 10 4  o 233.7413 8.851062  36.73968       2.751814      50.77290       7.148911      34.29871       2.981553      270.0082 20.01187  225.5571 9.944463  44.45111       22.34653  
1 1 1 19 10 5  o 187.1782 4.746959  23.41241       1.183025      25.95215       5.575613      23.29269       1.210589      191.4102 22.27593  186.6841 4.870650  4.726166       22.80220  
1 1 1 19 10 6  o 89.61560 5.581229  5.389222       0.6631715     -0.6430350     2.552862      5.825758       0.6867483     46.73174 20.69834  93.19076 5.555549  -46.45902      21.43095  
1 1 1 19 10 7  o 84.97511 9.334827  4.914681       1.039608      -3.379151      8.001568      5.057091       1.048495      75.59406 34.73558  86.22364 9.271195  -10.62958      35.95157  
1 1 1 19 10 8  o 107.8044 8.454390  7.855826       1.204776      0.000000       0.000000      7.855826       1.204776      ?        ?         107.8044 8.454390  0.000000       8.454390  
1 1 1 19 10 9  o 267.5250 11.70688  48.60508       4.163192      49.64279       11.59014      48.45135       4.460913      252.2014 35.46646  266.7077 12.58757  -14.50633      37.63398  
1 1 1 19 10 10 o 118.8904 17.81528  10.01608       2.735548      10.36947       5.184939      9.879770       3.220201      114.6086 32.47540  116.5518 21.52716  -1.943283      38.96242  
1 1 1 19 10 11 o 208.3435 6.828960  29.15643       1.893306      22.37591       4.101871      30.99209       2.134258      178.4225 17.47668  214.6384 7.473585  -36.21590      19.00760  
1 1 1 19 10 12 o 235.6788 11.88294  37.97988       3.719755      40.51923       6.587173      36.79102       4.507163      237.1416 21.06471  230.3604 14.76091  6.781174       25.72171  
1 1 1 19 10 13 o 252.3127 9.700679  43.23590       3.255404      44.07829       8.104461      43.07384       3.554789      241.7733 25.54168  251.3573 10.63731  -9.584076      27.66821  
1 1 1 19 10 14 o 278.7104 11.96619  53.43859       4.433735      48.15005       6.326142      58.54427       6.215810      258.9885 18.45181  287.9576 16.26541  -28.96915      24.59741  
1 1 1 19 10 15 o 141.1693 9.365609  13.62129       1.751811      13.01966       1.800584      24.27732       7.577901      137.8111 9.870546  165.4557 35.43869  -27.64455      36.78762  
1 1 1 19 10 16 o 148.4374 6.238116  14.86841       1.231122      15.44500       1.274354      6.800135       4.766990      151.2628 6.336469  88.49622 31.77477  62.76656       32.40042  
1 1 1 19 10 17 o 190.1124 5.324553  24.32503       1.347533      24.19990       1.374358      27.43708       6.853771      189.5784 5.446128  177.6077 30.02899  11.97070       30.51886  
1 1 1 19 10 18 o 115.9128 6.500056  9.125061       0.9999508     9.392230       1.028785      4.558262       4.253408      117.5704 6.593204  73.81860 29.19608  43.75180       29.93128  
1 1 1 19 10 19 o 58.14187 16.40041  2.604176       1.325413      2.473910       1.359664      5.092471       5.942485      56.65832 16.80382  75.11947 32.45556  -18.46115      36.54766  
1 1 1 19 10 20 o 32.36061 12.46078  0.5588276      0.7581491     0.5508647      0.7611085     1.576862       8.605792      32.30337 12.47283  68.75574 32.92815  -36.45237      35.21128  
1 1 1 19 10 21 o 32.68093 13.25150  0.4443771      0.8990336     0.5819025      0.9138348     -3.698200      5.015470      34.17641 13.52790  49.46864 24.04211  -15.29224      27.58673  
1 1 1 19 10 22 o 93.72050 11.81231  6.418729       1.442474      6.792299       1.482467      -0.2262428     6.252381      96.46252 11.77719  58.24933 27.94160  38.21318       30.32219  
1 1 1 19 10 23 o 37.18210 16.80581  -0.1953827     1.777153      -1.362321      2.091082      2.839572       3.372277      35.45458 16.76450  58.20700 24.78366  -22.75242      29.92120  
1 1 1 19 10 24 o 50.19347 21.15126  1.748863       2.414001      0.8444903      3.087653      3.170843       3.871700      48.83048 22.10340  58.95625 25.82361  -10.12577      33.99146  
1 1 1 19 11 0  o 43.67532 28.99918  -0.8903175     4.485504      -0.8903175     4.485504      -0.8903175     4.485504      43.67532 28.99918  43.67532 28.99918  0.000000       0.000000  
1 1 1 19 11 1  o 233.0678 15.50225  37.26439       4.787127      38.27794       11.31776      37.04354       5.282980      219.7205 40.13439  231.5894 17.24307  -11.86887      43.68172  
1 1 1 19 11 2  o 81.75269 10.18452  4.569407       1.085480      7.924953       2.635160      3.883686       1.191239      105.4494 19.47091  74.79343 12.38569  30.65598       23.07643  
1 1 1 19 11 3  o 56.65516 12.04273  2.252201       0.8811168     1.407811       2.912195      2.337288       0.9244456     59.65398 23.96998  57.67963 12.39701  1.974350       26.98603  
1 1 1 19 11 4  o 130.2229 5.007952  11.34672       0.8673825     2.648857       3.073174      12.09957       0.9041423     67.61271 25.30549  134.4745 5.054719  -66.86179      25.80539  
1 1 1 19 11 5  o 58.35634 10.78051  2.369857       0.8074299     -1.090286      4.290023      2.496928       0.8221224     59.40011 26.53798  59.95807 10.68169  -0.5579567     28.60705  
1 1 1 19 11 6  o 157.1764 9.142907  16.68017       1.906630      17.52521       5.068600      16.54089       2.057767      154.6676 25.47967  156.3316 9.929467  -1.664001      27.34608  
1 1 1 19 11 7  o 175.7760 8.050237  20.79748       1.880560      30.56090       12.56275      20.57369       1.901991      183.0560 50.06788  174.7949 8.188701  8.261154       50.73310  
1 1 1 19 11 8  o 131.2141 17.56935  12.13452       2.994790      0.000000       0.000000      12.13452       2.994790      ?        ?         131.2141 17.56935  0.000000       17.56935  
1 1 1 19 11 9  o 139.4478 13.74468  13.43125       2.520827      0.000000       0.000000      13.43125       2.520827      ?        ?         139.4478 13.74468  0.000000       13.74468  
1 1 1 19 11 10 o 169.1360 12.22285  19.60796       2.736165      4.759104       7.021548      22.26648       2.971025      90.08032 36.84268  180.1972 12.44981  -90.11687      38.88934  
1 1 1 19 11 11 o 275.5698 28.05658  57.93835       10.15891      0.000000       0.000000      57.93835       10.15891      ?        ?         275.5698 28.05658  0.000000       28.05658  
1 1 1 19 11 12 o 228.5197 8.467916  35.32875       2.574080      37.25066       5.140266      34.68549       2.973815      229.5705 16.92229  225.7967 9.907897  3.773849       19.60944  
1 1 1 19 11 13 o 297.2464 9.909667  60.19995       3.919599      53.92980       6.893204      63.19594       4.764881      273.3138 19.04637  303.1537 11.81812  -29.83987      22.41500  
1 1 1 19 11 14 f 39.76736 15.58800  0.7406406      1.202917      0.6006964      1.289161      1.682824       3.345009      39.49043 15.92003  61.09814 25.25496  -21.60771      29.85398  
1 1 1 19 11 15 o ?        ?         -3.205086      0.8447282     -3.292829      0.8813733     -2.215262      2.960297      ?        ?         43.18322 20.27243  0.000000       20.27243  
1 1 1 19 11 16 o 66.00571 9.825494  3.053164       0.8378856     2.957297       0.8433505     10.37847       7.372020      64.85809 10.08587  98.29417 38.57136  -33.43607      39.86822  
1 1 1 19 11 17 o 85.05128 7.329665  4.952107       0.8225929     4.934912       0.8317710     5.718373       5.552595      84.87154 7.429600  79.66842 32.69378  5.203117       33.52734  
1 1 1 19 11 18 o 126.9384 3.472009  10.79991       0.5867312     10.83928       0.5907652     7.947058       5.029272      127.1658 3.489650  87.10699 32.41781  40.05882       32.60509  
1 1 1 19 11 19 o 120.7153 3.250083  9.765728       0.5223181     9.760868       0.5228698     12.06498       11.37294      120.6843 3.254361  85.48602 40.00410  35.19829       40.13625  
1 1 1 19 11 20 o 130.6797 9.354779  11.95813       1.618203      11.83220       1.625182      26.52591       17.47978      129.9214 9.452103  89.32700 43.73198  40.59443       44.74179  
1 1 1 19 11 21 o 123.8693 8.220906  10.66828       1.349250      11.13513       1.376467      -0.7881147     6.818691      126.5704 8.205539  59.17198 28.58429  67.39838       29.73873  
1 1 1 19 11 22 o 25.34822 10.93231  0.3029250E-01  0.6718932     0.7627692E-01  0.6760466     -3.677727      6.070748      25.84444 11.05301  51.53170 25.33837  -25.68726      27.64421  
1 1 1 19 11 23 o 53.46347 22.60346  2.155402       2.771616      0.4723659      3.690608      4.332438       4.197435      50.23929 23.26471  63.73662 27.40488  -13.49733      35.94822  
1 1 1 19 12 0  o 57.81660 32.61309  3.268452       3.836133      3.268452       3.836133      3.268452       3.836133      57.81660 32.61309  57.81660 32.61309  0.000000       0.000000  
1 1 1 19 12 1  o 225.7528 13.47137  34.81199       4.034028      0.000000       0.000000      34.81199       4.034028      ?        ?         225.7528 13.47137  0.000000       13.47137  
1 1 1 19 12 2  o 225.3122 6.807228  34.04434       2.041410      33.78445       3.755699      34.15332       2.432055      222.6631 12.71092  225.3661 8.111855  -2.703018      15.07878  
1 1 1 19 12 3  o 238.8353 5.816548  38.16467       1.851132      36.46450       6.216741      38.33008       1.939091      227.1462 20.76878  239.2283 6.087866  -12.08209      21.64265  
1 1 1 19 12 4  f 180.6381 1.989676  21.75116       0.4789226     21.76276       4.887927      21.75104       0.4812382     174.5902 21.46126  180.6372 1.999306  -6.046997      21.55419  
1 1 1 19 12 5  o 63.47097 13.33089  2.845282       1.091546      5.005877       5.586550      2.759524       1.112998      88.33844 33.87400  62.41082 13.75459  25.92762       36.56004  
1 1 1 19 12 6  o 177.1207 7.645619  21.11059       1.800244      21.75534       5.834628      21.04275       1.892583      171.1285 26.43799  176.7388 8.057371  -5.610321      27.63853  
1 1 1 19 12 7  o 118.9893 17.00632  10.00640       2.619840      11.58205       10.64653      9.904844       2.702953      118.0877 46.34849  118.0920 17.72340  -0.4318237E-02 49.62159  
1 1 1 19 12 8  o 81.53445 18.53092  4.837316       1.967481      0.000000       0.000000      4.837316       1.967481      ?        ?         81.53445 18.53092  0.000000       18.53092  
1 1 1 19 12 9  o 106.1560 15.60254  7.964037       2.141256      0.000000       0.000000      7.964037       2.141256      ?        ?         106.1560 15.60254  0.000000       15.60254  
1 1 1 19 12 10 o 240.4988 20.74516  41.88099       6.583264      0.000000       0.000000      41.88099       6.583264      ?        ?         240.4988 20.74516  0.000000       20.74516  
1 1 1 19 12 11 f 133.2958 27.71068  14.04360       4.761199      15.35591       6.475351      12.49909       7.024876      132.5546 35.81765  117.0844 38.71762  15.47018       52.74427  
1 1 1 19 12 12 o 49.29301 17.85542  1.523232       1.509295      -1.457191      5.239560      1.792917       1.576101      61.55450 28.21914  52.07957 18.31384  9.474930       33.64100  
1 1 1 19 12 13 o 193.8966 8.568719  25.57100       2.208441      27.69292       3.056928      23.25453       3.193992      200.1768 11.50886  182.3226 13.23695  17.85425       17.54054  
1 1 1 19 12 14 o 219.5927 11.25655  33.39742       3.282805      32.54397       4.683558      34.22164       4.602673      212.0029 16.71419  218.2030 15.93977  -6.200119      23.09633  
1 1 1 19 12 15 o 106.7749 7.690713  7.783393       1.086900      8.016697       1.126563      4.643997       4.132545      108.3140 7.858900  75.76701 29.11360  32.54695       30.15567  
1 1 1 19 12 16 o 66.02184 9.776779  3.067049       0.8341546     2.797362       0.8456367     12.79629       5.079168      62.75287 10.48242  115.1743 31.96750  -52.42145      33.64226  
1 1 1 19 12 17 o 17.57800 8.542036  -1.049276      0.6326284     -1.206032      0.6526458     1.389203       2.574098      17.29617 8.464042  52.68005 21.99628  -35.38388      23.56854  
1 1 1 19 12 18 o 29.14092 12.07581  0.2386101      0.7674311     0.1755986      0.7725866     4.912689       6.654038      28.61857 12.00702  73.59487 32.95280  -44.97630      35.07215  
1 1 1 19 12 19 o 80.50105 8.389261  4.518779       0.8867204     4.486871       0.8934155     6.623817       7.256625      80.17034 8.492044  76.03514 34.19935  4.135201       35.23791  
1 1 1 19 12 20 o 56.80921 14.52247  2.494273       1.103424      2.628894       1.114246      -4.334918      7.936139      58.39025 14.40994  57.58072 28.43775  0.8095322      31.88028  
1 1 1 19 12 21 o 125.1596 6.833971  10.77764       1.135429      10.83508       1.138095      -1.440455      16.59809      125.4950 6.831550  66.30405 33.77074  59.19091       34.45479  
1 1 1 19 12 22 o 18.92354 9.508055  -2.923769      1.063215      -3.231365      1.107170      0.7210698      3.811210      18.88040 9.514464  51.61191 23.80861  -32.73151      25.63932  
1 1 1 19 13 0  o 436.4057 26.58491  134.4848       15.32685      134.4848       15.32685      134.4848       15.32685      436.4057 26.58491  436.4057 26.58491  0.000000       0.000000  
1 1 1 19 13 1  o 133.4463 21.07096  12.84998       3.622624      15.98807       8.119461      12.07004       4.047849      136.5532 41.19720  127.4997 24.71793  9.053497       48.04358  
1 1 1 19 13 2  o 242.8170 5.724990  39.46716       1.852368      44.89170       5.068100      38.63078       1.990054      255.1121 14.97458  240.0485 6.226716  15.06358       16.21758  
1 1 1 19 13 3  o 206.0934 1.975881  28.31524       0.5426233     19.78310       3.056059      28.59298       0.5513845     169.5167 13.64449  207.1004 1.998021  -37.58374      13.79000  
1 1 1 19 13 4  o 224.7147 9.799237  34.19436       2.927197      30.63129       6.291022      35.17892       3.306990      205.0686 23.44304  227.4841 10.94167  -22.41548      25.87076  
1 1 1 19 13 5  f 292.1046 8.661624  57.56933       3.367683      61.53722       5.404915      55.05134       4.305621      299.3071 13.58728  284.3455 11.38663  14.96155       17.72764  
1 1 1 19 13 6  o 113.7409 12.69451  8.949246       1.891242      16.57638       4.624655      7.417539       2.072463      149.3877 24.04842  102.4174 15.68449  46.97034       28.71114  
1 1 1 19 13 7  o 190.4761 9.797321  24.64293       2.478333      20.19707       6.449918      25.41303       2.684409      159.0216 31.55265  193.1781 10.46749  -34.15646      33.24361  
1 1 1 19 13 8  o 285.0095 11.75161  55.61952       4.453461      0.000000       0.000000      55.61952       4.453461      ?        ?         285.0095 11.75161  0.000000       11.75161  
1 1 1 19 13 9  o 203.8651 19.94485  30.15433       5.348863      0.000000       0.000000      30.15433       5.348863      ?        ?         203.8651 19.94485  0.000000       19.94485  
1 1 1 19 13 10 o 96.54077 26.80967  7.459239       3.571358      12.07949       9.353617      6.670733       3.864108      111.0274 43.48302  90.86600 28.60209  20.16141       52.04665  
1 1 1 19 13 11 o 40.59590 16.35996  0.6437570      1.360875      9.464763       14.04496      0.5601562      1.367308      103.0820 46.85086  40.02002 16.29963  63.06194       49.60526  
1 1 1 19 13 12 o 155.0773 17.41278  17.50972       3.536149      11.01113       8.882895      18.73350       3.854750      103.1731 41.71928  159.6404 18.46068  -56.46720      45.62122  
1 1 1 19 13 13 o 37.65107 14.59351  0.7126298      1.044890      -0.2190629     1.271451      2.650957       1.833905      33.26070 14.67520  59.84611 19.78204  -26.58540      24.63109  
1 1 1 19 13 14 o 125.8306 8.474820  10.85668       1.412700      11.09062       1.545299      9.666380       3.485722      126.8659 9.203589  108.0081 24.75074  18.85783       26.40654  
1 1 1 19 13 15 o 108.0546 7.921688  8.009511       1.132676      8.045510       1.193648      7.683893       3.589906      108.1276 8.349122  92.54513 27.26780  15.58247       28.51737  
1 1 1 19 13 16 o 122.7725 7.739309  10.34369       1.259683      10.68248       1.299096      5.013130       5.153034      124.7190 7.856839  74.60149 31.13370  50.11748       32.10976  
1 1 1 19 13 17 o 86.09196 4.804536  5.008046       0.5489861     4.982460       0.5543275     6.316556       3.964150      85.85590 4.865234  79.85161 28.93553  6.004295       29.34170  
1 1 1 19 13 18 o ?        ?         -3.435877      0.8428305     -3.559466      0.8588226     -0.2097336     4.387885      ?        ?         54.32579 25.22958  0.000000       25.22958  
1 1 1 19 13 19 o 103.6035 11.41769  7.749986       1.550147      8.161767       1.580868      -2.536875      7.901402      106.4102 11.32274  59.70424 29.26542  46.70597       31.37944  
1 1 1 19 13 20 o 88.01467 5.953629  5.298930       0.6941401     5.248926       0.7003255     8.092230       5.234275      87.56393 6.039059  78.78586 31.96420  8.778076       32.52969  
1 1 1 19 13 21 o 37.27651 12.67071  0.9973605      0.7518511     0.9180132      0.7545246     12.13434       8.939036      36.23815 12.67684  76.81985 35.78893  -40.58170      37.96775  
1 1 1 19 14 0  o 88.50719 9.903297  5.452896       1.130502      5.452896       1.130502      5.452896       1.130502      88.50719 9.903297  88.50719 9.903297  0.000000       0.000000  
1 1 1 19 14 1  o 31.46066 13.15533  0.1568769      0.9227210     0.9544414E-01  0.9855076     0.5934361      2.627131      31.88923 13.48013  52.38299 22.06909  -20.49376      25.86037  
1 1 1 19 14 2  o 110.6481 30.35534  9.786904       4.609784      2.737761       6.104832      19.13807       7.031345      79.74886 33.62254  151.6209 35.44131  -71.87202      48.85244  
1 1 1 19 14 3  o 117.3176 8.044190  9.316739       1.249921      5.752262       2.500804      10.50368       1.443100      87.76656 21.54530  124.4230 8.760053  -36.65647      23.25808  
1 1 1 19 14 4  o 185.2410 7.336150  23.12225       1.807254      21.42806       5.949207      23.29449       1.896897      166.6306 27.77044  185.8317 7.676913  -19.20117      28.81202  
1 1 1 19 14 5  o 121.0670 15.67148  10.36475       2.468929      10.03605       3.501896      10.68961       3.481380      115.1439 23.61690  119.4442 22.70289  -4.300285      32.75941  
1 1 1 19 14 6  o 147.4810 14.38437  15.21539       2.790950      14.47828       4.967670      15.55536       3.373737      135.0968 28.49342  147.4988 17.50624  -12.40193      33.44164  
1 1 1 19 14 7  o 232.1860 8.331323  36.49224       2.573469      23.90966       8.230698      37.85561       2.709306      163.4138 38.44517  236.3598 8.616647  -72.94606      39.39895  
1 1 1 19 14 8  o 211.6988 20.20366  32.85548       5.630263      0.000000       0.000000      32.85548       5.630263      ?        ?         211.6988 20.20366  0.000000       20.20366  
1 1 1 19 14 9  o 93.62570 24.56328  6.945948       3.102126      0.000000       0.000000      6.945948       3.102126      ?        ?         93.62570 24.56328  0.000000       24.56328  
1 1 1 19 14 10 o 58.81285 26.26527  -0.5058824E-01 4.197936      0.000000       0.000000      -0.5058824E-01 4.197936      ?        ?         58.81285 26.26527  0.000000       26.26527  
1 1 1 19 14 11 o 59.32912 21.94152  2.396220       2.297279      6.085439       11.27646      2.236476       2.346488      90.63270 41.49310  58.43317 22.06024  32.19953       46.99289  
1 1 1 19 14 12 o 155.3224 11.45331  16.84632       2.353819      20.63604       2.891103      9.395408       4.053827      171.0491 12.77668  103.5476 28.48940  67.50146       31.22322  
1 1 1 19 14 13 o 120.9084 12.46568  10.38477       1.979626      10.23159       1.996627      19.26472       15.20231      119.8717 12.69250  102.6315 47.41751  17.24020       49.08686  
1 1 1 19 14 14 o 177.5817 8.120514  21.61706       1.916480      21.21815       2.198256      22.88077       3.912553      175.0615 9.458668  174.7399 17.01868  0.3215790      19.47054  
1 1 1 19 14 15 o 263.1935 6.598881  47.08456       2.312471      47.66627       2.489236      43.41964       6.248092      264.4282 7.070899  234.2307 20.21609  30.19754       21.41700  
1 1 1 19 14 16 o 58.59018 7.924300  2.395152       0.6028249     2.169413       0.6099548     11.88198       3.954162      55.52171 8.515767  114.1297 26.50902  -58.60795      27.84324  
1 1 1 19 14 17 o 22.43880 10.84472  -1.410954      0.9843841     -1.875903      1.022756      4.438949       3.627799      21.37370 10.48750  69.21465 27.08818  -47.84094      29.04750  
1 1 1 19 14 18 o 88.12041 5.407055  5.278482       0.6318511     5.256031       0.6372772     6.580092       4.852298      87.91272 5.467109  76.09155 30.81050  11.82117       31.29179  
1 1 1 19 14 19 o 21.93970 10.15866  -0.4897037     0.7033906     -0.4328981     0.7124224     -2.687575      4.431422      22.48432 10.34367  47.39206 22.93007  -24.90774      25.15511  
1 1 1 19 14 20 o 69.87550 6.662626  3.378729       0.6128592     3.357891       0.6139169     9.410973       10.44531      69.64439 6.697797  71.30984 34.66597  -1.665459      35.30708  
1 1 1 19 15 0  f 64.45649 10.55814  3.008316       0.8338063     3.008316       0.8338063     3.008316       0.8338063     64.45649 10.55814  64.45649 10.55814  0.000000       0.000000  
1 1 1 19 15 1  o 54.82225 14.29092  2.163178       1.054478      1.848023       1.098980      5.819748       3.743390      50.98203 15.10402  86.15564 28.25244  -35.17361      32.03642  
1 1 1 19 15 2  o 182.6452 18.05040  23.93032       4.335695      19.90789       7.552508      25.90758       5.295157      149.1534 37.92204  187.3196 21.60962  -38.16621      43.64695  
1 1 1 19 15 3  o 37.80557 14.66233  0.6798420      1.055256      -1.865364      2.357054      1.317880       1.180134      39.18364 18.29558  45.30857 15.85374  -6.124928      24.20887  
1 1 1 19 15 4  o 72.04125 19.80643  3.887106       1.960158      2.928208       4.315171      4.136407       2.200261      71.70517 29.04765  73.99648 21.21719  -2.291306      35.97131  
1 1 1 19 15 5  o 136.5789 16.03023  13.31826       2.861940      3.606700       5.561747      16.81591       3.337754      78.21014 32.46804  153.2841 16.60611  -75.07394      36.46830  
1 1 1 19 15 6  o 66.21206 17.54517  3.252664       1.572603      8.270656       3.537395      2.016629       1.755634      101.4366 26.03991  54.75018 19.32234  46.68640       32.42575  
1 1 1 19 15 7  o 173.1002 15.27144  21.30692       3.486413      30.20672       6.652286      17.93667       4.093661      195.3486 26.21692  155.0877 20.29544  40.26088       33.15467  
1 1 1 19 15 8  o 168.2952 14.93585  20.17188       3.314716      16.87040       6.560174      21.30374       3.841116      133.9283 35.99211  171.3519 17.04861  -37.42360      39.82571  
1 1 1 19 15 9  o 87.61661 27.21354  6.470906       3.510162      0.000000       0.000000      6.470906       3.510162      ?        ?         87.61661 27.21354  0.000000       27.21354  
1 1 1 19 15 10 o 237.1538 13.21624  39.72194       4.159971      0.000000       0.000000      39.72194       4.159971      ?        ?         237.1538 13.21624  0.000000       13.21624  
1 1 1 19 15 11 o 53.06181 23.09565  0.6617025      3.054936      -10.04067      9.779530      1.818988       3.215868      62.98237 31.18916  59.01792 24.60993  3.964447       39.72924  
1 1 1 19 15 12 o 127.9420 11.03671  11.50134       1.863220      12.18921       2.241114      9.961687       3.352910      130.4140 13.07239  109.4865 23.67260  20.92753       27.04218  
1 1 1 19 15 13 o 109.5673 10.06504  8.407273       1.453095      9.361444       1.557885      2.021887       4.030101      115.5742 10.22107  61.64082 26.67999  53.93339       28.57082  
1 1 1 19 15 14 o 104.5425 8.521617  7.571599       1.176815      7.447123       1.193019      12.06061       7.164386      103.5797 8.724730  95.29134 37.82702  8.288330       38.82015  
1 1 1 19 15 15 o 158.1127 6.077248  16.98479       1.278021      17.25136       1.304768      10.68225       6.344376      159.3092 6.157966  91.33710 35.79976  67.97215       36.32552  
1 1 1 19 15 16 o 123.4841 3.911378  10.25215       0.6427858     10.42357       0.6593161     6.961492       2.888664      124.4935 3.979531  87.76050 24.01056  36.73298       24.33812  
1 1 1 19 15 17 o 26.43632 11.34004  0.5619243E-01  0.7155353     0.2337113      0.7219083     -9.865228      5.396928      28.22263 11.70523  42.78240 21.48572  -14.55977      24.46730  
1 1 1 19 15 18 o 72.03506 9.899343  3.725752       0.9251162     4.097147       0.9368114     -10.87109      5.873053      75.80585 9.480934  43.28348 21.82471  32.52238       23.79509  
1 1 1 19 15 19 o 18.04288 8.987668  -2.041716      0.8602853     -2.074500      0.8721974     -0.8660380     5.223102      18.14655 9.040980  52.87945 25.41067  -34.73290      26.97112  
1 1 1 19 16 0  o 132.7171 2.578637  11.75870       0.4556387     11.75870       0.4556387     11.75870       0.4556387     132.7171 2.578637  132.7171 2.578637  0.000000       0.000000  
1 1 1 19 16 1  o 73.74347 7.211275  3.705360       0.6995665     6.791477       1.047660      1.222083       0.9397812     99.85199 7.939224  42.54895 14.16431  57.30304       16.23757  
1 1 1 19 16 2  o 77.46972 31.02005  4.190483       4.859406      3.246491       6.425222      5.452039       7.427753      78.27070 33.78227  86.88824 36.88064  -8.617538      50.01423  
1 1 1 19 16 3  o 57.77634 19.83787  2.361001       1.843909      2.435863       2.378863      2.248326       2.918446      60.31434 22.32376  61.50261 24.22788  -1.188271      32.94451  
1 1 1 19 16 4  o 91.52715 19.86399  6.375221       2.352942      2.097260       3.745903      9.163095       3.023950      64.34278 26.67271  109.1099 21.56354  -44.76708      34.29898  
1 1 1 19 16 5  o 86.01057 31.43162  6.324107       4.691415      0.6834716      6.616805      12.02605       6.652667      70.98259 32.22062  109.5535 37.67873  -38.57086      49.57676  
1 1 1 19 16 6  o 209.2088 16.02519  31.57245       4.433413      31.56065       6.518910      31.58261       6.047214      198.6611 25.19130  201.5479 22.92349  -2.886841      34.06007  
1 1 1 19 16 7  o 144.0810 19.83088  15.75224       3.706463      19.16206       7.146946      14.49775       4.334982      137.5327 37.82305  133.2594 25.33851  4.273254       45.52607  
1 1 1 19 16 8  o 114.9709 20.36780  10.23691       3.006163      13.97999       6.316366      9.140764       3.418107      116.0407 36.57415  104.9326 24.83442  11.10809       44.20879  
1 1 1 19 16 9  o 35.06629 14.52145  0.3661880      1.108721      0.000000       0.000000      0.3661880      1.108721      ?        ?         35.06629 14.52145  0.000000       14.52145  
1 1 1 19 16 10 o 212.6989 18.29717  34.29214       5.135531      28.35602       17.67462      34.83951       5.367084      106.3379 49.79701  213.2824 19.08622  -106.9445      53.32941  
1 1 1 19 16 11 o 142.1531 25.74393  17.41446       4.696969      27.12581       10.22604      14.81786       5.287749      133.1521 46.66243  122.3599 32.05383  10.79214       56.61122  
1 1 1 19 16 12 o 63.65404 13.21649  3.001385       1.084312      2.837346       1.184215      3.852387       2.697257      61.21804 14.70231  67.50590 23.93816  -6.287861      28.09259  
1 1 1 19 16 13 o 110.6652 9.965624  8.607905       1.453840      8.313233       1.525462      11.52677       4.801088      108.3107 10.70958  104.8237 31.69100  3.487015       33.45167  
1 1 1 19 16 14 o 30.28757 13.95562  -0.7121071     1.304108      -1.032594      1.350541      3.709711       5.016527      29.41397 13.77134  67.55303 29.49618  -38.13906      32.55264  
1 1 1 19 16 15 o 117.8787 6.124856  9.472615       0.9587663     9.243588       0.9773181     15.33401       4.944170      116.3529 6.327360  121.8983 30.51252  -5.545433      31.16166  
1 1 1 19 16 16 o 143.6456 7.638663  14.26289       1.456864      15.50796       1.567063      6.332726       3.954853      149.6218 7.887783  76.30199 28.67569  73.31985       29.74075  
1 1 1 19 16 17 o 100.2099 11.16584  7.293284       1.465696      7.319337       1.599303      7.156610       3.663078      99.52603 12.32222  80.84472 27.95238  18.68131       30.54787  
1 1 1 19 16 18 o 68.67246 10.64153  3.443420       0.9422971     3.796694       1.009470      1.050843       2.627063      72.04832 10.85111  48.33850 21.21939  23.70982       23.83294  
1 1 1 19 17 0  o 46.26337 18.13771  2.026867       1.070205      2.026867       1.070205      2.026867       1.070205      46.26337 18.13771  46.26337 18.13771  0.000000       0.000000  
1 1 1 19 17 1  o 152.9032 7.381788  15.88677       1.499570      17.94460       8.322523      15.81772       1.524522      124.3795 42.15771  152.5118 7.524882  -28.13231      42.82402  
1 1 1 19 17 2  o 91.34442 7.467696  5.696289       0.9010283     5.668340       0.9101965     7.062733       6.364223      91.08946 7.567098  87.30842 35.30971  3.781044       36.11145  
1 1 1 19 17 3  o 83.05048 10.26867  4.821392       1.112214      4.352806       1.155469      10.73090       4.103354      78.43583 11.38783  111.4976 27.73330  -33.06176      29.98030  
1 1 1 19 17 4  o 52.71098 19.10056  1.902538       1.727342      3.198017       3.979555      1.601807       1.917380      68.33952 27.81731  51.33941 19.80377  17.00011       34.14663  
1 1 1 19 17 5  o 90.00033 27.41212  7.136282       3.583002      7.305454       6.987181      7.075925       4.173512      86.43261 36.17549  87.84819 29.85295  -1.415581      46.90272  
1 1 1 19 17 6  o 212.7015 12.64992  32.04231       3.569159      32.99462       5.199725      31.19386       4.908003      208.4534 18.92573  203.4606 18.29828  4.992752       26.32509  
1 1 1 19 17 7  o 54.92899 21.93608  1.836595       2.423502      -0.4978809     4.494847      2.793396       2.877604      56.48828 25.98486  62.21228 24.18900  -5.724003      35.50100  
1 1 1 19 17 8  o 163.2172 20.45597  20.97482       4.351523      26.47153       7.356818      18.01679       5.396848      161.4568 35.19070  139.5927 29.91348  21.86403       46.18660  
1 1 1 19 17 9  o 56.09799 20.59995  2.322384       2.018906      -0.3396821     3.631428      3.513274       2.428866      51.71490 23.62696  65.48206 22.75492  -13.76715      32.80274  
1 1 1 19 17 10 o 77.76591 29.27881  5.837868       4.127041      0.000000       0.000000      5.837868       4.127041      ?        ?         77.76591 29.27881  0.000000       29.27881  
1 1 1 19 17 11 o 110.4605 15.14388  9.128591       2.170422      9.468953       2.229193      2.927745       9.514864      112.4212 15.27560  72.60285 34.73104  39.81833       37.94192  
1 1 1 19 17 12 o 121.8941 11.54882  10.63967       1.853459      11.39566       2.001138      6.077363       4.915988      125.7699 12.08934  76.30000 30.96925  49.46994       33.24525  
1 1 1 19 17 13 o 65.20860 12.12109  3.131716       1.014465      3.074567       1.030994      4.871285       5.688136      64.43219 12.45895  70.84892 31.15811  -6.416733      33.55671  
1 1 1 19 17 14 o 64.02409 15.25376  3.197963       1.282738      3.626383       1.314105      -5.456091      5.906160      68.54769 14.81929  50.03752 24.67852  18.51017       28.78612  
1 1 1 19 17 15 o 132.7404 3.872183  11.85841       0.6841763     11.75336       0.6961719     14.82821       3.701510      132.1207 3.958788  130.3789 22.09394  1.741806       22.44581  
1 1 1 19 17 16 o 38.19189 15.46663  0.7569577      1.222961      0.8798516      1.244276      -2.738092      6.635570      39.36823 15.71924  54.34032 26.67346  -14.97210      30.96075  
1 1 1 19 17 17 o 70.34747 4.538166  3.356667       0.4231350     3.324857       1.245291      3.360819       0.4499034     65.00707 14.71938  70.30846 4.831550  -5.301384      15.49207  
1 1 1 19 18 0  o 29.07651 16.08061  0.8339497      0.9105012     0.8339497      0.9105012     0.8339497      0.9105012     29.07651 16.08061  29.07651 16.08061  0.000000       0.000000  
1 1 1 19 18 1  o 31.87344 13.16001  0.3010424      0.9068845     0.5222374      1.017412      -0.5542930     2.000679      35.23213 14.16407  39.34631 17.80311  -4.114174      22.75021  
1 1 1 19 18 2  o 212.3114 3.250551  30.16007       0.9196103     30.00059       0.9450377     33.00468       3.991202      211.7215 3.349736  213.8438 14.08505  -2.122345      14.47789  
1 1 1 19 18 3  o 38.42169 13.62344  0.9625911      0.8735856     0.7337666      0.8965262     5.263008       3.886574      36.00807 13.62649  76.53808 28.49539  -40.53001      31.58589  
1 1 1 19 18 4  o 96.12379 8.589293  6.391325       1.088595      6.432997       1.102434      4.762703       6.891922      96.40389 8.674592  76.14508 33.85171  20.25881       34.94548  
1 1 1 19 18 5  o 82.77168 27.72356  6.362139       3.599378      8.094892       4.472862      3.178363       6.063013      89.83455 30.89527  70.40077 31.49388  19.43378       44.11782  
1 1 1 19 18 6  o 46.22283 22.04079  -2.694669      3.767452      0.7639952      5.438790      -5.885157      5.223681      62.32037 28.63681  48.63162 23.82909  13.68876       37.25443  
1 1 1 19 18 7  f 63.44530 22.37658  3.275969       2.354225      3.718581       3.200148      2.753869       3.475644      66.84215 25.63606  62.43228 25.76878  4.409866       36.34883  
1 1 1 19 18 8  o 51.32279 16.89386  1.987412       1.337972      -5.507578      5.922786      2.390464       1.373477      51.93074 25.43061  55.56065 16.98159  -3.629906      30.57925  
1 1 1 19 18 9  o 55.88374 25.35937  0.5808787      4.095084      -0.4597204     5.495458      1.880216       6.140775      58.54523 27.52716  65.40214 30.18838  -6.856907      40.85441  
1 1 1 19 18 10 o 63.98807 28.50788  2.605929       4.914495      0.000000       0.000000      2.605929       4.914495      ?        ?         63.98807 28.50788  0.000000       28.50788  
1 1 1 19 18 11 o 18.18262 9.059208  -2.124268      0.8759774     -2.519186      0.9052806     3.681394       3.471008      17.60411 8.835242  65.03632 26.15629  -47.43221      27.60821  
1 1 1 19 18 12 o 72.19722 13.80301  3.942608       1.279524      3.332613       1.401946      6.984818       3.130855      64.81660 16.26123  85.16959 25.55684  -20.35300      30.29158  
1 1 1 19 18 13 o 19.46993 9.489352  -1.320363      0.7966745     -1.257122      0.8234134     -2.246934      3.151798      20.21210 9.804212  41.54959 19.90637  -21.33748      22.18978  
1 1 1 19 18 14 f 83.00303 4.001255  4.647746       0.4412479     8.329844       0.9545681     3.647183       0.4976010     110.1381 6.533587  73.20023 5.134025  36.93787       8.309391  
1 1 1 19 18 15 o 83.70344 7.283375  4.864988       0.8042815     2.550788       1.487891      5.820336       0.9559861     55.49237 17.78197  91.26891 7.939517  -35.77654      19.47394  
1 1 1 19 19 0  o 33.24303 20.58738  0.7848681      1.810397      0.7848681      1.810397      0.7848681      1.810397      33.24303 20.58738  33.24303 20.58738  0.000000       0.000000  
1 1 1 19 19 1  o 49.56034 11.29990  1.793770       0.7296265     1.822388       0.7697397     1.540461       2.290061      49.81884 11.78142  51.73685 21.08592  -1.918011      24.15404  
1 1 1 19 19 2  o 21.21453 10.42402  -1.943691      1.021692      -1.978828      1.030552      0.7350428E-01  7.808311      21.24223 10.44389  66.52060 31.72269  -45.27837      33.39766  
1 1 1 19 19 3  o 89.64198 5.865521  5.461742       0.6967861     5.546574       0.7131799     3.679902       3.268548      90.30962 5.959723  66.45065 25.79574  23.85897       26.47524  
1 1 1 19 19 4  o 96.99102 6.401694  6.415299       0.8227440     6.441823       0.8295119     4.809681       6.453892      97.17800 6.442284  73.50280 32.71278  23.67520       33.34110  
1 1 1 19 19 5  o 49.25037 13.32150  1.815060       0.8951813     1.568625       1.142894      2.206222       1.439902      46.36578 15.62285  53.54988 17.52004  -7.184101      23.47393  
1 1 1 19 19 6  o 139.7971 18.22506  15.28858       3.314256      19.27519       5.476283      12.98449       4.163261      140.6422 30.12827  118.6437 26.94977  21.99854       40.42281  
1 1 1 19 19 7  o 35.73359 15.20089  0.2916453      1.266596      4.721313       4.745008      -0.4819598E-01 1.314285      70.85893 29.74449  34.05220 14.97633  36.80673       33.30202  
1 1 1 19 19 8  o 152.9901 12.63382  17.00336       2.552622      15.58682       14.72691      17.04724       2.591852      83.07956 40.55907  152.9909 12.83179  -69.91136      42.54049  
1 1 1 19 19 9  o 44.81227 19.96865  0.2200418      2.412503      5.285815       5.223014      -1.153866      2.720051      71.33457 30.61936  41.99552 19.62342  29.33905       36.36790  
1 1 1 19 19 10 o 92.49780 4.337475  5.775420       0.5331270     10.79309       5.129455      5.720625       0.5360301     93.32927 33.01950  92.04444 4.382961  1.284828       33.30913  
1 1 1 19 19 11 o 57.22538 7.408360  2.288327       0.5516722     -1.862172      1.042316      3.903471       0.6502118     21.60696 10.59897  75.29939 6.545179  -53.69243      12.45703  
1 1 1 19 19 12 o 53.65654 10.72652  2.117668       0.7401010     1.954901       1.155762      2.230805       0.9635769     49.86407 15.63511  53.85942 13.46374  -3.995354      20.63320  
1 1 1 19 19 13 o 24.74860 10.62234  0.4577390E-01  0.6285216     -0.4403578     1.085934      0.2906575      0.7707374     28.38079 12.94871  29.31691 12.12090  -0.9361267     17.73655  
1 1 1 19 20 0  o 41.61563 23.27856  1.914813       1.933836      1.914813       1.933836      1.914813       1.933836      41.61563 23.27856  41.61563 23.27856  0.000000       0.000000  
1 1 1 19 20 1  o 52.63282 19.05091  2.092839       1.717752      1.450042       1.853707      5.999033       4.569630      48.28472 19.21715  75.77992 30.16834  -27.49520      35.76909  
1 1 1 19 20 2  o 56.73621 9.391308  2.294583       0.6851856     2.576615       0.7340707     0.3861500      1.909534      60.16185 9.469426  42.17510 18.30930  17.98676       20.61311  
1 1 1 19 20 3  o 122.0652 18.49628  11.85334       2.914352      4.377414       4.648580      16.69454       3.740798      68.85963 29.20008  142.9877 20.19481  -74.12809      35.50317  
1 1 1 19 20 4  f 33.25618 15.20748  -0.5914937     1.508906      -3.299468      3.133667      0.2258796      1.721634      39.58040 19.18193  39.61157 17.28807  -0.3116989E-01 25.82293  
1 1 1 19 20 5  o 31.45305 12.26620  0.5081514      0.7417350     0.3690926      0.7662891     2.574312       2.953762      30.25909 12.24697  58.36960 23.88711  -28.11051      26.84366  
1 1 1 19 20 6  o 23.15848 7.982248  0.3415891      0.2986289     0.8032651      0.9898562     0.2953615      0.3132232     37.01063 14.24159  22.43755 8.133186  14.57308       16.40035  
1 1 1 19 20 7  o 61.50439 6.457334  2.608292       0.5213331     4.761785       1.337201      2.222296       0.5661308     79.92171 13.00277  56.29465 7.752676  23.62706       15.13856  
1 1 1 19 20 8  o 22.76621 9.590095  0.8546527E-01  0.4959752     -3.742678      4.460979      0.1333779      0.4990693     45.94733 22.40748  23.38708 9.718853  22.56025       24.42440  
1 1 1 19 20 9  o 25.85228 11.56356  -0.2133295     0.8170874     -1.067689      7.592763      -0.2033195     0.8218601     59.32253 28.99582  26.00206 11.61626  33.32047       31.23612  
1 1 1 19 20 10 o 54.75092 21.21294  2.414167       2.207102      4.056362       4.122054      1.754134       2.613269      64.57728 27.44488  52.05536 21.97518  12.52192       35.15864  
1 1 1 19 21 0  o 66.26528 38.74116  7.078669       5.706270      7.078669       5.706270      7.078669       5.706270      66.26528 38.74116  66.26528 38.74116  0.000000       0.000000  
1 1 1 19 21 1  o 99.14543 4.229927  6.630939       0.5575450     5.457705       1.771852      6.759875       0.5873830     82.98730 16.60313  100.0510 4.416699  -17.06374      17.18054  
1 1 1 19 21 2  f 79.11092 12.16471  4.614912       1.241358      2.727640       3.377051      4.909759       1.334808      59.20007 24.98560  81.27571 12.74355  -22.07565      28.04779  
1 1 1 19 21 3  o 72.52538 12.48400  3.912298       1.162956      6.308352       2.598843      3.312359       1.300426      83.31512 22.76608  64.98541 15.27670  18.32970       27.41664  
1 1 1 19 21 4  o 116.9411 8.114742  9.518198       1.256646      9.719403       1.397230      8.666573       2.874574      117.6163 8.983076  98.81952 22.35482  18.79683       24.09219  
1 1 1 19 21 5  o 20.25149 8.717388  -0.2465277E-02 0.4256332     -0.1307632     0.4328619     3.742885       2.338760      19.03132 8.470825  64.38790 22.33142  -45.35658      23.88403  
1 1 1 19 21 6  o 97.62808 2.942806  6.390515       0.3823965     6.347327       0.3867740     8.266139       2.548860      97.28806 2.987025  98.75813 20.05411  -1.470070      20.27534  
1 1 1 20 0  0  o 69.02966 35.09366  4.768397       4.041362      4.768397       4.041362      4.768397       4.041362      69.02966 35.09366  69.02966 35.09366  0.000000       0.000000  
1 1 1 20 0  1  f 147.2440 17.64574  15.21266       3.330768      15.21266       3.330768      15.21266       3.330768      147.2440 17.64574  147.2440 17.64574  0.000000       0.000000  
1 1 1 20 0  2  f 129.2313 16.71284  11.78073       2.745634      11.78073       2.745634      11.78073       2.745634      129.2313 16.71284  129.2313 16.71284  0.000000       0.000000  
1 1 1 20 0  3  o 299.1702 17.91851  61.00371       7.083966      61.00371       7.083966      61.00371       7.083966      299.1702 17.91851  299.1702 17.91851  0.000000       0.000000  
1 1 1 20 0  4  o 210.0035 15.89807  30.17339       4.388750      30.17339       4.388750      30.17339       4.388750      210.0035 15.89807  210.0035 15.89807  0.000000       0.000000  
1 1 1 20 0  5  o 335.7387 9.307261  75.54065       4.156631      75.54065       4.156631      75.54065       4.156631      335.7387 9.307261  335.7387 9.307261  0.000000       0.000000  
1 1 1 20 0  6  o 26.65763 18.62716  -2.347757      2.436011      -2.347757      2.436011      -2.347757      2.436011      26.65763 18.62716  26.65763 18.62716  0.000000       0.000000  
1 1 1 20 0  7  o 76.25790 32.17744  5.662625       3.298555      5.662625       3.298555      5.662625       3.298555      76.25790 32.17744  76.25790 32.17744  0.000000       0.000000  
1 1 1 20 0  8  o 75.21404 40.78348  5.880613       5.735584      5.880613       5.735584      5.880613       5.735584      75.21404 40.78348  75.21404 40.78348  0.000000       0.000000  
1 1 1 20 0  9  o 116.5245 34.76460  11.55938       4.698710      11.55938       4.698710      11.55938       4.698710      116.5245 34.76460  116.5245 34.76460  0.000000       0.000000  
1 1 1 20 0  10 o 125.1567 12.72020  10.83860       2.067067      10.83860       2.067067      10.83860       2.067067      125.1567 12.72020  125.1567 12.72020  0.000000       0.000000  
1 1 1 20 0  11 o ?        ?         -6.088840      1.199629      -6.088840      1.199629      -6.088840      1.199629      ?        ?         ?        ?         0.000000       0.000000  
1 1 1 20 0  12 o 269.9765 7.189933  48.81546       2.582424      48.81546       2.582424      48.81546       2.582424      269.9765 7.189933  269.9765 7.189933  0.000000       0.000000  
1 1 1 20 0  13 o 55.33736 11.08432  2.282235       0.7250689     2.282235       0.7250689     2.282235       0.7250689     55.33736 11.08432  55.33736 11.08432  0.000000       0.000000  
1 1 1 20 0  14 o 72.48022 44.71156  4.575585       8.458929      4.575585       8.458929      4.575585       8.458929      72.48022 44.71156  72.48022 44.71156  0.000000       0.000000  
1 1 1 20 0  15 o 129.0912 24.29317  12.66240       3.746668      12.66240       3.746668      12.66240       3.746668      129.0912 24.29317  129.0912 24.29317  0.000000       0.000000  
1 1 1 20 0  16 o 16.31963 11.88990  -3.368457      1.509837      -3.368457      1.509837      -3.368457      1.509837      16.31963 11.88990  16.31963 11.88990  0.000000       0.000000  
1 1 1 20 0  17 f 120.5411 24.39244  11.30745       3.469997      11.30745       3.469997      11.30745       3.469997      120.5411 24.39244  120.5411 24.39244  0.000000       0.000000  
1 1 1 20 0  18 o 78.34278 21.36615  5.088469       1.927943      5.088469       1.927943      5.088469       1.927943      78.34278 21.36615  78.34278 21.36615  0.000000       0.000000  
1 1 1 20 0  19 o 31.97681 21.66743  -0.9813986     2.746977      -0.9813986     2.746977      -0.9813986     2.746977      31.97681 21.66743  31.97681 21.66743  0.000000       0.000000  
1 1 1 20 0  20 o 69.73875 31.22523  5.368796       3.090237      5.368796       3.090237      5.368796       3.090237      69.73875 31.22523  69.73875 31.22523  0.000000       0.000000  
1 1 1 20 0  21 o 153.9457 35.44046  21.45148       6.328699      21.45148       6.328699      21.45148       6.328699      153.9457 35.44046  153.9457 35.44046  0.000000       0.000000  
1 1 1 20 0  22 o 67.56574 33.23979  5.690129       3.568003      5.690129       3.568003      5.690129       3.568003      67.56574 33.23979  67.56574 33.23979  0.000000       0.000000  
1 1 1 20 0  23 o 23.57930 15.92319  -0.4755321     1.458971      -0.4755321     1.458971      -0.4755321     1.458971      23.57930 15.92319  23.57930 15.92319  0.000000       0.000000  
1 1 1 20 0  24 f 40.07853 18.61965  1.707136       1.102111      1.707136       1.102111      1.707136       1.102111      40.07853 18.61965  40.07853 18.61965  0.000000       0.000000  
1 1 1 20 0  25 o 87.78549 16.39116  6.035717       1.721469      6.035717       1.721469      6.035717       1.721469      87.78549 16.39116  87.78549 16.39116  0.000000       0.000000  
1 1 1 20 0  26 o 28.59799 17.48139  0.6838198      1.266206      0.6838198      1.266206      0.6838198      1.266206      28.59799 17.48139  28.59799 17.48139  0.000000       0.000000  
1 1 1 20 1  0  o 49.75330 26.73434  2.429464       2.443463      2.429464       2.443463      2.429464       2.443463      49.75330 26.73434  49.75330 26.73434  0.000000       0.000000  
1 1 1 20 1  1  o 101.3966 18.07714  7.214448       2.352870      8.781796       2.809299      3.531841       4.306190      111.7004 19.58811  79.28175 29.89488  32.41862       35.74070  
1 1 1 20 1  2  o 203.6679 8.798060  27.85172       2.382087      26.91298       5.882703      28.03583       2.605231      195.8877 22.97302  204.1913 9.601819  -8.303650      24.89889  
1 1 1 20 1  3  o 274.8512 7.317865  50.57756       2.677743      49.27176       2.829267      61.79819       8.293632      271.1801 7.837879  298.8035 20.96282  -27.62344      22.38017  
1 1 1 20 1  4  f 334.3220 13.58411  75.68921       6.038988      114.3207       14.21290      67.17834       6.671125      402.1802 26.67160  313.9469 15.99940  88.23334       31.10233  
1 1 1 20 1  5  o 98.91818 12.79169  6.712169       1.646639      9.269436       2.952669      5.557846       1.983765      114.5452 20.07625  88.79263 17.38887  25.75261       26.55991  
1 1 1 20 1  6  o 278.3454 9.750425  52.10118       3.610853      53.03217       4.314722      49.92527       6.596316      280.2957 11.57707  269.2484 18.49787  11.04733       21.82200  
1 1 1 20 1  7  o 295.2349 16.66997  59.68793       6.531427      56.59042       9.092112      62.99081       9.388694      283.1761 24.33107  299.2457 23.73968  -16.06958      33.99372  
1 1 1 20 1  8  o 276.2464 13.97184  51.89052       5.126387      57.85081       7.695466      47.13540       6.873566      288.6573 20.13306  260.5271 19.95137  28.13022       28.34426  
1 1 1 20 1  9  o 277.4777 12.24832  52.14627       4.517587      57.40636       7.060843      48.50069       5.878183      288.2299 18.48155  265.7354 16.68468  22.49460       24.89872  
1 1 1 20 1  10 o 254.5961 11.73773  43.89030       3.971359      37.38469       7.585399      46.34692       4.661256      228.2903 25.36305  260.9911 13.44840  -32.70079      28.70790  
1 1 1 20 1  11 o 230.8104 8.439698  35.82138       2.591337      35.11348       4.098844      36.29271       3.344543      226.8600 13.62182  231.6338 10.86609  -4.773819      17.42487  
1 1 1 20 1  12 o 69.86189 10.49157  3.365000       0.9465382     3.388173       0.9544346     1.981933       7.373656      70.09533 10.54476  85.10120 36.45197  -15.00587      37.94652  
1 1 1 20 1  13 o 311.5066 5.993359  64.96245       2.487775      64.84808       3.773668      65.05035       3.308530      310.1190 9.141891  311.0396 7.989243  -0.9205627     12.14093  
1 1 1 20 1  14 o 206.6672 22.21260  30.83761       6.021177      37.97709       8.346802      23.09132       8.694285      224.2000 28.58844  164.7559 40.00715  59.44411       49.17185  
1 1 1 20 1  15 o 126.9241 11.01914  11.03415       1.845206      10.90100       2.071100      11.54657       4.063076      125.6517 12.53686  123.1342 25.59898  2.517525       28.50404  
1 1 1 20 1  16 o 159.8509 6.230474  17.18141       1.324577      19.54595       2.357501      16.09062       1.601210      169.1246 10.51294  154.2794 7.814182  14.84518       13.09898  
1 1 1 20 1  17 o 111.9593 7.824703  8.509290       1.160003      8.978777       1.244382      5.395407       3.204743      114.9234 8.179367  82.80524 26.04539  32.11813       27.29953  
1 1 1 20 1  18 o 126.0682 9.439033  10.90221       1.574135      10.95848       1.967875      10.80224       2.623070      125.3397 11.92599  121.9911 16.56397  3.348679       20.41064  
1 1 1 20 1  19 o 98.95290 19.25662  7.475168       2.447715      6.331381       2.681269      13.19584       5.996413      88.82795 22.60104  115.3518 35.52466  -26.52388      42.10473  
1 1 1 20 1  20 o 34.43212 15.71315  -0.7105603     1.600260      -0.1937984     1.743692      -3.469652      4.029096      38.54838 17.08837  46.89703 22.47859  -8.348652      28.23649  
1 1 1 20 1  21 o 149.1970 23.39669  18.61331       4.498619      15.53484       8.009564      20.03196       5.437245      104.8775 40.47066  147.6792 28.66430  -42.80169      49.59351  
1 1 1 20 1  22 o 73.64284 25.33616  5.002740       3.008125      5.798960       3.614358      3.208156       5.426210      76.97590 27.66424  66.68545 29.81567  10.29045       40.67290  
1 1 1 20 1  23 o 35.87926 14.40583  0.6214526      1.051015      0.3406483      1.096913      3.767763       3.671734      34.01858 14.29195  64.99786 26.61983  -30.97929      30.21383  
1 1 1 20 1  24 o 46.61549 15.20094  1.670926       1.084366      1.320643       1.584007      1.979861       1.487580      45.07186 17.81996  50.25349 17.78156  -5.181629      25.17409  
1 1 1 20 1  25 o 32.99689 12.89310  0.6069546      0.8207719     -1.301764      1.155562      2.550317       1.166002      25.14995 12.05041  56.34488 15.18783  -31.19494      19.38769  
1 1 1 20 2  0  o 163.4881 13.76596  18.30922       2.948180      18.30922       2.948180      18.30922       2.948180      163.4881 13.76596  163.4881 13.76596  0.000000       0.000000  
1 1 1 20 2  1  o 331.7404 10.03533  73.95852       4.431024      79.52529       6.725313      69.68838       5.890222      342.3112 14.77891  320.7772 13.81254  21.53403       20.22875  
1 1 1 20 2  2  o 122.0078 13.59033  10.17911       2.172025      11.90946       2.630837      6.474630       3.849383      131.6718 15.27760  94.75838 28.31581  36.91346       32.17437  
1 1 1 20 2  3  o 38.72812 17.59897  -1.121571      1.980751      -2.986569      2.876257      0.5607178      2.731738      42.08386 19.82672  54.30616 22.66637  -12.22230      30.11417  
1 1 1 20 2  4  o 226.9325 14.22000  35.00423       4.278399      34.74546       4.923719      35.80187       8.644558      225.3168 16.51403  222.3092 29.94240  3.007553       34.19445  
1 1 1 20 2  5  o 205.4461 16.26552  28.91207       4.416553      24.28620       5.537228      37.00101       7.322206      185.6887 22.86063  228.9261 24.37795  -43.23744      33.41995  
1 1 1 20 2  6  o 69.54716 21.12089  3.380964       2.129184      1.855465       2.617946      6.361608       3.659399      60.58862 23.19981  93.59066 27.51838  -33.00204      35.99295  
1 1 1 20 2  7  o 254.1141 14.27709  43.94375       4.814950      43.70316       6.750793      44.19287       6.869494      250.7262 20.38170  252.0039 20.63771  -1.277756      29.00567  
1 1 1 20 2  8  o 344.1718 13.37465  80.36339       6.122150      73.85780       7.684863      91.66435       10.12863      327.7404 17.66200  362.9095 21.03508  -35.16901      27.46672  
1 1 1 20 2  9  o 30.10083 12.92882  -0.4930736E-01 0.9323523     8.465548       4.967760      -0.3601851     0.9492198     106.2683 32.25930  28.10638 12.52491  78.16196       34.60543  
1 1 1 20 2  10 o 174.4428 8.633738  20.48192       2.000662      20.71802       8.167550      20.46685       2.063528      161.5369 38.49333  174.3205 8.913173  -12.78363      39.51178  
1 1 1 20 2  11 o 102.4053 6.600074  7.049922       0.8958309     1.970019       1.693356      9.024160       1.055651      55.32810 19.01029  115.8733 6.867774  -60.54517      20.21281  
1 1 1 20 2  12 o 167.1189 3.629111  18.63797       0.8081639     23.90475       2.146730      17.76828       0.8723406     188.3771 8.574642  163.1439 4.012746  25.23320       9.467134  
1 1 1 20 2  13 o 159.8480 1.908549  17.03232       0.4065219     10.58300       7.776315      17.04999       0.4070786     114.4763 40.64078  159.9308 1.910172  -45.45452      40.68565  
1 1 1 20 2  14 o 216.7964 13.46212  32.30044       3.869824      38.01575       7.844597      30.46225       4.448824      225.8708 26.57148  209.1569 16.08593  16.71382       31.06124  
1 1 1 20 2  15 o 102.5093 4.283056  7.035856       0.5837578     7.006984       0.5887705     8.709803       4.483134      102.2929 4.329222  104.3412 30.39765  -2.048241      30.70438  
1 1 1 20 2  16 o 131.5499 8.878899  11.76520       1.547290      12.41949       1.737494      9.258002       3.401197      134.9073 9.730658  109.9906 23.89132  24.91669       25.79691  
1 1 1 20 2  17 o 137.9958 7.677738  12.90260       1.406232      11.86276       1.849136      14.32877       2.165565      131.2819 10.66208  144.0519 11.37403  -12.77002      15.59001  
1 1 1 20 2  18 o 86.27667 9.061573  5.124220       1.026237      5.992877       1.154825      1.862285       2.237842      93.25647 9.422261  55.64096 21.41270  37.61551       23.39408  
1 1 1 20 2  19 o 136.8917 11.54932  13.11406       2.087086      15.75403       2.801144      9.819521       3.129200      148.2550 14.35877  111.7324 21.80047  36.52261       26.10431  
1 1 1 20 2  20 o 63.50399 24.81194  2.942156       3.039547      3.824446       3.504437      0.2627678      6.107037      69.19302 26.75126  64.71690 29.95430  4.476128       40.16080  
1 1 1 20 2  21 o 56.42733 17.51621  2.469675       1.454476      2.210673       1.491478      7.496279       6.570557      53.84698 17.84139  81.89562 34.72130  -28.04865      39.03696  
1 1 1 20 2  22 o 45.42802 20.96090  -0.7200340     2.956523      -3.701289      3.918813      3.218745       4.504388      44.19421 21.42568  65.07045 28.18527  -20.87624      35.40437  
1 1 1 20 2  23 o 43.98383 17.83479  1.072302       1.628498      0.9368287      1.721803      2.221619       5.015072      43.68751 18.09441  61.56306 27.98656  -17.87555      33.32650  
1 1 1 20 2  24 o 35.44801 15.28126  0.2623715      1.311629      0.5124109      1.359631      -3.092339      4.980170      37.59240 15.85922  48.80719 23.77403  -11.21479      28.57830  
1 1 1 20 2  25 o 40.66313 16.49422  0.9527084      1.393459      -3.371763      6.686125      1.149071       1.424744      52.41282 25.92511  42.36708 16.85226  10.04574       30.92103  
1 1 1 20 3  0  o 146.4432 13.89750  14.77470       2.652399      14.77470       2.652399      14.77470       2.652399      146.4432 13.89750  146.4432 13.89750  0.000000       0.000000  
1 1 1 20 3  1  o 176.1548 9.513535  20.88187       2.224823      20.19393       2.723701      22.26119       3.856731      172.7325 11.90630  180.2354 16.23226  -7.502899      20.13073  
1 1 1 20 3  2  o 216.5691 10.27782  31.58257       2.957535      31.87582       3.410797      30.69396       5.937426      217.2042 11.82923  209.7927 21.54485  7.411545       24.57867  
1 1 1 20 3  3  o 334.1679 9.232076  74.97179       4.106967      70.07041       9.174567      76.20010       4.592843      317.5479 21.81471  336.5980 10.25187  -19.05014      24.10357  
1 1 1 20 3  4  o 372.0284 10.84269  93.19412       5.369368      92.71842       5.828748      95.86012       13.79875      370.7122 11.81462  366.2296 28.49988  4.482605       30.85172  
1 1 1 20 3  5  o 203.8802 9.701170  27.97937       2.627998      27.65704       2.773991      30.80210       8.208939      202.5662 10.31087  205.0046 31.01895  -2.438416      32.68776  
1 1 1 20 3  6  o 230.8935 15.91441  36.47813       4.866435      36.48253       5.582683      36.46418       9.930754      229.9116 18.37535  220.4357 34.97512  9.475983       39.50839  
1 1 1 20 3  7  f 344.9676 12.74401  80.57639       5.848043      83.01435       6.584480      71.46982       12.72579      349.4978 14.16788  312.9159 30.92380  36.58191       34.01485  
1 1 1 20 3  8  o 125.2727 10.59429  10.64125       1.751921      12.59879       3.454000      9.963194       2.032817      133.6708 20.00574  120.6874 12.83720  12.98340       23.77022  
1 1 1 20 3  9  o 175.5215 7.300333  20.67157       1.703717      15.34508       3.900888      21.92710       1.893897      147.4837 20.39457  180.6777 7.885432  -33.19395      21.86592  
1 1 1 20 3  10 o 102.1724 31.10180  7.829793       4.613337      2.724835       7.607862      10.79859       5.801721      88.98402 37.52604  118.0882 34.63002  -29.10420      51.06311  
1 1 1 20 3  11 o 171.7380 4.888055  19.72082       1.117465      16.40911       6.872750      19.81075       1.132535      143.9736 35.93851  172.1225 4.943001  -28.14893      36.27685  
1 1 1 20 3  12 f 202.9514 1.790757  27.45391       0.4842864     32.96313       3.721698      27.35902       0.4884394     219.8280 12.76014  202.5996 1.809250  17.22844       12.88777  
1 1 1 20 3  13 o 53.81513 13.99248  2.055513       1.012616      5.061827       6.677553      1.984752       1.024464      91.29757 36.42808  52.92118 14.22370  38.37638       39.10650  
1 1 1 20 3  14 o 102.0759 9.735800  7.107717       1.308224      -1.900714      4.745925      7.848501       1.360950      59.17728 27.02640  107.3359 9.617139  -48.15863      28.68650  
1 1 1 20 3  15 o 75.95879 12.29277  4.041270       1.201749      3.730650       1.259552      7.194398       4.013029      72.56687 13.52320  95.48294 28.99602  -22.91607      31.99447  
1 1 1 20 3  16 o 104.7576 2.443003  7.320837       0.3410226     7.394707       0.3441251     3.279402       2.545377      105.2843 2.452897  67.74811 23.30614  37.53618       23.43487  
1 1 1 20 3  17 o 32.77365 15.15695  -1.094367      1.558926      1.364101       4.455434      -1.437333      1.664115      65.51631 28.20308  32.69433 15.30055  32.82198       32.08614  
1 1 1 20 3  18 o 63.67416 15.87221  3.003427       1.341914      3.138479       1.388353      1.085353       5.232159      65.02811 16.10681  66.82191 29.61255  -1.793800      33.70953  
1 1 1 20 3  19 o 178.6131 11.98795  22.38140       2.836673      22.57102       3.032656      21.05497       8.021025      178.7333 12.81851  137.8100 40.79911  40.92329       42.76543  
1 1 1 20 3  20 o 42.95232 15.38483  1.223188       1.116807      1.377777       1.141305      -2.262235      5.419266      44.71819 15.59459  56.50265 26.79684  -11.78446      31.00422  
1 1 1 20 3  21 o 85.64859 13.53819  5.399997       1.493801      4.977349       1.512595      22.09249       9.505916      81.65533 14.42918  116.3361 44.29031  -34.68072      46.58146  
1 1 1 20 3  22 o 71.70049 29.33384  5.023887       4.452707      -0.8795196     5.462565      16.71312       7.686671      56.79734 26.92697  105.0440 39.86584  -48.24665      48.10766  
1 1 1 20 3  23 o 76.88177 13.16968  4.417279       1.300680      4.315458       1.360418      5.500874       4.438000      75.42548 14.05261  71.95079 29.34264  3.474693       32.53408  
1 1 1 20 3  24 o 69.75392 11.84391  3.609782       1.061543      3.353217       1.091547      8.085153       4.558890      66.65220 12.75457  80.53471 30.66918  -13.88251      33.21562  
1 1 1 20 3  25 o 33.47812 14.68092  0.9979785E-01  1.254591      0.5691333      1.301483      -6.063471      4.716311      37.09472 15.57497  42.37115 21.09616  -5.276428      26.22266  
1 1 1 20 4  0  o 79.60957 22.37599  5.171207       2.054523      5.171207       2.054523      5.171207       2.054523      79.60957 22.37599  79.60957 22.37599  0.000000       0.000000  
1 1 1 20 4  1  o 66.97368 19.70241  3.141957       1.875460      0.5417985      2.406419      7.164680       2.993170      51.32262 21.33570  99.69188 22.99993  -48.36926      31.37211  
1 1 1 20 4  2  o 43.16324 19.06853  -0.5673929     2.153162      -0.2051057     3.578443      -0.7729962     2.695768      57.82092 25.08314  47.84872 21.22738  9.972198       32.85979  
1 1 1 20 4  3  o 291.5875 12.06176  57.43545       4.676428      56.90994       11.14926      57.54764       5.151478      280.3620 30.32589  291.4427 13.29999  -11.08072      33.11419  
1 1 1 20 4  4  o 196.0653 19.43998  26.67619       5.012100      25.66270       5.529716      31.34209       11.86483      191.1664 22.11528  196.5873 46.09740  -5.420929      51.12784  
1 1 1 20 4  5  o 107.9897 19.30843  8.244282       2.676458      8.668908       3.044036      6.797693       5.618477      110.1262 21.51553  98.91452 34.59332  11.21168       40.73838  
1 1 1 20 4  6  o 268.9225 12.55645  48.97888       4.487110      45.27013       5.300930      58.35315       8.427655      257.4090 15.52668  288.8616 22.06184  -31.45261      26.97782  
1 1 1 20 4  7  o 65.38446 22.35426  2.794681       2.340747      2.053177       3.419094      3.448795       3.211301      66.62109 26.23002  73.50532 26.11441  -6.884232      37.01320  
1 1 1 20 4  8  o 246.8841 9.740445  41.05276       3.198102      39.61656       5.906890      41.64835       3.803855      239.0963 18.68850  248.1352 11.53592  -9.038940      21.96218  
1 1 1 20 4  9  o 172.8263 12.32641  20.31368       2.820068      19.22453       4.180347      21.22329       3.820287      165.6905 19.29452  175.2743 16.55310  -9.583786      25.42211  
1 1 1 20 4  10 o 226.1131 6.073394  34.22828       1.828257      49.51317       10.45956      33.74657       1.856843      257.8469 31.06767  224.4901 6.213300  33.35684       31.68288  
1 1 1 20 4  11 o 286.9275 6.286446  55.11317       2.403538      55.24726       12.55326      55.10807       2.448844      266.2525 36.32919  286.8881 6.405824  -20.63559      36.88962  
1 1 1 20 4  12 o 125.0333 9.983822  10.61741       1.649589      8.346900       6.296035      10.78476       1.709301      104.4266 36.61263  125.9511 10.27375  -21.52448      38.02676  
1 1 1 20 4  13 o 296.9572 10.94363  59.86812       4.322999      58.80571       7.970119      60.31097       5.145694      287.3012 20.96297  296.9014 13.03823  -9.600189      24.68687  
1 1 1 20 4  14 o 327.1755 9.127111  72.36639       3.975238      68.04415       6.431147      75.03892       5.057029      313.0381 15.46552  331.7930 11.45530  -18.75491      19.24594  
1 1 1 20 4  15 o 185.5963 5.068300  23.07982       1.252271      23.44606       1.285277      16.22255       5.561474      187.0446 5.161709  142.2543 30.26998  44.79034       30.70692  
1 1 1 20 4  16 o 77.78155 8.526629  4.141796       0.8692781     3.662817       0.9342750     7.229337       2.372044      72.74369 9.894683  99.14127 18.63944  -26.39758      21.10292  
1 1 1 20 4  17 o 29.70219 14.09306  -1.654726      1.502341      -2.025388      1.531916      7.667903       7.682726      28.77666 13.81092  94.14359 38.52535  -65.36693      40.92608  
1 1 1 20 4  18 o 114.2832 11.51355  9.130260       1.729463      9.716693       1.819882      3.664676       5.555870      117.8160 11.74866  75.59989 31.98437  42.21606       34.07391  
1 1 1 20 4  19 o 94.98605 7.436633  6.165328       0.9337612     6.009438       0.9609703     8.801820       3.951983      93.66379 7.769385  99.18803 28.43373  -5.524246      29.47609  
1 1 1 20 4  20 o 74.99413 13.63964  4.136157       1.312830      4.193160       1.344765      2.978544       6.060080      75.39197 13.89782  70.20940 31.44151  5.182564       34.37612  
1 1 1 20 4  21 o 28.17401 11.31724  0.3139264      0.6489653     0.5207751      0.6612710     -5.089133      3.379659      30.81532 11.69335  38.34674 18.86521  -7.531424      22.19528  
1 1 1 20 4  22 f 79.87791 22.30902  5.587407       2.465308      5.466389       2.633428      6.445454       7.012151      77.95112 23.44975  75.17540 33.73125  2.775719       41.08148  
1 1 1 20 4  23 o 89.05890 9.320620  5.606635       1.089741      5.625798       1.105656      4.955334       6.445936      89.14095 9.452151  69.24588 31.57582  19.89507       32.96021  
1 1 1 20 4  24 o 64.51720 14.85248  3.279276       1.250424      3.669863       1.264196      -14.35565      8.494587      68.75168 14.26713  48.66723 24.72607  20.08445       28.54697  
1 1 1 20 4  25 o 90.66914 8.988016  5.848260       1.071640      5.625587       1.081392      18.02823       7.997825      88.72753 9.283673  91.09955 38.45002  -2.372017      39.55491  
1 1 1 20 5  0  o 38.77231 24.68414  0.3653425      2.803818      0.3653425      2.803818      0.3653425      2.803818      38.77231 24.68414  38.77231 24.68414  0.000000       0.000000  
1 1 1 20 5  1  o 155.0961 12.53681  16.34341       2.568898      12.02804       5.078928      17.82693       2.977903      127.1089 30.39715  161.6612 13.96058  -34.55225      33.44973  
1 1 1 20 5  2  o 103.8730 8.593731  7.282952       1.178848      4.711608       7.551309      7.347183       1.193480      96.43417 38.65010  104.3222 8.663598  -7.887993      39.60919  
1 1 1 20 5  3  o 83.31348 23.10789  4.992180       2.655003      4.175053       3.044185      7.589071       5.426917      77.87139 25.47423  102.5386 34.03473  -24.66716      42.51234  
1 1 1 20 5  4  o 240.2462 13.43191  39.19185       4.282874      41.83870       6.220748      36.80658       5.905349      245.9243 19.13358  230.4521 19.41082  15.47221       27.25571  
1 1 1 20 5  5  o 364.6999 22.65675  93.09217       10.95612      91.37612       14.38522      95.46265       16.90707      354.2668 30.77793  356.6595 36.06992  -2.392670      47.41646  
1 1 1 20 5  6  o 294.9091 14.74048  59.27588       5.774236      60.64479       7.353406      57.07423       9.325568      296.2878 18.72093  283.5498 24.93526  12.73795       31.18077  
1 1 1 20 5  7  o 145.9573 9.693748  14.38604       1.874663      9.192446       3.465570      16.53441       2.228924      112.4646 23.86485  156.2867 10.76869  -43.82204      26.18197  
1 1 1 20 5  8  o 222.7825 7.125297  33.27443       2.112510      29.23855       4.952543      34.17206       2.335649      205.2427 18.30044  225.6367 7.779911  -20.39400      19.88550  
1 1 1 20 5  9  o 266.4504 7.358413  47.61699       2.610105      59.30563       12.19446      47.05578       2.672030      280.6389 33.25484  264.8208 7.579887  15.81805       34.10775  
1 1 1 20 5  10 o 122.8809 4.487849  10.09739       0.7336113     9.330541       3.412546      10.13455       0.7511740     112.9598 23.44020  123.0969 4.587544  -10.13712      23.88490  
1 1 1 20 5  11 o 194.3661 11.16568  25.64828       2.879704      19.81036       6.280011      27.20265       3.240472      161.4262 30.30803  199.8208 12.22866  -38.39459      32.68206  
1 1 1 20 5  12 o 283.7003 22.36615  57.66213       8.386870      54.74683       10.73617      62.22659       13.43389      268.5642 30.54239  278.8570 37.07066  -10.29279      48.03198  
1 1 1 20 5  13 o 359.2240 23.55059  93.75417       11.21086      93.75417       11.21086      0.000000       0.000000      359.2240 23.55059  ?        ?         0.000000       23.55059  
1 1 1 20 5  14 o 280.5273 9.766760  53.38255       3.645324      51.08248       4.249229      59.79343       7.094113      273.3573 11.69258  290.4507 18.42453  -17.09344      21.82154  
1 1 1 20 5  15 o 243.6381 6.957515  39.97097       2.256462      40.26445       2.344035      36.26194       8.333047      244.4386 7.204352  213.4069 30.14191  31.03174       30.99093  
1 1 1 20 5  16 o 111.7628 6.936972  8.447634       1.028003      7.712849       1.210449      10.34901       1.947154      106.3381 8.616228  121.9952 12.13890  -15.65710      14.88597  
1 1 1 20 5  17 o 26.09659 12.18892  -0.9215385     1.047560      -1.178935      1.088874      2.278585       3.839369      25.54086 12.08300  65.61620 27.08332  -40.07534      29.65646  
1 1 1 20 5  18 o 60.52724 11.87619  2.629119       0.9236329     2.300619       0.9768894     5.397904       2.836102      56.14690 13.26868  81.15532 24.31760  -25.00842      27.70205  
1 1 1 20 5  19 o 100.9250 6.846669  6.937139       0.9153200     6.883681       0.9274169     8.946301       5.685644      100.4946 6.968789  92.70816 34.47492  7.786423       35.17221  
1 1 1 20 5  20 o 111.6689 10.83932  8.806862       1.592636      8.936813       1.639798      6.644668       6.688781      112.3450 11.09861  80.08259 34.51556  32.26237       36.25607  
1 1 1 20 5  21 o 84.20014 11.08154  5.080820       1.213179      4.996981       1.251932      6.372491       4.913988      83.21937 11.60491  77.74102 31.17155  5.478348       33.26169  
1 1 1 20 5  22 o 40.90350 19.19832  -1.369610      2.652588      -3.781270      2.974704      7.991861       5.860813      37.34720 18.23185  80.18972 33.31310  -42.84252      37.97581  
1 1 1 20 5  23 o 54.05132 16.01794  2.322981       1.235855      2.562142       1.250841      -7.479512      8.008030      56.71981 15.90880  53.66447 26.83780  3.055340       31.19868  
1 1 1 20 5  24 o 74.93683 9.351576  4.016030       0.9135320     3.937299       0.9272548     6.617079       5.329658      74.04330 9.625721  71.04346 30.71560  2.999840       32.18855  
1 1 1 20 5  25 f 38.53327 16.71379  0.4399985      1.588407      -0.4214732E-01 1.646897      6.868483       6.013557      36.42142 16.34432  68.75379 31.01007  -32.33237      35.05369  
1 1 1 20 6  0  o 277.4424 13.02627  52.00899       4.791507      52.00899       4.791507      52.00899       4.791507      277.4424 13.02627  277.4424 13.02627  0.000000       0.000000  
1 1 1 20 6  1  o 211.9037 8.581544  30.16328       2.418122      29.74494       3.579295      30.51454       3.279782      209.3573 12.89282  212.4157 11.63176  -3.058395      17.36441  
1 1 1 20 6  2  o 218.6077 9.608126  32.16635       2.792000      33.60766       3.549667      29.82801       4.521288      222.8363 11.99866  208.4659 16.40840  14.37036       20.32741  
1 1 1 20 6  3  o 156.2142 22.91764  17.34282       4.628715      7.488461       6.396270      28.17706       6.706744      103.4839 36.84618  198.2246 26.01859  -94.74073      45.10662  
1 1 1 20 6  4  o 213.8349 14.34910  31.18242       4.064952      26.33344       4.938463      41.37035       7.158294      194.5928 19.29948  242.6754 22.38882  -48.08261      29.55891  
1 1 1 20 6  5  o 257.1020 17.33763  45.49883       5.905025      45.49883       5.905025      0.000000       0.000000      257.1020 17.33763  ?        ?         0.000000       17.33763  
1 1 1 20 6  6  o 82.44376 12.77564  4.704376       1.358131      9.275044       8.993752      4.597716       1.373886      114.5300 43.19980  81.40650 13.11056  33.12354       45.14543  
1 1 1 20 6  7  o 177.8532 7.905302  21.25234       1.868818      19.00241       4.416368      21.74309       2.062585      164.1882 20.64103  179.7549 8.636348  -15.56662      22.37496  
1 1 1 20 6  8  o 56.51166 12.44489  2.245564       0.9117466     4.795448       7.478539      2.207092       0.9185988     94.88403 38.31108  55.99669 12.61466  38.88734       40.33446  
1 1 1 20 6  9  o 42.06805 8.618873  1.231992       0.4668860     7.131570       4.275486      1.160791       0.4696949     97.61709 29.98500  40.77728 8.895084  56.83981       31.27656  
1 1 1 20 6  10 o 242.2961 12.51056  39.97662       4.025535      43.15970       5.048156      34.41761       6.671247      250.5178 15.19383  219.0778 23.20495  31.44005       27.73666  
1 1 1 20 6  11 o 121.4282 7.856489  9.947036       1.264400      9.483982       3.896447      10.00153       1.336736      112.0597 26.51129  121.6760 8.294144  -9.616310      27.77843  
1 1 1 20 6  12 o 356.7437 12.47424  86.88405       5.920728      74.84733       10.28500      92.84998       7.240846      320.5410 24.25958  366.9835 14.83767  -46.44247      28.43736  
1 1 1 20 6  13 o 174.1727 10.97578  20.70035       2.534398      25.11396       3.156093      12.68696       4.252664      191.2811 12.45003  129.3301 25.58318  61.95096       28.45176  
1 1 1 20 6  14 o 133.2543 8.189174  12.02654       1.447078      12.66929       1.621544      9.512528       3.206966      136.5655 8.960241  112.7756 22.13123  23.78989       23.87629  
1 1 1 20 6  15 o 74.54252 10.17464  3.850629       0.9842882     3.729827       0.9871954     24.27061       12.83492      73.28130 10.40153  142.0152 51.97454  -68.73394      53.00513  
1 1 1 20 6  16 o 124.5399 5.282594  10.42549       0.8746652     9.863445       0.9003673     19.85042       3.687007      121.0647 5.596355  166.0092 16.90293  -44.94447      17.80529  
1 1 1 20 6  17 o 145.2402 3.165320  14.09630       0.6126013     13.96535       0.6165999     24.09538       5.387860      144.5591 3.200992  175.3854 23.65685  -30.82635      23.87243  
1 1 1 20 6  18 o 35.67358 14.35148  0.5156185      1.045288      0.6653078      1.125127      -0.4282351     2.825259      37.87377 15.00449  47.35056 21.31481  -9.476791      26.06638  
1 1 1 20 6  19 o 84.65482 10.47853  5.051603       1.156810      5.127427       1.175232      2.689750       6.559162      85.25536 10.57128  71.04169 32.18080  14.21367       33.87264  
1 1 1 20 6  20 o 136.4883 6.208787  12.65932       1.126256      12.51474       1.131121      29.35720       12.15567      135.6774 6.273432  119.5160 48.62868  16.16142       49.03167  
1 1 1 20 6  21 o 104.1120 8.140838  7.509075       1.120415      7.317265       1.133219      15.85359       7.474444      102.6620 8.356016  103.7646 39.32748  -1.102577      40.20540  
1 1 1 20 6  22 o 49.26436 20.98738  1.194463       2.420585      0.9560868      3.119842      1.554980       3.836746      51.59695 22.86600  56.50569 25.18064  -4.908741      34.01350  
1 1 1 20 6  23 o 27.83854 12.16047  -0.1929898E-01 0.8534309     0.1208664      0.8653581     -4.999168      5.158036      29.13337 12.48340  46.70895 23.04174  -17.57558      26.20605  
1 1 1 20 6  24 o 30.98196 14.73217  -1.401276      1.659374      -2.379245      1.743829      7.967829       5.397471      28.85539 14.05828  74.69466 31.55954  -45.83927      34.54909  
1 1 1 20 7  0  o 299.8699 13.86714  60.83289       5.513988      60.83289       5.513988      60.83289       5.513988      299.8699 13.86714  299.8699 13.86714  0.000000       0.000000  
1 1 1 20 7  1  o 77.31840 17.88325  4.259461       1.805783      5.244586       3.969399      4.002376       2.027764      86.76840 29.11437  74.79452 19.97070  11.97388       35.30546  
1 1 1 20 7  2  o 138.7194 11.51452  13.06862       2.109247      8.412926       3.109692      17.03563       2.870498      108.0405 22.33841  157.9116 13.77963  -49.87108      26.24658  
1 1 1 20 7  3  o 427.8513 17.87802  125.9328       10.17016      150.1035       22.96870      120.0383       11.34266      441.5633 39.45157  415.6106 20.54486  25.95270       44.48053  
1 1 1 20 7  4  o 198.5955 15.22745  27.02514       3.998936      26.36680       4.829412      28.46106       7.132394      194.7318 18.84692  197.7740 27.83296  -3.042145      33.61369  
1 1 1 20 7  5  o 355.4300 17.08689  86.85027       8.068946      120.2052       16.77637      76.81200       9.203386      404.1002 31.40186  331.6540 20.93196  72.44614       37.73889  
1 1 1 20 7  6  o 212.3598 11.58451  30.55792       3.265695      25.71674       12.04626      30.94193       3.392745      171.5000 49.78930  213.5737 11.96937  -42.07367      51.20781  
1 1 1 20 7  7  o 164.4459 7.117242  18.15129       1.555890      22.53929       5.424302      17.75789       1.624137      177.3376 23.53507  162.5813 7.517193  14.75627       24.70643  
1 1 1 20 7  8  o 312.6496 7.035473  65.50308       2.931060      82.87128       8.701012      63.27990       3.113005      345.0276 18.99861  307.1492 7.606009  37.87842       20.46457  
1 1 1 20 7  9  o 87.23854 2.799194  5.080775       0.3249768     9.640663       4.978745      5.061265       0.3256713     111.5445 31.89474  87.06998 2.810651  24.47456       32.01834  
1 1 1 20 7  10 o 120.2730 10.98824  9.872859       1.741610      18.87229       3.959655      7.714242       1.939267      163.6615 18.47952  105.3108 14.17943  58.35072       23.29268  
1 1 1 20 7  11 o 177.6907 7.961090  21.27584       1.880211      24.21975       4.347385      20.59849       2.085328      185.6159 17.79445  174.5615 8.995384  11.05443       19.93889  
1 1 1 20 7  12 o 82.45448 16.64599  4.887053       1.765838      6.961838       3.671041      4.262480       2.014163      94.94202 27.46259  76.17071 19.69853  18.77131       33.79683  
1 1 1 20 7  13 o 280.4247 12.49760  54.00875       4.658263      48.32234       8.405355      56.52948       5.596302      253.9862 25.16602  285.2259 14.77480  -31.23970      29.18259  
1 1 1 20 7  14 o 173.6283 9.967805  20.56881       2.296491      18.32360       3.173499      23.03710       3.327422      161.5070 14.91436  181.8553 13.83503  -20.34831      20.34320  
1 1 1 20 7  15 o 175.7293 7.193526  20.86523       1.680895      22.18322       2.155991      18.82239       2.684154      180.5045 8.991971  164.6778 12.32136  15.82672       15.25357  
1 1 1 20 7  16 f 63.32586 15.57526  2.956327       1.305036      2.328991       1.372761      8.847743       4.206827      56.35301 16.92580  101.5129 29.40892  -45.15991      33.93180  
1 1 1 20 7  17 o 96.28983 12.61865  6.586340       1.580151      6.922182       1.622452      0.3964210      6.965421      98.74728 12.61820  70.11523 32.28740  28.63205       34.66547  
1 1 1 20 7  18 o 30.83881 11.63588  0.5139227      0.6526113     0.4909954      0.6583334     1.815669       4.960585      30.62109 11.65611  65.40081 28.91552  -34.77972      31.17647  
1 1 1 20 7  19 o 54.22349 11.38579  2.136747       0.7964332     2.191829       0.8081305     0.2752604      4.697948      54.92337 11.41510  58.56008 26.79932  -3.636707      29.12916  
1 1 1 20 7  20 o 135.9352 6.022833  12.55336       1.088245      12.76910       1.137844      10.23929       3.726499      136.9997 6.249348  105.3629 26.55558  31.63684       27.28100  
1 1 1 20 7  21 o 50.72811 17.45454  1.961774       1.427693      2.249338       1.462977      -3.785130      6.540146      53.57013 17.66691  55.26279 26.98982  -1.692669      32.25787  
1 1 1 20 7  22 o 54.53546 21.58288  2.257941       2.325719      1.493072       2.501686      7.128225       6.312721      50.84864 21.48512  74.73314 32.84671  -23.88450      39.24942  
1 1 1 20 7  23 o 30.06097 10.87481  0.5735046      0.5596230     0.5070978      0.5626060     6.785965       5.441638      29.14175 10.84314  72.13969 31.11235  -42.99794      32.94772  
1 1 1 20 7  24 f 48.61345 17.05035  1.890916       1.365519      1.251285       1.394651      16.72341       6.715960      42.97165 16.80192  97.86630 37.23504  -54.89466      40.85036  
1 1 1 20 8  0  o 227.9943 11.62252  35.13509       3.509949      35.13509       3.509949      35.13509       3.509949      227.9943 11.62252  227.9943 11.62252  0.000000       0.000000  
1 1 1 20 8  1  o 429.1171 7.114163  123.3137       4.067927      126.4659       7.618363      122.0565       4.811224      431.6649 13.26040  426.4725 8.466249  5.192383       15.73263  
1 1 1 20 8  2  o 144.4662 17.03855  14.49519       3.216966      10.72629       5.015244      17.12991       4.193261      118.9087 31.24944  155.7919 20.71182  -36.88315      37.49009  
1 1 1 20 8  3  o 60.24438 22.55895  2.017140       2.442907      -0.2535506     3.824678      3.581856       3.174927      59.11374 25.78416  73.98495 25.99480  -14.87120      36.61356  
1 1 1 20 8  4  o 247.4989 13.07649  41.66225       4.297283      45.41234       5.311674      34.55750       7.311133      257.3517 15.56199  219.1325 25.51499  38.21922       29.88628  
1 1 1 20 8  5  o 102.0752 9.855813  7.078777       1.323907      4.166478       3.615422      7.529760       1.422726      78.93340 27.73905  105.2187 10.27832  -26.28530      29.58207  
1 1 1 20 8  6  o 156.9325 7.888116  16.56587       1.644239      29.65694       12.07124      16.31840       1.659707      184.1567 48.52135  155.7270 8.025307  28.42970       49.18056  
1 1 1 20 8  7  o 146.5028 4.989271  14.35923       0.9725733     2.208785       7.663630      14.55812       0.9805011     86.93597 37.19812  147.5143 4.995366  -60.57837      37.53203  
1 1 1 20 8  8  o 232.0738 2.926178  35.92273       0.9048995     17.24034       8.300049      36.14746       0.9103258     143.1738 41.25774  232.7978 2.934570  -89.62402      41.36197  
1 1 1 20 8  9  o 70.77491 12.54299  3.504353       1.139616      -0.5397114     3.999990      3.861611       1.188888      58.68339 25.95452  74.40752 12.42896  -15.72414      28.77701  
1 1 1 20 8  10 o 157.5728 8.026464  16.74414       1.679755      19.34134       5.529813      16.48013       1.763064      160.4775 26.80442  156.2078 8.502217  4.269699       28.12053  
1 1 1 20 8  11 o 308.9296 9.549908  64.60036       3.926543      57.24971       6.182235      69.57048       5.083544      286.5576 16.25718  319.1825 11.97359  -32.62491      20.19067  
1 1 1 20 8  12 o 129.0333 16.00129  11.76221       2.692335      13.11450       3.971980      10.61279       3.661960      132.4105 23.36572  118.4617 24.02154  13.94874       33.51106  
1 1 1 20 8  13 o 53.89506 18.96986  1.908374       1.691318      2.849171       3.460378      1.613080       1.938664      68.40465 26.54534  52.96850 20.03952  15.43615       33.26015  
1 1 1 20 8  14 o 102.2423 12.41356  7.308391       1.656614      7.968489       1.777292      2.936832       4.573756      106.6818 12.75490  72.39265 29.68628  34.28913       32.31042  
1 1 1 20 8  15 o 199.7698 8.313902  27.12460       2.208299      26.15060       2.784441      28.77584       3.625449      194.8484 10.76611  202.5524 13.50955  -7.703903      17.27475  
1 1 1 20 8  16 o 106.1020 21.10246  8.723821       2.878483      7.132217       3.442666      12.42165       5.247479      92.06821 26.58362  116.2018 32.58177  -24.13361      42.05069  
1 1 1 20 8  17 f 57.14185 10.36363  2.320740       0.7600626     2.425551       0.7837097     0.6621351      3.117623      58.41958 10.45125  53.48188 23.30419  4.937698       25.54044  
1 1 1 20 8  18 o 78.18964 11.58082  4.373860       1.170166      4.777863       1.201427      -3.087977      5.163308      81.90393 11.30981  53.53520 25.60289  28.36873       27.98964  
1 1 1 20 8  19 o 87.84596 9.794101  5.428307       1.126985      5.430553       1.148632      5.370374       5.832456      87.76818 9.999465  75.00150 32.27710  12.76669       33.79054  
1 1 1 20 8  20 o 126.9389 6.357635  10.98415       1.071962      11.15789       1.097462      7.375456       5.001781      127.8942 6.460619  81.26075 31.80560  46.63345       32.45514  
1 1 1 20 8  21 o 61.03786 9.781795  2.669798       0.7687332     2.782390       0.7728997     -7.688891      7.413475      62.41334 9.600512  52.86340 26.34095  9.549942       28.03597  
1 1 1 20 8  22 o 40.93008 18.52972  -0.1450982     2.170810      -0.1212725     2.351202      -0.2827368     5.651151      42.33857 19.21383  56.07063 26.80721  -13.73206      32.98178  
1 1 1 20 8  23 o 20.94438 10.61616  -4.867783      1.504386      -4.937519      1.519173      -1.337900      10.80832      21.00369 10.64859  60.90736 30.56293  -39.90367      32.36488  
1 1 1 20 9  0  o 100.8211 23.77201  7.958016       2.773821      7.958016       2.773821      7.958016       2.773821      100.8211 23.77201  100.8211 23.77201  0.000000       0.000000  
1 1 1 20 9  1  o 50.79157 19.87788  1.156214       1.953533      4.411906       3.285209      -0.6247658     2.429802      79.51303 26.48312  45.56526 20.18690  33.94777       33.29965  
1 1 1 20 9  2  o 132.5445 17.23067  12.27104       2.971286      9.550765       5.982838      13.16166       3.423300      111.3930 35.65342  136.5557 19.35484  -25.16268      40.56817  
1 1 1 20 9  3  o 287.4444 12.26216  56.08418       4.685926      51.24706       5.359879      71.77203       9.652580      273.6132 14.75551  318.1903 22.91936  -44.57715      27.25843  
1 1 1 20 9  4  o 228.0698 12.77743  35.41937       3.867629      29.17373       7.071328      38.08524       4.619893      199.3971 27.33247  235.6744 14.78563  -36.27731      31.07537  
1 1 1 20 9  5  o 283.5358 9.793394  54.24488       3.694555      61.09890       8.260263      52.53085       4.130764      294.3006 21.20561  278.4945 11.15372  15.80609       23.96004  
1 1 1 20 9  6  o 125.4327 5.570289  10.54397       0.9287038     21.20197       12.85432      10.48804       0.9311372     150.3650 52.34202  125.0950 5.600189  25.27002       52.64076  
1 1 1 20 9  7  o 167.1992 2.294043  18.63881       0.5111040     11.73010       9.500384      18.65886       0.5118452     119.6617 44.55125  167.2890 2.296136  -47.62730      44.61038  
1 1 1 20 9  8  o 112.0858 10.44107  8.570064       1.541505      9.979647       10.29632      8.537745       1.559077      113.7851 45.28922  111.8358 10.58805  1.949318       46.51043  
1 1 1 20 9  9  o 90.59061 24.95227  6.194169       3.107745      0.000000       0.000000      6.194169       3.107745      ?        ?         90.59061 24.95227  0.000000       24.95227  
1 1 1 20 9  10 o 255.1727 9.206136  44.05545       3.125164      33.42834       7.235871      46.49236       3.465004      210.9964 26.30588  261.8095 9.950297  -50.81310      28.12486  
1 1 1 20 9  11 o 127.5881 13.17715  11.30188       2.208099      11.73248       4.204635      11.13790       2.594697      123.1743 26.41027  125.5402 15.86426  -2.365944      30.80871  
1 1 1 20 9  12 o 246.5783 10.66695  41.53442       3.496553      42.86911       5.277261      40.48999       4.668293      246.6498 16.14539  240.8700 14.61335  5.779816       21.77668  
1 1 1 20 9  13 o 181.0280 14.31707  22.99479       3.425509      20.74882       4.903471      25.13571       4.787416      165.7546 22.80435  185.3012 19.68982  -19.54660      30.12851  
1 1 1 20 9  14 o 142.3305 8.898503  13.82835       1.679230      14.38870       2.542198      13.39461       2.236621      143.0241 13.49878  138.6105 12.23488  4.413605       18.21838  
1 1 1 20 9  15 o 62.29747 14.89690  2.858095       1.219896      2.690708       1.300059      4.091206       3.528604      60.19815 15.95296  73.01005 27.15730  -12.81189      31.49629  
1 1 1 20 9  16 o 18.28287 9.254323  -3.774180      1.118105      -3.709968      1.145473      -5.069999      5.145753      18.79574 9.496796  51.06287 24.70688  -32.26712      26.46921  
1 1 1 20 9  17 o 119.7859 6.299990  9.736155       1.002050      9.553929       1.022320      14.19521       5.057137      118.5895 6.494234  122.4597 30.97473  -3.870201      31.64820  
1 1 1 20 9  18 o 71.87548 12.01587  3.743715       1.110232      3.888827       1.131068      -0.8648957E-01 5.810944      73.29271 11.99582  61.34431 28.67031  11.94839       31.07872  
1 1 1 20 9  19 o 130.2341 9.159160  11.82109       1.579340      11.88282       1.610106      10.25203       8.117799      130.4726 9.322506  85.41428 37.40310  45.05833       38.54738  
1 1 1 20 9  20 o 57.43805 10.08419  2.375413       0.7436746     2.256963       0.7477472     13.16076       7.135165      55.81459 10.43749  94.09109 37.61779  -38.27650      39.03894  
1 1 1 20 9  21 o 22.33526 11.08785  -2.735881      1.265140      -2.645249      1.288765      -5.140208      6.637900      22.88963 11.33276  52.51123 25.94771  -29.62160      28.31457  
1 1 1 20 9  22 o 31.30305 15.45987  -3.899174      2.345513      -3.645156      2.631425      -4.881251      5.174058      34.22255 16.79820  46.55118 22.98518  -12.32863      28.46925  
1 1 1 20 9  23 o 24.55383 11.82771  -1.423329      1.147694      -1.516610      1.156005      4.994321       9.588501      24.32450 11.75511  65.04865 31.95672  -40.72415      34.05018  
1 1 1 20 10 0  o 188.1346 15.41220  24.38464       3.802070      24.38464       3.802070      24.38464       3.802070      188.1346 15.41220  188.1346 15.41220  0.000000       0.000000  
1 1 1 20 10 1  o 463.9709 9.106689  144.8841       5.630213      151.0665       9.111772      141.0658       7.160821      469.8831 14.57017  456.1210 11.79162  13.76212       18.74385  
1 1 1 20 10 2  f 243.3006 13.25366  40.41015       4.280648      36.93060       7.631289      42.00762       5.170734      225.1359 25.90969  246.8410 15.80333  -21.70517      30.34892  
1 1 1 20 10 3  o 22.21979 10.65428  -1.277155      0.9070047     2.738357       1.700430      -2.873919      1.072281      62.32860 18.86370  19.76287 9.873959  42.56573       21.29165  
1 1 1 20 10 4  o 280.6631 9.582399  53.17366       3.578456      69.35866       9.361206      50.40387       3.872566      311.6329 22.69881  272.8198 10.67304  38.81308       25.08286  
1 1 1 20 10 5  o 46.94892 11.88050  1.553960       0.7437398     7.431845       4.679256      1.401617       0.7533163     98.57979 31.52864  44.70255 12.27403  53.87724       33.83352  
1 1 1 20 10 6  o 210.6248 4.261960  29.63397       1.196169      40.02895       7.976992      29.39486       1.209848      232.9559 26.14842  209.7648 4.328373  23.19116       26.50424  
1 1 1 20 10 7  o 124.0878 10.04532  10.48076       1.646798      17.69802       10.57159      10.30127       1.667149      137.4807 47.48831  122.9555 10.26912  14.52517       48.58595  
1 1 1 20 10 8  o 168.2612 9.098214  19.17012       2.032334      3.381838       13.06281      19.56177       2.057387      101.3970 45.72127  169.9704 9.117198  -68.57335      46.62143  
1 1 1 20 10 9  o 156.2669 7.046321  16.44421       1.463471      0.000000       0.000000      16.44421       1.463471      ?        ?         156.2669 7.046321  0.000000       7.046321  
1 1 1 20 10 10 o 100.0286 22.94252  7.581791       2.992798      0.000000       0.000000      7.581791       2.992798      ?        ?         100.0286 22.94252  0.000000       22.94252  
1 1 1 20 10 11 o 118.9407 16.71894  10.13779       2.576753      0.000000       0.000000      10.13779       2.576753      ?        ?         118.9407 16.71894  0.000000       16.71894  
1 1 1 20 10 12 o 132.9527 15.94363  12.62658       2.768332      13.04299       4.281988      12.32755       3.628655      128.5975 25.88534  127.5820 22.14723  1.015564       34.06685  
1 1 1 20 10 13 o 278.9101 11.70419  53.79229       4.340232      52.66650       5.362009      55.93150       7.391396      273.0211 14.79391  274.5638 20.34731  -1.542694      25.15697  
1 1 1 20 10 14 o 191.5612 10.48934  25.32257       2.667280      28.05128       5.039820      24.26090       3.143629      193.4431 19.83236  185.9621 12.76365  7.481018       23.58460  
1 1 1 20 10 15 o 47.00861 16.23932  1.520282       1.236252      -0.5444494E-01 1.370626      8.390708       2.862914      35.38331 15.43434  103.0266 21.54773  -67.64331      26.50516  
1 1 1 20 10 16 o 132.7754 8.300958  12.10384       1.461306      10.77672       1.550020      22.71202       4.382318      124.7376 9.394421  171.7393 19.49413  -47.00173      21.63969  
1 1 1 20 10 17 o 108.7107 7.607981  8.110453       1.095129      8.060930       1.109939      9.929112       6.726251      108.3216 7.740741  90.69386 36.43344  17.62773       37.24667  
1 1 1 20 10 18 o 126.5319 4.624422  10.79160       0.7783943     10.79704       0.7833610     10.36687       6.923419      126.5547 4.653185  88.98250 36.51058  37.57217       36.80590  
1 1 1 20 10 19 o 57.94764 10.87624  2.439812       0.8089870     2.536704       0.8272163     0.3138158      3.874866      59.10159 10.90547  53.47825 24.42248  5.623344       26.74671  
1 1 1 20 10 20 o 84.35335 6.809424  4.896635       0.7588960     4.778156       0.7638785     13.88995       6.655252      83.26633 6.947908  97.10973 37.03777  -13.84339      37.68381  
1 1 1 20 10 21 o 97.17335 9.440223  6.703040       1.206985      6.556744       1.213588      20.03614       11.58567      95.98906 9.617433  85.31253 40.06745  10.67653       41.20553  
1 1 1 20 10 22 o 86.24162 9.523542  5.320038       1.076225      5.496606       1.099621      1.302614       5.245183      87.64506 9.570839  56.77174 26.75506  30.87331       28.41538  
1 1 1 20 11 0  o 37.85295 25.79942  -1.984902      4.013667      -1.984902      4.013667      -1.984902      4.013667      37.85295 25.79942  37.85295 25.79942  0.000000       0.000000  
1 1 1 20 11 1  o 127.7560 9.268148  11.06142       1.567056      8.800076       1.789830      18.48704       3.243361      113.1760 12.05341  163.3586 15.06953  -50.18259      19.29703  
1 1 1 20 11 2  o 235.0982 8.725488  37.27449       2.728716      34.93977       5.698927      37.96897       3.108169      222.3809 19.42674  236.8844 9.868405  -14.50345      21.78953  
1 1 1 20 11 3  o 183.9430 8.460355  22.82507       2.068144      18.20885       6.600180      23.32766       2.177821      151.1269 33.64038  185.8625 8.818554  -34.73557      34.77703  
1 1 1 20 11 4  o 241.8044 6.229222  39.20953       2.005440      36.92738       4.575555      39.75219       2.231164      231.1303 14.93636  243.2979 6.889014  -12.16754      16.44851  
1 1 1 20 11 5  o 100.0362 4.278764  6.698707       0.5690424     4.898323       4.021841      6.735485       0.5748251     82.73320 29.24100  100.3074 4.310663  -17.57420      29.55703  
1 1 1 20 11 6  o 47.12872 9.513649  1.554024       0.5768432     1.697553       3.456147      1.549911       0.5850496     63.52602 25.89895  47.03993 9.657381  16.48609       27.64092  
1 1 1 20 11 7  o 178.8061 10.66478  21.79896       2.529474      14.79022       8.614953      22.46018       2.646104      126.7443 42.89246  181.3755 11.00022  -54.63120      44.28056  
1 1 1 20 11 8  o 159.4489 7.618382  17.16188       1.613985      0.000000       0.000000      17.16188       1.613985      ?        ?         159.4489 7.618382  0.000000       7.618382  
1 1 1 20 11 9  o 52.64502 21.33936  1.143345       2.330453      0.000000       0.000000      1.143345       2.330453      ?        ?         52.64502 21.33936  0.000000       21.33936  
1 1 1 20 11 10 o 107.5095 21.93487  8.753189       3.035816      -1.687137      7.685469      10.68337       3.304548      72.53033 33.58207  119.2655 21.58787  -46.73513      39.92231  
1 1 1 20 11 11 o 77.88946 30.42265  4.310780       4.568420      3.657256       12.31131      4.415138       4.919671      92.21564 42.62860  79.16046 31.37081  13.05518       52.92754  
1 1 1 20 11 12 o 267.2458 11.07186  49.25546       3.934264      61.52118       5.926926      39.59367       5.260313      294.4397 15.15737  234.2531 16.96704  60.18655       22.75140  
1 1 1 20 11 13 o 164.2994 10.04054  18.60180       2.187701      21.13105       5.303021      18.08307       2.401586      161.9746 25.40475  161.3103 11.24319  0.6643372      27.78148  
1 1 1 20 11 14 f 106.2462 17.96303  8.509315       2.452563      8.492279       3.503670      8.525681       3.434267      99.93462 26.04925  100.5468 25.57622  -0.6121979     36.50626  
1 1 1 20 11 15 o 131.2841 9.519402  11.94432       1.653998      12.07835       1.764233      10.97121       4.753691      131.6884 10.13174  106.4696 31.37985  25.21876       32.97495  
1 1 1 20 11 16 o 25.19762 11.05643  -0.1077476     0.7125562     0.5622330      0.7430523     -7.770975      2.513010      32.37912 12.36935  27.46238 13.89772  4.916744       18.60503  
1 1 1 20 11 17 o 120.4249 6.152021  9.861331       0.9839345     9.901563       0.9877074     4.625393       11.26792      120.6665 6.163240  76.08957 36.75383  44.57691       37.26700  
1 1 1 20 11 18 o 50.16568 10.85737  1.838213       0.7046835     1.849473       0.7053974     -3.717181      15.66820      50.32867 10.83891  70.45230 35.53927  -20.12363      37.15537  
1 1 1 20 11 19 o 137.6245 5.345089  12.84112       0.9783576     12.77809       0.9904272     15.37995       6.286016      137.2496 5.426184  107.2713 36.63390  29.97836       37.03358  
1 1 1 20 11 20 o 72.30320 7.146120  3.625728       0.6795018     3.562372       0.6818929     12.61198       8.121056      71.62473 7.244104  83.28727 36.90189  -11.66254      37.60620  
1 1 1 20 11 21 o 91.34569 7.766511  5.824256       0.9363839     5.923126       0.9423803     -1.870752      8.313759      92.13244 7.747807  58.02333 28.73761  34.10910       29.76372  
1 1 1 20 12 0  o 72.86607 37.84914  5.846644       4.765632      5.846644       4.765632      5.846644       4.765632      72.86607 37.84914  72.86607 37.84914  0.000000       0.000000  
1 1 1 20 12 1  o 117.0747 17.12745  9.741257       2.592916      15.35534       4.180239      6.230510       3.305684      144.6794 22.40690  90.36626 26.03632  54.31316       34.35054  
1 1 1 20 12 2  o 58.10641 11.25619  2.370985       0.8400581     4.848776       1.495466      1.228667       1.015401      82.92325 14.03414  43.48235 14.72555  39.44090       20.34205  
1 1 1 20 12 3  o 114.0374 7.534187  8.785478       1.138458      15.27431       4.397370      8.319306       1.178644      143.2016 23.88555  110.8517 8.033853  32.34996       25.20044  
1 1 1 20 12 4  o 66.18084 6.845554  2.972860       0.5949858     4.813169       2.661449      2.876047       0.6104354     80.07906 23.44700  65.02530 7.163601  15.05376       24.51691  
1 1 1 20 12 5  o 113.7381 2.149000  8.626322       0.3256986     4.618372       5.426066      8.640815       0.3262870     83.84966 33.03421  113.8335 2.151077  -29.98389      33.10418  
1 1 1 20 12 6  o 205.9436 9.211129  28.77853       2.521356      35.55718       5.395323      26.88450       2.851933      223.2579 18.29617  198.3504 10.83139  24.90752       21.26191  
1 1 1 20 12 7  o 81.46781 9.631777  4.564919       1.025404      8.930255       3.874400      4.236115       1.063320      106.0092 27.27207  78.21674 10.46444  27.79243       29.21079  
1 1 1 20 12 8  o 119.8815 26.76341  11.39721       4.166972      0.000000       0.000000      11.39721       4.166972      ?        ?         119.8815 26.76341  0.000000       26.76341  
1 1 1 20 12 9  o 69.89888 25.19193  3.509691       2.999671      0.000000       0.000000      3.509691       2.999671      ?        ?         69.89888 25.19193  0.000000       25.19193  
1 1 1 20 12 10 o 45.20094 21.75736  -4.466093      3.866659      0.000000       0.000000      -4.466093      3.866659      ?        ?         45.20094 21.75736  0.000000       21.75736  
1 1 1 20 12 11 o 87.89908 30.87647  6.668819       4.479181      1.221145       10.89378      7.777180       4.913757      82.88484 38.90366  93.24831 32.36753  -10.36347      50.60782  
1 1 1 20 12 12 o 57.39856 14.46672  2.427336       1.105933      8.429705       4.298108      2.001762       1.144468      96.95741 30.11320  52.24368 15.39684  44.71374       33.82111  
1 1 1 20 12 13 o 33.75756 15.80874  -1.405470      1.781494      -4.171524      5.663465      -1.101722      1.876762      55.07998 26.46606  36.01476 16.64690  19.06521       31.26614  
1 1 1 20 12 14 o 131.5796 15.23639  12.71596       2.622119      14.79641       6.227856      12.26771       2.890832      116.7053 36.24858  127.4206 17.48663  -10.71535      40.24601  
1 1 1 20 12 15 o 102.9320 9.784678  7.413013       1.325935      9.066751       1.621659      4.077538       2.303058      113.3079 10.87385  69.92531 22.09075  43.38256       24.62197  
1 1 1 20 12 16 o 32.69234 13.13759  0.4553222      0.8749050     0.3585680      0.8829527     5.690571       6.494882      31.86889 13.05309  75.71918 33.29739  -43.85029      35.76450  
1 1 1 20 12 17 o 89.99834 7.011150  5.563294       0.8341796     6.015714       0.8679708     0.8988435E-01  3.019003      93.60629 7.009580  48.59563 21.94008  45.01067       23.03262  
1 1 1 20 12 18 o 54.93972 12.57951  2.261977       0.9010317     2.323724       0.9154003     0.3412747      5.105463      55.67785 12.62957  57.43744 26.85393  -1.759598      29.67558  
1 1 1 20 12 19 o 126.4039 4.752083  10.80834       0.7989950     10.77940       0.8020119     14.63380       9.220268      126.2244 4.776927  84.99616 38.36126  41.22820       38.65754  
1 1 1 20 12 20 o 61.96372 10.24709  2.794012       0.8165330     2.927691       0.8233246     -5.208714      6.370259      63.55189 10.05661  50.31343 24.96035  13.23845       26.91012  
1 1 1 20 12 21 o 103.0139 6.480688  7.306126       0.8850833     7.419225       0.8952211     2.397173       5.897884      103.7984 6.505117  59.85799 28.25867  43.94044       28.99775  
1 1 1 20 13 0  o 132.5007 35.14975  14.95562       5.361784      14.95562       5.361784      14.95562       5.361784      132.5007 35.14975  132.5007 35.14975  0.000000       0.000000  
1 1 1 20 13 1  o 138.7836 10.74934  13.19671       1.972410      10.15207       9.449722      13.33540       2.016833      107.8272 43.22950  139.4463 10.94156  -31.61911      44.59268  
1 1 1 20 13 2  o 145.4167 6.382866  14.22976       1.233798      12.64719       3.744792      14.42247       1.306760      130.0922 22.41120  146.3216 6.720088  -16.22946      23.39704  
1 1 1 20 13 3  o 171.3386 4.432724  19.65046       1.011194      27.11741       5.985624      19.43109       1.025940      189.7659 24.22250  170.3626 4.523333  19.40327       24.64123  
1 1 1 20 13 4  o 255.9527 4.147306  43.80566       1.414488      47.63747       6.442847      43.61162       1.449861      257.3480 18.92039  255.3596 4.260893  1.988373       19.39424  
1 1 1 20 13 5  o 118.3779 7.895686  9.504601       1.238352      12.33246       3.859137      9.179994       1.307497      127.0523 23.66526  116.1650 8.505749  10.88725       25.14741  
1 1 1 20 13 6  o 241.7352 8.586075  39.64626       2.761327      32.82204       6.591570      41.09876       3.041028      207.3551 24.31769  245.7461 9.303476  -38.39104      26.03660  
1 1 1 20 13 7  o 179.2627 14.44500  22.62995       3.421300      19.62315       5.501629      24.52599       4.368806      156.6571 27.34982  183.9589 18.05481  -27.30182      32.77177  
1 1 1 20 13 8  o 59.83634 23.54720  2.075415       2.754262      0.000000       0.000000      2.075415       2.754262      ?        ?         59.83634 23.54720  0.000000       23.54720  
1 1 1 20 13 9  o 63.68456 29.98484  -2.716156      6.560413      0.000000       0.000000      -2.716156      6.560413      ?        ?         63.68456 29.98484  0.000000       29.98484  
1 1 1 20 13 10 o 62.79081 24.13485  2.656378       2.840580      0.000000       0.000000      2.656378       2.840580      ?        ?         62.79081 24.13485  0.000000       24.13485  
1 1 1 20 13 11 o 77.00777 31.34851  4.716320       5.054576      -8.879676      9.679941      9.813130       5.926748      64.52206 31.77845  98.17287 35.40684  -33.65081      47.57640  
1 1 1 20 13 12 o 65.63331 18.80480  3.355151       1.729003      -0.3754143     5.245580      3.809854       1.831344      60.58044 27.94079  69.71102 19.13615  -9.130577      33.86562  
1 1 1 20 13 13 o 111.6331 17.42436  9.473950       2.507301      5.768629       5.202742      10.59481       2.861511      78.49973 31.86056  116.8239 19.03680  -38.32420      37.11462  
1 1 1 20 13 14 f 76.46445 14.25936  4.352288       1.399458      4.354376       1.734903      4.348398       2.367829      74.49312 17.73422  71.78658 22.35963  2.706543       28.53867  
1 1 1 20 13 15 o 103.1018 9.848799  7.469371       1.336654      8.903395       1.605375      4.228616       2.413356      112.0113 10.89318  70.18609 22.66141  41.82526       25.14361  
1 1 1 20 13 16 o 115.7198 8.053558  9.259883       1.234100      9.331166       1.263730      7.793013       5.732653      116.0767 8.223500  81.24843 33.26707  34.82826       34.26841  
1 1 1 20 13 17 o 122.1101 7.867156  10.31571       1.273285      10.46592       1.280180      -3.517678      12.28528      123.0083 7.851199  65.73080 32.92628  57.27746       33.84939  
1 1 1 20 13 18 o 138.8137 5.500680  13.09617       1.015457      13.04091       1.025470      15.88455       7.284117      138.4863 5.568382  97.82816 38.35495  40.65819       38.75705  
1 1 1 20 13 19 o 30.33349 12.04860  0.4446839      0.7272798     0.4793169      0.7283531     -11.28045      13.40158      30.73056 12.10419  58.92361 30.04196  -28.19306      32.38874  
1 1 1 20 13 20 o 74.58852 8.549583  3.937773       0.8344082     3.767226       0.8399187     16.80751       7.296250      72.79304 8.840111  95.12099 38.03651  -22.32796      39.05027  
1 1 1 20 14 0  o 53.09689 17.75975  2.471202       1.120287      2.471202       1.120287      2.471202       1.120287      53.09689 17.75975  53.09689 17.75975  0.000000       0.000000  
1 1 1 20 14 1  o 24.90359 11.28568  -0.4212858     0.8077152     5.725222       3.180729      -0.8449690     0.8350895     84.95226 25.81800  22.84491 10.73800  62.10735       27.96201  
1 1 1 20 14 2  o 97.82849 4.263206  6.416287       0.5544102     11.40318       4.344477      6.333732       0.5589804     118.2685 28.00321  97.18675 4.327194  21.08170       28.33557  
1 1 1 20 14 3  o 209.8760 2.006504  29.37646       0.5611467     34.82222       4.016300      29.26804       0.5667053     223.2602 13.56423  209.4859 2.030154  13.77428       13.71532  
1 1 1 20 14 4  o 187.9665 10.16314  24.22216       2.536085      14.85808       5.446102      26.81500       2.865767      131.7321 31.45992  197.3619 10.93973  -65.62978      33.30772  
1 1 1 20 14 5  o 106.2971 8.009032  7.697272       1.126078      8.935348       4.234763      7.603067       1.168135      102.4687 29.45206  105.5331 8.375384  -3.064407      30.61978  
1 1 1 20 14 6  o 180.0389 14.59083  22.99807       3.470447      20.74409       6.108881      24.07215       4.217028      156.3057 30.42505  181.7327 17.63550  -25.42697      35.16666  
1 1 1 20 14 7  o 260.8044 10.73076  46.93144       3.721263      47.34796       7.887988      46.81221       4.220434      245.1631 24.47220  259.1230 12.25774  -13.95993      27.37044  
1 1 1 20 14 8  o 107.0590 19.05023  8.680998       2.618052      4.899524       4.375180      10.79029       3.267635      77.83879 29.94411  117.6930 21.63269  -39.85422      36.94080  
1 1 1 20 14 9  o 69.83475 28.51461  3.378376       4.197314      0.000000       0.000000      3.378376       4.197314      ?        ?         69.83475 28.51461  0.000000       28.51461  
1 1 1 20 14 10 o 112.7428 31.45392  12.03723       4.903556      0.000000       0.000000      12.03723       4.903556      ?        ?         112.7428 31.45392  0.000000       31.45392  
1 1 1 20 14 11 o 184.4060 11.90371  24.02279       2.909409      29.80121       11.65593      23.63885       3.004510      134.2874 49.46581  182.4544 12.43220  -48.16701      51.00417  
1 1 1 20 14 12 o 131.3074 19.23112  13.46061       3.265135      7.310644       9.667808      14.25241       3.468964      82.20564 37.92091  134.4159 19.97386  -52.21026      42.85966  
1 1 1 20 14 13 o 92.19638 23.20503  7.291390       2.848278      3.482651       6.905001      8.072334       3.126678      71.25669 32.56450  95.99911 24.39568  -24.74242      40.68901  
1 1 1 20 14 14 o 150.7653 10.03225  15.94947       2.003989      13.87751       2.631181      18.81171       3.092522      136.7618 14.66704  159.3081 14.73498  -22.54631      20.79042  
1 1 1 20 14 15 o 98.61942 11.00090  6.957718       1.421065      8.057870       1.552063      1.253421       3.534143      106.1079 11.14319  55.17072 24.39888  50.93715       26.82305  
1 1 1 20 14 16 o 56.21610 11.55784  2.332468       0.8368462     2.387360       0.8698521     1.650047       3.067022      56.74525 11.88523  54.23096 23.37286  2.514294       26.22116  
1 1 1 20 14 17 o 189.0819 6.455943  24.45971       1.624223      25.03108       1.684873      16.94929       6.108627      191.1477 6.624932  112.9006 36.01460  78.24715       36.61886  
1 1 1 20 14 18 o 102.0405 5.038011  7.070052       0.6829050     7.044491       0.6842361     13.62059       10.95346      101.8480 5.057555  76.84546 36.89370  25.00256       37.23875  
1 1 1 20 14 19 o 34.26003 13.83068  0.5742690      0.9744774     0.6160452      0.9838673     -1.583069      7.070187      34.73579 13.94104  56.00116 27.49768  -21.26537      30.82977  
1 1 1 20 15 0  o 200.5752 9.605741  27.34013       2.553853      27.34013       2.553853      27.34013       2.553853      200.5752 9.605741  200.5752 9.605741  0.000000       0.000000  
1 1 1 20 15 1  o 164.7870 4.322575  18.20220       0.9483393     12.57836       9.796399      18.25540       0.9528143     105.4062 43.35922  165.0245 4.336735  -59.61834      43.57556  
1 1 1 20 15 2  o 42.28566 12.10004  1.275080       0.7163057     5.756519       3.901541      1.118753       0.7286921     82.92675 28.83842  40.01184 12.39453  42.91491       31.38915  
1 1 1 20 15 3  o 61.36434 11.03272  2.670925       0.8689740     -2.282184      2.762063      3.215039       0.9154603     41.13117 19.39361  67.64001 10.49698  -26.50884      22.05218  
1 1 1 20 15 4  o 115.0417 7.436793  9.004007       1.133917      6.214108       4.600909      9.184424       1.170007      84.60582 31.09289  116.1395 7.602015  -31.53371      32.00872  
1 1 1 20 15 5  o 102.6081 17.79886  7.884634       2.345405      6.723854       3.430432      8.903531       3.213948      88.86841 26.77077  105.0876 23.53756  -16.21921      35.64675  
1 1 1 20 15 6  o 46.61939 20.32041  0.2189794      2.372006      -1.805524      3.423995      2.087123       3.289115      47.41856 22.11089  61.01281 25.11362  -13.59425      33.46021  
1 1 1 20 15 7  o 46.01212 21.68667  -2.304454      3.447833      -0.2007030     4.206886      -6.608583      6.017364      56.60035 25.69193  52.92950 25.85855  3.670845       36.45189  
1 1 1 20 15 8  o 55.91543 21.11888  2.142814       2.151033      6.101522       5.044430      1.263020       2.378077      81.19696 31.89316  51.56499 21.30236  29.63197       38.35315  
1 1 1 20 15 9  o 97.29128 24.91296  8.141517       3.243454      0.000000       0.000000      8.141517       3.243454      ?        ?         97.29128 24.91296  0.000000       24.91296  
1 1 1 20 15 10 o 120.6707 34.10542  15.23356       5.725972      0.000000       0.000000      15.23356       5.725972      ?        ?         120.6707 34.10542  0.000000       34.10542  
1 1 1 20 15 11 o 33.49633 16.39567  -3.786270      2.453361      1.475817       20.67254      -3.861442      2.470822      79.27164 40.08707  33.49420 16.40702  45.77744       43.31470  
1 1 1 20 15 12 o 48.38193 22.15159  -0.4498986     3.214648      -8.662979      8.432925      0.9465024      3.477205      56.93498 28.32468  54.60014 24.17136  2.334846       37.23631  
1 1 1 20 15 13 o 23.44946 11.50894  -2.232341      1.234127      -2.127172      1.264878      -4.316772      5.631169      24.20543 11.83196  51.80692 25.24521  -27.60148      27.88039  
1 1 1 20 15 14 o 40.86179 13.89804  1.188044       0.9045777     1.212363       1.051128      1.118614       1.776055      41.83459 14.93230  45.45926 18.55354  -3.624672      23.81612  
1 1 1 20 15 15 f 79.71100 12.48548  4.696034       1.282658      4.769296       1.317887      3.380383       5.584829      80.16969 12.76413  65.12479 29.57737  15.04489       32.21403  
1 1 1 20 15 16 o 60.01826 27.24812  2.373958       4.734479      4.199583       5.559240      -2.446141      9.033116      65.89938 29.76056  60.09790 29.79847  5.801483       42.11460  
1 1 1 20 15 17 o 126.8259 6.315914  11.02524       1.064018      11.17137       1.096092      8.637267       4.430798      127.5786 6.468676  83.70549 30.55283  43.87306       31.23010  
1 1 1 20 16 0  o 79.71696 39.88249  7.999514       5.175278      7.999514       5.175278      7.999514       5.175278      79.71696 39.88249  79.71696 39.88249  0.000000       0.000000  
1 1 1 20 16 1  o 47.42037 9.842374  1.602375       0.6015410     5.401210       9.119776      1.585775       0.6028538     83.15652 37.77827  47.15203 9.910122  36.00448       39.05648  
1 1 1 20 16 2  o 135.2884 8.653780  12.56872       1.551876      3.380443       7.901437      12.93738       1.582702      77.16604 35.09889  137.2442 8.699059  -60.07813      36.16083  
1 1 1 20 16 3  o 88.44604 7.895001  5.370115       0.9207014     5.896541       3.588596      5.333022       0.9525868     81.81226 27.68325  88.03141 8.215569  -6.219147      28.87660  
1 1 1 20 16 4  o 41.78345 18.08064  0.2100798      1.849935      -6.296063      3.555826      2.624588       2.166172      38.41954 18.98574  59.48895 21.41191  -21.06940      28.61692  
1 1 1 20 16 5  o 53.49217 22.28965  1.370762       2.635278      7.029771       5.347638      -0.4442697     3.028544      84.53268 32.94447  48.27053 21.86629  36.26216       39.54078  
1 1 1 20 16 6  o 95.02209 19.87519  7.142454       2.435544      6.315439       2.943387      8.938344       4.337412      85.67226 24.53205  96.27559 30.30298  -10.60332      38.98836  
1 1 1 20 16 7  o 39.27363 18.91929  -3.194012      2.937415      -3.835552      5.178753      -2.889716      3.566656      52.07636 25.09534  44.68811 21.34656  7.388256       32.94619  
1 1 1 20 16 8  o 52.39822 22.60229  1.009255       2.872895      0.7618085      4.246449      1.218105       3.901242      58.04585 26.13022  58.10401 25.66824  -0.5815887E-01 36.62850  
1 1 1 20 16 9  o 45.65090 19.74719  0.5139993      2.205121      1.276487       3.365797      -0.5940369E-01 2.918780      55.68821 24.24049  48.11631 21.66166  7.571907       32.50890  
1 1 1 20 16 10 o 29.22605 13.46623  -0.7035474     1.214159      -2.446466      12.36708      -0.6865845     1.220053      70.24467 34.83600  29.39397 13.52739  40.85071       37.37027  
1 1 1 20 16 11 o 78.72070 30.66142  6.505499       4.629977      0.7777150      17.82844      6.919729       4.794474      74.92010 37.80741  80.26363 31.21859  -5.343529      49.03061  
1 1 1 20 16 12 o 49.93626 22.70427  0.7608278E-01  3.302073      4.117723       9.515188      -0.4773009     3.520884      71.94364 34.49981  49.38256 22.81705  22.56108       41.36248  
1 1 1 20 16 13 o 115.6061 12.70928  9.798654       1.925578      8.113065       2.347005      13.26970       3.367972      100.5480 18.18657  126.0320 20.77804  -25.48399      27.61301  
1 1 1 20 16 14 o 163.4118 10.19331  18.96649       2.208534      19.98943       2.323838      9.419080       7.099440      167.4973 10.46404  79.25717 34.83431  88.24013       36.37204  
1 1 1 20 16 15 o 136.0252 8.477083  12.93725       1.528887      13.19362       1.570179      8.254262       6.710798      137.2549 8.628815  75.28703 33.44090  61.96784       34.53621  
1 1 1 20 16 16 o 120.2505 9.198037  10.22579       1.462672      10.50524       1.493262      3.614000       7.263466      121.8376 9.267263  64.42447 30.68748  57.41310       32.05625  
1 1 1 20 17 0  o 70.89118 40.70898  7.158197       6.126713      7.158197       6.126713      7.158197       6.126713      70.89118 40.70898  70.89118 40.70898  0.000000       0.000000  
1 1 1 20 17 1  o 86.82716 6.849947  5.151755       0.7861159     1.041180       8.156216      5.190298       0.7897930     70.36800 33.22372  87.15129 6.856062  -16.78329      33.92376  
1 1 1 20 17 2  o 69.83971 7.129869  3.351823       0.6542271     2.939684       0.8942856     3.826359       0.9595971     64.08424 10.85992  73.63641 10.04095  -9.552170      14.79049  
1 1 1 20 17 3  o 62.25240 12.93153  2.852189       1.037607      2.854478       1.144750      2.841645       2.456405      61.75316 14.20739  60.90400 22.65785  0.8491631      26.74375  
1 1 1 20 17 4  o 64.66328 18.31790  3.302569       1.649858      1.318571       3.115155      4.076041       1.945053      55.01482 23.63117  71.01722 19.80893  -16.00240      30.83546  
1 1 1 20 17 5  o 135.7632 35.23069  19.66101       6.427857      9.936624       9.196396      28.94950       8.987916      86.57823 38.75501  150.3197 42.81208  -63.74146      57.74794  
1 1 1 20 17 6  o 70.25154 25.58072  4.309298       3.103346      3.492410       3.614594      6.599925       6.052788      66.14394 26.66018  79.38362 33.47430  -13.23969      42.79362  
1 1 1 20 17 7  o 157.5933 22.37652  20.56082       4.567044      21.23544       8.666333      20.30143       5.373794      119.4678 42.84917  148.6089 28.16768  -29.14111      51.27835  
1 1 1 20 17 8  o 52.79270 22.02135  1.542281       2.576179      -1.216544      6.093005      2.142828       2.842778      59.07771 28.13100  56.98509 23.39002  2.092625       36.58478  
1 1 1 20 17 9  o 137.2260 11.56815  13.47044       2.095628      24.05672       7.742116      12.63349       2.176893      136.6996 39.98098  132.1094 12.51525  4.590179       41.89404  
1 1 1 20 17 10 o 46.14768 20.86678  -0.5757466E-01 2.743138      0.000000       0.000000      -0.5757466E-01 2.743138      ?        ?         46.14768 20.86678  0.000000       20.86678  
1 1 1 20 17 11 o 124.5872 30.61964  16.14610       5.046581      10.47538       16.20097      16.75546       5.310812      76.28637 38.15435  124.8500 31.83061  -48.56364      49.68845  
1 1 1 20 17 12 o 128.3642 20.20518  13.74332       3.341940      12.31324       8.796685      13.98454       3.612815      82.66100 37.37316  127.0343 22.14758  -44.37328      43.44270  
1 1 1 20 17 13 o 91.09401 13.51616  6.244399       1.590974      6.028495       1.694446      7.851980       4.623637      88.42875 14.90980  80.25494 30.80596  8.173813       34.22440  
1 1 1 20 17 14 o 96.02493 11.35686  6.725988       1.425077      6.620888       1.460542      8.811592       6.506226      94.94922 11.79750  76.70440 33.53959  18.24482       35.55397  
1 1 1 20 18 0  o 31.71805 22.89438  -7.101075      4.944234      -7.101075      4.944234      -7.101075      4.944234      31.71805 22.89438  31.71805 22.89438  0.000000       0.000000  
1 1 1 20 18 1  o 21.49700 10.45418  -1.535348      0.9522843     -1.834153      0.9702293     6.318958       4.974323      20.72935 10.18009  78.51171 31.40249  -57.78236      33.01138  
1 1 1 20 18 2  o 98.03275 4.403306  6.474573       0.5737381     6.392154       0.5853878     8.483717       2.890244      97.37572 4.523848  100.5087 22.17593  -3.132950      22.63266  
1 1 1 20 18 3  o 40.97441 12.33088  1.221949       0.7280694     1.420906       0.7589614     -1.073867      2.578155      43.90673 12.41928  41.84065 19.39954  2.066082       23.03434  
1 1 1 20 18 4  o 150.9958 11.00221  16.15664       2.198509      16.70975       2.401542      13.29415       5.463277      152.8165 11.88704  108.9114 33.97012  43.90510       35.98986  
1 1 1 20 18 5  o 51.66148 22.83825  0.7472842      3.093650      8.609416       5.495261      -2.900608      3.743166      85.82721 33.41111  44.94851 21.57661  40.87870       39.77251  
1 1 1 20 18 6  o 67.18292 23.79408  3.956359       2.664179      7.914349       3.838470      0.2773135      3.700739      88.67269 28.57507  52.79938 24.01765  35.87331       37.32804  
1 1 1 20 18 7  o 59.22089 22.93509  2.784242       2.579189      -0.6295851E-01 3.862529      5.075326       3.464840      52.24937 24.05419  72.61425 26.92958  -20.36488      36.10826  
1 1 1 20 18 8  o 103.7513 23.46292  9.541921       3.167481      23.18340       10.76766      8.249646       3.314117      102.4184 43.96281  93.27597 25.79684  9.142456       50.97260  
1 1 1 20 18 9  o 51.75103 20.08441  1.949818       1.981041      3.912472       4.794557      1.545770       2.175422      66.07078 28.84285  49.91342 20.47139  16.15736       35.36930  
1 1 1 20 18 10 o 43.57895 18.40937  0.8324074      1.836021      3.507700       3.457822      -0.2180008     2.166686      62.83534 25.79446  40.82176 18.49326  22.01358       31.73886  
1 1 1 20 18 11 o 64.63347 26.76820  3.987867       3.767885      -2.228189      12.24571      4.637902       3.959998      64.05908 32.19728  67.42368 27.63278  -3.364594      42.42918  
1 1 1 20 18 12 o 23.42720 11.57703  -2.583453      1.322188      -3.647353      1.387315      7.956625       4.366630      21.79792 10.93969  81.36935 30.22124  -59.57143      32.14032  
1 1 1 20 19 0  o 45.50755 30.56586  0.5898755      5.240613      0.5898755      5.240613      0.5898755      5.240613      45.50755 30.56586  45.50755 30.56586  0.000000       0.000000  
1 1 1 20 19 1  o 20.39018 9.871488  -1.237549      0.8244265     -1.219762      0.8368021     -1.825588      4.811464      20.68879 9.998900  52.12949 24.87142  -31.44070      26.80608  
1 1 1 20 19 2  o 41.06565 9.349556  1.219590       0.5001051     1.101308       0.5088696     4.564884       2.706220      38.91922 9.815363  70.78748 24.03931  -31.86826      25.96593  
1 1 1 20 19 3  o 27.03231 10.64067  0.3354013      0.5625523     0.3799061      0.5652493     -4.294956      5.765586      27.64591 10.72860  51.56989 25.21942  -23.92398      27.40661  
1 1 1 20 19 4  o 74.47617 8.042347  3.868187       0.7854875     3.767662       0.8025811     6.153017       3.826281      73.36269 8.358878  76.92418 28.34033  -3.561485      29.54734  
1 1 1 20 19 5  o 142.4672 8.538856  14.12966       1.613580      12.20679       2.291221      16.02171       2.272784      128.2463 13.61532  149.1732 11.52315  -20.92691      17.83704  
1 1 1 20 19 6  o 63.53672 28.96118  2.863295       5.415871      -0.9675912     7.352875      7.406447       8.007300      60.07105 29.17542  74.45512 34.40445  -14.38407      45.10955  
1 1 1 20 19 7  o 127.0645 17.11316  12.74760       2.823933      11.50248       3.496766      15.08240       4.788339      112.4453 24.06424  119.6865 30.06679  -7.241173      38.51103  
1 1 1 20 19 8  f 38.54080 16.80316  0.2646714      1.622763      1.413028       5.881990      0.1700652      1.688285      60.26611 28.38053  38.59581 16.97432  21.67030       33.06935  
1 1 1 20 19 9  o 49.11073 21.72518  0.8948860      2.803983      5.545259       6.844105      -0.4311401E-01 3.073790      69.24046 31.92793  47.06014 21.58903  22.18032       38.54192  
1 1 1 20 20 0  o 67.90136 32.41008  5.782785       3.358032      5.782785       3.358032      5.782785       3.358032      67.90136 32.41008  67.90136 32.41008  0.000000       0.000000  
1 1 1 20 20 1  o 39.10085 18.59430  -1.824940      2.644540      -3.285179      2.967901      3.802151       5.826119      37.96558 18.46135  65.84169 30.02192  -27.87611      35.24397  
1 1 1 20 20 2  o 62.40583 30.00535  1.100471       7.306336      1.564524       9.563002      0.4497406      11.32430      65.62222 32.17236  66.00776 32.83582  -0.3855438     45.97012  
1 1 1 20 20 3  o 26.32681 12.77829  -1.979693      1.404534      -2.557600      1.449084      6.988087       5.708298      25.19613 12.38717  74.57179 32.00959  -49.37566      34.32281  
1 1 1 20 20 4  o 85.25773 11.70392  5.321116       1.294599      5.741871       1.318953      -5.758060      6.768126      88.79629 11.41050  51.90807 25.74738  36.88822       28.16251  
1 1 1 20 20 5  o 76.05090 24.53835  5.599297       2.829994      4.122306       3.217509      10.64690       5.948034      65.53511 25.55029  86.14364 34.37767  -20.60853      42.83271  
1 1 1 21 0  1  o 40.55013 26.10469  0.1802308      3.245800      0.1802308      3.245800      0.1802308      3.245800      40.55013 26.10469  40.55013 26.10469  0.000000       0.000000  
1 1 1 21 0  2  f 48.06913 25.80768  2.283436       2.275258      2.283436       2.275258      2.283436       2.275258      48.06913 25.80768  48.06913 25.80768  0.000000       0.000000  
1 1 1 21 0  3  o 123.9013 16.70043  10.89614       2.616448      10.89614       2.616448      10.89614       2.616448      123.9013 16.70043  123.9013 16.70043  0.000000       0.000000  
1 1 1 21 0  4  o 248.5531 12.34323  41.77138       4.064996      41.77138       4.064996      41.77138       4.064996      248.5531 12.34323  248.5531 12.34323  0.000000       0.000000  
1 1 1 21 0  5  o 156.8624 19.39501  17.42045       3.887561      17.42045       3.887561      17.42045       3.887561      156.8624 19.39501  156.8624 19.39501  0.000000       0.000000  
1 1 1 21 0  6  o 61.06520 28.43431  3.761101       2.571125      3.761101       2.571125      3.761101       2.571125      61.06520 28.43431  61.06520 28.43431  0.000000       0.000000  
1 1 1 21 0  7  o 36.20203 24.21883  -0.9758692     3.231345      -0.9758692     3.231345      -0.9758692     3.231345      36.20203 24.21883  36.20203 24.21883  0.000000       0.000000  
1 1 1 21 0  8  o 426.5893 49.17681  142.0432       26.98989      142.0432       26.98989      142.0432       26.98989      426.5893 49.17681  426.5893 49.17681  0.000000       0.000000  
1 1 1 21 0  9  o 42.81596 27.98008  -0.1554517     3.925686      -0.1554517     3.925686      -0.1554517     3.925686      42.81596 27.98008  42.81596 27.98008  0.000000       0.000000  
1 1 1 21 0  10 o 18.03865 12.74076  -1.481184      1.236556      -1.481184      1.236556      -1.481184      1.236556      18.03865 12.74076  18.03865 12.74076  0.000000       0.000000  
1 1 1 21 0  11 o 274.1542 20.56156  52.45984       7.412017      52.45984       7.412017      52.45984       7.412017      274.1542 20.56156  274.1542 20.56156  0.000000       0.000000  
1 1 1 21 0  12 o 55.48008 36.46340  0.1846340      6.809981      0.1846340      6.809981      0.1846340      6.809981      55.48008 36.46340  55.48008 36.46340  0.000000       0.000000  
1 1 1 21 0  13 o 21.66445 13.88686  0.5833950E-01  0.9060407     0.5833950E-01  0.9060407     0.5833950E-01  0.9060407     21.66445 13.88686  21.66445 13.88686  0.000000       0.000000  
1 1 1 21 0  14 o 18.05843 12.87256  -1.928332      1.368537      -1.928332      1.368537      -1.928332      1.368537      18.05843 12.87256  18.05843 12.87256  0.000000       0.000000  
1 1 1 21 0  15 o 76.44223 18.59688  4.641715       1.641284      4.641715       1.641284      4.641715       1.641284      76.44223 18.59688  76.44223 18.59688  0.000000       0.000000  
1 1 1 21 0  16 o 183.6878 11.30640  23.13080       2.743158      23.13080       2.743158      23.13080       2.743158      183.6878 11.30640  183.6878 11.30640  0.000000       0.000000  
1 1 1 21 0  17 o 120.9386 9.344975  10.05284       1.484741      10.05284       1.484741      10.05284       1.484741      120.9386 9.344975  120.9386 9.344975  0.000000       0.000000  
1 1 1 21 0  18 o 122.1527 11.18067  10.41580       1.782992      10.41580       1.782992      10.41580       1.782992      122.1527 11.18067  122.1527 11.18067  0.000000       0.000000  
1 1 1 21 0  19 o 51.72499 26.26554  3.033346       2.262316      3.033346       2.262316      3.033346       2.262316      51.72499 26.26554  51.72499 26.26554  0.000000       0.000000  
1 1 1 21 0  20 o 31.55882 21.93700  -1.977703      3.260201      -1.977703      3.260201      -1.977703      3.260201      31.55882 21.93700  31.55882 21.93700  0.000000       0.000000  
1 1 1 21 0  21 o 45.99994 32.77970  -4.993647      8.847949      -4.993647      8.847949      -4.993647      8.847949      45.99994 32.77970  45.99994 32.77970  0.000000       0.000000  
1 1 1 21 0  22 o 43.52694 31.25504  -6.208795      8.686003      -6.208795      8.686003      -6.208795      8.686003      43.52694 31.25504  43.52694 31.25504  0.000000       0.000000  
1 1 1 21 0  23 o 129.3120 29.79686  15.26821       4.469059      15.26821       4.469059      15.26821       4.469059      129.3120 29.79686  129.3120 29.79686  0.000000       0.000000  
1 1 1 21 0  24 o 16.85075 12.33070  -3.999847      1.740497      -3.999847      1.740497      -3.999847      1.740497      16.85075 12.33070  16.85075 12.33070  0.000000       0.000000  
1 1 1 21 1  0  o 250.1757 11.09568  42.18657       3.682294      42.18657       3.682294      42.18657       3.682294      250.1757 11.09568  250.1757 11.09568  0.000000       0.000000  
1 1 1 21 1  1  o 281.3748 10.34635  53.35519       3.872626      57.19875       5.807346      50.27730       5.196814      289.5116 15.10578  271.6776 14.40672  17.83395       20.87434  
1 1 1 21 1  2  o 107.3816 16.55651  8.051646       2.292987      7.851110       3.975709      8.151601       2.806864      102.9432 28.16992  106.8854 20.45225  -3.942200      34.81148  
1 1 1 21 1  3  o 69.29326 19.46457  3.412932       1.871001      4.300280       2.273048      1.548532       3.294819      77.39680 21.34836  63.21204 25.46235  14.18477       33.22776  
1 1 1 21 1  4  o 140.4709 14.33741  13.54488       2.646090      14.99993       2.817987      2.698087       7.693989      147.8479 14.48963  89.76622 37.79026  58.08165       40.47287  
1 1 1 21 1  5  o 203.3536 9.750028  27.88169       2.634293      32.12242       5.620540      26.68788       2.982120      214.4640 19.89433  198.5323 11.31941  15.93163       22.88915  
1 1 1 21 1  6  o 331.0871 8.291090  73.61348       3.654985      77.99565       4.244966      61.05321       7.186691      340.4376 9.366472  296.9997 18.24741  43.43790       20.51094  
1 1 1 21 1  7  o 302.9215 13.57581  62.50837       5.465932      54.89884       7.000048      74.39616       8.749293      281.0183 18.80177  326.2691 20.22385  -45.25073      27.61359  
1 1 1 21 1  8  o 218.0569 33.02480  36.22701       9.295792      46.42838       15.82641      30.85398       11.48584      225.7538 53.44429  189.9502 45.89539  35.80353       70.44629  
1 1 1 21 1  9  o 191.6348 15.63987  25.37230       3.959051      38.57138       7.750865      20.71295       4.605119      230.1407 25.71344  170.7505 20.65934  59.39017       32.98468  
1 1 1 21 1  10 o 135.9240 11.95776  12.64106       2.143751      10.32559       6.081844      12.96956       2.290778      113.4675 35.90505  137.4813 12.64607  -24.01380      38.06699  
1 1 1 21 1  11 o 166.5286 8.689234  18.73588       1.921493      24.90055       6.017199      18.03586       2.027656      183.4682 25.28433  163.1971 9.363430  20.27110       26.96240  
1 1 1 21 1  12 o 337.8759 17.48799  80.13091       7.846756      85.53928       9.165907      65.29276       15.18211      346.5120 19.93520  272.8361 43.19653  73.67587       47.57470  
1 1 1 21 1  13 o 205.2968 6.550732  28.33599       1.789737      28.55414       1.820910      22.12779       9.714005      206.0608 6.640288  151.3595 44.92116  54.70134       45.40929  
1 1 1 21 1  14 o 200.5917 1.768754  26.82616       0.4727743     28.45519       1.516853      26.65088       0.4975593     205.9186 5.533096  199.9276 1.867663  5.990952       5.839805  
1 1 1 21 1  15 o 169.3339 2.092665  19.12481       0.4721903     19.19278       0.4801910     17.13600       2.597547      169.6317 2.124386  156.9439 12.52452  12.68782       12.70341  
1 1 1 21 1  16 o 83.20236 9.550911  4.787646       1.039720      2.869694       1.306607      8.098610       1.716736      62.32184 15.73395  107.4117 12.21090  -45.08982      19.91640  
1 1 1 21 1  17 o 249.5294 9.148862  42.67566       3.036872      48.58590       3.679831      30.05391       5.377554      265.1653 10.43485  198.3412 20.64887  66.82419       23.13573  
1 1 1 21 1  18 o 140.5724 6.642372  13.41576       1.240700      13.97696       1.365480      10.75935       2.970828      143.2675 7.175442  117.7959 19.61618  25.47162       20.88736  
1 1 1 21 1  19 o 48.58641 17.81514  1.621556       1.509061      2.686516       1.702696      -2.278058      3.258227      58.64481 19.04272  43.83071 20.78442  14.81410       28.18896  
1 1 1 21 1  20 o 197.3623 11.03704  27.57450       2.891057      31.34177       3.873631      22.83725       4.343787      206.6107 14.15545  169.3218 19.61467  37.28891       24.18909  
1 1 1 21 1  21 o 144.5666 19.98903  17.02543       3.747718      16.41485       4.478824      18.45132       6.844351      133.9405 26.03254  118.1100 38.16539  15.83048       46.19838  
1 1 1 21 1  22 o 79.18482 31.93847  7.826742       5.191456      2.944627       6.588695      15.82076       8.430977      64.85783 30.38244  92.10697 39.20135  -27.24914      49.59676  
1 1 1 21 1  23 o 53.61758 21.05664  2.300592       2.198517      3.865198       2.687687      -0.8633829     3.822019      63.71424 23.70107  47.90753 22.65639  15.80671       32.78800  
1 1 1 21 1  24 o 92.16744 14.42154  6.595120       1.713157      7.356196       1.841494      1.698780       4.670811      97.17179 14.67909  56.00596 26.01685  41.16583       29.87226  
1 1 1 21 2  0  o 376.8539 11.18879  95.43739       5.607403      95.43739       5.607403      95.43739       5.607403      376.8539 11.18879  376.8539 11.18879  0.000000       0.000000  
1 1 1 21 2  1  o 125.4317 15.62609  10.88061       2.555269      11.75670       3.222263      9.396173       4.194356      129.2852 19.29383  112.4724 28.07565  16.81283       34.06603  
1 1 1 21 2  2  o 34.81992 16.18408  -1.539241      1.811283      -1.664321      2.544425      -1.410737      2.579008      42.75551 19.62461  44.03995 20.03967  -1.284435      28.04842  
1 1 1 21 2  3  o 231.3567 10.41869  36.11442       3.203707      37.37244       3.676843      32.14816       6.528652      234.9531 11.78171  212.9230 23.39554  22.03011       26.19466  
1 1 1 21 2  4  o 73.65591 25.70243  3.563089       3.100567      5.769261       3.556357      -3.427022      6.330348      89.15605 27.34010  66.94896 30.81156  22.20709       41.19263  
1 1 1 21 2  5  o 317.6454 15.39552  69.02909       6.497036      61.98150       8.952367      76.87151       9.443703      296.3359 22.84780  331.2002 21.51468  -34.86432      31.38317  
1 1 1 21 2  6  o 173.4751 13.11191  20.53146       3.008493      17.30648       3.399845      32.17036       6.458804      158.1283 16.37182  212.6289 23.17027  -54.50066      28.37072  
1 1 1 21 2  7  o 149.0497 17.98351  15.53721       3.499630      16.73076       4.314739      13.24224       5.983038      153.1463 21.75470  130.2704 34.08160  22.87592       40.43293  
1 1 1 21 2  8  o 108.7684 17.55350  8.355343       2.457538      7.995381       2.576633      11.98142       8.177918      105.8756 18.95975  121.7444 41.77872  -15.86882      45.87955  
1 1 1 21 2  9  o 91.23129 14.97089  5.840088       1.756902      6.160091       6.021579      5.810312       1.836823      94.62448 35.42083  90.76137 15.75910  3.863113       38.76834  
1 1 1 21 2  10 o 171.7343 9.770258  19.97350       2.226595      27.64549       7.455932      19.22230       2.333057      190.2839 30.43014  168.2649 10.45707  22.01907       32.17676  
1 1 1 21 2  11 o 43.90170 15.50567  1.186071       1.130737      3.727443       7.690063      1.129912       1.143162      89.22320 37.68283  43.41284 15.56346  45.81036       40.77030  
1 1 1 21 2  12 o 264.0701 14.29407  48.20514       5.011027      48.71734       5.336040      44.38065       14.58098      264.8626 15.18267  210.7207 52.20053  54.14194       54.36368  
1 1 1 21 2  13 o 206.4460 9.476149  28.94349       2.599873      29.55876       2.677207      18.75283       10.89560      208.5563 9.659761  134.4877 48.06751  74.06856       49.02853  
1 1 1 21 2  14 o 111.9201 5.828837  8.429481       0.8662921     7.186051       0.9891890     12.52164       1.794506      103.0209 7.252109  135.2747 10.02660  -32.25381      12.37440  
1 1 1 21 2  15 f 45.44154 14.34253  1.441430       0.9710207     0.8338042      1.302898      2.200603       1.456339      41.55341 16.24203  55.37153 17.57585  -13.81812      23.93144  
1 1 1 21 2  16 o 208.8298 7.171535  29.51903       1.992660      30.61328       3.459870      28.97591       2.437517      209.4050 12.45564  206.0270 8.899701  3.377945       15.30842  
1 1 1 21 2  17 o 125.5855 8.780799  10.82672       1.460165      11.03264       1.614397      9.900841       3.423211      126.3937 9.658587  110.3648 23.96525  16.02894       25.83837  
1 1 1 21 2  18 o 61.39788 13.79232  2.788559       1.100776      2.167445       1.302485      4.341099       2.059248      53.76445 16.55637  73.64533 20.32190  -19.88088      26.21246  
1 1 1 21 2  19 o 23.09659 11.34402  -2.247927      1.205938      -2.616388      1.280570      0.6395892      3.584840      23.10974 11.41520  54.53657 24.31916  -31.42683      26.86501  
1 1 1 21 2  20 o 105.5282 15.68531  8.432913       2.138665      10.63500       2.696937      4.701919       3.510472      116.6808 17.91783  71.35831 26.97307  45.32245       32.38202  
1 1 1 21 2  21 o 36.26101 16.96889  -1.226582      2.046390      -1.925831      2.120681      8.232299       7.799725      34.67423 16.53465  78.40430 35.34375  -43.73008      39.02019  
1 1 1 21 2  22 o 55.58633 26.62343  -0.8389936     5.628466      -4.132542      6.582345      8.118902       10.85555      53.47646 26.31229  73.34258 35.58124  -19.86612      44.25338  
1 1 1 21 2  23 o 90.40355 13.14317  6.159567       1.536942      6.589943       1.589016      -0.8586834E-01 6.053205      93.58054 13.10141  56.37558 27.15813  37.20496       30.15312  
1 1 1 21 2  24 o 40.97290 15.27546  1.180424       1.117631      1.152490       1.176705      1.437871       3.572238      41.00039 15.58907  52.60913 23.79810  -11.60875      28.44940  
1 1 1 21 3  0  o 139.6534 17.41625  13.76577       3.105037      13.76577       3.105037      13.76577       3.105037      139.6534 17.41625  139.6534 17.41625  0.000000       0.000000  
1 1 1 21 3  1  o 207.9816 10.91897  29.23520       3.015478      31.36235       4.222766      27.02177       4.307559      214.1544 14.89053  198.1359 16.46389  16.01851       22.19882  
1 1 1 21 3  2  o 197.1516 11.60543  26.32974       3.035356      25.79144       3.476261      28.05721       6.227380      194.5581 13.49237  198.4055 24.04482  -3.847366      27.57167  
1 1 1 21 3  3  o 184.3930 13.57070  23.19170       3.311060      25.87531       5.189116      21.34873       4.300235      192.0419 20.59950  175.0419 18.72709  16.99991       27.83960  
1 1 1 21 3  4  o 218.5247 13.55965  32.53722       3.928961      47.43175       9.506066      29.46866       4.314743      255.1890 28.43802  207.1183 15.75187  48.07072       32.50911  
1 1 1 21 3  5  o 118.1703 14.43109  9.640582       2.225293      7.487635       2.532877      16.92517       4.659076      102.5101 19.24945  153.4706 23.53192  -50.96059      30.40218  
1 1 1 21 3  6  o 397.7917 16.61900  108.8262       8.789747      100.3987       11.94605      118.7745       12.97929      375.7704 23.98286  408.8745 23.92706  -33.10403      33.87746  
1 1 1 21 3  7  o 152.6186 13.99241  15.99549       2.813963      13.98154       4.009529      17.95030       3.950222      139.4319 22.33389  159.8766 18.90776  -20.44463      29.26271  
1 1 1 21 3  8  o 85.93012 11.46798  5.082996       1.280372      1.656164       2.951784      5.877177       1.421013      61.01403 24.26086  92.42020 11.80806  -31.40617      26.98184  
1 1 1 21 3  9  o 189.0487 11.27744  24.29639       2.827999      35.58654       6.160981      21.28259       3.183152      223.8906 20.89217  176.0564 13.67568  47.83417       24.97012  
1 1 1 21 3  10 o 249.5106 9.999946  42.14264       3.318024      45.84787       8.026471      41.37896       3.643952      250.9454 24.30737  246.7813 11.10969  4.164169       26.72589  
1 1 1 21 3  11 o 422.7281 10.64357  121.2783       5.990684      114.4545       15.34836      122.5047       6.506791      387.0087 29.99641  424.1960 11.52203  -37.18738      32.13319  
1 1 1 21 3  12 o 131.0283 11.29469  11.77712       1.952798      12.80080       2.081763      4.274548       5.635787      136.5546 11.54885  83.41433 33.40427  53.14024       35.34433  
1 1 1 21 3  13 o 105.0061 9.962867  7.554465       1.377354      8.027554       1.412798      -1.520855      6.187857      108.2889 9.900311  67.22044 30.76040  41.06849       32.31437  
1 1 1 21 3  14 o 44.67132 11.91288  1.419953       0.7221003     3.324333       1.242700      0.4491607      0.8872634     67.96910 14.18023  33.51177 13.30897  34.45733       19.44756  
1 1 1 21 3  15 o 55.85039 9.469648  2.180822       0.6795974     2.703280       0.8747768     1.385460       1.079330      61.89138 11.01060  45.22880 15.18182  16.66257       18.75423  
1 1 1 21 3  16 o 41.14599 14.29712  1.107896       0.9588404     0.9794893      1.009310      2.296369       3.070611      40.08207 14.58947  61.91530 24.70311  -21.83323      28.68966  
1 1 1 21 3  17 o 157.8287 8.067861  17.01110       1.691120      13.99453       2.605829      19.20602       2.222793      139.5694 14.20936  166.6216 10.05822  -27.05217      17.40901  
1 1 1 21 3  18 o 73.00883 15.47061  4.006699       1.458234      9.047027       2.052046      -1.135178      2.072615      111.4849 14.13025  37.68361 17.44485  73.80125       22.44965  
1 1 1 21 3  19 o 98.01447 7.159613  6.582476       0.9286399     6.627516       0.9418864     5.014910       5.556645      98.32043 7.239988  74.18011 31.70570  24.14032       32.52182  
1 1 1 21 3  20 o 69.85799 20.47786  4.081378       2.029069      4.240427       2.402110      3.685237       3.790984      69.93130 22.61105  66.18092 27.07005  3.750381       35.27105  
1 1 1 21 3  21 o 43.50642 20.69099  -2.000379      3.275856      -0.1404718     3.840580      -6.966781      6.275844      51.58266 23.83248  50.00934 24.80345  1.573326       34.39765  
1 1 1 21 3  22 o 127.4758 10.19373  11.57953       1.717131      13.88298       1.933602      2.985298       3.734915      139.3784 10.48808  60.55601 25.94077  78.82236       27.98076  
1 1 1 21 3  23 o 71.51999 13.88534  3.944096       1.275573      3.786284       1.301691      7.758792       6.399808      69.61628 14.50351  72.63951 32.43578  -3.023232      35.53071  
1 1 1 21 3  24 o 26.63143 13.14153  -2.961653      1.682352      -3.371609      1.741070      2.810552       6.533085      26.33018 13.06003  60.62829 28.94152  -34.29811      31.75179  
1 1 1 21 4  0  o 38.12645 25.50643  -1.078953      3.584184      -1.078953      3.584184      -1.078953      3.584184      38.12645 25.50643  38.12645 25.50643  0.000000       0.000000  
1 1 1 21 4  1  o 103.4308 15.28954  7.441345       2.043837      9.364310       2.961982      5.693604       2.823809      114.7401 20.10527  88.40721 23.54949  26.33293       30.96450  
1 1 1 21 4  2  o 185.5152 11.41214  23.32055       2.807456      22.03940       3.415843      25.98755       4.928455      179.4341 14.40727  192.9299 19.43527  -13.49585      24.19296  
1 1 1 21 4  3  o 198.4692 10.02267  26.58468       2.642056      35.75976       6.049455      24.42208       2.936967      226.0668 20.29780  189.7670 11.67108  36.29976       23.41399  
1 1 1 21 4  4  o 137.4242 22.20991  13.52441       3.928431      11.64265       5.021598      16.49260       6.306748      123.8645 30.60441  146.6123 33.07209  -22.74776      45.05988  
1 1 1 21 4  5  o 85.72319 24.69599  5.366520       2.974241      7.388472       3.573800      0.8105668      5.364567      99.71254 26.46172  72.48489 31.07080  27.22765       40.81197  
1 1 1 21 4  6  o 43.25049 19.52407  -1.067894      2.389723      -1.281807      2.496654      1.270084       8.253910      43.51748 19.76869  87.09386 37.93489  -43.57639      42.77683  
1 1 1 21 4  7  o 366.9050 20.20742  94.37128       9.841417      84.86292       20.64397      97.16770       11.19546      309.2659 51.93318  369.8079 22.83046  -60.54199      56.72993  
1 1 1 21 4  8  f 74.58238 12.36604  3.873438       1.185942      3.656909       4.017313      3.894109       1.241261      76.93972 28.90424  74.64204 12.94902  2.297684       31.67226  
1 1 1 21 4  9  o 163.5113 7.251539  17.97785       1.576050      15.86422       3.169639      18.67207       1.816527      150.8876 16.00856  166.4303 8.216382  -15.54268      17.99397  
1 1 1 21 4  10 o 199.6616 10.97915  27.12248       2.909793      30.24670       7.357425      26.54321       3.168087      199.9274 28.41658  197.0654 12.12329  2.861984       30.89460  
1 1 1 21 4  11 o 124.6659 4.022745  10.39342       0.6673822     12.95706       9.487842      10.38068       0.6690394     120.0317 44.55373  124.5879 4.035298  -4.556168      44.73610  
1 1 1 21 4  12 o 121.2461 2.235798  9.803564       0.3612218     12.30847       2.454535      9.748113       0.3651981     132.8271 14.08212  120.9012 2.266859  11.92590       14.26340  
1 1 1 21 4  13 o 64.49776 14.35252  2.994856       1.201731      3.034966       1.232609      2.224231       5.402792      64.87109 14.61155  73.81647 31.39780  -8.945389      34.63119  
1 1 1 21 4  14 o 130.2148 6.395152  11.43339       1.106253      8.054508       1.414527      16.75458       1.775127      108.2733 9.914217  157.0129 8.516266  -48.73958      13.06975  
1 1 1 21 4  15 o 150.7696 6.798529  15.36464       1.362334      15.91286       1.440081      10.69472       4.203030      153.3537 7.066236  113.3292 27.99779  40.02450       28.87574  
1 1 1 21 4  16 o 104.3540 8.136091  7.447145       1.122419      6.954932       1.217908      10.22193       2.891696      100.4651 9.199586  116.2217 19.35223  -15.75660      21.42758  
1 1 1 21 4  17 o 78.35944 6.336116  4.176167       0.6559504     4.080720       0.7139013     4.693500       1.662044      77.27727 7.009021  79.05189 16.31924  -1.774620      17.76074  
1 1 1 21 4  18 o 115.6729 8.769986  9.247166       1.341701      9.556050       1.425210      6.840706       3.978049      117.3977 9.183610  84.94935 29.13904  32.44839       30.55196  
1 1 1 21 4  19 o 39.08785 15.56064  0.7685764      1.215687      -0.2209560     1.477754      2.840411       2.138280      35.10405 15.63641  59.83870 21.30422  -24.73466      26.42664  
1 1 1 21 4  20 o 52.77417 19.59233  2.062521       1.834878      1.328503       1.914844      10.30418       6.416344      47.87340 19.36565  88.64719 35.59357  -40.77378      40.52074  
1 1 1 21 4  21 o 71.00174 24.93578  4.748455       2.921285      5.084319       3.055027      1.162455       9.982482      72.81516 25.50571  67.15456 32.91262  5.660606       41.63870  
1 1 1 21 4  22 o 30.44688 13.50345  -0.1179600     1.090113      -0.6844732     1.112708      13.40758       5.436928      27.49263 12.74621  101.2955 34.07462  -73.80283      36.38057  
1 1 1 21 4  23 o 60.25364 19.00447  3.140672       1.705132      3.209503       1.767876      2.222296       6.457603      60.65573 19.37740  60.45009 28.83358  0.2056389      34.73988  
1 1 1 21 5  0  o 168.0988 26.31688  20.75253       5.463934      20.75253       5.463934      20.75253       5.463934      168.0988 26.31688  168.0988 26.31688  0.000000       0.000000  
1 1 1 21 5  1  o 55.96412 20.39149  1.838471       1.972435      2.839768       3.393459      1.327583       2.423950      70.44370 26.54348  55.67961 22.03451  14.76409       34.49747  
1 1 1 21 5  2  o 149.9129 21.29442  15.96306       4.134288      13.97528       5.339827      18.93781       6.532330      136.0729 30.23487  157.8921 32.14206  -21.81923      44.12776  
1 1 1 21 5  3  o 107.2397 17.87582  8.118639       2.464565      9.946627       2.987423      4.223569       4.360816      118.3375 19.63301  81.78217 30.23308  36.55534       36.04849  
1 1 1 21 5  4  o 107.1650 19.44197  8.191235       2.674089      12.78897       4.070159      4.699386       3.547047      132.6833 23.89975  81.90945 27.52227  50.77386       36.45097  
1 1 1 21 5  5  o 311.0362 22.66720  68.60490       9.330199      68.60490       9.330199      0.000000       0.000000      311.0362 22.66720  ?        ?         0.000000       22.66720  
1 1 1 21 5  6  o 134.0409 25.84908  13.28081       4.449625      14.77566       5.249853      9.467689       8.384740      139.8535 29.11858  112.1110 41.83139  27.74249       50.96819  
1 1 1 21 5  7  o 236.1481 10.90396  37.79793       3.421909      35.76068       4.787019      39.92670       4.893353      227.5176 15.88968  240.7489 15.33315  -13.23134      22.08138  
1 1 1 21 5  8  o 369.4913 11.50861  92.69691       5.659405      99.91002       12.16345      90.70394       6.393625      371.3720 24.72030  364.4276 13.18801  6.944397       28.01815  
1 1 1 21 5  9  o 164.7891 6.144575  18.21852       1.346891      10.59818       5.988073      18.62460       1.382313      114.1631 35.55747  166.6005 6.237696  -52.43741      36.10045  
1 1 1 21 5  10 o 120.6894 5.207954  9.765071       0.8355771     6.063744       3.924417      9.940834       0.8551863     89.27770 28.90378  121.7618 5.283371  -32.48409      29.38269  
1 1 1 21 5  11 o 137.5859 2.436962  12.62554       0.4467824     14.51487       7.565575      12.61893       0.4475634     127.5068 40.00573  137.5495 2.441867  -10.04272      40.08018  
1 1 1 21 5  12 o 336.4287 23.89525  84.22987       10.64247      75.28423       21.05437      87.29996       12.33422      247.1853 63.56671  336.5202 27.75243  -89.33490      69.36082  
1 1 1 21 5  13 o 127.5419 14.42407  11.46044       2.408429      11.46044       2.408429      0.000000       0.000000      127.5419 14.42407  ?        ?         0.000000       14.42407  
1 1 1 21 5  14 o 163.3548 9.263506  18.21855       2.008155      17.32976       2.150753      24.26229       5.608438      158.8959 10.21197  177.0459 24.42283  -18.14992      26.47186  
1 1 1 21 5  15 o 157.8618 7.391173  16.90037       1.550445      18.45068       1.736646      10.81150       3.441681      164.7401 7.934458  117.5820 22.78923  47.15810       24.13099  
1 1 1 21 5  16 o 128.5225 4.816549  11.10522       0.8234164     10.56869       0.8515433     18.82679       3.230452      125.3037 5.110715  161.4786 15.19173  -36.17487      16.02835  
1 1 1 21 5  17 o 72.66385 8.664450  3.665045       0.8224351     3.834829       0.8676270     2.161425       2.581983      74.25222 8.949246  57.69917 22.77032  16.55305       24.46582  
1 1 1 21 5  18 o 107.3980 12.48711  8.292248       1.753746      7.782228       1.830597      13.98677       6.116857      103.3038 13.63081  110.7986 36.10144  -7.494797      38.58903  
1 1 1 21 5  19 o 122.7046 10.78093  10.66311       1.744847      10.74786       1.941946      10.30805       3.974918      122.2928 12.07426  103.8997 28.05751  18.39302       30.54524  
1 1 1 21 5  20 o 92.24297 8.411169  5.923573       1.022502      5.860554       1.025823      15.61069       12.71839      91.71049 8.490588  85.63409 40.73854  6.076393       41.61393  
1 1 1 21 5  21 o 85.97215 21.87468  6.497464       2.511675      6.076516       2.652289      10.15462       7.817683      81.54487 23.26718  80.65796 35.94370  0.8869095      42.81718  
1 1 1 21 5  22 o 46.30445 13.33885  1.643245       0.8677112     1.504201       0.8755034     9.350355       6.518184      44.42221 13.55429  78.14394 33.87647  -33.72173      36.48745  
1 1 1 21 5  23 f 40.34868 19.47808  -2.399030      3.153082      -0.8955306     3.704362      -6.353055      6.007330      46.81645 22.18898  47.26337 23.57605  -0.4469147     32.37562  
1 1 1 21 6  0  o 114.5945 17.54881  9.474028       2.493284      9.474028       2.493284      9.474028       2.493284      114.5945 17.54881  114.5945 17.54881  0.000000       0.000000  
1 1 1 21 6  1  o 310.3717 10.34723  65.02641       4.273388      61.12694       5.851263      69.48396       6.255986      298.9174 14.73552  318.7195 14.77054  -19.80206      20.86395  
1 1 1 21 6  2  o 230.1302 9.926461  35.74576       3.036820      38.23017       6.496605      35.05112       3.435236      232.8486 21.16937  227.4219 11.37184  5.426712       24.03041  
1 1 1 21 6  3  o 395.6657 14.02641  106.8202       7.383476      111.5989       9.763115      100.4353       11.28508      401.1305 18.31371  376.6583 22.58830  24.47217       29.07961  
1 1 1 21 6  4  o 110.6136 16.23094  8.568131       2.321229      7.427385       2.824209      10.94306       4.075003      101.0768 21.62268  121.3959 25.97625  -20.31917      33.79801  
1 1 1 21 6  5  o 158.4689 14.37714  17.28891       3.002914      16.38249       3.155093      26.01097       9.787167      153.7836 15.61291  176.3263 42.21529  -22.54272      45.00992  
1 1 1 21 6  6  o 163.2723 13.04641  18.26218       2.814827      37.52882       8.375179      15.80874       2.988680      224.4003 28.66239  151.1469 15.03837  73.25334       32.36797  
1 1 1 21 6  7  o 44.53793 14.71443  1.307764       1.014703      3.647274       12.87977      1.293153       1.017867      104.2813 46.32334  44.38497 14.74002  59.89628       48.61193  
1 1 1 21 6  8  o 138.1199 7.067386  12.83681       1.296410      14.35191       3.811989      12.63866       1.378582      141.0607 20.91256  136.9446 7.584265  4.116104       22.24537  
1 1 1 21 6  9  o 109.1436 5.074333  7.986311       0.7359703     8.533055       4.500605      7.971289       0.7460125     103.9840 30.50255  109.0306 5.149360  -5.046547      30.93415  
1 1 1 21 6  10 o 128.6552 6.138279  11.12514       1.049284      4.224175       2.720567      12.33107       1.137275      75.68570 24.02212  135.4291 6.319448  -59.74336      24.83943  
1 1 1 21 6  11 o 320.2567 12.97101  70.65005       5.523901      71.44616       8.603293      70.09166       7.205268      314.3018 20.65658  315.0841 17.22684  -0.7822876     26.89718  
1 1 1 21 6  12 o 277.9059 10.91899  52.83919       4.035595      50.87543       11.07392      53.13993       4.333603      245.8180 34.77770  278.1463 11.71862  -32.32829      36.69897  
1 1 1 21 6  13 o 96.15180 16.12798  6.687452       1.993284      6.687452       1.993284      0.000000       0.000000      96.15180 16.12798  ?        ?         0.000000       16.12798  
1 1 1 21 6  14 o 28.74301 13.14481  -0.6608558     1.127663      -0.7952940     1.142469      4.425145       7.027023      28.25198 13.03364  82.62661 35.49183  -54.37463      37.80933  
1 1 1 21 6  15 o 98.88657 8.622312  6.712269       1.124797      6.415136       1.184424      9.442421       3.590254      96.41393 9.335904  107.0099 25.53521  -10.59593      27.18834  
1 1 1 21 6  16 o 140.4475 6.208642  13.34802       1.159069      13.14831       1.324142      14.00257       2.397174      139.0338 7.171511  140.3307 12.96613  -1.296875      14.81726  
1 1 1 21 6  17 o 132.2997 6.943498  11.92175       1.219797      12.36348       1.285648      7.938078       3.860887      134.6282 7.192699  92.33385 28.51768  42.29433       29.41077  
1 1 1 21 6  18 o 27.88555 12.28966  -0.1378115     0.8893060     -0.8635761E-01 0.9020234     -1.924074      5.314734      28.46425 12.46620  55.54952 26.40029  -27.08526      29.19557  
1 1 1 21 6  19 o 83.32523 10.26470  4.930235       1.115653      5.281425       1.159472      0.5456587      4.096880      86.26412 10.28949  55.54694 25.26864  30.71718       27.28329  
1 1 1 21 6  20 o 61.82185 13.57876  2.890128       1.087944      2.779667       1.104715      6.445611       6.267499      60.39740 14.00001  74.84842 32.81826  -14.45102      35.67966  
1 1 1 21 6  21 o 47.39045 19.79707  1.242932       2.086583      1.031875       2.523966      1.698609       3.708617      48.55423 21.06445  55.85562 24.83193  -7.301392      32.56279  
1 1 1 21 6  22 o 70.03917 13.40412  3.746466       1.205432      3.691471       1.218270      6.314551       8.325077      69.33723 13.67181  68.58713 32.72134  0.7501068      35.46272  
1 1 1 21 6  23 o 26.52531 12.39983  -0.7691219     1.087958      -0.6961929     1.109927      -2.556884      5.495398      27.19617 12.65024  50.23739 24.57915  -23.04122      27.64351  
1 1 1 21 7  0  o 320.6613 11.45221  69.31055       4.879208      69.31055       4.879208      69.31055       4.879208      320.6613 11.45221  320.6613 11.45221  0.000000       0.000000  
1 1 1 21 7  1  o 137.0577 11.75535  12.81415       2.126188      11.37146       3.321999      13.81521       2.767220      126.1003 20.47156  141.3791 14.91319  -15.27873      25.32761  
1 1 1 21 7  2  o 174.6833 10.41967  20.67228       2.414353      21.72775       3.212610      19.30256       3.659742      178.0706 13.64308  166.6218 16.70856  11.44878       21.57104  
1 1 1 21 7  3  o 309.5354 14.74436  65.72059       6.064001      62.62424       8.316557      69.23552       8.860885      297.7187 21.10022  312.8631 21.38296  -15.14441      30.04081  
1 1 1 21 7  4  o 281.8330 12.74969  54.14339       4.775722      47.19175       6.245519      63.93103       7.410774      260.0807 18.13495  302.6341 18.46478  -42.55341      25.88096  
1 1 1 21 7  5  o 180.0506 19.15221  22.88240       4.524589      20.63867       5.084630      31.41775       9.917093      168.7304 23.23069  195.6574 39.40203  -26.92700      45.74041  
1 1 1 21 7  6  o 263.2141 13.88212  47.54258       4.851768      66.67101       12.86969      44.37360       5.238265      292.7274 33.60228  253.3038 15.59491  39.42354       37.04476  
1 1 1 21 7  7  o 205.0447 9.556359  28.45657       2.603864      46.96793       17.29292      28.02713       2.633894      209.6530 59.27491  203.4251 9.745071  6.227905       60.07063  
1 1 1 21 7  8  o 309.5504 6.854934  64.32608       2.827536      51.71516       6.708045      67.05083       3.118073      270.5178 18.72470  315.8387 7.408792  -45.32086      20.13714  
1 1 1 21 7  9  o 38.21138 14.23263  0.7940694      0.9697999     2.423800       3.562290      0.6636133      1.007868      67.42596 26.70279  37.28162 14.36412  30.14434       30.32107  
1 1 1 21 7  10 o 57.80343 16.08715  2.408259       1.284380      0.7412764      3.480879      2.670984       1.381890      58.89095 25.13046  60.72053 16.60468  -1.829582      30.12069  
1 1 1 21 7  11 o 118.3169 9.172684  9.545197       1.434874      21.69760       5.829123      8.761353       1.480426      166.8142 27.15720  113.1033 9.923298  53.71082       28.91341  
1 1 1 21 7  12 o 302.6087 10.08794  62.53241       4.062094      84.92067       9.589187      57.63631       4.484321      338.8852 21.34357  289.3305 11.65517  49.55466       24.31854  
1 1 1 21 7  13 o 162.4915 36.01177  23.97479       7.592310      25.31723       8.737323      19.83618       15.34119      160.3208 40.80277  118.2406 51.60575  42.08018       65.78769  
1 1 1 21 7  14 f 90.75195 13.78618  5.903433       1.614775      5.782598       1.699821      7.021161       5.169795      89.34216 14.79559  88.84332 32.90453  0.4988327      36.07793  
1 1 1 21 7  15 o 90.35131 11.13692  5.741066       1.312484      5.542528       1.472635      6.507823       2.894027      87.96420 12.95084  88.87418 23.91507  -0.9099808     27.19660  
1 1 1 21 7  16 o 47.30365 15.34774  1.615447       1.106159      0.3891712      1.231479      6.737291       2.516785      36.58684 15.24060  91.62000 21.05692  -55.03316      25.99365  
1 1 1 21 7  17 o 65.02559 9.543408  2.982796       0.8023226     2.790514       0.8168538     8.243472       4.272633      62.64045 10.13198  91.22044 30.19631  -28.57998      31.85081  
1 1 1 21 7  18 o 93.91387 7.662719  6.078601       0.9506005     7.363458       1.062404      0.9197867      2.128812      103.3713 7.769740  47.02897 19.84260  56.34230       21.30957  
1 1 1 21 7  19 o 100.5699 11.22798  7.251126       1.479037      7.328633       1.519971      5.870008       6.416245      100.9368 11.50610  74.31709 32.87029  26.61974       34.82594  
1 1 1 21 7  20 o 33.44086 13.01390  0.6003852      0.8335162     0.7511615      0.8465596     -4.179767      4.766634      35.22065 13.26058  47.13218 23.02380  -11.91152      26.56950  
1 1 1 21 7  21 o 36.49656 14.06403  0.7955781      0.9663121     0.8102807      0.9839007     0.3953422      5.133491      36.78782 14.18745  55.88807 26.37825  -19.10025      29.95156  
1 1 1 21 7  22 o 65.37476 12.42594  3.225855       1.042905      3.283409       1.049627      -1.225103      9.230422      65.98946 12.39170  59.56749 29.63423  6.421970       32.12074  
1 1 1 21 8  0  o 336.7514 11.27777  76.44792       5.047771      76.44792       5.047771      76.44792       5.047771      336.7514 11.27777  336.7514 11.27777  0.000000       0.000000  
1 1 1 21 8  1  o 388.0473 8.832331  101.3773       4.567026      107.2677       12.09088      100.3970       4.932431      386.5007 23.58887  385.8066 9.594400  0.6940918      25.46542  
1 1 1 21 8  2  o 282.2599 9.091885  53.73169       3.415149      54.15863       3.818313      52.02421       7.636020      282.9625 10.14313  270.4827 21.35949  12.47983       23.64553  
1 1 1 21 8  3  o 246.3723 14.73322  41.79432       4.814761      33.94911       7.603617      47.04558       6.220846      213.7452 27.31995  259.3379 18.11547  -45.59265      32.78033  
1 1 1 21 8  4  o 172.6298 14.34011  20.56813       3.268935      19.43735       3.686010      24.73380       7.074713      166.7088 16.82286  179.3462 30.70716  -12.63731      35.01340  
1 1 1 21 8  5  o 157.1720 9.292943  16.72734       1.937578      5.259544       3.130838      23.84589       2.466699      84.01031 25.63139  187.5603 9.904758  -103.5500      27.47858  
1 1 1 21 8  6  o 183.6578 7.226211  22.69198       1.765001      6.894061       4.489565      25.57997       1.919562      94.54271 30.93676  194.9660 7.402176  -100.4232      31.80998  
1 1 1 21 8  7  o 94.07707 7.749271  5.994830       0.9628389     7.922616       6.288412      5.948551       0.9743276     100.2672 36.42822  93.68530 7.877673  6.581879       37.27027  
1 1 1 21 8  8  o 68.00521 12.89701  3.269176       1.125953      1.517522       5.641891      3.341835       1.149068      73.62386 31.71544  68.74134 13.02108  4.882515       34.28437  
1 1 1 21 8  9  o 111.7341 2.388083  8.327152       0.3555564     9.049199       4.973070      8.323442       0.3564687     104.5751 32.37701  111.7089 2.394750  -7.133743      32.46545  
1 1 1 21 8  10 o 141.0846 7.363995  13.44900       1.379624      19.75347       4.301965      12.72628       1.456556      164.4454 20.04608  137.0555 8.010406  27.38997       21.58731  
1 1 1 21 8  11 o 284.5545 9.457282  55.13466       3.580977      51.00820       6.393155      57.02118       4.322727      266.1538 18.13473  288.0824 11.28257  -21.92862      21.35802  
1 1 1 21 8  12 o 36.99982 17.76204  -3.117231      2.537478      -2.492158      6.834580      -3.217168      2.732806      66.07272 30.94918  38.62160 18.51221  27.45111       36.06319  
1 1 1 21 8  13 o 144.5347 23.80389  16.42843       4.425058      22.46858       7.531728      13.24441       5.468381      153.1849 37.26058  120.4905 33.06406  32.69439       49.81549  
1 1 1 21 8  14 o 74.49506 16.96141  4.181157       1.645828      4.906543       1.702472      -6.178850      6.433920      81.17133 16.30658  56.10175 27.25771  25.06958       31.76299  
1 1 1 21 8  15 o 22.09864 10.17229  -0.4742184     0.6904482     -0.9844145     0.7889629     1.194602       1.426898      21.07957 10.06116  44.89694 17.14346  -23.81737      19.87775  
1 1 1 21 8  16 o 46.32209 14.95358  1.558444       1.050873      1.494740       1.060282      5.099983       7.905546      45.60406 15.04018  77.77602 35.27045  -32.17197      38.34335  
1 1 1 21 8  17 o 38.47731 14.27089  0.9188781      0.9730690     0.5758155      0.9981254     7.495613       4.370224      35.27946 14.08142  85.58966 30.45848  -50.31020      33.55600  
1 1 1 21 8  18 o 55.41406 14.60594  2.345336       1.093552      2.176774       1.144822      4.101806       3.695545      53.24308 15.31644  68.05225 27.11748  -14.80916      31.14404  
1 1 1 21 8  19 o 131.5287 13.39731  12.74794       2.315330      12.63833       2.395213      14.30948       9.040533      130.3938 14.00443  89.58337 39.34298  40.81042       41.76115  
1 1 1 21 8  20 o 32.37753 14.46805  -0.1928141     1.275762      -0.1184673     1.282368      -7.353328      12.58502      32.89020 14.61320  61.78373 31.24750  -28.89353      34.49568  
1 1 1 21 8  21 o 79.52045 17.00881  5.141176       1.747764      4.841509       1.781821      12.75612       8.982107      76.39371 17.83029  78.89969 36.45123  -2.505981      40.57846  
1 1 1 21 8  22 o 102.0715 18.39786  8.701311       2.410302      9.517168       2.518596      -0.1785038     8.309087      106.8942 18.34219  59.08635 29.16585  47.80787       34.45406  
1 1 1 21 9  0  o 37.65365 23.21557  0.8440965      2.277683      0.8440965      2.277683      0.8440965      2.277683      37.65365 23.21557  37.65365 23.21557  0.000000       0.000000  
1 1 1 21 9  1  o 129.5605 12.16018  11.52581       2.074817      10.72396       3.330471      12.03439       2.652412      121.3134 21.38374  131.2491 15.46238  -9.935722      26.38844  
1 1 1 21 9  2  o 152.0015 12.34983  15.84747       2.479863      21.95797       3.897765      11.69193       3.214332      177.1200 16.71243  127.6091 19.52296  49.51096       25.69925  
1 1 1 21 9  3  o 189.0926 15.64064  24.88120       3.905746      27.66230       4.882910      19.94111       6.507855      197.6515 18.76459  159.0386 31.82057  38.61287       36.94128  
1 1 1 21 9  4  o 259.6214 10.70494  45.81125       3.695437      45.82401       5.581816      45.80128       4.930799      256.2747 16.43201  257.5392 14.42579  -1.264496      21.86583  
1 1 1 21 9  5  o 89.88172 9.901698  5.533729       1.166292      0.8291673      3.196800      6.256058       1.252632      57.77396 24.34265  95.61144 9.978676  -37.83748      26.30853  
1 1 1 21 9  6  o 170.9843 6.461727  19.65008       1.469590      15.22784       5.284359      20.02077       1.529944      139.0285 29.44208  172.5434 6.666863  -33.51483      30.18746  
1 1 1 21 9  7  o 122.8585 4.070674  10.09903       0.6654951     10.47254       7.041039      10.09566       0.6684877     109.7204 38.69790  122.8355 4.089798  -13.11516      38.91341  
1 1 1 21 9  8  o 59.02559 10.04739  2.430285       0.7619697     4.293509       7.418368      2.410418       0.7660213     87.10807 36.91068  58.75288 10.15150  28.35519       38.28122  
1 1 1 21 9  9  o 27.52390 12.32969  -0.3651856     0.9326953     2.288417       7.929401      -0.4024149     0.9392152     82.23696 36.44877  27.38729 12.31222  54.84968       38.47212  
1 1 1 21 9  10 o 110.3950 9.171081  8.336176       1.336926      31.25063       7.865321      7.654428       1.356668      193.9100 31.52145  105.5727 9.754040  88.33721       32.99611  
1 1 1 21 9  11 o 146.7764 16.05580  15.46734       3.089061      19.24075       4.987851      13.11953       3.934403      156.8214 24.68400  129.8888 23.60084  26.93259       34.15112  
1 1 1 21 9  12 o 95.19759 16.77387  6.678193       2.050101      7.937925       6.251512      6.526393       2.170108      92.64748 35.75350  93.38725 18.09251  -0.7397690     40.07058  
1 1 1 21 9  13 o 157.4575 14.08937  17.70241       2.924957      18.41691       6.548248      17.52431       3.269222      137.8736 35.44757  155.1556 16.04379  -17.28203      38.90930  
1 1 1 21 9  14 o 104.0455 28.98327  9.816195       4.166905      14.12745       6.080564      5.998956       5.721593      116.4573 35.75638  81.34322 33.26216  35.11410       48.83533  
1 1 1 21 9  15 o 72.44471 13.44299  3.850680       1.249938      5.563864       1.562794      0.8090338      2.082352      87.14670 13.92650  46.73809 19.66703  40.40861       24.09854  
1 1 1 21 9  16 o 39.61833 15.25044  0.8977503      1.135346      0.6130373      1.256455      2.164707       2.650477      38.26878 15.61042  56.91290 22.86790  -18.64412      27.68801  
1 1 1 21 9  17 o 162.2308 7.411020  18.04194       1.597851      17.57326       1.719700      21.00213       4.321852      159.6647 8.109514  161.0453 20.61132  -1.380630      22.14929  
1 1 1 21 9  18 o 143.7899 4.671597  13.94920       0.8939033     13.84235       0.9038808     18.70912       6.032804      143.2101 4.743116  128.8860 34.46122  14.32407       34.78610  
1 1 1 21 9  19 o 106.9950 4.500093  7.730614       0.6401587     7.703920       0.6424806     11.40372       7.536577      106.8019 4.524728  84.51485 36.53271  22.28709       36.81184  
1 1 1 21 9  20 o 23.69223 11.82953  -3.561820      1.528184      -4.342142      1.745259      -0.9972643     3.163946      24.61996 12.34386  44.51720 20.91741  -19.89724      24.28804  
1 1 1 21 9  21 o 112.1065 12.19843  9.306754       1.792900      8.859143       1.812899      29.25993       12.10400      108.8788 12.73594  93.71616 42.93617  15.16265       44.78526  
1 1 1 21 10 0  o 135.8493 15.14665  12.97407       2.654662      12.97407       2.654662      12.97407       2.654662      135.8493 15.14665  135.8493 15.14665  0.000000       0.000000  
1 1 1 21 10 1  o 255.7061 11.29095  44.59922       3.837716      49.71592       6.637990      42.03029       4.703460      264.5602 18.95510  246.4430 14.38533  18.11716       23.79566  
1 1 1 21 10 2  o 102.1422 17.07253  7.468259       2.241730      11.39782       7.585756      7.092248       2.346533      114.4222 40.18257  98.92398 18.48069  15.49825       44.22866  
1 1 1 21 10 3  o 128.7823 8.676417  11.24708       1.480226      8.356435       2.130608      13.94404       2.057992      108.8958 15.08801  142.7701 10.90006  -33.87429      18.61342  
1 1 1 21 10 4  o 152.2463 10.23449  15.80816       2.064220      20.71362       6.115994      15.17752       2.192896      162.4342 29.33566  148.8494 11.13672  13.58482       31.37845  
1 1 1 21 10 5  o 76.14441 9.272216  3.981574       0.9214208     3.814111       3.793262      3.992074       0.9498704     75.08373 28.11173  76.17359 9.568679  -1.089859      29.69561  
1 1 1 21 10 6  o 126.0340 4.766741  10.64677       0.7990968     6.658828       4.990007      10.75174       0.8095444     91.54307 32.54986  126.6484 4.805693  -35.10535      32.90271  
1 1 1 21 10 7  o 48.27374 13.87173  1.657585       0.9395261     -3.356498      6.518670      1.763952       0.9494392     64.41063 30.18823  49.67850 13.83344  14.73212       33.20683  
1 1 1 21 10 8  o 30.28055 13.24185  -0.1519251     1.014413      4.689015       7.821849      -0.2347398     1.023053      87.36324 37.48450  29.83811 13.16453  57.52513       39.72900  
1 1 1 21 10 9  o 162.4900 9.177165  18.01394       1.978973      0.000000       0.000000      18.01394       1.978973      ?        ?         162.4900 9.177165  0.000000       9.177165  
1 1 1 21 10 10 o 111.0605 22.49126  9.573349       3.214222      -10.82162      11.59318      11.27162       3.345369      71.01549 34.93769  121.4903 21.44864  -50.47486      40.99617  
1 1 1 21 10 11 o 57.11571 20.93629  2.211843       2.083902      3.200069       5.397958      2.038766       2.259031      73.74596 31.37635  56.66346 21.58654  17.08250       38.08482  
1 1 1 21 10 12 o 76.34388 20.64633  4.589514       2.150480      19.60546       5.724065      2.121805       2.320466      149.9627 29.69585  57.06013 21.84365  92.90253       36.86446  
1 1 1 21 10 13 o 160.0909 19.61916  19.66203       4.097861      20.51691       6.241218      19.01422       5.432985      147.7180 32.58375  147.1053 28.74746  0.6126709      43.45247  
1 1 1 21 10 14 o 174.9499 11.79768  21.63479       2.734243      8.110497       5.321669      26.48550       3.187085      88.32318 33.24876  193.0107 12.45847  -104.6876      35.50624  
1 1 1 21 10 15 o 108.7872 11.18227  8.399413       1.597937      8.077259       2.070856      8.873517       2.512203      103.9275 15.42054  106.7489 18.32062  -2.821373      23.94657  
1 1 1 21 10 16 o 72.36317 15.74816  4.019962       1.475290      5.480436       1.663324      -1.366123      3.194234      85.15923 15.21638  45.38932 21.22752  39.76991       26.11792  
1 1 1 21 10 17 o 69.53218 9.969990  3.444484       0.8973541     3.214096       0.9188714     8.191607       4.170993      66.81600 10.67996  88.17017 29.84514  -21.35416      31.69849  
1 1 1 21 10 18 o 25.60883 11.35123  -0.1524387     0.7692245     -0.1249213     0.7731147     -2.866102      7.677462      25.88795 11.43190  58.77877 28.81918  -32.89082      31.00377  
1 1 1 21 10 19 o 48.26808 15.09536  1.808070       1.078057      1.741117       1.089936      4.829564       7.321917      47.47914 15.21981  67.98235 31.90425  -20.50321      35.34861  
1 1 1 21 10 20 o 74.84288 19.40000  4.835004       1.950536      4.839442       2.070229      4.799915       5.820803      73.94677 20.36466  66.04237 30.07274  7.904404       36.31927  
1 1 1 21 11 0  o 43.93383 29.71434  -1.579153      5.118906      -1.579153      5.118906      -1.579153      5.118906      43.93383 29.71434  43.93383 29.71434  0.000000       0.000000  
1 1 1 21 11 1  o 96.57514 21.21320  6.984776       2.655086      -0.3979441     4.717074      10.40845       3.212260      62.34272 27.84182  118.4961 21.11834  -56.15342      34.94497  
1 1 1 21 11 2  f 104.6050 13.90680  7.689013       1.890464      10.69121       4.681417      7.104042       2.066449      114.4228 30.24905  99.61932 16.11723  14.80344       34.27492  
1 1 1 21 11 3  o 242.0638 11.36580  40.15976       3.655853      43.38071       5.985453      38.24311       4.617185      246.1948 18.37761  233.8841 14.89240  12.31073       23.65418  
1 1 1 21 11 4  o 114.7207 8.310743  8.942095       1.261829      6.247741       6.169811      9.059711       1.289076      90.43825 35.34595  115.4421 8.438222  -25.00382      36.33924  
1 1 1 21 11 5  o 178.0443 4.925027  21.25070       1.167328      26.95709       7.917655      21.12390       1.180225      177.4138 34.73529  177.4964 4.994983  -0.8258057E-01 35.09259  
1 1 1 21 11 6  o 168.7081 2.179572  18.98451       0.4899826     22.78058       11.68208      18.97782       0.4904142     138.7220 49.74976  168.6782 2.181879  -29.95618      49.79758  
1 1 1 21 11 7  o 154.2886 10.68308  16.38145       2.182799      17.98772       5.177052      16.03417       2.407230      150.1802 26.85589  152.0193 11.98028  -1.839142      29.40691  
1 1 1 21 11 8  o 104.1257 12.06349  7.591407       1.642872      6.227487       10.34545      7.626692       1.663987      92.33829 41.23526  104.3134 12.20141  -11.97508      43.00257  
1 1 1 21 11 9  o 96.17056 7.673011  6.304019       0.9751410     0.000000       0.000000      6.304019       0.9751410     ?        ?         96.17056 7.673011  0.000000       7.673011  
1 1 1 21 11 10 o 56.68739 21.00141  2.164559       2.106291      0.000000       0.000000      2.164559       2.106291      ?        ?         56.68739 21.00141  0.000000       21.00141  
1 1 1 21 11 11 f 143.3700 15.31005  14.92434       2.879669      21.49968       11.85668      14.51216       2.968554      117.7195 47.97853  140.7480 16.11853  -23.02847      50.61370  
1 1 1 21 11 12 o 68.29237 25.77698  3.680962       3.203391      0.8640625E-01  5.696637      5.343258       3.873916      63.31476 29.17145  77.89144 28.54645  -14.57668      40.81511  
1 1 1 21 11 13 f 89.53109 23.70035  6.815136       2.871393      6.328440       3.955675      7.357222       4.174699      82.11218 29.00146  87.34990 29.85379  -5.237717      41.62132  
1 1 1 21 11 14 o 104.0079 14.80004  8.024171       1.993356      5.250843       5.322687      8.476586       2.149806      75.09583 31.51179  106.3366 15.63872  -31.24075      35.17900  
1 1 1 21 11 15 o 129.1168 11.98829  11.95421       2.039034      12.19548       2.708743      11.63873       3.097448      126.6695 16.43514  120.3222 20.02235  6.347382       25.90382  
1 1 1 21 11 16 o 109.9710 11.32129  8.661654       1.635329      8.143478       1.930107      9.980153       3.078809      104.5782 14.21846  108.5827 22.03287  -4.004471      26.22235  
1 1 1 21 11 17 o 84.26373 8.509066  4.965816       0.9423485     5.421430       0.9752895     -1.439159      3.656737      88.12482 8.407192  47.09196 22.23769  41.03286       23.77385  
1 1 1 21 11 18 o 101.4848 7.439807  7.129220       0.9990969     7.408739       1.013616      -2.418388      5.924000      103.4851 7.399419  53.66085 26.09088  49.82425       27.11984  
1 1 1 21 11 19 o 92.34845 9.075655  6.039195       1.102403      6.408660       1.159304      2.550221       3.562536      95.03215 9.272716  57.66890 25.02221  37.36325       26.68509  
1 1 1 21 12 0  o 36.04220 24.32675  -1.103146      3.396725      -1.103146      3.396725      -1.103146      3.396725      36.04220 24.32675  36.04220 24.32675  0.000000       0.000000  
1 1 1 21 12 1  o 161.9010 16.19407  18.68378       3.446814      9.296071       12.44984      19.46307       3.587025      103.3565 45.74727  165.0464 16.53235  -61.68991      48.64290  
1 1 1 21 12 2  o 34.80606 13.14078  0.6379060      0.8326243     -2.366502      2.747641      0.9416931      0.8737057     41.27781 19.42572  38.76306 13.63511  2.514748       23.73341  
1 1 1 21 12 3  o 115.6263 8.555871  9.112295       1.308900      4.460727       14.12084      9.152608       1.314560      96.15412 44.85799  115.8775 8.574231  -19.72342      45.67008  
1 1 1 21 12 4  o 87.84942 6.029621  5.212364       0.7015535     11.63446       2.957578      4.829472       0.7221644     126.1031 18.12075  84.45850 6.465975  41.64456       19.23982  
1 1 1 21 12 5  o 129.0765 2.730206  11.12205       0.4695871     19.58431       6.913378      11.08283       0.4706742     146.5665 35.72760  128.8477 2.741386  17.71880       35.83262  
1 1 1 21 12 6  o 62.91963 15.03061  2.903691       1.242870      -4.552759      11.41773      2.993104       1.250300      77.08283 37.17500  63.91428 14.94856  13.16855       40.06794  
1 1 1 21 12 7  o 198.2757 9.473014  26.93322       2.495590      28.89899       9.493484      26.78729       2.586559      165.9731 42.68599  197.5119 9.858951  -31.53883      43.80973  
1 1 1 21 12 8  o 50.48836 12.73383  1.850497       0.8564337     7.492333       9.570940      1.804958       0.8598832     90.85990 40.16841  49.85357 12.85968  41.00633       42.17668  
1 1 1 21 12 9  o 39.93288 18.09167  -0.6815437     2.073988      0.000000       0.000000      -0.6815437     2.073988      ?        ?         39.93288 18.09167  0.000000       18.09167  
1 1 1 21 12 10 o 31.23708 15.67679  -7.333079      2.848671      0.000000       0.000000      -7.333079      2.848671      ?        ?         31.23708 15.67679  0.000000       15.67679  
1 1 1 21 12 11 o 97.06429 24.18168  7.964650       3.116042      5.272170       8.850983      8.345578       3.329180      80.26605 36.75224  98.44252 25.25701  -18.17647      44.59421  
1 1 1 21 12 12 f 63.51867 29.51694  0.3108630      6.020091      -2.941453      14.51271      0.9868047      6.616170      74.78708 37.19799  66.61671 30.95222  8.170364       48.39143  
1 1 1 21 12 13 o 168.8821 11.78209  20.28445       2.634795      25.86237       7.159939      19.41079       2.833634      157.0123 35.10428  164.0065 13.07425  -6.994232      37.45993  
1 1 1 21 12 14 o 155.8327 14.49793  17.92875       2.975964      18.30823       4.478726      17.62876       3.982193      146.4795 23.75912  147.3128 20.87018  -0.8333282     31.62373  
1 1 1 21 12 15 o 33.56684 15.84239  -1.470128      1.851334      -2.561513      4.716568      -1.271354      2.012879      50.58995 24.26772  35.91759 16.81504  14.67236       29.52402  
1 1 1 21 12 16 o 149.7796 9.553468  15.76417       1.896782      15.05457       2.056419      19.80959       4.910071      145.4193 10.68711  146.5426 26.10202  -1.123383      28.20513  
1 1 1 21 12 17 o 96.18280 12.20446  6.798878       1.529022      7.204401       1.614839      3.284842       4.753621      98.78446 12.55076  63.12328 28.08524  35.66118       30.76203  
1 1 1 21 12 18 o 131.2667 7.039990  11.88350       1.226898      12.01361       1.283907      10.51520       4.163565      131.7919 7.339905  96.82436 29.56130  34.96753       30.45891  
1 1 1 21 12 19 o 111.7526 5.277511  8.496977       0.7836670     8.682461       0.7931698     0.8948952      5.077836      112.9655 5.283868  55.87374 26.32968  57.09172       26.85463  
1 1 1 21 13 0  o 57.37650 35.64030  2.964051       5.466120      2.964051       5.466120      2.964051       5.466120      57.37650 35.64030  57.37650 35.64030  0.000000       0.000000  
1 1 1 21 13 1  o 39.93950 14.24256  0.9981660      0.9560449     6.173779       3.424182      0.5605912      0.9956396     86.52861 26.87860  35.76397 14.13171  50.76464       30.36716  
1 1 1 21 13 2  o 147.5803 7.185977  14.75503       1.408900      18.03843       2.464362      13.16076       1.717217      161.1788 11.55080  138.5586 9.355603  22.62016       14.86433  
1 1 1 21 13 3  o 185.6878 6.024897  23.23627       1.488782      15.79256       12.89033      23.33690       1.498812      109.7679 47.61241  186.0801 6.052740  -76.31218      47.99559  
1 1 1 21 13 4  o 29.20250 13.00105  -0.2971612     1.020268      5.203317       3.238104      -0.9034175     1.075025      79.75307 26.28292  26.58168 12.39301  53.17139       29.05819  
1 1 1 21 13 5  o 100.2713 10.67124  7.003909       1.403944      13.61806       6.646667      6.695030       1.436352      115.2071 37.63868  97.78818 11.22640  17.41888       39.27725  
1 1 1 21 13 6  o 215.7511 7.981179  31.69660       2.290575      42.90833       14.53523      31.41108       2.319558      165.8860 55.71346  214.6933 8.122637  -48.80730      56.30245  
1 1 1 21 13 7  o 23.51605 11.08735  -0.9204814     0.9025337     7.935201       8.224998      -1.028410      0.9080168     89.13902 38.34515  23.07797 10.95187  66.06105       39.87849  
1 1 1 21 13 8  o 92.17090 24.29119  7.120465       3.024914      23.09956       11.42095      5.914985       3.136941      120.9713 47.84294  83.01562 25.71655  37.95566       54.31655  
1 1 1 21 13 9  o 97.09197 24.15552  7.948806       3.112416      0.000000       0.000000      7.948806       3.112416      ?        ?         97.09197 24.15552  0.000000       24.15552  
1 1 1 21 13 10 o 58.29908 25.48716  1.320930       3.755662      0.000000       0.000000      1.320930       3.755662      ?        ?         58.29908 25.48716  0.000000       25.48716  
1 1 1 21 13 11 o 45.70928 21.45090  -1.693390      3.309557      0.000000       0.000000      -1.693390      3.309557      ?        ?         45.70928 21.45090  0.000000       21.45090  
1 1 1 21 13 12 o 38.27831 14.37899  0.8845080      0.9941456     -1.050537      11.22286      0.8998120      0.9980692     70.56035 34.64608  38.46952 14.41643  32.09082       37.52578  
1 1 1 21 13 13 o 128.6420 20.14482  13.35491       3.339939      -3.819606      7.834457      17.16956       3.692274      60.09580 29.39082  147.0152 19.31440  -86.91940      35.16911  
1 1 1 21 13 14 o 97.85455 22.00599  8.178129       2.799621      6.662914       6.018376      8.596552       3.162640      76.64936 32.88383  97.81286 24.35816  -21.16350      40.92269  
1 1 1 21 13 15 o 67.95213 20.36312  3.945190       1.988633      1.969757       3.771997      4.705624       2.340297      57.79635 25.39693  72.79660 22.15049  -15.00025      33.69938  
1 1 1 21 13 16 o 82.96572 12.05022  5.067116       1.293265      4.773288       1.434936      6.338594       2.984969      79.13908 14.12546  80.58452 25.10574  -1.445435      28.80671  
1 1 1 21 13 17 o 56.02760 15.70317  2.512361       1.219184      2.618546       1.234563      -1.670346      7.748366      57.18218 15.71774  58.12767 28.59042  -0.9454842     32.62605  
1 1 1 21 14 0  o 140.4881 13.32391  13.87165       2.439596      13.87165       2.439596      13.87165       2.439596      140.4881 13.32391  140.4881 13.32391  0.000000       0.000000  
1 1 1 21 14 1  o 147.9318 7.806520  14.91485       1.533389      14.03562       3.820945      15.08363       1.674112      133.5882 22.24695  148.4627 8.497901  -14.87450      23.81472  
1 1 1 21 14 2  o 135.1453 5.657274  12.32107       1.016530      13.48739       4.110919      12.24511       1.049110      128.2975 24.94481  134.6667 5.860416  -6.369110      25.62397  
1 1 1 21 14 3  o 103.3041 6.794732  7.252985       0.9301341     26.73161       11.54438      7.125712       0.9331679     134.1758 49.26177  102.3642 6.881270  31.81161       49.74006  
1 1 1 21 14 4  o 163.3010 10.78417  18.56899       2.333518      26.57464       5.874345      17.06902       2.542747      179.9066 25.19379  155.4844 12.37480  24.42224       28.06890  
1 1 1 21 14 5  o 20.84228 10.45573  -3.488760      1.260820      0.2764774      3.097830      -4.236300      1.380317      51.68292 22.85042  20.95256 10.56680  30.73036       25.17537  
1 1 1 21 14 6  o 175.7934 6.767227  20.97967       1.582249      39.13649       14.91159      20.77292       1.591233      139.2861 54.79671  174.8881 6.841298  -35.60197      55.22212  
1 1 1 21 14 7  o 150.0602 11.49686  15.87368       2.281384      25.30684       8.318027      15.10636       2.372357      147.4156 40.90671  145.7773 12.32832  1.638306       42.72407  
1 1 1 21 14 8  o 41.49578 19.45401  -1.672715      2.710393      0.8814132      9.663123      -1.890816      2.823745      72.75477 34.85643  41.76967 19.66826  30.98510       40.02263  
1 1 1 21 14 9  o 89.01475 38.71572  10.49726       8.571154      0.000000       0.000000      10.49726       8.571154      ?        ?         89.01475 38.71572  0.000000       38.71572  
1 1 1 21 14 10 o 108.7948 31.18111  11.95691       4.753073      0.000000       0.000000      11.95691       4.753073      ?        ?         108.7948 31.18111  0.000000       31.18111  
1 1 1 21 14 11 o 67.40320 27.97772  3.744019       4.128928      0.000000       0.000000      3.744019       4.128928      ?        ?         67.40320 27.97772  0.000000       27.97772  
1 1 1 21 14 12 o 65.63667 19.57264  3.546461       1.840697      -0.9284995     9.269402      3.730167       1.878099      66.10775 32.25262  67.20296 19.70180  -1.095207      37.79408  
1 1 1 21 14 13 o 52.53786 23.23660  0.9935644      3.206147      -0.3319822     7.363457      1.303656       3.561473      62.30400 29.99873  55.16692 24.44036  7.137089       38.69438  
1 1 1 21 14 14 o 41.75544 19.83481  -1.837080      2.992691      -0.3351540     8.379647      -2.056653      3.203989      62.81462 30.65028  42.60711 20.31923  20.20751       36.77378  
1 1 1 21 14 15 o 63.77177 16.38539  3.269407       1.399766      3.971274       1.721508      1.900022       2.404610      68.97704 18.39347  52.34420 21.50151  16.63284       28.29549  
1 1 1 21 14 16 o 105.7692 12.26087  8.258790       1.696066      8.544473       1.772738      5.168808       5.830153      107.2779 12.64369  67.67009 30.52630  39.60779       33.04115  
1 1 1 21 15 0  o 18.66029 13.00448  -1.010699      1.165697      -1.010699      1.165697      -1.010699      1.165697      18.66029 13.00448  18.66029 13.00448  0.000000       0.000000  
1 1 1 21 15 1  o 86.92516 6.082001  5.131238       0.7000299     4.084386       1.226924      5.636509       0.8523871     75.10209 12.71317  90.82141 7.099663  -15.71932      14.56125  
1 1 1 21 15 2  o 64.75362 10.66294  2.985106       0.8880600     7.965696       4.384233      2.772011       0.9068588     90.76086 30.59883  62.08493 11.38103  28.67593       32.64684  
1 1 1 21 15 3  o 95.26009 10.54186  6.382336       1.315775      7.075723       2.567885      6.135473       1.532199      93.64857 21.08705  92.25827 12.80840  1.390297       24.67223  
1 1 1 21 15 4  o 60.75544 16.42684  2.828019       1.361500      11.35640       5.802443      2.331112       1.400602      101.4900 35.17590  55.36151 17.18930  46.12847       39.15119  
1 1 1 21 15 5  o 19.93983 9.738855  -1.501361      0.8518097     -0.6027805     3.425167      -1.560600      0.8794392     49.87997 22.84794  20.20662 9.874838  29.67334       24.89057  
1 1 1 21 15 6  o 69.07534 21.80319  3.949315       2.243939      6.219850       5.398419      3.475079       2.467176      79.24951 32.34597  65.23225 22.91536  14.01726       39.64058  
1 1 1 21 15 7  o 48.87214 20.80171  0.9083214      2.374239      2.496958       4.997030      0.4451223      2.698258      65.58552 29.00821  48.78738 21.45773  16.79813       36.08200  
1 1 1 21 15 8  o 49.44148 21.36886  0.8003408      2.577839      1.282113       3.764820      0.3750971      3.537061      57.29249 25.26660  53.10426 23.88173  4.188236       34.76692  
1 1 1 21 15 9  f 57.05929 24.70676  1.633315       3.458777      0.000000       0.000000      1.633315       3.458777      ?        ?         57.05929 24.70676  0.000000       24.70676  
1 1 1 21 15 10 o 72.93015 33.29405  4.888309       7.193075      0.000000       0.000000      4.888309       7.193075      ?        ?         72.93015 33.29405  0.000000       33.29405  
1 1 1 21 15 11 o 44.45495 17.10710  1.261655       1.428318      0.000000       0.000000      1.261655       1.428318      ?        ?         44.45495 17.10710  0.000000       17.10710  
1 1 1 21 15 12 o 70.10488 23.52573  4.485176       2.591762      2.198785       8.590802      4.714114       2.718425      66.95912 32.28098  71.34565 24.09443  -4.386528      40.28155  
1 1 1 21 15 13 f 51.59069 22.92523  1.027480       3.157258      0.8169139      12.62501      1.041527       3.260871      67.34290 33.68131  52.07716 23.21018  15.26573       40.90407  
1 1 1 21 15 14 o 75.41468 29.46124  6.582082       4.284862      -13.09425      10.24789      10.75081       4.716979      54.19822 27.49687  94.10239 31.73878  -39.90417      41.99318  
1 1 1 21 15 15 o 94.48847 13.42946  6.731466       1.643312      6.313638       1.882236      8.070992       3.370162      88.96666 16.48406  88.60473 26.49888  0.3619308      31.20761  
1 1 1 21 16 0  o 64.75757 12.81333  3.180613       0.9828287     3.180613       0.9828287     3.180613       0.9828287     64.75757 12.81333  64.75757 12.81333  0.000000       0.000000  
1 1 1 21 16 1  o 21.81681 10.40859  -1.019235      0.8425058     -2.345093      1.083824      1.005285       1.339280      20.98755 10.39133  42.24051 16.47976  -21.25296      19.48236  
1 1 1 21 16 2  o 103.0172 9.362266  7.399769       1.271158      8.107163       1.883623      6.808194       1.722535      105.2968 13.75311  96.34868 13.81124  8.948090       19.49098  
1 1 1 21 16 3  o 141.4756 8.431008  13.80678       1.582196      17.48828       3.415176      12.80066       1.785351      151.6158 17.20825  135.2883 9.973639  16.32741       19.88963  
1 1 1 21 16 4  o 47.99212 11.98715  1.695550       0.7642701     0.4153172      5.154259      1.724331       0.7728131     60.09755 27.71033  48.38598 12.03586  11.71157       30.21133  
1 1 1 21 16 5  o 84.11357 17.32236  5.506526       1.876856      3.235015       3.154934      6.750744       2.334969      63.87635 25.18194  91.49817 19.73211  -27.62182      31.99198  
1 1 1 21 16 6  o 128.7605 13.65630  12.12914       2.307410      16.33024       4.856723      10.90446       2.622253      132.1332 28.42787  119.2539 16.98092  12.87928       33.11337  
1 1 1 21 16 7  o 64.35523 25.16803  3.430498       3.129821      4.967148       7.514784      3.108007       3.442614      73.67601 33.78323  63.18493 25.81473  10.49108       42.51714  
1 1 1 21 16 8  o 60.57871 26.41477  2.250736       4.011326      3.379405       4.683653      -0.8559197     7.770480      65.94319 28.65083  63.24229 30.54158  2.700905       41.87670  
1 1 1 21 16 9  o 51.06355 21.34904  1.463514       2.429537      8.964367       4.899223      -0.9826474     2.797786      87.91296 32.12125  43.27612 20.11437  44.63684       37.89938  
1 1 1 21 16 10 o 61.72394 28.64608  1.713848       5.642167      0.000000       0.000000      1.713848       5.642167      ?        ?         61.72394 28.64608  0.000000       28.64608  
1 1 1 21 16 11 o 60.89952 23.79782  3.195622       2.796493      0.000000       0.000000      3.195622       2.796493      ?        ?         60.89952 23.79782  0.000000       23.79782  
1 1 1 21 16 12 o 48.68100 22.62880  -0.3289157     3.542381      -16.13808      14.92965      0.6141998      3.646513      59.92931 30.65050  51.92318 23.70452  8.006130       38.74735  
1 1 1 21 16 13 o 78.34518 32.93457  8.617629       5.830510      3.809371       10.12622      11.00226       7.131229      66.96374 32.88610  81.50860 35.38383  -14.54486      48.30643  
1 1 1 21 17 0  o 16.32942 11.86087  -2.883348      1.438288      -2.883348      1.438288      -2.883348      1.438288      16.32942 11.86087  16.32942 11.86087  0.000000       0.000000  
1 1 1 21 17 1  o 43.22511 12.66876  1.376504       0.7766519     1.003679       0.9709828     2.038668       1.294022      39.27665 14.30776  51.66618 16.58578  -12.38952      21.90434  
1 1 1 21 17 2  o 24.45046 11.43991  -0.7816131     0.9293981     0.3850683E-01  1.214906      -1.938727      1.443086      33.48353 14.56946  27.23824 13.15602  6.245291       19.63033  
1 1 1 21 17 3  o 45.07870 15.61140  1.459346       1.142788      1.725043       1.282032      0.4316643      2.521363      48.29749 16.54283  46.99327 20.70276  1.304226       26.50037  
1 1 1 21 17 4  o 138.8399 13.80911  14.19098       2.520947      8.514305       6.053930      15.38181       2.772787      83.35445 34.16446  143.7168 14.68508  -60.36238      37.18685  
1 1 1 21 17 5  o 91.47489 17.64571  6.611429       2.072933      6.749599       5.788700      6.591104       2.220168      77.13241 32.64091  90.14385 19.07885  -13.01144      37.80783  
1 1 1 21 17 6  o 45.54819 20.44653  0.8746026E-01  2.579612      0.3182432      3.170050      -0.3649117     4.438253      49.89112 22.50753  53.76058 25.10301  -3.869461      33.71572  
1 1 1 21 17 7  o 49.70076 22.16178  0.6082563      2.976674      -1.599380      4.500536      2.324997       3.968741      50.88947 24.21644  59.75092 26.15914  -8.861443      35.64739  
1 1 1 21 17 8  o 86.49110 33.32265  9.611244       5.423916      12.91133       6.928010      4.385571       8.717999      91.83810 36.94703  69.62766 33.29074  22.21043       49.73285  
1 1 1 21 17 9  f 37.91411 18.31048  -2.740135      2.793544      -0.8689720     3.941784      -4.628262      3.959612      49.42822 23.26318  41.89153 20.57131  7.536690       31.05405  
1 1 1 21 17 10 o 29.79075 13.91646  -0.9193807     1.366388      1.309331       2.920579      -1.543903      1.546023      51.48608 22.49287  29.51429 14.08618  21.97179       26.53959  
1 1 1 21 17 11 o 68.39632 33.30062  4.923604       9.740088      7.764831       23.88184      4.356704       10.66762      70.54272 36.26168  68.01743 33.47278  2.525291       49.34913  
1 1 1 21 18 0  o 53.05436 20.62208  2.767367       1.388128      2.767367       1.388128      2.767367       1.388128      53.05436 20.62208  53.05436 20.62208  0.000000       0.000000  
1 1 1 21 18 1  o 45.19269 12.90169  1.532438       0.8152919     1.279412       1.029994      1.956951       1.334130      42.37945 14.81223  50.38139 16.87857  -8.001942      22.45636  
1 1 1 21 18 2  o 20.17508 9.929809  -1.817936      0.9397489     -1.437205      1.049300      -3.360988      2.112421      23.30839 11.24813  30.70202 15.06619  -7.393633      18.80188  
1 1 1 21 18 3  o 57.87986 25.83617  1.777175       4.056750      3.234449       5.167189      -0.5642871     6.549787      64.58225 28.96866  59.29210 28.48267  5.290154       40.62568  
1 1 1 21 18 4  o 82.98907 18.81337  5.671010       2.032297      9.875695       4.150844      4.345263       2.330773      96.03383 29.55307  69.72783 22.24663  26.30600       36.99049  
1 1 1 21 18 5  o 90.54795 20.58055  6.984551       2.426674      -3.071350      6.646793      8.531036       2.606601      55.38896 27.08518  100.9261 20.08858  -45.53709      33.72178  
1 1 1 21 18 6  o 48.00222 22.95242  -1.905043      4.145368      -5.076168      5.935454      1.114696       5.792046      50.24005 24.77104  59.84802 28.17716  -9.607967      37.51742  
1 1 1 21 18 7  o 96.97663 28.69712  9.967051       3.969044      14.01781       7.306170      8.271111       4.727451      91.49453 37.51986  82.30494 31.25752  9.189590       48.83413  
1 1 1 21 18 8  o 105.0031 34.32549  14.18025       5.527617      11.80315       9.784151      15.29465       6.699159      78.29529 36.78719  99.41575 37.33012  -21.12046      52.41026  
1 1 1 21 19 0  o 36.55947 19.65226  1.465198       1.320818      1.465198       1.320818      1.465198       1.320818      36.55947 19.65226  36.55947 19.65226  0.000000       0.000000  
1 1 1 21 19 1  f 20.88988 10.45772  -3.135148      1.230207      -2.956767      1.374405      -3.853937      2.758936      23.21926 11.53181  35.14310 17.23993  -11.92384      20.74121  
1 1 1 21 19 2  o 57.10656 23.37999  2.547727       2.831153      1.924258       9.045263      2.615440       2.980934      65.36647 31.88423  57.74783 23.85274  7.618641       39.81906  
1 1 1 21 19 3  o 108.9202 24.59500  11.01640       3.484942      9.384328       4.043736      15.72791       6.870574      92.64156 29.27238  100.4010 37.78236  -7.759430      47.79518  
1 1 1 22 0  0  o 495.2325 12.64499  164.5290       8.332224      164.5290       8.332224      164.5290       8.332224      495.2325 12.64499  495.2325 12.64499  0.000000       0.000000  
1 1 1 22 0  1  o 250.2439 17.53461  43.11349       5.779873      43.11349       5.779873      43.11349       5.779873      250.2439 17.53461  250.2439 17.53461  0.000000       0.000000  
1 1 1 22 0  2  o 50.71159 32.13823  1.080964       4.689901      1.080964       4.689901      1.080964       4.689901      50.71159 32.13823  50.71159 32.13823  0.000000       0.000000  
1 1 1 22 0  3  o 32.52146 21.49702  -0.4429133     2.420425      -0.4429133     2.420425      -0.4429133     2.420425      32.52146 21.49702  32.52146 21.49702  0.000000       0.000000  
1 1 1 22 0  4  o 139.3402 25.58383  14.62610       4.277740      14.62610       4.277740      14.62610       4.277740      139.3402 25.58383  139.3402 25.58383  0.000000       0.000000  
1 1 1 22 0  5  o 41.08850 28.67695  -4.764292      5.726153      -4.764292      5.726153      -4.764292      5.726153      41.08850 28.67695  41.08850 28.67695  0.000000       0.000000  
1 1 1 22 0  6  o 172.1679 10.89676  20.15289       2.476663      20.15289       2.476663      20.15289       2.476663      172.1679 10.89676  172.1679 10.89676  0.000000       0.000000  
1 1 1 22 0  7  o 278.3766 22.37022  54.55467       8.170961      54.55467       8.170961      54.55467       8.170961      278.3766 22.37022  278.3766 22.37022  0.000000       0.000000  
1 1 1 22 0  8  o 50.21679 33.92703  -1.858390      6.638008      -1.858390      6.638008      -1.858390      6.638008      50.21679 33.92703  50.21679 33.92703  0.000000       0.000000  
1 1 1 22 0  9  o 68.71225 40.59790  4.864179       6.380871      4.864179       6.380871      4.864179       6.380871      68.71225 40.59790  68.71225 40.59790  0.000000       0.000000  
1 1 1 22 0  10 o 99.66048 35.37461  9.385895       4.275763      9.385895       4.275763      9.385895       4.275763      99.66048 35.37461  99.66048 35.37461  0.000000       0.000000  
1 1 1 22 0  11 o 166.2733 12.91988  19.07301       2.821728      19.07301       2.821728      19.07301       2.821728      166.2733 12.91988  166.2733 12.91988  0.000000       0.000000  
1 1 1 22 0  12 o 130.7068 9.006228  11.65237       1.551219      11.65237       1.551219      11.65237       1.551219      130.7068 9.006228  130.7068 9.006228  0.000000       0.000000  
1 1 1 22 0  13 f 59.18364 16.20252  2.860981       1.104603      2.860981       1.104603      2.860981       1.104603      59.18364 16.20252  59.18364 16.20252  0.000000       0.000000  
1 1 1 22 0  14 o 19.21986 13.80330  -2.706539      1.697098      -2.706539      1.697098      -2.706539      1.697098      19.21986 13.80330  19.21986 13.80330  0.000000       0.000000  
1 1 1 22 0  15 o 20.01466 13.30076  -0.2225280     0.9470468     -0.2225280     0.9470468     -0.2225280     0.9470468     20.01466 13.30076  20.01466 13.30076  0.000000       0.000000  
1 1 1 22 0  16 o 84.64157 11.52028  5.143755       1.231333      5.143755       1.231333      5.143755       1.231333      84.64157 11.52028  84.64157 11.52028  0.000000       0.000000  
1 1 1 22 0  17 o 96.12553 14.24006  6.789968       1.706530      6.789968       1.706530      6.789968       1.706530      96.12553 14.24006  96.12553 14.24006  0.000000       0.000000  
1 1 1 22 0  18 o 40.63990 26.63357  0.6029261      3.594280      0.6029261      3.594280      0.6029261      3.594280      40.63990 26.63357  40.63990 26.63357  0.000000       0.000000  
1 1 1 22 0  19 o 159.3378 12.21717  17.85653       2.557983      17.85653       2.557983      17.85653       2.557983      159.3378 12.21717  159.3378 12.21717  0.000000       0.000000  
1 1 1 22 0  20 o 28.13142 19.79482  -2.406808      2.896907      -2.406808      2.896907      -2.406808      2.896907      28.13142 19.79482  28.13142 19.79482  0.000000       0.000000  
1 1 1 22 0  21 o 34.54097 22.80517  0.2634189      2.711296      0.2634189      2.711296      0.2634189      2.711296      34.54097 22.80517  34.54097 22.80517  0.000000       0.000000  
1 1 1 22 0  22 o 61.14370 38.04117  6.638903       6.252394      6.638903       6.252394      6.638903       6.252394      61.14370 38.04117  61.14370 38.04117  0.000000       0.000000  
1 1 1 22 1  0  o 185.0077 16.23938  23.68859       3.929363      23.68859       3.929363      23.68859       3.929363      185.0077 16.23938  185.0077 16.23938  0.000000       0.000000  
1 1 1 22 1  1  o 276.3622 11.72357  51.84979       4.307490      51.44214       5.483109      52.50693       6.961667      273.6091 15.09766  273.9010 19.19572  -0.2919312     24.42161  
1 1 1 22 1  2  o 226.0052 12.92774  34.85789       3.877029      27.64868       6.196642      39.49537       4.969971      195.3593 24.32970  239.3114 15.67159  -43.95206      28.94017  
1 1 1 22 1  3  o 238.6377 13.68699  38.98310       4.334063      39.68476       5.128439      37.22970       8.107076      239.5349 16.16191  224.2762 27.71653  15.25862       32.08448  
1 1 1 22 1  4  o 49.80647 18.88029  1.307758       1.722856      1.570055       1.768844      -3.540801      7.604989      52.21960 19.26378  72.36688 33.47107  -20.14729      38.61872  
1 1 1 22 1  5  o 131.8440 17.53074  12.25681       3.003627      15.37312       7.782259      11.71133       3.255907      134.7259 40.26169  127.9174 19.73570  6.808517       44.83862  
1 1 1 22 1  6  o 170.4435 13.52091  19.98675       3.045713      25.31451       4.474863      15.38848       4.157233      189.7993 17.90500  145.5627 22.12878  44.23653       28.46528  
1 1 1 22 1  7  o 68.63012 22.73099  3.313069       2.421069      3.313069       2.421069      0.000000       0.000000      68.63012 22.73099  ?        ?         0.000000       22.73099  
1 1 1 22 1  8  o 167.3647 29.93746  21.81130       6.431433      16.20560       9.004825      27.64841       9.188807      132.7301 43.83332  179.7776 39.44368  -47.04753      58.96748  
1 1 1 22 1  9  o 88.26395 28.96466  6.006453       3.934207      10.75673       5.242416      -0.1180876     5.952629      114.2682 32.74596  70.24825 31.33076  44.01997       45.32013  
1 1 1 22 1  10 o 258.9499 11.27650  45.87527       3.881694      41.91909       6.600871      47.96656       4.799213      240.0952 20.83829  263.1505 13.73403  -23.05533      24.95712  
1 1 1 22 1  11 o 24.68279 11.58333  -0.9478601     0.9650225     -2.716316      1.489129      0.3325474      1.267095      26.16338 12.79945  37.32100 15.49566  -11.15762      20.09830  
1 1 1 22 1  12 o 141.7969 6.012432  13.53684       1.133453      18.24726       2.110536      11.62762       1.343665      163.3569 9.739984  130.9431 7.735241  32.41374       12.43789  
1 1 1 22 1  13 f 188.1309 4.778619  23.74242       1.196973      17.52078       2.018182      27.11854       1.486678      159.9477 9.512059  200.8318 5.560696  -40.88409      11.01819  
1 1 1 22 1  14 o 35.98234 12.46480  0.8336223      0.7285616     1.177142       0.9748336     0.3989576      1.096558      42.01900 14.42428  35.42060 14.53154  6.598400       20.47499  
1 1 1 22 1  15 o 57.77298 13.22969  2.443382       0.9964877     1.659189       1.270704      3.695903       1.605925      48.54919 16.47279  69.63060 17.36727  -21.08141      23.93689  
1 1 1 22 1  16 o 82.19643 12.31894  4.855602       1.307758      6.487439       1.822152      3.122180       1.878012      93.66438 15.11380  63.02772 19.95301  30.63666       25.03098  
1 1 1 22 1  17 o 23.08280 10.69621  -0.5808460     0.7820547     -2.319414      1.042772      1.654137       1.182308      20.42423 10.12654  47.63433 15.88793  -27.21010      18.84073  
1 1 1 22 1  18 o 32.93530 14.77785  -0.3232638     1.345828      -0.6781439E-01 1.613966      -0.9062576     2.438226      37.32533 16.49844  41.25164 19.03434  -3.926315      25.18937  
1 1 1 22 1  19 o 35.83148 16.20545  -0.4033434     1.655493      1.986343       3.340227      -1.181499      1.906069      57.27451 24.53339  35.13520 16.42076  22.13931       29.52166  
1 1 1 22 1  20 o 85.66500 16.98953  5.825500       1.870847      5.019905       2.480572      6.888242       2.849100      74.36855 22.83876  86.38442 23.92929  -12.01588      33.07899  
1 1 1 22 1  21 o 38.40284 17.93291  -0.9871411     2.265511      1.548481       3.658124      -2.564745      2.885461      54.57885 24.43604  38.68120 18.66321  15.89765       30.74793  
1 1 1 22 1  22 o 68.77937 28.97567  5.610937       4.528454      5.878099       5.535388      5.070293       7.874366      68.39897 30.37695  65.97835 31.57107  2.420624       43.81200  
1 1 1 22 2  0  o 185.1516 14.30372  23.53500       3.479260      23.53500       3.479260      23.53500       3.479260      185.1516 14.30372  185.1516 14.30372  0.000000       0.000000  
1 1 1 22 2  1  f 134.8223 14.38992  12.55919       2.545279      12.44703       3.554759      12.67718       3.646116      131.6877 20.95954  132.7593 21.33320  -1.071533      29.90665  
1 1 1 22 2  2  o 224.4975 9.162946  33.99892       2.735309      31.07429       7.267775      34.48156       2.952389      205.0362 27.27702  225.8774 9.832614  -20.84114      28.99510  
1 1 1 22 2  3  f 174.3024 11.15163  20.65397       2.576506      20.33634       2.857569      22.03457       5.957497      172.5067 12.51645  172.4015 26.80326  0.1051788      29.58169  
1 1 1 22 2  4  o 284.3554 24.79200  58.69899       9.300083      63.72479       14.11816      54.84642       12.36093      280.8408 38.75859  263.2557 36.19408  17.58511       53.03056  
1 1 1 22 2  5  f 116.6375 10.53522  9.277659       1.619767      5.080675       2.245291      13.83217       2.338971      83.33325 20.38965  142.0132 12.48715  -58.67995      23.90955  
1 1 1 22 2  6  f 136.3959 9.045524  12.59950       1.634737      13.68836       2.010975      10.47809       2.806934      141.7368 10.72721  121.4333 17.88164  20.30353       20.85249  
1 1 1 22 2  7  o 223.8843 15.05592  34.73246       4.465522      34.88654       6.308080      34.57770       6.322348      219.8508 21.82019  218.7404 21.98879  1.110397       30.97786  
1 1 1 22 2  8  o 205.5554 40.44622  36.41341       10.68373      0.000000       0.000000      36.41341       10.68373      ?        ?         205.5554 40.44622  0.000000       40.44622  
1 1 1 22 2  9  o 91.58455 27.98415  6.552671       3.730166      3.254635       4.893301      11.12776       5.763340      76.58200 30.96518  114.8488 34.72189  -38.26678      46.52367  
1 1 1 22 2  10 o 179.9076 19.06163  23.33550       4.500215      20.44486       8.371295      24.51039       5.336973      148.5838 40.96334  181.8094 22.50992  -33.22557      46.74068  
1 1 1 22 2  11 o 156.2119 8.213352  16.54465       1.703646      15.75556       7.903168      16.58310       1.744664      127.6657 40.98942  156.3297 8.406144  -28.66405      41.84251  
1 1 1 22 2  12 o 108.4197 6.977409  7.957446       1.002684      5.328693       1.776147      9.187081       1.214765      85.53537 16.17572  116.2817 7.886503  -30.74638      17.99586  
1 1 1 22 2  13 o 97.77036 7.269917  6.495957       0.9403530     8.724117       1.430083      4.798716       1.248130      112.6163 9.621946  82.60806 11.66281  30.00824       15.11962  
1 1 1 22 2  14 f 25.12277 11.90199  -1.164297      1.063602      -4.085065      1.351650      3.584984       1.723573      20.93407 10.54468  68.54920 18.46028  -47.61513      21.25964  
1 1 1 22 2  15 o 95.14735 7.697409  6.196315       0.9675958     6.065833       1.613270      6.269625       1.209238      91.64161 13.62508  94.98877 9.689103  -3.347160      16.71889  
1 1 1 22 2  16 o 81.06370 6.678651  4.485205       0.7150272     4.176961       0.8177423     5.486192       1.473613      77.80451 8.001407  87.01468 13.11637  -9.210167      15.36430  
1 1 1 22 2  17 o 82.85107 11.82369  4.937338       1.268356      6.132267       1.394324      -0.7938931     3.053630      92.62067 11.54763  46.55781 21.41710  46.06286       24.33187  
1 1 1 22 2  18 o 33.59817 13.77709  0.4151300      0.9850349     -0.8200000     1.672371      1.071259       1.218907      34.29368 15.80231  41.69718 15.86329  -7.403496      22.39100  
1 1 1 22 2  19 o 148.7692 7.475056  15.21878       1.477091      15.65916       1.662169      13.56508       3.221010      150.3516 8.329021  129.9456 19.17751  20.40598       20.90812  
1 1 1 22 2  20 o 92.72389 22.52793  7.633902       2.755642      7.630292       2.992395      7.654039       7.068616      90.59213 24.29213  75.62441 33.90490  14.96772       41.70911  
1 1 1 22 2  21 o 54.54816 22.55841  2.238268       2.670587      4.288930       3.651848      -0.1191608     3.915480      65.39402 26.63652  50.45969 23.56715  14.93433       35.56564  
1 1 1 22 2  22 o 55.56978 21.94202  2.618416       2.398742      2.372121       2.419811      16.57726       18.21705      54.12434 21.81417  71.03154 36.10072  -16.90720      42.17962  
1 1 1 22 3  0  o 36.17749 22.86591  0.4645962      2.356027      0.4645962      2.356027      0.4645962      2.356027      36.17749 22.86591  36.17749 22.86591  0.000000       0.000000  
1 1 1 22 3  1  o 270.8637 12.42270  49.97399       4.471802      48.17331       6.738840      51.39080       5.977548      261.8255 19.45423  272.4070 16.54566  -10.58142      25.53872  
1 1 1 22 3  2  o 243.6700 12.70678  40.51491       4.111573      40.70211       5.135957      40.18085       6.860966      242.5879 15.97730  237.2373 21.95237  5.350616       27.15107  
1 1 1 22 3  3  o 120.0498 14.73098  10.01909       2.307159      12.78860       2.766066      3.686973       4.182500      135.5111 15.60289  77.49420 29.40771  58.01694       33.29059  
1 1 1 22 3  4  f 132.0225 12.04923  11.94212       2.096391      8.550470       6.056950      12.40372       2.234499      104.6241 35.95333  134.3913 12.62560  -29.76727      38.10575  
1 1 1 22 3  5  o 53.58659 19.26373  1.765743       1.752705      1.709411       1.828948      2.399447       6.134323      53.60600 19.61962  79.94046 33.70350  -26.33446      38.99815  
1 1 1 22 3  6  o 50.06419 20.35114  0.8894168      2.126636      1.620368       2.270692      -4.329200      6.067248      55.80313 21.54445  61.83192 29.02562  -6.028797      36.14762  
1 1 1 22 3  7  o 205.2608 22.72968  30.71266       6.112830      0.000000       0.000000      30.71266       6.112830      ?        ?         205.2608 22.72968  0.000000       22.72968  
1 1 1 22 3  8  o 151.5410 14.79088  16.02013       2.948768      17.82117       4.256988      14.35885       4.088489      156.5761 20.92696  139.2379 22.82622  17.33826       30.96730  
1 1 1 22 3  9  o 233.9179 20.30791  39.54288       6.267316      44.97710       8.253583      32.14223       9.631823      243.9728 25.77724  192.1756 38.94833  51.79721       46.70588  
1 1 1 22 3  10 o 112.7329 23.81637  9.724985       3.465397      6.421158       4.664612      13.79443       5.176955      89.88839 31.51421  129.9527 30.43429  -40.06435      43.81086  
1 1 1 22 3  11 o 130.3266 6.948161  11.47342       1.202276      3.765908       9.198588      11.60738       1.212679      88.09629 39.13992  131.0823 6.967728  -42.98598      39.75529  
1 1 1 22 3  12 o 194.5127 6.216032  25.48200       1.609077      26.58602       3.802522      25.24119       1.775916      193.9153 14.82835  193.3481 6.904093  0.5672455      16.35685  
1 1 1 22 3  13 f 103.1287 2.812551  7.107310       0.3861427     4.812397       1.724580      7.228435       0.3962019     80.63970 16.60291  103.9990 2.861719  -23.35926      16.84773  
1 1 1 22 3  14 o 65.16490 9.099118  2.955937       0.7685953     4.985050       1.142711      1.279585       1.038642      84.47802 10.36842  43.49622 14.89019  40.98180       18.14447  
1 1 1 22 3  15 o 55.74578 11.53171  2.242136       0.8283232     1.050839       0.9280192     6.910157       1.837018      39.99777 14.05389  97.27122 14.62504  -57.27345      20.28309  
1 1 1 22 3  16 o 81.36839 11.44906  4.724184       1.207081      4.691123       1.266377      5.052627       3.991481      80.75612 12.14392  75.27703 28.68995  5.479088       31.15426  
1 1 1 22 3  17 f 54.88060 17.75457  2.317272       1.480930      4.129517       1.825015      -1.176735      2.534079      71.76745 18.84606  41.31564 19.18257  30.45181       26.89135  
1 1 1 22 3  18 o 129.8701 8.422018  11.67600       1.449607      10.27909       1.794887      14.29631       2.458262      119.9926 11.36089  139.9640 13.34192  -19.97145      17.52360  
1 1 1 22 3  19 o 29.35744 13.74606  -1.012603      1.346075      -1.136264      1.423662      0.3007174E-01  4.133932      29.82420 14.01913  53.53036 24.73008  -23.70616      28.42732  
1 1 1 22 3  20 o 75.04764 16.36684  4.468712       1.590514      3.861969       1.909787      5.842159       2.873350      67.14533 19.91548  78.02400 24.67797  -10.87867      31.71165  
1 1 1 22 3  21 o 39.53373 17.76875  -0.3742155E-01 1.954931      0.6335477E-01  2.053741      -1.009764      6.379345      40.75465 18.27325  56.04685 27.21040  -15.29220      32.77678  
1 1 1 22 3  22 o 40.03519 19.75783  -4.654785      3.806289      -3.759412      4.297049      -7.916714      8.201733      44.00849 21.57385  51.92459 26.13153  -7.916103      33.88639  
1 1 1 22 4  0  o 33.38413 23.80544  -6.349226      4.695829      -6.349226      4.695829      -6.349226      4.695829      33.38413 23.80544  33.38413 23.80544  0.000000       0.000000  
1 1 1 22 4  1  o 187.5511 13.93103  24.18505       3.456718      17.60797       5.140134      29.61544       4.670603      154.0054 25.97035  206.0517 17.16655  -52.04626      31.13117  
1 1 1 22 4  2  o 150.9114 10.53403  15.48047       2.105012      14.35340       2.258030      22.96093       5.817253      144.9198 11.79497  176.4869 25.47241  -31.56711      28.07071  
1 1 1 22 4  3  o 361.1629 21.48260  92.91296       10.29193      91.17756       12.20222      97.19078       19.15804      352.3350 26.17722  338.1458 43.52650  14.18924       50.79176  
1 1 1 22 4  4  o 369.3806 19.97998  96.51125       9.797676      94.56593       12.71711      99.35225       15.36838      357.3656 26.90313  358.2484 32.54860  -0.8828125     42.22783  
1 1 1 22 4  5  o 40.88315 17.97924  -0.3383541     1.893849      -0.3383541     1.893849      0.000000       0.000000      40.88315 17.97924  ?        ?         0.000000       17.97924  
1 1 1 22 4  6  o 220.2962 14.98177  33.64653       4.371714      30.60074       5.124345      41.79127       8.379679      207.7996 18.70635  235.7394 27.17264  -27.93980      32.98909  
1 1 1 22 4  7  o 111.5416 22.08612  9.230880       3.166509      8.859098       4.823056      9.512538       4.197972      104.8444 31.77746  110.0455 28.42806  -5.201141      42.63757  
1 1 1 22 4  8  o 168.0148 11.82366  19.38131       2.630214      22.77233       6.331493      18.67407       2.891518      170.8691 28.83305  164.2538 13.32538  6.615234       31.76335  
1 1 1 22 4  9  o 137.6930 10.08651  12.95344       1.837819      16.80991       7.218916      12.68617       1.900437      137.1491 38.12743  136.0955 10.56201  1.053574       39.56333  
1 1 1 22 4  10 o 334.7148 17.68469  79.91894       7.859629      88.76221       12.61871      74.31362       10.04635      335.8744 28.46224  313.8906 24.20594  21.98386       37.36344  
1 1 1 22 4  11 o 84.80520 31.14712  5.709305       4.615835      8.026110       5.356192      -0.9766750     9.099006      96.31363 33.76945  77.77986 36.19294  18.53377       49.50056  
1 1 1 22 4  12 o 119.0447 35.18288  13.16077       5.968938      25.59352       12.51141      9.497159       6.791682      138.3513 51.19799  99.99806 37.57891  38.35324       63.50913  
1 1 1 22 4  13 o 20.57287 9.989254  -1.414272      0.8604659     -2.766179      1.024833      1.815857       1.584125      19.10546 9.561555  51.74001 18.34550  -32.63456      20.68769  
1 1 1 22 4  14 o 181.6113 7.192994  22.39376       1.737265      25.91008       2.433091      18.73658       2.481349      194.0837 9.436245  163.7511 11.44385  30.33264       14.83255  
1 1 1 22 4  15 o 107.5429 6.319700  7.849081       0.9016404     5.319760       1.199619      11.13310       1.366924      86.96209 10.56913  127.4412 8.091130  -40.47910      13.31063  
1 1 1 22 4  16 f 113.5283 5.209560  8.704660       0.7859949     8.734651       0.8025367     7.999571       3.891301      113.6938 5.311987  91.85111 28.67248  21.84267       29.16039  
1 1 1 22 4  17 f 39.78014 11.82811  1.146336       0.6729853     0.8707975      0.8024561     1.799616       1.235606      36.58400 13.04820  49.17744 16.23688  -12.59344      20.83007  
1 1 1 22 4  18 o 84.56689 11.99861  5.188951       1.314175      4.355202       1.655292      6.610493       2.161407      74.37175 17.06560  91.02480 18.45227  -16.65305      25.13406  
1 1 1 22 4  19 o 47.86137 19.23091  1.413736       1.874435      1.048620       1.968033      4.980664       6.151256      46.09037 19.23816  70.65790 31.65713  -24.56753      37.04430  
1 1 1 22 4  20 o 63.47502 11.75598  2.982575       0.9577307     3.273165       1.001256      -0.1434981     3.284009      66.58754 11.71179  48.00421 22.12867  18.58333       25.03685  
1 1 1 22 4  21 o 43.04936 19.00082  0.4585509      2.133237      0.5396584      2.207686      -0.6835340     8.284301      43.90443 19.35589  59.58873 29.35827  -15.68430      35.16473  
1 1 1 22 5  0  o 288.6896 18.16270  57.49855       6.922751      57.49855       6.922751      57.49855       6.922751      288.6896 18.16270  288.6896 18.16270  0.000000       0.000000  
1 1 1 22 5  1  o 52.14121 18.42064  1.708683       1.595924      1.439545       2.097721      2.078525       2.459054      53.47129 20.69056  60.09918 22.60627  -6.627884      30.64543  
1 1 1 22 5  2  o 148.1918 24.75600  16.27290       4.716205      7.605784       6.298022      27.33785       7.116095      100.0545 36.44046  189.5871 29.09608  -89.53262      46.63141  
1 1 1 22 5  3  o 165.2900 8.695108  18.46134       1.908381      0.000000       0.000000      18.46134       1.908381      ?        ?         165.2900 8.695108  0.000000       8.695108  
1 1 1 22 5  4  o 320.7013 11.71106  70.08991       4.996210      71.26028       6.116121      67.74237       8.662085      321.6136 14.30726  307.5265 21.26915  14.08710       25.63346  
1 1 1 22 5  5  o 161.0262 16.14851  18.16827       3.418279      18.22156       3.637637      17.76596       9.994795      160.7157 17.25579  137.0277 46.20032  23.68799       49.31766  
1 1 1 22 5  6  o 60.78630 26.44818  0.2633470      4.003146      0.8609000      4.494791      -2.028652      8.802955      65.88900 28.34503  78.61015 36.23457  -12.72115      46.00418  
1 1 1 22 5  7  o 66.61347 14.60277  3.182062       1.260372      -1.713655      3.775604      3.796038       1.337070      52.44775 24.01069  72.99119 14.25865  -20.54344      27.92530  
1 1 1 22 5  8  o 46.38917 14.27598  1.499159       0.9685897     0.000000       0.000000      1.499159       0.9685897     ?        ?         46.38917 14.27598  0.000000       14.27598  
1 1 1 22 5  9  o 123.3917 8.392136  10.34129       1.371638      0.000000       0.000000      10.34129       1.371638      ?        ?         123.3917 8.392136  0.000000       8.392136  
1 1 1 22 5  10 o 121.7814 18.86302  10.88389       2.962117      9.365760       5.128434      11.64390       3.628583      103.9663 32.97979  123.5047 22.89129  -19.53834      40.14571  
1 1 1 22 5  11 o 166.8852 15.22819  19.78952       3.349138      17.93977       4.750413      21.61760       4.722503      151.9515 24.27806  169.6156 21.36770  -17.66409      32.34197  
1 1 1 22 5  12 o 61.87484 18.50090  2.863527       1.642920      0.7082821      5.332694      3.089547       1.726920      66.27515 29.60013  64.05021 18.92288  2.224937       35.13179  
1 1 1 22 5  13 o 149.0330 7.961425  15.13767       1.575317      9.670639       2.672706      18.04799       1.950048      113.5934 18.27728  162.2432 9.055912  -48.64977      20.39776  
1 1 1 22 5  14 o 200.6039 7.490541  27.38902       1.998769      24.29143       3.083338      29.63418       2.625024      185.3992 12.55478  207.3392 9.526653  -21.94005      15.76006  
1 1 1 22 5  15 o 71.35957 11.54738  3.649520       1.060530      3.074486       1.106737      10.10789       3.709019      64.67072 13.28761  107.6375 26.12654  -42.96680      29.31137  
1 1 1 22 5  16 o 78.75713 10.15559  4.382561       1.040999      4.230260       1.051358      11.99765       7.434231      77.21372 10.48938  95.44753 38.31678  -18.23380      39.72660  
1 1 1 22 5  17 o 108.2746 6.701294  8.008412       0.9621109     7.228241       1.116758      10.25473       1.894958      102.1836 8.272387  119.4552 12.07018  -17.27160      14.63289  
1 1 1 22 5  18 o 138.4800 11.33435  13.70579       2.073214      14.69900       2.678103      12.22040       3.275115      140.4945 14.51392  121.4839 20.99068  19.01062       25.51985  
1 1 1 22 5  19 o 21.24383 10.74812  -4.736886      1.497373      -5.103805      1.534303      2.611069       6.866083      21.08794 10.69240  65.36517 30.74481  -44.27723      32.55105  
1 1 1 22 5  20 o 92.10552 9.357393  6.015434       1.132530      6.453948       1.182894      1.192255       3.923027      95.38673 9.429702  54.46170 24.75607  40.92503       26.49118  
1 1 1 22 5  21 o 73.13885 27.38284  5.948475       3.599060      8.094246       4.440159      1.837920       6.145497      80.25209 30.33512  59.76416 28.39914  20.48793       41.55395  
1 1 1 22 6  0  o 169.7465 17.21621  20.20932       3.794888      20.20932       3.794888      20.20932       3.794888      169.7465 17.21621  169.7465 17.21621  0.000000       0.000000  
1 1 1 22 6  1  o 225.5647 9.528582  34.44490       2.857549      35.93740       3.788845      32.47598       4.351746      229.1350 12.45598  216.3864 15.18893  12.74860       19.64320  
1 1 1 22 6  2  o 205.3895 12.88608  28.95917       3.508959      27.54928       5.363230      30.01439       4.639837      195.7282 20.88595  206.9115 16.97766  -11.18324      26.91587  
1 1 1 22 6  3  o 188.1439 14.66384  24.54908       3.647290      26.23802       4.302825      20.23801       6.874472      193.3403 16.87039  158.2307 33.64114  35.10960       37.63425  
1 1 1 22 6  4  o 146.4729 16.32423  15.09778       3.132045      15.33839       4.106112      14.76300       4.843399      144.6676 21.99187  138.7102 27.17647  5.957413       34.96002  
1 1 1 22 6  5  o 280.1525 16.59510  55.01151       6.167338      55.50110       6.905020      53.08041       13.71359      279.6123 18.63897  242.9330 43.98225  36.67932       47.76871  
1 1 1 22 6  6  o 125.7087 28.96553  12.53665       4.752225      9.612604       7.039424      14.98515       6.441617      106.2625 38.55141  132.4255 35.69905  -26.16304      52.54173  
1 1 1 22 6  7  o 65.44021 14.17375  3.071469       1.200127      0.3081820      4.977034      3.242059       1.236618      65.95985 29.07150  67.25075 14.24340  -1.290901      32.37324  
1 1 1 22 6  8  o 134.7150 8.182094  12.30623       1.461844      9.922157       4.695292      12.56213       1.538301      109.3094 30.88010  136.0109 8.530746  -26.70144      32.03677  
1 1 1 22 6  9  o 209.0271 5.365826  29.32279       1.493322      0.000000       0.000000      29.32279       1.493322      ?        ?         209.0271 5.365826  0.000000       5.365826  
1 1 1 22 6  10 o 193.8444 6.889899  25.36459       1.776840      21.92922       6.070038      25.68654       1.858236      164.0188 28.82459  194.9695 7.164730  -30.95079      29.70169  
1 1 1 22 6  11 o 219.8671 15.44835  34.47091       4.497208      33.52430       4.963305      38.81266       10.62964      214.8608 17.48671  197.8122 41.64568  17.04866       45.16800  
1 1 1 22 6  12 o 72.24783 9.954422  3.643819       0.9328848     -0.2480045     4.185616      3.847250       0.9569559     57.34483 25.86712  74.28222 9.915340  -16.93739      27.70238  
1 1 1 22 6  13 o 175.3766 8.834343  21.09015       2.057872      16.26498       7.656075      21.46591       2.136497      119.1062 40.43388  176.7833 9.100218  -57.67703      41.44530  
1 1 1 22 6  14 o 113.5675 11.76784  9.129163       1.755062      7.867835       2.081404      12.23235       3.264723      103.1043 15.64000  125.1121 20.27615  -22.00777      25.60726  
1 1 1 22 6  15 o 141.3033 8.979184  13.80876       1.681939      14.05711       1.899063      12.90515       3.622376      141.8848 10.11080  125.4656 22.49312  16.41917       24.66108  
1 1 1 22 6  16 o 74.78792 11.23427  4.014853       1.084996      3.576835       1.159163      7.112888       3.082774      69.71490 12.95475  89.26588 24.95265  -19.55098      28.11513  
1 1 1 22 6  17 f 81.38737 6.784987  4.543514       0.7291458     4.767978       0.7794113     2.969739       2.063788      83.27808 7.091024  60.42978 20.97656  22.84830       22.14269  
1 1 1 22 6  18 o 52.44695 15.02328  2.121508       1.103662      2.477273       1.146278      -2.398077      4.085615      56.59721 14.97095  47.45342 22.71598  9.143791       27.20561  
1 1 1 22 6  19 o 56.56519 17.65467  2.599596       1.475375      2.379931       1.676742      3.352901       3.105077      54.32405 18.90460  61.88474 24.79062  -7.560688      31.17625  
1 1 1 22 6  20 o 37.33840 16.66672  -0.2900414E-01 1.688128      0.9422757E-01  1.805257      -0.8872727     4.764194      38.97370 17.32594  51.82812 24.73353  -12.85442      30.19827  
1 1 1 22 6  21 o 78.41892 9.936083  4.430698       1.014996      4.751192       1.038236      -2.488780      4.824173      81.33283 9.775511  48.47055 23.56210  32.86228       25.50947  
1 1 1 22 7  0  o 185.0063 17.59934  24.00070       4.242910      24.00070       4.242910      24.00070       4.242910      185.0063 17.59934  185.0063 17.59934  0.000000       0.000000  
1 1 1 22 7  1  o 218.9058 8.377750  32.36174       2.439247      34.06392       2.719085      25.34556       5.520400      224.3221 9.115550  185.8523 22.76581  38.46973       24.52296  
1 1 1 22 7  2  o 59.61767 21.74183  2.238544       2.243024      1.789101       5.851327      2.315965       2.428543      75.51387 32.41095  61.08768 22.56546  14.42619       39.49265  
1 1 1 22 7  3  o 256.9102 13.28871  45.48343       4.533767      40.20820       5.846689      53.43959       7.180281      237.7641 18.60196  273.0900 19.86748  -35.32584      27.21672  
1 1 1 22 7  4  o 112.3962 20.98762  9.331909       3.027747      15.58789       3.868136      -0.5641980     4.865039      146.3257 20.39163  63.02826 28.20247  83.29741       34.80226  
1 1 1 22 7  5  o 289.2129 22.52208  61.47182       8.611218      63.40366       10.72027      57.95825       14.45753      285.9673 28.51258  249.3841 45.16887  36.58321       53.41529  
1 1 1 22 7  6  o 61.68198 16.44055  2.768010       1.375752      6.629198       3.327249      1.971744       1.510964      91.99044 25.99762  53.66481 17.96213  38.32563       31.59928  
1 1 1 22 7  7  o 126.8731 9.322087  10.98226       1.564997      8.160028       9.825933      11.05571       1.585232      100.5738 42.54200  127.2694 9.414146  -26.69562      43.57118  
1 1 1 22 7  8  o 63.98023 11.16296  2.880604       0.9171008     7.867665       6.014268      2.761882       0.9279528     95.83824 35.49125  62.50439 11.56738  33.33385       37.32872  
1 1 1 22 7  9  f 170.8413 4.515491  19.55923       1.027047      10.77717       8.074670      19.70365       1.035457      104.9378 40.59700  171.4668 4.535866  -66.52897      40.84961  
1 1 1 22 7  10 o 95.23632 4.481531  6.089558       0.5671301     9.427648       5.564121      6.054514       0.5700992     101.0503 34.46719  94.95527 4.518619  6.095039       34.76212  
1 1 1 22 7  11 o 58.47472 26.10458  0.1558770      4.142679      -0.7768052     4.912727      2.451342       7.707102      59.80426 27.38237  77.55450 35.03104  -17.75023      44.46310  
1 1 1 22 7  12 o 25.23057 12.29801  -2.240232      1.338837      -0.2408267     4.652585      -2.420745      1.397968      59.19337 26.92761  25.50476 12.46103  33.68861       29.67108  
1 1 1 22 7  13 o 125.9342 16.12326  11.71528       2.643657      9.633049       4.987610      12.52885       3.117631      98.70774 32.62320  128.1273 18.82095  -29.41953      37.66299  
1 1 1 22 7  14 o 111.5323 13.78713  9.035848       2.005448      5.762483       2.443660      15.78827       3.509727      83.68414 21.72561  143.1269 18.86118  -59.44272      28.77058  
1 1 1 22 7  15 o 61.75597 17.62913  2.991681       1.522280      1.408088       1.657441      11.53040       3.848687      47.52057 18.39054  114.1489 25.89907  -66.62836      31.76435  
1 1 1 22 7  16 o 61.85213 11.11599  2.768166       0.8824958     2.672556       1.055865      2.989741       1.607378      59.70752 13.57886  61.22416 18.29811  -1.516636      22.78610  
1 1 1 22 7  17 o 27.54798 12.28922  -0.2257023     0.9163763     -0.5183249     0.9640660     2.514425       2.950110      26.43475 12.11349  58.67326 23.92514  -32.23852      26.81695  
1 1 1 22 7  18 o 106.7639 9.698142  8.054923       1.364666      8.253051       1.433671      6.144099       4.452326      107.8245 10.09575  75.02251 29.80734  32.80195       31.47065  
1 1 1 22 7  19 o 48.51561 19.27690  1.611713       1.862248      3.899622       2.169382      -4.796048      3.630528      66.04260 21.49817  39.41335 19.42148  26.62925       28.97180  
1 1 1 22 7  20 f 39.09417 15.35819  0.9193128      1.169923      1.170014       1.188263      -7.014961      6.684789      41.50273 15.69177  49.32121 24.64373  -7.818478      29.21550  
1 1 1 22 8  0  o 39.03452 24.97297  0.4446775      2.912646      0.4446775      2.912646      0.4446775      2.912646      39.03452 24.97297  39.03452 24.97297  0.000000       0.000000  
1 1 1 22 8  1  o 44.04767 19.36003  -0.2727448     2.193084      -1.588568      3.151783      0.9623181      3.053530      47.73413 21.88447  56.98549 23.88702  -9.251358      32.39629  
1 1 1 22 8  2  o 360.3220 10.63518  88.48776       5.100742      94.26447       6.626383      80.08730       7.990758      369.4070 13.48426  335.9247 17.91621  33.48227       22.42356  
1 1 1 22 8  3  o 365.8305 13.90010  92.72262       6.763643      103.8269       9.410438      80.85641       9.727932      381.4886 18.56783  332.0079 22.11473  49.48068       28.87604  
1 1 1 22 8  4  o 103.4111 29.45571  8.696356       4.254414      -8.542948      7.420070      17.13937       5.192745      60.56525 29.39056  147.9545 27.34580  -87.38928      40.14471  
1 1 1 22 8  5  o 316.2704 13.22489  69.26537       5.561152      69.46933       10.61821      69.18827       6.528093      299.7318 26.87030  313.7190 15.66564  -13.98715      31.10347  
1 1 1 22 8  6  o 74.64433 13.24513  3.961328       1.269181      7.753435       4.084021      3.555949       1.335297      97.10562 29.20051  70.15800 14.75202  26.94762       32.71532  
1 1 1 22 8  7  o 104.2436 7.391721  7.370759       1.020099      -8.178310      11.70878      7.489685       1.023993      75.64739 36.75810  105.0934 7.358699  -29.44601      37.48744  
1 1 1 22 8  8  o 125.2538 5.518096  10.55473       0.9187268     6.920730       7.830647      10.60545       0.9251159     91.96543 38.37975  125.5494 5.543451  -33.58392      38.77802  
1 1 1 22 8  9  o 150.0540 3.123395  15.04249       0.6245226     0.000000       0.000000      15.04249       0.6245226     ?        ?         150.0540 3.123395  0.000000       3.123395  
1 1 1 22 8  10 o 118.1216 9.822816  9.628733       1.532125      5.515146       3.281613      10.77534       1.732547      81.59921 26.43187  124.6880 10.52588  -43.08882      28.45062  
1 1 1 22 8  11 o 85.09483 19.78809  5.628162       2.201208      5.235226       5.385818      5.706961       2.411841      79.68187 32.38826  84.78036 21.36157  -5.098488      38.79841  
1 1 1 22 8  12 o 65.73288 25.74857  3.146732       3.280304      5.606382       4.343912      -0.1170743     5.003877      79.47668 30.01291  60.37716 27.64112  19.09952       40.80204  
1 1 1 22 8  13 o 77.19901 22.04078  4.922619       2.379335      3.790001       4.097266      5.498910       2.922626      69.64072 28.27057  79.77227 24.84053  -10.13155      37.63346  
1 1 1 22 8  14 o 89.35908 15.37503  5.987481       1.764732      4.724248       2.059983      9.471256       3.420953      76.31403 20.01413  104.2509 24.95764  -27.93688      31.99139  
1 1 1 22 8  15 o 42.92131 15.42884  1.248251       1.124314      1.184590       1.138507      3.753938       7.142735      42.35120 15.48285  71.74278 32.91145  -29.39159      36.37145  
1 1 1 22 8  16 o 87.50661 10.89514  5.474351       1.242981      5.257544       1.384532      6.374977       2.821876      84.77197 12.64280  84.39723 23.97266  0.3747330      27.10219  
1 1 1 22 8  17 o 90.22304 11.47090  5.885048       1.347942      5.647888       1.425689      7.883286       4.138358      87.70608 12.55676  85.58854 29.70438  2.117538       32.24938  
1 1 1 22 8  18 o 44.81772 17.76291  1.261086       1.577455      1.767424       1.618382      -8.371749      7.058910      48.97182 18.35654  50.35157 25.18343  -1.379749      31.16357  
1 1 1 22 8  19 o 30.32432 13.27911  0.3662666E-03  1.023205      -0.4618030     1.046762      9.923325       4.850295      27.71700 12.67141  87.91372 31.98499  -60.19672      34.40355  
1 1 1 22 8  20 o 105.8287 11.08728  8.154014       1.540334      7.508499       1.572984      23.22124       7.599545      100.8571 11.93528  117.5087 40.27588  -16.65164      42.00711  
1 1 1 22 9  0  o 269.8355 13.82457  49.88366       4.940839      49.88366       4.940839      49.88366       4.940839      269.8355 13.82457  269.8355 13.82457  0.000000       0.000000  
1 1 1 22 9  1  o 258.2126 11.96742  45.89575       4.106470      31.85740       9.403993      49.20333       4.564670      188.8213 38.67756  266.6982 12.88256  -77.87692      40.76658  
1 1 1 22 9  2  f 141.2243 11.24327  13.73727       2.098351      14.58777       2.761576      12.57545       3.227674      143.9905 14.59428  131.2244 19.01188  12.76608       23.96758  
1 1 1 22 9  3  o 61.75082 25.86552  1.440114       3.576295      0.9333000      3.846708      4.669408       9.709993      61.19603 26.27256  91.39291 40.42899  -30.19688      48.21567  
1 1 1 22 9  4  o 39.27337 16.05598  0.5015582      1.332839      1.408761       2.721274      0.2152470      1.528760      56.40470 22.98661  39.45094 16.73796  16.95377       28.43490  
1 1 1 22 9  5  o 27.93989 12.17367  -0.1092235     0.8506157     -0.3944481     3.917972      -0.9511438E-01 0.8714004     56.54644 25.30505  28.39699 12.34780  28.14945       28.15695  
1 1 1 22 9  6  o 76.01453 11.07927  4.044649       1.089239      1.540401       4.721132      4.185444       1.119440      67.09808 28.95900  77.31359 11.19116  -10.21551      31.04619  
1 1 1 22 9  7  o 69.03589 8.505634  3.283284       0.7659229     1.718137       10.28836      3.292007       0.7680542     83.58155 38.75304  69.12546 8.518326  14.45609       39.67820  
1 1 1 22 9  8  o 106.3689 5.178127  7.614420       0.7317355     18.42123       9.949017      7.555644       0.7337227     122.8463 45.61894  105.9495 5.213090  16.89687       45.91584  
1 1 1 22 9  9  o 118.1235 9.840744  9.638305       1.534894      18.09369       10.42753      9.451047       1.551797      117.2355 45.91229  116.8695 10.06249  0.3660049      47.00204  
1 1 1 22 9  10 o 69.34513 29.39060  2.901114       4.705299      0.000000       0.000000      2.901114       4.705299      ?        ?         69.34513 29.39060  0.000000       29.39060  
1 1 1 22 9  11 o 69.68996 24.26439  3.938897       2.762481      3.095983       3.444248      5.459037       4.625349      65.80563 26.19339  78.65258 30.64290  -12.84695      40.31229  
1 1 1 22 9  12 o 110.7659 25.84698  10.63352       3.744948      10.81151       4.286265      10.05936       7.698539      107.9467 29.12931  91.49751 38.10941  16.44923       47.96711  
1 1 1 22 9  13 o 111.1290 18.94822  9.661961       2.705329      7.972827       4.648671      10.52699       3.326691      88.23134 31.41222  112.2759 23.00963  -24.04458      38.93804  
1 1 1 22 9  14 o 65.14680 21.89799  3.518755       2.245455      8.364270       5.065560      2.333788       2.505016      87.54596 32.54351  57.23945 22.47728  30.30651       39.55133  
1 1 1 22 9  15 o 22.50140 10.83481  -1.309212      0.9608741     -3.946935      1.206736      3.260501       1.588336      19.04788 9.638436  63.84961 17.93358  -44.80173      20.35959  
1 1 1 22 9  16 o 90.95741 13.53096  6.141347       1.590120      6.008674       1.848474      6.518958       3.118494      87.95907 16.37337  82.95716 25.63107  5.001907       30.41445  
1 1 1 22 9  17 o 106.3605 9.254538  7.965132       1.298577      8.242816       1.344962      4.146441       4.987608      108.0997 9.431447  66.69786 29.25945  41.40186       30.74195  
1 1 1 22 9  18 o 120.0154 6.352546  9.867678       1.012299      10.11191       1.043836      6.008132       4.149568      121.4311 6.474432  73.00958 28.84961  48.42147       29.56718  
1 1 1 22 9  19 o 35.01103 15.71227  -0.1564703     1.522219      -0.3486545     1.596774      1.758581       5.040514      34.80145 15.80939  57.99344 26.96961  -23.19199      31.26174  
1 1 1 22 10 0  o 205.0784 16.61270  29.49289       4.469041      29.49289       4.469041      29.49289       4.469041      205.0784 16.61270  205.0784 16.61270  0.000000       0.000000  
1 1 1 22 10 1  o 181.4926 11.15113  22.69879       2.683797      21.05216       3.931609      24.13557       3.672544      170.6842 17.53549  184.7075 15.05175  -14.02328      23.10949  
1 1 1 22 10 2  o 84.61927 25.07779  5.696586       3.029177      6.267171       6.715769      5.550851       3.394049      89.07938 36.18202  83.20387 26.87502  5.875511       45.07111  
1 1 1 22 10 3  o 134.6747 19.93661  13.51076       3.469824      13.34331       3.951605      14.07460       7.251246      131.2925 23.44754  119.1715 39.33354  12.12096       45.79208  
1 1 1 22 10 4  o 15.09587 7.612504  -2.277066      0.7155262     -0.6631626     2.652444      -2.403728      0.7430739     45.92758 20.66530  15.28123 7.712333  30.64635       22.05753  
1 1 1 22 10 5  o 118.3625 8.397497  9.560818       1.315856      16.53494       5.709455      9.169599       1.352260      137.7442 31.75630  115.7577 8.833422  21.98643       32.96198  
1 1 1 22 10 6  o 121.5273 6.901230  10.00695       1.112974      6.196713       4.177452      10.29807       1.154710      85.38590 29.83129  123.2399 7.061054  -37.85400      30.65557  
1 1 1 22 10 7  o 85.24696 11.78363  5.130354       1.302782      -2.655956      3.071105      6.838977       1.438639      42.68327 20.22225  98.90256 11.10796  -56.21929      23.07219  
1 1 1 22 10 8  o 54.51483 17.02433  2.192601       1.371697      6.689649       9.851625      2.103695       1.385190      87.98920 39.68791  53.60841 17.15516  34.38079       43.23690  
1 1 1 22 10 9  o 55.34561 12.57009  2.231814       0.9058305     5.550051       9.376415      2.200553       0.9100873     83.71541 38.13876  54.91672 12.69129  28.79869       40.19495  
1 1 1 22 10 10 o 75.89417 11.99821  4.129060       1.173098      0.000000       0.000000      4.129060       1.173098      ?        ?         75.89417 11.99821  0.000000       11.99821  
1 1 1 22 10 11 o 58.74699 21.86144  2.544016       2.287060      9.671488       4.613573      0.2218348      2.633405      98.81091 31.27268  47.82767 21.11043  50.98323       37.73103  
1 1 1 22 10 12 o 82.71916 34.24860  7.371155       6.165557      2.623720       13.04594      8.736461       6.996177      77.35841 37.85313  86.26009 36.15750  -8.901688      52.34715  
1 1 1 22 10 13 o 102.7924 16.08215  8.002841       2.130665      7.693072       4.613966      8.086802       2.402127      85.77302 31.19753  101.5024 18.43909  -15.72940      36.23929  
1 1 1 22 10 14 o 68.69970 28.69657  4.087753       4.383712      4.100983       4.652572      3.983104       13.08509      69.00403 29.23485  75.37489 37.08932  -6.370857      47.22599  
1 1 1 22 10 15 f 114.1034 10.91114  9.287952       1.638801      10.56574       2.096502      7.280697       2.627651      119.8658 13.35222  92.31274 21.72549  27.55309       25.50056  
1 1 1 22 10 16 o 76.26246 14.06758  4.409296       1.376910      4.099633       1.513035      5.901653       3.321551      72.12415 16.14630  76.76871 26.61367  -4.644562      31.12861  
1 1 1 22 10 17 o 27.18329 12.80803  -1.014355      1.200862      -1.032537      1.328447      -0.9331038     2.808257      28.80266 13.53997  42.70919 19.95105  -13.90654      24.11172  
1 1 1 22 10 18 o 61.18658 14.96149  2.957099       1.209509      3.284176       1.243535      -2.775477      5.206048      64.69616 14.75293  49.89988 24.30648  14.79628       28.43333  
1 1 1 22 11 0  o 80.69721 24.79676  5.696272       2.331276      5.696272       2.331276      5.696272       2.331276      80.69721 24.79676  80.69721 24.79676  0.000000       0.000000  
1 1 1 22 11 1  f 61.95526 24.89320  2.204542       3.140647      8.143353       15.13223      1.937207       3.210557      97.22408 45.70245  60.93654 24.91676  36.28754       52.05343  
1 1 1 22 11 2  o 169.3550 14.59231  20.40980       3.260946      21.85163       6.410702      19.90651       3.787568      158.6995 31.42706  165.0016 17.49272  -6.302048      35.96742  
1 1 1 22 11 3  o 149.2209 9.375251  15.27781       1.854751      14.37776       3.197824      15.73408       2.276847      139.8581 17.54406  150.3880 11.44782  -10.52992      20.94866  
1 1 1 22 11 4  o 87.25139 11.02197  5.333497       1.252919      11.01291       3.999189      4.715378       1.319339      115.0405 26.61702  81.37000 12.57281  33.67052       29.43708  
1 1 1 22 11 5  o 120.0976 6.547370  9.768765       1.043828      13.30111       4.825909      9.595396       1.069137      123.1555 29.74478  118.9563 6.772838  4.199196       30.50611  
1 1 1 22 11 6  o 53.83411 16.11415  2.143387       1.245852      -1.966273      4.286343      2.522612       1.302065      52.68608 24.62371  58.06797 16.21115  -5.381893      29.48099  
1 1 1 22 11 7  o 48.13378 13.18628  1.692408       0.8705817     -1.314684      3.839346      1.855404       0.8938648     51.37507 23.76901  50.32990 13.17619  1.045170       27.17679  
1 1 1 22 11 8  f 46.46158 13.84370  1.573022       0.9211326     0.3739183      9.402810      1.584641       0.9255847     73.81399 35.09053  46.61861 13.87386  27.19538       37.73367  
1 1 1 22 11 9  o 24.55680 11.97051  -2.099448      1.269155      -2.247565      10.17588      -2.097108      1.279143      70.72743 34.34435  24.70740 12.03805  46.02003       36.39298  
1 1 1 22 11 10 o 98.09528 26.13863  8.556258       3.478163      0.000000       0.000000      8.556258       3.478163      ?        ?         98.09528 26.13863  0.000000       26.13863  
1 1 1 22 11 11 o 85.28725 26.34701  6.645648       3.295290      0.3741530      8.509116      7.752164       3.574190      68.90416 32.92975  91.30921 27.28484  -22.40505      42.76484  
1 1 1 22 11 12 o 50.37850 22.02605  0.7255758      2.805343      8.774610       5.427507      -2.208733      3.277038      88.10128 33.48423  43.82900 20.80127  44.27228       39.41937  
1 1 1 22 11 13 o 38.38126 18.57565  -3.250349      2.913463      -1.482680      3.745058      -5.960109      4.636854      48.29057 22.71138  44.68873 22.00704  3.601833       31.62462  
1 1 1 22 11 14 o 22.98991 11.26910  -2.073947      1.171633      -1.885104      8.751103      -2.077394      1.182277      63.26067 30.96483  23.13429 11.33580  40.12638       32.97456  
1 1 1 22 11 15 o 83.92616 22.36615  6.256331       2.546419      5.632092       4.084704      6.653144       3.256705      73.16982 28.71158  82.04030 26.30962  -8.870483      38.94292  
1 1 1 22 11 16 o 105.5253 11.70061  8.117537       1.617659      9.049538       1.863873      5.272377       3.256576      110.4826 12.90312  72.10831 26.21239  38.37427       29.21609  
1 1 1 22 11 17 o 24.28450 11.85232  -1.971043      1.255117      -2.496737      1.468267      -0.5444221     2.418759      25.50777 12.52605  41.06568 18.95198  -15.55790      22.71738  
1 1 1 22 12 0  f 100.5227 29.55892  9.000696       3.440418      9.000696       3.440418      9.000696       3.440418      100.5227 29.55892  100.5227 29.55892  0.000000       0.000000  
1 1 1 22 12 1  o 174.5454 20.99973  23.46400       4.786231      25.77277       7.404993      21.80737       6.272586      165.3198 34.72107  156.3816 31.19571  8.938217       46.67682  
1 1 1 22 12 2  o 97.95205 13.92595  6.917470       1.766503      12.48378       4.486551      5.896231       1.921731      119.6624 28.53922  88.78351 16.86016  30.87885       33.14743  
1 1 1 22 12 3  o 64.60133 14.40824  3.080150       1.208708      -1.439330      6.534286      3.240274       1.229934      64.15736 30.11877  66.32152 14.33587  -2.164162      33.35652  
1 1 1 22 12 4  o 130.4998 6.433330  11.53963       1.115266      12.61886       4.889637      11.48040       1.145460      116.9454 30.91374  130.0966 6.629407  -13.15121      31.61658  
1 1 1 22 12 5  o 88.72263 11.48597  5.574767       1.326088      5.289022       4.133826      5.607545       1.400082      77.92342 29.31045  88.67545 12.16951  -10.75204      31.73641  
1 1 1 22 12 6  o 44.99424 12.74408  1.474481       0.7986304     0.8742738      7.648305      1.481098       0.8030202     70.54438 32.94449  45.08941 12.78178  25.45498       35.33714  
1 1 1 22 12 7  o 59.78283 11.44372  2.577518       0.8784339     5.945378       5.850916      2.499853       0.8885049     79.73576 33.21782  58.73956 11.76210  20.99620       35.23877  
1 1 1 22 12 8  o 35.10515 14.66124  0.3428722      1.143961      7.579952       3.658494      -0.4413975     1.204352      90.62526 27.71843  30.66343 13.84947  59.96182       30.98579  
1 1 1 22 12 9  o 47.28905 21.02503  0.1217793      2.659178      5.442436       13.38264      -0.9693220E-01 2.713281      80.37422 39.11017  46.79206 20.99004  33.58216       44.38679  
1 1 1 22 12 10 o 46.91104 21.46661  -0.5767158     3.013536      0.000000       0.000000      -0.5767158     3.013536      ?        ?         46.91104 21.46661  0.000000       21.46661  
1 1 1 22 12 11 o 67.49804 24.58340  3.928941       2.866299      0.000000       0.000000      3.928941       2.866299      ?        ?         67.49804 24.58340  0.000000       24.58340  
1 1 1 22 12 12 o 116.5729 26.47715  12.48296       4.018804      19.39336       8.823627      10.67424       4.514209      108.2835 42.28429  100.9792 30.77129  7.304306       52.29564  
1 1 1 22 12 13 o 63.05426 27.97642  2.700901       4.683842      2.526522       5.410737      3.222262       9.355753      63.96163 29.07408  70.11344 33.77293  -6.151810      44.56358  
1 1 1 22 12 14 o 43.65295 18.61333  0.7336549      1.906909      3.380707       3.842478      -0.1312976     2.196475      63.10712 26.64409  41.57547 18.74751  21.53166       32.57878  
1 1 1 22 12 15 o 96.87852 22.53273  8.395364       2.853716      9.093409       5.857902      8.178154       3.267684      80.93961 33.43530  91.31458 25.74908  -10.37498      42.20111  
1 1 1 22 12 16 o 34.29152 14.95085  0.1303064      1.284765      0.5420570      1.519710      -0.9011847     2.405339      39.13596 16.64951  39.76086 18.53753  -0.6249046     24.91679  
1 1 1 22 13 0  o 37.08669 25.69512  -2.338692      4.378881      -2.338692      4.378881      -2.338692      4.378881      37.08669 25.69512  37.08669 25.69512  0.000000       0.000000  
1 1 1 22 13 1  f 67.26247 15.36487  3.397661       1.346867      6.537462       3.849556      2.959695       1.437738      84.56301 28.67171  62.19674 16.90756  22.36628       33.28562  
1 1 1 22 13 2  o 160.0664 10.11099  17.81105       2.145569      17.22623       10.96323      17.83434       2.187876      104.6763 44.63162  160.0370 10.31449  -55.36070      45.80797  
1 1 1 22 13 3  o 42.05729 14.22392  1.224031       0.9473857     13.71983       12.41358      1.150823       0.9501568     94.59459 43.39189  41.20065 14.23661  53.39394       45.66768  
1 1 1 22 13 4  o 69.04140 5.432414  3.232877       0.4957534     5.860777       2.282764      3.102800       0.5078748     85.51244 20.33272  67.57072 5.693511  17.94172       21.11482  
1 1 1 22 13 5  f 67.49171 9.801382  3.212740       0.8557256     -1.837021      3.737643      3.492076       0.8790750     48.43892 22.75217  70.48569 9.609457  -22.04676      24.69823  
1 1 1 22 13 6  o 29.23769 13.07817  -0.2978232     1.045227      2.151782       4.665953      -0.4272416     1.072483      64.17148 28.22077  28.84294 13.04423  35.32854       31.08961  
1 1 1 22 13 7  o 98.77383 9.954530  6.842896       1.292342      0.8526276      5.246934      7.229770       1.333421      61.92770 28.33347  101.5358 9.984415  -39.60812      30.04121  
1 1 1 22 13 8  o 147.0050 18.65522  16.81305       3.572137      19.23716       6.402273      15.71730       4.304423      133.1429 35.45635  135.1027 24.82441  -1.959732      43.28283  
1 1 1 22 13 9  o 98.33748 32.89993  10.60483       5.069143      23.48904       13.61542      8.531511       5.461798      100.0119 45.71399  86.76278 33.43580  13.24910       56.63675  
1 1 1 22 13 10 o 45.68119 21.59131  -1.852272      3.461963      0.000000       0.000000      -1.852272      3.461963      ?        ?         45.68119 21.59131  0.000000       21.59131  
1 1 1 22 13 11 o 74.20850 28.14865  5.439000       3.831028      0.000000       0.000000      5.439000       3.831028      ?        ?         74.20850 28.14865  0.000000       28.14865  
1 1 1 22 13 12 o 60.38817 25.94937  2.606706       3.759084      4.816845       8.755662      2.107260       4.162207      71.29810 33.88504  59.56957 26.40451  11.72852       42.95805  
1 1 1 22 13 13 o 80.98782 20.11506  5.578636       2.160947      -6.419115      8.677943      6.371786       2.231232      56.74344 28.30980  87.19462 19.67290  -30.45118      34.47416  
1 1 1 22 13 14 o 36.39637 17.86241  -4.002124      2.971733      0.7151359      5.076067      -6.462025      3.665568      56.77804 26.62001  37.10316 18.49336  19.67487       32.41341  
1 1 1 22 13 15 o 43.93185 19.57102  0.3501120      2.315759      1.592074       3.593067      -0.5323539     3.028727      54.49141 24.31984  45.06356 20.93934  9.427849       32.09222  
1 1 1 22 14 0  o 113.1321 12.65721  9.118269       1.846888      9.118269       1.846888      9.118269       1.846888      113.1321 12.65721  113.1321 12.65721  0.000000       0.000000  
1 1 1 22 14 1  o 143.3812 7.444158  14.05926       1.417397      9.197453       2.703305      15.90258       1.664547      108.0214 19.49799  152.0762 8.244959  -44.05474      21.16957  
1 1 1 22 14 2  o 130.8356 6.924149  11.67268       1.202865      10.63000       2.770111      11.91497       1.335326      117.2504 18.32978  131.8677 7.631941  -14.61731      19.85516  
1 1 1 22 14 3  o 91.75455 4.796615  5.680744       0.5844202     6.048086       11.88441      5.679853       0.5851281     80.47833 38.58298  91.74583 4.802930  -11.26749      38.88078  
1 1 1 22 14 4  o 175.1638 1.967958  20.47770       0.4593395     26.86870       4.239985      20.40180       0.4620590     188.4823 17.06663  174.8366 1.983315  13.64569       17.18149  
1 1 1 22 14 5  o 152.4290 9.571653  16.17921       1.934328      12.81850       5.779209      16.60320       2.052722      106.1888 35.11760  154.0803 10.05281  -47.89149      36.52814  
1 1 1 22 14 6  f 143.7438 8.434973  14.26594       1.608546      12.91175       7.060760      14.34007       1.651985      98.74639 38.02614  143.9886 8.649910  -45.24221      38.99754  
1 1 1 22 14 7  o 105.9106 18.28908  8.803862       2.487819      13.94467       7.101143      8.084605       2.656160      101.4123 38.35626  99.26812 20.74949  2.144135       43.60899  
1 1 1 22 14 8  f 86.91975 32.53881  8.536050       5.081720      8.538548       5.994800      8.529672       9.579205      84.30215 34.20565  80.39669 37.31675  3.905457       50.62179  
1 1 1 22 14 9  o 60.88728 23.36310  3.008168       2.658684      -5.765965      13.66329      3.353463       2.710494      67.34499 33.87032  63.08182 23.73267  4.263168       41.35745  
1 1 1 22 14 10 o 59.64507 29.89973  -8.180529      10.21968      0.000000       0.000000      -8.180529      10.21968      ?        ?         59.64507 29.89973  0.000000       29.89973  
1 1 1 22 14 11 o 55.97313 23.38103  2.178183       2.910197      0.000000       0.000000      2.178183       2.910197      ?        ?         55.97313 23.38103  0.000000       23.38103  
1 1 1 22 14 12 o 109.2750 13.36785  8.900206       1.906022      0.000000       0.000000      8.900206       1.906022      ?        ?         109.2750 13.36785  0.000000       13.36785  
1 1 1 22 14 13 f 74.10320 31.80886  7.042617       5.637065      -3.329436      11.11597      10.63335       6.540436      62.00670 31.09773  83.11449 34.90723  -21.10779      46.75023  
1 1 1 22 15 0  o 65.15258 19.36422  3.672302       1.462662      3.672302       1.462662      3.672302       1.462662      65.15258 19.36422  65.15258 19.36422  0.000000       0.000000  
1 1 1 22 15 1  o 132.5747 12.28363  12.62586       2.145332      13.83792       2.374862      7.249167       5.001887      138.2029 13.05033  82.41404 31.93332  55.78883       34.49707  
1 1 1 22 15 2  o 15.94227 8.012071  -2.202351      0.7573055     -0.2263519     3.271919      -2.314201      0.7784438     49.47543 22.53580  16.02421 8.062523  33.45123       23.93463  
1 1 1 22 15 3  o 24.29271 11.33393  -0.7289054     0.9017271     2.369549       13.23667      -0.7433518     0.9038268     74.83998 36.91752  24.24978 11.32487  50.59019       38.61549  
1 1 1 22 15 4  o 50.01280 11.90834  1.845994       0.7821581     6.196694       3.978436      1.671073       0.7977266     78.94825 28.92977  47.44778 12.45997  31.50047       31.49892  
1 1 1 22 15 5  o 134.8790 8.134498  12.56210       1.455209      11.27521       3.511828      12.82887       1.598943      113.8461 23.91150  135.8545 8.881227  -22.00841      25.50756  
1 1 1 22 15 6  o 50.98864 20.53366  1.638567       2.142163      9.292440       5.456429      0.2439153      2.329167      88.07825 33.55008  44.73966 19.79558  43.33859       38.95475  
1 1 1 22 15 7  o 120.9118 17.58450  11.45821       2.750193      16.71443       5.814834      9.943630       3.121377      120.7840 34.44701  107.5308 22.50755  13.25317       41.14835  
1 1 1 22 15 8  o 114.1351 15.94933  10.00790       2.359547      8.292086       5.255039      10.44116       2.640707      82.68417 32.52947  114.7913 17.84318  -32.10716      37.10183  
1 1 1 22 15 9  o 47.29107 21.84990  -0.4295981     3.228305      -6.462992      4.097349      9.447347       5.242439      40.09126 19.91121  86.71712 32.92004  -46.62587      38.47318  
1 1 1 22 15 10 o 48.47578 23.59734  -3.456599      4.884520      0.000000       0.000000      -3.456599      4.884520      ?        ?         48.47578 23.59734  0.000000       23.59734  
1 1 1 22 15 11 o 83.74289 33.05943  9.417646       5.444268      0.000000       0.000000      9.417646       5.444268      ?        ?         83.74289 33.05943  0.000000       33.05943  
1 1 1 22 15 12 o 81.91763 32.72026  9.072174       5.393136      18.84442       24.84643      8.588994       5.524856      73.20126 37.58687  79.55183 32.62521  -6.350563      49.77125  
1 1 1 22 16 0  o 93.89522 8.621696  6.131473       1.056699      6.131473       1.056699      6.131473       1.056699      93.89522 8.621696  93.89522 8.621696  0.000000       0.000000  
1 1 1 22 16 1  o 125.4692 3.892693  10.58244       0.6500324     10.36732       1.746794      10.61701       0.7003293     120.5488 10.99531  125.5858 4.190799  -5.037086      11.76688  
1 1 1 22 16 2  f 103.5862 2.662683  7.180704       0.3672270     10.11448       1.953629      7.073246       0.3738919     117.7983 12.64363  102.7957 2.732012  15.00257       12.93543  
1 1 1 22 16 3  o 19.99708 10.01960  -3.017735      1.141055      -4.820002      6.840346      -2.966149      1.157270      54.79815 26.93498  20.34899 10.18044  34.44916       28.79469  
1 1 1 22 16 4  o 77.59872 13.23563  4.483572       1.319532      -3.677463      3.189195      6.169221       1.449413      39.14416 19.05767  91.99464 12.11818  -52.85049      22.58418  
1 1 1 22 16 5  o 86.24120 22.04201  6.505342       2.542277      1.227403       4.076299      9.865147       3.252302      56.40628 25.47769  104.9972 23.79732  -48.59088      34.86295  
1 1 1 22 16 6  o 48.98403 20.74287  1.230725       2.340318      -1.279078      5.856031      1.707766       2.553062      56.15140 26.96303  52.42505 21.89923  3.726345       34.73587  
1 1 1 22 16 7  o 65.22704 21.92710  3.762925       2.251427      4.814016       5.593455      3.559708       2.459460      68.83640 30.55551  63.35236 22.81379  5.484032       38.13277  
1 1 1 22 16 8  o 51.87433 24.83433  -1.525214      4.885335      -0.2236797     5.712879      -5.066986      9.424051      56.98877 27.16517  59.06216 29.47212  -2.073383      40.08182  
1 1 1 22 16 9  o 116.4193 25.51063  12.81848       3.847923      13.49372       7.022145      12.52872       4.600037      90.93153 36.97452  105.9543 30.76945  -15.02277      48.10275  
1 1 1 22 17 0  o 25.49026 14.28711  0.6373934      0.7302516     0.6373934      0.7302516     0.6373934      0.7302516     25.49026 14.28711  25.49026 14.28711  0.000000       0.000000  
1 1 1 22 17 1  o 94.30201 2.577497  5.952365       0.3235826     3.380619       0.9406064     6.297575       0.3446166     68.34029 10.67813  96.98398 2.669168  -28.64368      11.00668  
1 1 1 22 17 2  o 95.96135 7.022278  6.343618       0.8917245     6.097080       1.526121      6.471426       1.098816      90.61848 13.01127  96.11443 8.672723  -5.495941      15.63679  
1 1 1 22 17 3  o 48.65983 14.59389  1.822440       1.021113      9.371179       1.759019      -2.014235      1.254038      113.5522 11.79696  24.24627 11.83662  89.30594       16.71148  
1 1 1 22 17 4  o 52.13097 21.11354  1.889332       2.279235      1.633223       4.109293      2.003131       2.739197      57.03337 25.68696  54.27639 22.67883  2.756973       34.26587  
1 1 1 22 17 5  o 58.77000 23.89317  2.816100       2.931770      2.925437       5.065955      2.761040       3.594943      62.63763 28.33682  59.66388 25.50172  2.973759       38.12235  
1 1 1 22 17 6  o 53.80680 18.89315  2.334892       1.676957      0.2484563E-01  6.414077      2.504383       1.737388      58.89344 28.26370  55.29512 19.24339  3.598324       34.19276  
1 1 1 23 0  1  o 62.03587 32.67957  4.140903       3.589950      4.140903       3.589950      4.140903       3.589950      62.03587 32.67957  62.03587 32.67957  0.000000       0.000000  
1 1 1 23 0  2  f 150.7515 42.66920  20.24956       7.422276      20.24956       7.422276      20.24956       7.422276      150.7515 42.66920  150.7515 42.66920  0.000000       0.000000  
1 1 1 23 0  3  o 43.87272 27.54767  1.022290       3.358117      1.022290       3.358117      1.022290       3.358117      43.87272 27.54767  43.87272 27.54767  0.000000       0.000000  
1 1 1 23 0  4  o 68.84379 23.01397  4.188712       1.881951      4.188712       1.881951      4.188712       1.881951      68.84379 23.01397  68.84379 23.01397  0.000000       0.000000  
1 1 1 23 0  5  o 152.6239 11.28865  15.96742       2.266303      15.96742       2.266303      15.96742       2.266303      152.6239 11.28865  152.6239 11.28865  0.000000       0.000000  
1 1 1 23 0  6  o 132.8083 28.61003  14.04854       4.442721      14.04854       4.442721      14.04854       4.442721      132.8083 28.61003  132.8083 28.61003  0.000000       0.000000  
1 1 1 23 0  7  o 113.9347 19.78707  9.710432       2.732825      9.710432       2.732825      9.710432       2.732825      113.9347 19.78707  113.9347 19.78707  0.000000       0.000000  
1 1 1 23 0  8  o 38.06741 25.33358  -0.5340290     3.456205      -0.5340290     3.456205      -0.5340290     3.456205      38.06741 25.33358  38.06741 25.33358  0.000000       0.000000  
1 1 1 23 0  9  o 49.19319 34.70092  -6.830942      9.078304      -6.830942      9.078304      -6.830942      9.078304      49.19319 34.70092  49.19319 34.70092  0.000000       0.000000  
1 1 1 23 0  10 o 43.78137 30.28097  -2.996571      6.015449      -2.996571      6.015449      -2.996571      6.015449      43.78137 30.28097  43.78137 30.28097  0.000000       0.000000  
1 1 1 23 0  11 o 71.96476 17.19526  4.107705       1.430569      4.107705       1.430569      4.107705       1.430569      71.96476 17.19526  71.96476 17.19526  0.000000       0.000000  
1 1 1 23 0  12 o 13.67332 10.08207  -4.054349      1.346420      -4.054349      1.346420      -4.054349      1.346420      13.67332 10.08207  13.67332 10.08207  0.000000       0.000000  
1 1 1 23 0  13 o 15.30248 11.19174  -3.409663      1.421018      -3.409663      1.421018      -3.409663      1.421018      15.30248 11.19174  15.30248 11.19174  0.000000       0.000000  
1 1 1 23 0  14 o 58.58908 11.33161  2.576851       0.7894112     2.576851       0.7894112     2.576851       0.7894112     58.58908 11.33161  58.58908 11.33161  0.000000       0.000000  
1 1 1 23 0  15 o 15.21766 11.10736  -3.074872      1.355021      -3.074872      1.355021      -3.074872      1.355021      15.21766 11.10736  15.21766 11.10736  0.000000       0.000000  
1 1 1 23 0  16 o 82.96889 18.77236  5.531647       1.810040      5.531647       1.810040      5.531647       1.810040      82.96889 18.77236  82.96889 18.77236  0.000000       0.000000  
1 1 1 23 0  17 o 19.85532 14.34397  -3.355385      1.960873      -3.355385      1.960873      -3.355385      1.960873      19.85532 14.34397  19.85532 14.34397  0.000000       0.000000  
1 1 1 23 0  18 o 55.43139 20.35800  2.944134       1.389141      2.944134       1.389141      2.944134       1.389141      55.43139 20.35800  55.43139 20.35800  0.000000       0.000000  
1 1 1 23 0  19 o 45.19693 19.16781  2.091734       1.169457      2.091734       1.169457      2.091734       1.169457      45.19693 19.16781  45.19693 19.16781  0.000000       0.000000  
1 1 1 23 0  20 o 30.78467 20.54627  -0.1198876     2.301742      -0.1198876     2.301742      -0.1198876     2.301742      30.78467 20.54627  30.78467 20.54627  0.000000       0.000000  
1 1 1 23 1  0  o 113.6704 28.26307  10.51577       3.704431      10.51577       3.704431      10.51577       3.704431      113.6704 28.26307  113.6704 28.26307  0.000000       0.000000  
1 1 1 23 1  1  o 153.7748 13.50832  16.39011       2.739862      14.18831       3.316728      21.12088       4.861686      140.8507 18.08873  169.6732 22.02210  -28.82246      28.49869  
1 1 1 23 1  2  o 167.2396 15.80302  19.64144       3.479938      23.11584       6.867766      18.44122       4.036493      169.8626 31.50164  160.0270 19.31997  9.835556       36.95422  
1 1 1 23 1  3  o 49.49329 18.72133  1.358745       1.691823      1.754032       3.970132      1.271037       1.870124      66.06726 27.42979  50.16911 19.50191  15.89815       33.65587  
1 1 1 23 1  4  o 175.5343 16.03320  21.70899       3.708849      23.27164       4.706308      19.14815       6.024776      179.1327 20.06076  154.6308 30.32368  24.50188       36.35876  
1 1 1 23 1  5  f 99.83361 36.09169  8.362300       6.162764      12.39332       8.050819      2.657408       9.577593      115.3077 41.30635  88.50471 39.58862  26.80303       57.21427  
1 1 1 23 1  6  o 140.5400 15.69758  13.99616       2.889579      15.01862       4.350022      13.18870       3.865684      140.3333 24.13242  132.2500 22.75659  8.083237       33.16981  
1 1 1 23 1  7  f 39.00112 17.10774  -0.2026763     1.704741      0.3529680      2.346487      -0.8237787     2.480855      48.18423 20.59928  44.12067 19.90708  4.063557       28.64650  
1 1 1 23 1  8  o 74.58791 26.50442  4.174458       3.308088      2.592205       3.775694      9.401845       6.862799      67.50893 27.23455  101.2693 37.83319  -33.76033      46.61621  
1 1 1 23 1  9  f 156.5462 26.00556  19.48617       5.234527      17.35698       6.004692      26.22602       10.68337      140.9852 32.61177  150.7617 47.57217  -9.776443      57.67702  
1 1 1 23 1  10 o 29.32494 13.82804  -1.387241      1.404755      3.645357       6.313679      -1.649347      1.440872      78.02679 33.58070  28.79829 13.70353  49.22851       36.26913  
1 1 1 23 1  11 o 107.8345 9.896481  8.047814       1.406198      4.885303       2.121327      10.52678       1.878134      79.27836 20.06611  122.6173 11.63398  -43.33892      23.19479  
1 1 1 23 1  12 o 35.52457 11.49976  0.8632149      0.6212278     0.2965533      0.7961218     1.745429       0.9933551     30.41672 12.41897  48.85292 14.33016  -18.43620      18.96271  
1 1 1 23 1  13 o 82.26881 6.668220  4.615184       0.7247412     4.986162       1.152416      4.372468       0.9321481     84.16893 10.50298  79.32806 8.975797  4.840866       13.81584  
1 1 1 23 1  14 o 121.6111 5.795067  10.01542       0.9363837     10.32045       1.401920      9.769712       1.258200      122.2522 8.661924  119.2558 7.963292  2.996475       11.76618  
1 1 1 23 1  15 o 109.7000 8.795901  8.349048       1.274996      10.01521       1.678017      6.073213       1.961140      119.1249 10.68446  88.60887 17.23016  30.51606       20.27403  
1 1 1 23 1  16 o 58.36238 9.065965  2.408965       0.6821800     4.771694       0.9414722     -0.2027718     0.9898406     82.71594 8.670405  28.88462 12.83581  53.83132       15.48980  
1 1 1 23 1  17 o 126.2999 7.561641  10.98486       1.266775      11.88750       1.871016      10.22089       1.721312      129.1424 10.97655  119.7422 10.90755  9.400185       15.47448  
1 1 1 23 1  18 o 34.48048 15.83449  -0.6481405     1.659413      -1.169534      1.828104      1.792285       3.955040      34.11729 15.98910  57.41571 25.57731  -23.29842      30.16372  
1 1 1 23 1  19 o 34.75646 15.21659  0.9666380E-01  1.342911      -4.056448      4.935952      0.4286536      1.395553      47.23492 23.14861  37.39385 15.93320  9.841076       28.10205  
1 1 1 23 1  20 o 47.20994 18.06834  1.631300       1.587413      1.301557       1.935271      2.309377       2.775198      46.39713 19.19691  54.81566 22.85997  -8.418530      29.85129  
1 1 1 23 2  0  o 49.34922 29.70009  2.023976       3.536177      2.023976       3.536177      2.023976       3.536177      49.34922 29.70009  49.34922 29.70009  0.000000       0.000000  
1 1 1 23 2  1  o 90.26915 25.49724  6.285797       3.201297      9.162723       4.720400      3.835745       4.356143      106.0709 31.27174  77.16548 29.82759  28.90540       43.21581  
1 1 1 23 2  2  o 196.0605 16.42587  27.07245       4.251923      28.11604       8.402659      26.71325       4.929645      183.0982 35.72278  192.6897 19.46585  -9.591446      40.68214  
1 1 1 23 2  3  o 52.57688 19.51738  1.643549       1.820792      1.318154       1.965262      3.615824       4.838366      51.17532 19.96374  77.54427 30.98557  -26.36895      36.85996  
1 1 1 23 2  4  o 41.53349 18.43818  -0.4585449     2.037313      -0.4940420     2.102053      0.9124422E-01  8.272663      42.04456 18.69328  79.47257 36.05579  -37.42802      40.61353  
1 1 1 23 2  5  o 164.2454 11.78694  18.57776       2.562540      15.07893       3.249562      24.33163       4.167191      145.2726 17.11485  184.9208 17.10539  -39.64816      24.19737  
1 1 1 23 2  6  o 80.08359 18.44042  4.751310       1.927148      1.037058       3.076684      7.149462       2.472210      57.04883 23.94961  98.13708 19.59165  -41.08825      30.94215  
1 1 1 23 2  7  o 102.3473 20.47101  7.863563       2.694240      13.42721       4.400666      4.527778       3.407514      130.3776 26.23976  77.19533 26.94417  53.18227       37.61002  
1 1 1 23 2  8  o 155.0503 11.43336  16.61870       2.345602      16.66185       2.824281      16.52276       4.211142      153.9321 13.91935  147.7470 22.06497  6.185150       26.08853  
1 1 1 23 2  9  o 125.9147 23.89361  12.42691       3.862349      10.80106       4.261806      19.90060       9.137362      113.7354 28.24849  134.2147 44.14695  -20.47923      52.41117  
1 1 1 23 2  10 o 96.20325 14.65181  6.672675       1.819027      16.79731       6.949956      5.928093       1.884727      130.0058 37.84008  89.75897 16.36045  40.24686       41.22543  
1 1 1 23 2  11 o 80.95807 10.90529  4.605329       1.146552      0.9324564      5.596554      4.766235       1.171398      66.74697 30.02673  82.36710 10.94328  -15.62012      31.95872  
1 1 1 23 2  12 o 81.48274 8.853691  4.595514       0.9458745     4.489999       1.571655      4.655436       1.184384      77.61404 15.73572  81.11404 11.26111  -3.500008      19.35008  
1 1 1 23 2  13 o 30.06478 13.62610  -0.4962068     1.177853      3.255197       1.628285      -4.613753      1.705897      64.69672 18.15280  24.19609 12.14153  40.50063       21.83897  
1 1 1 23 2  14 o 66.61108 7.084620  3.051497       0.6191995     4.147848       1.564994      2.848017       0.6742163     73.60502 16.37846  64.02618 8.082314  9.578842       18.26411  
1 1 1 23 2  15 o 110.6161 5.736838  8.297489       0.8427100     8.788947       0.9918376     7.021768       1.597994      113.5424 6.583789  98.58659 12.44068  14.95577       14.07540  
1 1 1 23 2  16 f 91.39170 7.305716  5.745081       0.8822963     5.734253       1.016226      5.778232       1.778107      90.81006 8.496799  86.90162 15.94256  3.908440       18.06546  
1 1 1 23 2  17 o 108.0608 7.143649  8.024214       1.022865      8.873821       1.999679      7.723141       1.190383      109.1570 14.07513  105.3151 8.556114  3.841904       16.47169  
1 1 1 23 2  18 o 43.90632 14.42973  1.435935       0.9762733     1.328445       1.040754      2.223646       2.817396      42.84274 14.89481  55.74826 23.12292  -12.90551      27.50499  
1 1 1 23 2  19 o 78.06503 11.54176  4.473779       1.164466      5.547498       1.397411      2.034101       2.106421      86.41515 12.49814  52.02956 20.55616  34.38559       24.05742  
1 1 1 23 2  20 o 63.11468 16.33636  3.240310       1.384465      5.882704       1.690394      -2.143823      2.412943      86.71529 15.18199  35.91758 17.26279  50.79771       22.98906  
1 1 1 23 3  0  o 162.5551 27.64956  20.13897       5.469147      20.13897       5.469147      20.13897       5.469147      162.5551 27.64956  162.5551 27.64956  0.000000       0.000000  
1 1 1 23 3  1  o 148.0812 22.32144  16.25593       4.267754      17.50358       5.774997      14.75467       6.334802      147.7942 30.34094  131.1986 35.41631  16.59566       46.63569  
1 1 1 23 3  2  o 148.6103 20.17230  16.09381       3.891604      12.81168       5.738147      18.88918       5.295575      123.0801 33.90752  156.8390 26.26674  -33.75887      42.89128  
1 1 1 23 3  3  o 78.11805 21.11846  4.579708       2.250447      7.259530       3.257823      2.133817       3.112382      96.71558 25.07315  63.12284 24.97198  33.59275       35.38733  
1 1 1 23 3  4  o 60.60699 26.74600  0.2787264E-01  4.225193      0.2787264E-01  4.225193      0.000000       0.000000      60.60699 26.74600  ?        ?         0.000000       26.74600  
1 1 1 23 3  5  o 78.26244 26.04562  4.662643       3.177694      2.174277       3.639294      12.64775       6.519287      65.62965 26.64323  118.3423 37.13741  -52.71261      45.70611  
1 1 1 23 3  6  o 135.9891 19.52847  13.58207       3.437334      14.49518       3.689133      7.569808       9.466344      140.0023 20.37215  97.79903 41.57826  42.20327       46.30093  
1 1 1 23 3  7  o 189.2633 19.49698  26.24121       4.846808      29.69004       8.523578      24.59315       5.892133      183.1095 36.21651  177.6306 25.63400  5.478958       44.37046  
1 1 1 23 3  8  o 63.61247 23.01753  2.823133       2.507268      4.209021       3.510523      1.380083       3.582189      74.77866 27.21047  60.86589 25.71325  13.91277       37.43770  
1 1 1 23 3  9  o 63.26119 27.05087  1.502111       4.048104      2.915187       5.087893      -0.9355170     6.682500      72.57788 30.65192  67.95054 31.40974  4.627342       43.88749  
1 1 1 23 3  10 o 32.87206 14.28569  -0.5911907E-01 1.165025      0.6604143      2.816614      -0.2076296     1.279618      52.32288 22.47252  33.44755 14.74139  18.87533       26.87606  
1 1 1 23 3  11 o 253.0041 7.322104  43.44573       2.465925      25.27139       5.976823      47.17407       2.707068      174.6915 26.50711  263.3749 7.721833  -88.68346      27.60894  
1 1 1 23 3  12 o 215.8833 6.171655  31.51030       1.773570      40.11039       5.368237      30.45656       1.879085      232.2418 17.47492  211.9859 6.660474  20.25584       18.70119  
1 1 1 23 3  13 o 164.2197 5.011547  18.16600       1.095373      11.90785       2.735173      19.36142       1.195421      126.0797 16.68998  169.4322 5.301344  -43.35252      17.51170  
1 1 1 23 3  14 o 97.34476 8.160224  6.539045       1.048761      5.221783       1.324128      8.756407       1.717956      85.21067 11.99310  110.7843 11.81987  -25.57362      16.83876  
1 1 1 23 3  15 o 42.50619 14.29105  1.282934       0.9563624     0.2910869      1.131743      3.760102       1.788559      34.37870 14.48446  68.28698 18.97599  -33.90828      23.87233  
1 1 1 23 3  16 o 68.66351 10.96180  3.397130       0.9692485     2.189127       1.663039      4.018537       1.192770      53.51252 18.81261  73.99970 12.54389  -20.48718      22.61114  
1 1 1 23 3  17 o 96.81962 6.607557  6.421653       0.8473584     6.399436       0.8637087     6.991845       4.375598      96.59272 6.752953  80.00593 30.14208  16.58679       30.88927  
1 1 1 23 3  18 o 26.73770 12.13266  -0.3727005     0.9372054     -3.655003      1.423130      2.140954       1.245398      22.29525 11.17378  52.08680 16.21479  -29.79154      19.69195  
1 1 1 23 3  19 o 34.65935 15.21639  0.7467637E-01  1.351282      -0.7564290     2.161853      0.6075966      1.731128      38.36315 17.77928  41.19793 17.65470  -2.834778      25.05576  
1 1 1 23 3  20 o 54.58273 11.60829  2.231643       0.8183028     2.170162       0.8450949     3.155424       3.275805      53.56438 12.12369  59.53692 24.83319  -5.972538      27.63460  
1 1 1 23 4  0  o 94.09250 36.85603  8.830363       4.420473      8.830363       4.420473      8.830363       4.420473      94.09250 36.85603  94.09250 36.85603  0.000000       0.000000  
1 1 1 23 4  1  o 114.9899 16.14388  9.420682       2.405631      7.585968       3.238852      11.67825       3.592756      99.02263 24.64440  124.8353 22.42221  -25.81269      33.31820  
1 1 1 23 4  2  o 175.4005 15.09859  21.58806       3.494601      17.16615       4.996876      25.82129       4.889109      149.1051 26.10003  188.7038 19.73503  -39.59871      32.72129  
1 1 1 23 4  3  o 92.43106 19.49998  6.334640       2.326084      13.37794       3.356812      -0.1713393     3.226230      135.5872 19.10883  53.12357 23.41037  82.46367       30.21908  
1 1 1 23 4  4  o 165.5309 20.91505  20.20841       4.510500      25.46650       5.791110      12.09963       7.191602      183.0884 24.33945  114.1251 39.17790  68.96333       46.12284  
1 1 1 23 4  5  o 158.2423 19.09371  18.25144       3.944829      19.08499       4.563584      15.78755       7.846040      159.6864 22.03349  127.4816 40.83211  32.20484       46.39758  
1 1 1 23 4  6  o 102.7593 26.19289  8.463450       3.596693      8.218026       3.888266      9.918197       9.466533      100.1410 28.03486  103.0973 42.53790  -2.956299      50.94533  
1 1 1 23 4  7  o 42.64207 18.93070  -0.3729205     2.147717      0.5095897      2.279336      -7.359113      6.413110      48.17719 20.43901  56.01953 27.21680  -7.842342      34.03686  
1 1 1 23 4  8  o 122.5968 12.53554  10.53308       2.019042      10.84594       9.265480      10.51749       2.068757      102.7203 42.20191  122.3385 12.88351  -19.61820      44.12467  
1 1 1 23 4  9  o 22.89564 11.44201  -3.732165      1.443903      7.979035       6.764779      -4.291177      1.477962      92.66084 36.76527  22.20777 11.16520  70.45308       38.42326  
1 1 1 23 4  10 o 104.2551 8.572000  7.457237       1.180329      7.053470       3.898216      7.497991       1.238465      89.83678 28.78192  104.3920 8.990641  -14.55522      30.15345  
1 1 1 23 4  11 o 151.7625 5.585977  15.53291       1.127705      8.241921       3.549193      16.35163       1.189337      97.85629 26.54949  155.6624 5.743720  -57.80612      27.16369  
1 1 1 23 4  12 o 36.18431 14.93583  0.4271384      1.167721      18.42811       11.45966      0.2382684      1.173831      106.8479 45.59642  34.80767 14.71272  72.04025       47.91135  
1 1 1 23 4  13 o 35.95399 15.38748  0.1916420      1.311921      -0.3301490E-01 1.333365      7.008167       7.344641      34.75199 15.18973  82.30965 35.81862  -47.55766      38.90632  
1 1 1 23 4  14 o 49.72041 13.39197  1.841277       0.9069796     3.958350       1.717995      1.023233       1.067929      70.73144 18.14172  40.34613 14.95286  30.38531       23.50979  
1 1 1 23 4  15 o 141.0421 9.625348  13.89709       1.798160      0.000000       0.000000      13.89709       1.798160      ?        ?         141.0421 9.625348  0.000000       9.625348  
1 1 1 23 4  16 f 87.43967 8.069563  5.304527       0.9296248     5.589141       0.9608662     1.139982       3.675515      89.74899 8.122357  55.48566 24.69095  34.26333       25.99261  
1 1 1 23 4  17 o 32.74591 14.66781  -0.2499770     1.319692      0.3466796E-01  1.497881      -1.237376      2.789792      36.32595 15.98183  42.21894 19.77500  -5.892994      25.42577  
1 1 1 23 4  18 o 28.83556 13.49997  -0.9408233     1.297610      -6.736907      1.944768      3.710199       1.742107      23.08691 11.73969  66.41558 18.82601  -43.32867      22.18646  
1 1 1 23 4  19 o 57.84018 14.61279  2.628246       1.126467      1.712898       1.179287      12.16517       3.806542      47.06157 15.86967  111.3673 26.10750  -64.30574      30.55238  
1 1 1 23 5  0  o 90.04861 45.96774  9.858289       6.950595      9.858289       6.950595      9.858289       6.950595      90.04861 45.96774  90.04861 45.96774  0.000000       0.000000  
1 1 1 23 5  1  o 132.7977 15.83818  12.52892       2.747476      11.90158       3.600319      13.40367       4.251371      125.7411 22.30441  131.6608 25.14933  -5.919655      33.61511  
1 1 1 23 5  2  o 151.4581 12.91270  15.94247       2.581223      17.06211       3.273324      14.10142       4.197428      155.0107 16.08059  135.7878 24.07953  19.22284       28.95529  
1 1 1 23 5  3  o 188.6912 16.55886  25.33417       4.121309      16.33382       11.60761      26.63244       4.408541      121.1781 48.13392  192.9175 17.33405  -71.73941      51.15998  
1 1 1 23 5  4  o 202.0846 15.54706  28.86921       4.154378      27.04965       6.149117      30.39716       5.634863      187.1654 25.30300  202.5699 21.18845  -15.40454      33.00291  
1 1 1 23 5  5  o 136.0105 23.35701  14.17971       4.080697      12.14716       4.312691      31.56157       12.61175      122.9417 27.06025  162.4568 51.73979  -39.51516      58.38889  
1 1 1 23 5  6  o 103.7657 32.14785  9.414093       4.901981      7.747371       7.072795      10.95479       6.800138      94.41560 37.55035  107.1055 38.00636  -12.68988      53.42764  
1 1 1 23 5  7  o 141.3637 33.57762  17.77439       6.230600      7.332673       8.192934      32.09584       9.595046      92.71841 39.01257  181.3906 40.70018  -88.67220      56.37806  
1 1 1 23 5  8  o 57.48297 22.67020  1.907795       2.557830      -0.7998677     3.246801      6.337376       4.152788      49.89433 22.61727  86.31467 29.76593  -36.42034      37.38384  
1 1 1 23 5  9  o 101.4810 10.59823  7.169032       1.412047      15.25818       5.591975      6.618117       1.459339      129.4709 32.47368  97.09681 11.50233  32.37412       34.45059  
1 1 1 23 5  10 o 113.2301 7.846231  8.758807       1.176528      9.824090       4.635790      8.685468       1.216353      102.9563 31.14372  112.6402 8.159176  -9.683945      32.19477  
1 1 1 23 5  11 o 134.1920 7.508060  12.28257       1.337188      8.711647       3.725370      12.81069       1.432660      99.43492 27.29224  136.8919 7.887411  -37.45697      28.40911  
1 1 1 23 5  12 o 36.95778 13.31687  0.8609028      0.8381602     -3.477445      2.617244      1.356676       0.8847561     35.98993 17.46262  43.45488 13.68733  -7.464951      22.18752  
1 1 1 23 5  13 o 233.4455 12.32510  38.78780       3.820391      41.86035       6.342607      37.03832       4.786010      229.2426 20.99635  222.9977 16.21728  6.244965       26.53011  
1 1 1 23 5  14 o 89.40501 9.627061  5.608398       1.128855      3.869810       1.528133      7.696766       1.674814      70.69759 16.52014  103.2847 12.41784  -32.58710      20.66682  
1 1 1 23 5  15 o 26.47415 12.47709  -1.048368      1.140920      -1.648633      1.215511      3.397070       3.307839      25.13274 12.12299  64.42641 25.66122  -39.29367      28.38072  
1 1 1 23 5  16 o 37.45805 15.24292  0.6288713      1.194532      -0.5450752     1.292768      7.484456       3.124056      30.92131 14.11559  89.92732 25.11245  -59.00601      28.80773  
1 1 1 23 5  17 o 114.7516 13.19833  9.745359       1.981433      10.37107       2.053618      1.311368       7.539650      118.3657 13.24724  63.84684 30.64157  54.51884       33.38255  
1 1 1 23 5  18 o 31.17651 13.60472  0.3462551E-01  1.065842      0.6264307      1.219826      -1.875561      2.191525      37.24352 15.30810  35.03564 16.73498  2.207878       22.68033  
1 1 1 23 5  19 o 28.80070 13.60782  -1.138613      1.372824      -1.818000      1.509609      2.108887       3.300505      28.00640 13.50940  55.29396 24.03728  -27.28757      27.57344  
1 1 1 23 6  0  o 81.79761 39.29511  7.612957       4.945196      7.612957       4.945196      7.612957       4.945196      81.79761 39.29511  81.79761 39.29511  0.000000       0.000000  
1 1 1 23 6  1  o 101.4507 18.87531  7.606881       2.457777      5.827513       2.861402      12.61330       4.799652      86.35700 24.00335  123.6642 29.53424  -37.30723      38.05827  
1 1 1 23 6  2  o 115.1319 15.21157  9.444673       2.276649      11.23183       3.394137      7.982937       3.069603      121.9744 21.67698  101.5567 23.19352  20.41767       31.74635  
1 1 1 23 6  3  o 81.18225 26.75211  5.197604       3.354766      7.267551       13.56335      5.062718       3.462346      99.86634 45.63950  80.34344 27.19190  19.52290       53.12592  
1 1 1 23 6  4  o 156.0720 14.14726  17.15463       2.910263      22.64030       4.173847      11.96418       4.059982      176.6697 17.97994  122.7848 25.64318  53.88487       31.31854  
1 1 1 23 6  5  o 154.3198 20.50783  17.79830       4.112813      16.46144       4.383461      27.63234       11.88883      146.1450 23.29023  149.4624 50.38804  -3.317459      55.51026  
1 1 1 23 6  6  o 104.8707 27.97114  9.205402       3.980540      9.269336       4.865601      9.076018       6.921737      102.0787 32.09032  97.96054 37.66903  4.118195       49.48480  
1 1 1 23 6  7  o 45.55997 22.09171  -5.222953      4.171006      -11.05446      6.065793      0.7479044E-02  5.744682      48.66079 24.17725  65.97248 29.97624  -17.31170      38.51123  
1 1 1 23 6  8  f 106.6826 19.86888  8.690683       2.720589      7.498765       4.068518      9.654719       3.658975      92.41801 29.38164  108.0656 25.77279  -15.64755      39.08347  
1 1 1 23 6  9  o 152.5237 7.231122  15.80383       1.465474      17.30404       4.480020      15.62406       1.550791      147.1197 23.65428  151.4532 7.709609  -4.333511      24.87897  
1 1 1 23 6  10 o 84.00844 6.307150  4.795204       0.7008854     8.098751       4.633637      4.717850       0.7090437     92.21094 31.45345  83.29046 6.438531  8.920479       32.10567  
1 1 1 23 6  11 o 84.57314 5.841782  4.851137       0.6542965     6.296596       4.212193      4.815397       0.6623359     82.28841 29.82586  84.23476 5.938902  -1.946358      30.41139  
1 1 1 23 6  12 o 23.17231 11.42884  -2.538099      1.266928      -0.7104193     3.257466      -2.863840      1.375201      48.50521 22.24184  23.79453 11.76737  24.71069       25.16288  
1 1 1 23 6  13 o 117.9079 9.465247  9.690116       1.474645      8.882584       3.537110      9.860002       1.622362      99.04911 26.34389  118.4179 10.38658  -19.36877      28.31751  
1 1 1 23 6  14 o 50.03886 13.60553  1.877707       0.9308779     1.554336       1.460518      2.098942       1.208046      47.49488 17.50737  52.41753 15.90719  -4.922657      23.65474  
1 1 1 23 6  15 o 90.40749 12.91190  5.994487       1.511359      6.315509       1.653627      4.365975       3.724478      92.19810 13.89081  69.13766 27.32811  23.06043       30.65584  
1 1 1 23 6  16 o 121.5286 10.15752  10.46121       1.629870      10.94970       1.740200      6.971159       4.651425      124.0018 10.63426  78.80167 30.72112  45.20012       32.50961  
1 1 1 23 6  17 o 56.55171 10.68915  2.337573       0.7759886     1.921153       0.9207976     3.358091       1.441479      50.10984 13.49218  64.62524 16.63972  -14.51539      21.42240  
1 1 1 23 6  18 o 94.26957 10.35075  6.388062       1.278859      8.854085       1.430673      -3.416656      2.852721      111.5854 9.718735  36.55048 17.84534  75.03491       20.32019  
1 1 1 23 7  0  o 70.26212 35.30647  5.617767       4.064711      5.617767       4.064711      5.617767       4.064711      70.26212 35.30647  70.26212 35.30647  0.000000       0.000000  
1 1 1 23 7  1  o 235.6975 10.77204  38.18010       3.374247      41.91470       4.485130      33.30996       5.121812      244.6005 13.81700  214.2395 18.11065  30.36102       22.77949  
1 1 1 23 7  2  o 116.0769 25.17443  10.71399       3.781524      16.13596       6.277632      7.626065       4.737512      133.5136 34.90104  94.02038 31.80757  39.49320       47.22080  
1 1 1 23 7  3  f 153.4947 13.31082  16.53677       2.695638      19.84063       3.713521      12.85679       3.919204      165.6303 17.06986  128.3700 23.78765  37.26033       29.27853  
1 1 1 23 7  4  o 168.0350 16.54238  20.36103       3.656025      21.63878       4.782214      18.56381       5.671615      168.8083 21.76598  148.7919 29.64726  20.01636       36.77931  
1 1 1 23 7  5  o 64.55193 23.19965  3.005731       2.541903      3.405902       2.649412      -1.627060      9.014633      67.56606 23.74568  74.27174 35.02465  -6.705688      42.31529  
1 1 1 23 7  6  o 90.27090 13.73077  5.840049       1.599660      -0.4633000     4.896966      6.593022       1.692510      60.65394 27.60516  96.07224 13.60069  -35.41830      30.77375  
1 1 1 23 7  7  o 53.69571 17.23705  2.100137       1.397645      8.612180       7.287465      1.851461       1.424081      93.17103 37.74669  51.27869 17.43810  41.89233       41.58004  
1 1 1 23 7  8  o 42.32928 20.79581  -6.331149      4.061315      11.01995       13.53310      -8.048479      4.257559      95.42519 44.31366  41.07393 20.38168  54.35126       48.77615  
1 1 1 23 7  9  f 177.2997 15.09871  22.79214       3.533246      20.03907       5.248379      25.07401       4.778183      154.2167 26.49438  180.4695 20.21649  -26.25281      33.32655  
1 1 1 23 7  10 o 120.7598 5.812696  9.865468       0.9326023     11.74819       4.947063      9.796094       0.9496291     109.7652 31.91852  120.2924 5.942768  -10.52728      32.46704  
1 1 1 23 7  11 o 46.15329 17.18834  1.381998       1.414329      4.040472       3.780423      0.9493487      1.525079      70.02262 27.57756  43.39241 17.37690  26.63021       32.59568  
1 1 1 23 7  12 o 80.81918 8.395642  4.530944       0.8909932     4.480496       3.225660      4.535111       0.9270612     71.54411 26.07565  80.71786 8.759422  -9.173759      27.50758  
1 1 1 23 7  13 o 137.0524 8.870261  13.02331       1.611230      19.79483       7.690752      12.71246       1.647798      122.1457 40.51546  135.2012 9.201221  -13.05550      41.54714  
1 1 1 23 7  14 o 119.9759 10.99550  10.23655       1.738325      9.020833       2.231081      12.11474       2.773114      109.0531 15.81423  125.4324 17.03101  -16.37921      23.24102  
1 1 1 23 7  15 o 55.36458 15.00675  2.367902       1.134580      2.303734       1.162960      3.634728       5.167330      54.51321 15.35747  66.79987 29.52403  -12.28667      33.27943  
1 1 1 23 7  16 o 27.92822 13.02884  -0.8448026     1.191118      -1.051626      1.270662      0.6536868      3.420243      28.07442 13.21153  51.66999 23.33805  -23.59557      26.81808  
1 1 1 23 7  17 o 43.15188 15.62380  1.331080       1.155429      0.2563463      1.314059      4.993734       2.425842      35.50785 15.30114  73.65501 22.57905  -38.14716      27.27524  
1 1 1 23 7  18 o 41.84856 17.02965  0.9802850      1.490992      1.568523       1.732769      -0.6974568     2.926353      47.39358 18.66893  43.83535 20.44040  3.558231       27.68283  
1 1 1 23 8  0  o 40.66380 27.32296  -0.8339769     4.195014      -0.8339769     4.195014      -0.8339769     4.195014      40.66380 27.32296  40.66380 27.32296  0.000000       0.000000  
1 1 1 23 8  1  o 104.6226 12.04962  7.677065       1.649212      7.557877       1.936789      7.991420       3.145402      102.6525 14.56787  100.0980 23.91072  2.554520       27.99903  
1 1 1 23 8  2  o 69.54041 28.40327  2.969361       4.166189      4.958165       6.083316      1.212587       5.717451      81.82753 33.96188  69.18456 30.79045  12.64297       45.84169  
1 1 1 23 8  3  o 114.4473 15.02837  9.425727       2.236552      11.47169       3.616663      8.158813       2.845986      120.6894 23.33293  102.5407 21.51609  18.14865       31.73906  
1 1 1 23 8  4  o 171.0816 16.18382  21.17983       3.645561      28.88582       5.463712      14.99621       4.894354      194.4813 21.43847  133.2500 28.43165  61.23135       35.60852  
1 1 1 23 8  5  o 108.4759 13.44051  8.386968       1.901248      11.16886       7.053152      8.168989       1.974331      102.9233 38.37354  106.6187 14.25349  -3.695351      40.93520  
1 1 1 23 8  6  o 27.07405 12.17589  -0.3637500     0.9194798     9.147202       6.139093      -0.5819994     0.9299697     95.49343 35.76094  25.88078 11.87366  69.61265       37.68062  
1 1 1 23 8  7  o 80.95894 10.01681  4.579818       1.057579      0.000000       0.000000      4.579818       1.057579      ?        ?         80.95894 10.01681  0.000000       10.01681  
1 1 1 23 8  8  o 52.05291 24.08405  -1.206363      3.942665      -11.25787      14.47315      -0.4006655     4.097635      72.10378 36.06244  55.21692 25.17746  16.88687       43.98186  
1 1 1 23 8  9  o 91.06729 23.49099  6.948014       2.869316      0.7523939      6.961473      8.215961       3.149266      68.22678 31.71711  98.72133 24.14363  -30.49454      39.86088  
1 1 1 23 8  10 o 115.6108 12.58862  9.581520       1.908039      5.465837       5.630413      10.11549       2.028039      77.26228 32.41468  118.5078 13.05893  -41.24553      34.94635  
1 1 1 23 8  11 o 120.4764 8.067871  9.988554       1.287727      13.51691       5.432920      9.778532       1.325499      113.1207 33.60002  119.0342 8.410843  -5.913521      34.63674  
1 1 1 23 8  12 o 64.52015 14.87322  3.158540       1.252517      7.576717       7.152699      3.018776       1.272174      81.40224 35.38646  62.84438 15.33036  18.55786       38.56451  
1 1 1 23 8  13 o 132.0386 21.33012  14.33683       3.625025      25.84408       7.665628      11.02225       4.114112      147.3837 38.58645  107.0107 28.38852  40.37299       47.90430  
1 1 1 23 8  14 o 48.59887 19.90653  1.339444       2.053673      4.452263       7.037455      1.049684       2.147131      70.99489 32.60515  47.44624 19.96813  23.54865       38.23378  
1 1 1 23 8  15 o 32.25034 13.76197  0.1941218      1.043852      -0.2827084     1.125141      3.140911       2.797046      30.07261 13.50121  61.02654 23.81384  -30.95393      27.37483  
1 1 1 23 8  16 o 38.03691 15.38945  0.7265414      1.209501      0.3244781      1.642571      1.202740       1.787603      39.07629 16.97251  45.52287 18.60074  -6.446575      25.18042  
1 1 1 23 8  17 o 25.90069 12.57145  -1.905440      1.359423      -3.671440      1.489687      6.888089       3.324156      23.00133 11.51373  81.27802 26.62176  -58.27670      29.00489  
1 1 1 23 9  0  o 68.73383 31.10463  5.119893       3.067459      5.119893       3.067459      5.119893       3.067459      68.73383 31.10463  68.73383 31.10463  0.000000       0.000000  
1 1 1 23 9  1  o 224.4208 13.50257  35.59459       4.019201      36.48172       6.496753      35.04455       5.115645      216.1316 22.90650  218.2256 17.74526  -2.093979      28.97589  
1 1 1 23 9  2  o 110.6437 17.23288  9.078367       2.458011      7.363934       3.139718      11.79280       3.950660      94.56054 24.66452  119.7080 25.54553  -25.14746      35.50933  
1 1 1 23 9  3  o 80.21606 34.68894  4.715024       6.800672      4.441316       9.687676      4.980952       9.549026      83.69000 38.36858  84.54085 38.50452  -0.8508453     54.35757  
1 1 1 23 9  4  o 63.61521 25.60558  2.585018       3.329295      0.5760100      14.06099      2.704338       3.426736      83.13433 40.36962  64.54587 25.97849  18.58846       48.00613  
1 1 1 23 9  5  o 85.24895 14.80547  5.327017       1.620854      0.000000       0.000000      5.327017       1.620854      ?        ?         85.24895 14.80547  0.000000       14.80547  
1 1 1 23 9  6  o 119.7461 8.897745  9.878602       1.409614      15.85379       5.823985      9.506786       1.452810      127.4466 33.76105  117.2471 9.377034  10.19952       35.03908  
1 1 1 23 9  7  o 130.8143 6.921413  11.64111       1.202196      8.524762       5.368651      11.80562       1.233520      91.38943 33.58685  131.6851 7.055450  -40.29563      34.31991  
1 1 1 23 9  8  o 22.78418 11.52966  -5.597162      1.728203      -15.46573      17.53999      -5.500419      1.736653      72.29008 36.59841  23.02769 11.64189  49.26238       38.40543  
1 1 1 23 9  9  f 91.55499 24.91344  7.315253       3.119806      1.123313       9.282331      8.103798       3.312509      72.31734 34.51488  95.99323 25.47663  -23.67588      42.89914  
1 1 1 23 9  10 o 114.6791 9.669732  9.181493       1.463897      3.719171       9.551064      9.312900       1.481401      75.54112 35.75179  115.4760 9.717438  -39.93486      37.04888  
1 1 1 23 9  11 o 140.7598 8.780439  13.72043       1.638703      5.838022       8.053748      14.06086       1.673715      77.17612 35.23136  142.4518 8.861274  -65.27564      36.32865  
1 1 1 23 9  12 o 60.27327 23.84572  2.766465       2.838088      3.055293       4.730204      2.604005       3.547585      65.59148 28.64083  61.22221 25.71039  4.369270       38.48793  
1 1 1 23 9  13 o 34.83177 16.62612  -2.021875      2.155243      -2.326818      6.039478      -1.977374      2.307150      56.16851 27.07570  36.38470 17.32108  19.78381       32.14208  
1 1 1 23 9  14 o 69.56239 25.42008  4.561037       3.068453      7.535427       7.033391      3.861840       3.410089      76.60862 34.11904  65.41547 26.05494  11.19315       42.92981  
1 1 1 23 9  15 o 38.42197 15.86251  0.6510178      1.317456      1.186151       1.335417      -18.84286      8.060002      42.85236 16.52801  45.80807 23.34991  -2.955711      28.60758  
1 1 1 23 9  16 o 75.46605 17.44078  4.651272       1.718670      5.769153       1.965284      1.016742       3.543657      83.69624 18.14572  52.58357 23.75260  31.11266       29.89069  
1 1 1 23 10 0  o 191.2696 14.94074  25.75483       3.753026      25.75483       3.753026      25.75483       3.753026      191.2696 14.94074  191.2696 14.94074  0.000000       0.000000  
1 1 1 23 10 1  o 61.55330 22.88337  2.751588       2.504712      7.557229       4.528961      0.6341010      3.006307      89.79032 31.07925  52.71595 22.92850  37.07438       38.62170  
1 1 1 23 10 2  o 120.9803 15.91533  10.76654       2.503523      9.459991       4.354013      11.41186       3.059946      101.1801 30.08573  121.8905 19.49625  -20.71041      35.85046  
1 1 1 23 10 3  o 76.38432 23.78464  4.842061       2.679471      4.567348       3.274933      5.398327       4.660207      73.90499 26.35969  78.56081 30.71457  -4.655815      40.47490  
1 1 1 23 10 4  o 143.1128 13.69193  14.71105       2.579260      21.29319       8.090036      13.96630       2.721268      134.5052 41.23357  138.4434 14.98998  -3.938187      43.87376  
1 1 1 23 10 5  o 130.2755 8.742512  11.69048       1.508867      10.76342       5.334553      11.77110       1.573105      102.2152 33.73694  130.5488 9.099946  -28.33364      34.94267  
1 1 1 23 10 6  o 134.7190 7.660105  12.41471       1.369442      14.87778       6.909467      12.31400       1.397159      112.2746 38.40600  134.0807 7.854384  -21.80608      39.20092  
1 1 1 23 10 7  o 104.4509 4.192604  7.333920       0.5823531     14.39989       6.640081      7.279149       0.5846057     110.5457 37.65360  104.0524 4.225146  6.493294       37.88992  
1 1 1 23 10 8  f 118.7142 3.679420  9.453780       0.5813408     6.356215       6.541974      9.478435       0.5836499     79.57831 34.21460  118.8669 3.689302  -39.28856      34.41293  
1 1 1 23 10 9  o 113.2778 39.28513  16.50844       7.237794      15.59206       13.49674      16.87835       8.575064      91.07531 42.92040  106.5808 41.66555  -15.50552      59.81788  
1 1 1 23 10 10 o 42.91884 20.67664  -3.277694      3.509803      -3.295693      13.40945      -3.276370      3.636581      71.03930 35.40228  43.76879 21.07615  27.27051       41.20104  
1 1 1 23 10 11 o 80.04218 26.16446  6.005029       3.211668      0.000000       0.000000      6.005029       3.211668      ?        ?         80.04218 26.16446  0.000000       26.16446  
1 1 1 23 10 12 f 58.53339 23.34293  2.592576       2.740508      -1.295591      10.69624      2.865746       2.835144      67.14524 33.13396  60.26538 23.83627  6.879856       40.81699  
1 1 1 23 10 13 o 81.54626 22.52039  5.908260       2.527752      6.056970       4.406266      5.835313       3.086069      74.99888 29.69925  77.77717 25.65970  -2.778290      39.24876  
1 1 1 23 10 14 o 64.82571 26.69735  3.894256       3.719651      14.14313       7.855543      0.9322693      4.223083      90.14854 38.08051  55.32647 25.35295  34.82206       45.74820  
1 1 1 23 10 15 o 82.68650 12.98746  5.117439       1.383861      8.314743       2.202991      3.033418       1.778574      102.4148 16.71899  59.75985 19.46656  42.65498       25.66070  
1 1 1 23 10 16 o 35.01620 14.28104  0.5584402      1.051336      0.9916941      1.199126      -0.8813764     2.185985      40.04039 15.60159  38.08913 17.72925  1.951252       23.61643  
1 1 1 23 11 0  o 14.51152 10.49127  -1.965103      1.058604      -1.965103      1.058604      -1.965103      1.058604      14.51152 10.49127  14.51152 10.49127  0.000000       0.000000  
1 1 1 23 11 1  o 51.56384 22.98346  0.1907110      3.198215      -2.757253      8.276010      0.7082452      3.467603      65.75140 31.69505  55.00677 24.25407  10.74463       39.91035  
1 1 1 23 11 2  o 41.77734 19.93435  -2.744506      3.092514      -3.856961      4.678633      -1.881358      4.121167      49.77311 23.95176  50.84815 23.88606  -1.075039      33.82648  
1 1 1 23 11 3  o 153.3670 12.70716  16.79043       2.573603      18.26406       4.347254      15.99530       3.193321      150.2822 22.39127  146.2602 16.68282  4.021957       27.92285  
1 1 1 23 11 4  o 24.25211 11.93835  -2.620538      1.360158      0.2686138      8.466949      -2.697071      1.378055      69.96541 33.27166  24.28631 11.96705  45.67910       35.35836  
1 1 1 23 11 5  o 69.66708 13.18362  3.562422       1.179061      5.649948       5.717008      3.469687       1.204965      77.65152 32.62583  68.50565 13.67925  9.145874       35.37749  
1 1 1 23 11 6  o 125.3897 5.062113  10.60885       0.8440606     7.956686       5.052267      10.68500       0.8560923     87.07108 32.47474  125.8225 5.116767  -38.75143      32.87537  
1 1 1 23 11 7  o 146.8083 3.763673  14.46011       0.7356610     8.503576       7.684519      14.51521       0.7390555     84.39108 36.68215  147.0851 3.773928  -62.69405      36.87577  
1 1 1 23 11 8  o 209.3643 12.03944  31.24488       3.344625      28.70774       8.735711      31.68068       3.620495      150.1966 42.01159  209.6705 13.02285  -59.47397      43.98373  
1 1 1 23 11 9  o 96.41873 38.76446  13.26059       7.621007      8.160392       13.14057      15.84551       9.355004      80.17423 38.95384  97.44621 41.37696  -17.27197      56.82829  
1 1 1 23 11 10 o 51.31915 23.20316  0.2493024      3.390930      11.31208       14.78432      -0.3649800     3.483802      81.31712 39.89476  49.85043 22.91133  31.46669       46.00566  
1 1 1 23 11 11 o 78.50305 25.27398  5.790204       3.003305      0.000000       0.000000      5.790204       3.003305      ?        ?         78.50305 25.27398  0.000000       25.27398  
1 1 1 23 11 12 o 66.32655 27.54998  4.047285       4.007579      0.000000       0.000000      4.047285       4.007579      ?        ?         66.32655 27.54998  0.000000       27.54998  
1 1 1 23 11 13 o 39.03750 19.04809  -3.700346      3.236159      8.311706       10.61385      -4.931482      3.397955      73.97632 35.71782  37.88417 18.69094  36.09215       40.31270  
1 1 1 23 11 14 o 42.46284 20.55809  -2.959821      3.576271      -5.864756      6.122281      -1.455190      4.406158      49.49623 24.54010  49.74554 23.75243  -0.2493095     34.15252  
1 1 1 23 12 0  o 181.1705 9.479497  22.46642       2.274086      22.46642       2.274086      22.46642       2.274086      181.1705 9.479497  181.1705 9.479497  0.000000       0.000000  
1 1 1 23 12 1  o 46.49919 20.96460  -0.2498565     2.745517      1.898626       4.809959      -1.288140      3.343747      63.68850 28.29897  47.19216 21.95317  16.49634       35.81582  
1 1 1 23 12 2  o 114.4681 11.79146  9.335983       1.772861      0.7845060      4.474903      10.92809       1.930856      59.11308 26.69787  123.8868 11.84025  -64.77377      29.20561  
1 1 1 23 12 3  o 24.63476 12.04995  -2.272343      1.318472      -0.5642382     4.826456      -2.410090      1.370605      56.86217 26.42556  24.94172 12.21808  31.92046       29.11343  
1 1 1 23 12 4  o 94.89547 8.380507  6.230932       1.048836      5.261678       6.790252      6.254622       1.061576      76.07118 33.72190  95.03902 8.471236  -18.96783      34.76965  
1 1 1 23 12 5  o 95.56725 7.047372  6.253945       0.8911361     1.088746       4.318874      6.483628       0.9107338     58.97804 26.46720  97.30580 7.072188  -38.32776      27.39578  
1 1 1 23 12 6  o 57.06742 12.11100  2.392467       0.8924269     6.516182       5.261170      2.270302       0.9055496     79.16585 32.07254  55.39500 12.55852  23.77085       34.44363  
1 1 1 23 12 7  o 85.14748 13.44471  5.342401       1.474876      9.262375       5.689040      5.059957       1.527086      88.72469 34.14192  82.22548 14.46539  6.499207       37.07989  
1 1 1 23 12 8  o 62.06699 16.19515  3.004784       1.353346      9.251377       4.926258      2.494859       1.407501      90.90391 32.33934  56.39925 17.18137  34.50466       36.62010  
1 1 1 23 12 9  o 29.00077 13.44175  -0.7832204     1.236188      -1.663506      7.098365      -0.7556875     1.255371      60.23725 29.11494  29.39456 13.59676  30.84269       32.13334  
1 1 1 23 12 10 f 55.24232 26.58275  -1.928849      5.761807      -9.776940      14.03686      -0.3385637     6.318666      64.17728 32.51868  59.61872 28.46043  4.558563       43.21413  
1 1 1 23 12 11 o 42.08337 20.15986  -2.356712      3.230593      0.000000       0.000000      -2.356712      3.230593      ?        ?         42.08337 20.15986  0.000000       20.15986  
1 1 1 23 12 12 o 50.53039 23.66801  -0.4910097     3.996335      0.000000       0.000000      -0.4910097     3.996335      ?        ?         50.53039 23.66801  0.000000       23.66801  
1 1 1 23 12 13 o 47.66809 23.29469  -3.725192      4.893374      -16.99367      12.54623      -1.344640      5.314245      56.26922 28.72169  53.26763 25.60604  3.001587       38.47863  
1 1 1 23 13 0  o 116.9943 25.11265  11.31669       3.436980      11.31669       3.436980      11.31669       3.436980      116.9943 25.11265  116.9943 25.11265  0.000000       0.000000  
1 1 1 23 13 1  o 119.5856 13.40066  10.42064       2.098712      14.04660       4.477205      9.399536       2.375914      123.2636 27.90957  111.1296 16.54856  12.13404       32.44687  
1 1 1 23 13 2  o 168.2434 9.625957  19.73720       2.149014      18.93607       4.139614      20.03275       2.514369      153.1086 20.82989  168.1148 11.28950  -15.00620      23.69255  
1 1 1 23 13 3  o 104.4891 8.847511  7.592662       1.220304      8.963694       9.082906      7.567459       1.231469      82.71262 37.62560  104.2640 8.950225  -21.55135      38.67547  
1 1 1 23 13 4  o 98.78127 7.133276  6.693032       0.9326146     -1.108662      11.61057      6.743696       0.9356378     70.15208 34.59948  99.15800 7.128770  -29.00591      35.32624  
1 1 1 23 13 5  f 132.0959 4.961578  11.78348       0.8717864     16.09538       5.498022      11.67227       0.8829569     123.2639 32.87154  131.4384 5.050713  -8.174484      33.25730  
1 1 1 23 13 6  o 60.19427 18.30444  2.909794       1.598485      4.056111       5.799090      2.815535       1.662907      69.53341 30.97363  59.17243 18.78085  10.36098       36.22273  
1 1 1 23 13 7  o 135.0104 11.52483  13.06940       2.053557      21.58738       9.080428      12.61027       2.108176      111.4245 43.06607  132.1258 12.10868  -20.70130      44.73596  
1 1 1 23 13 8  o 76.04943 9.463066  4.094713       0.9382759     5.539899       7.691788      4.072884       0.9453357     72.46474 33.56710  75.79285 9.573357  -3.328102      34.90558  
1 1 1 23 13 9  o 56.91454 23.40753  2.383057       2.854347      1.744105       8.698648      2.460157       3.021655      66.22409 32.06200  57.71591 23.94340  8.508183       40.01572  
1 1 1 23 13 10 o 53.21678 25.59934  -1.767596      5.332814      23.28311       17.20087      -4.431515      5.609201      81.97242 40.72574  50.01340 24.54436  31.95902       47.55009  
1 1 1 23 13 11 o 36.70778 18.01546  -4.068147      3.023156      0.000000       0.000000      -4.068147      3.023156      ?        ?         36.70778 18.01546  0.000000       18.01546  
1 1 1 23 13 12 o 97.40778 28.44435  10.05576       3.921426      0.000000       0.000000      10.05576       3.921426      ?        ?         97.40778 28.44435  0.000000       28.44435  
1 1 1 23 14 0  o 103.6975 15.39334  8.003925       1.989386      8.003925       1.989386      8.003925       1.989386      103.6975 15.39334  103.6975 15.39334  0.000000       0.000000  
1 1 1 23 14 1  o 117.7278 10.53547  9.825014       1.635296      9.661382       2.931806      9.898913       1.970259      107.7103 21.18217  116.4677 12.91200  -8.757378      24.80734  
1 1 1 23 14 2  o 126.9565 8.520580  11.18708       1.433097      7.771472       12.84455      11.23014       1.442101      77.45135 37.82593  127.1784 8.559443  -49.72704      38.78228  
1 1 1 23 14 3  o 67.31331 8.938010  3.192806       0.7819119     6.708992       13.88049      3.181613       0.7831555     76.05269 37.56961  67.17961 8.972731  8.873077       38.62622  
1 1 1 23 14 4  o 65.01909 13.49461  3.179527       1.130839      -1.688177      2.793460      4.133574       1.236703      41.12662 19.42545  74.71051 12.88802  -33.58389      23.31200  
1 1 1 23 14 5  o 111.9191 12.42897  9.132132       1.822366      5.097841       5.267439      9.680669       1.942311      71.03928 30.62384  114.8801 12.91146  -43.84083      33.23440  
1 1 1 23 14 6  o 32.36365 15.05190  -0.9316952     1.570570      5.981029       4.903209      -1.722042      1.657924      73.88837 30.56245  30.38640 14.52556  43.50197       33.83867  
1 1 1 23 14 7  o 60.92906 13.31568  2.809855       1.050824      0.5596476      5.737132      2.887966       1.068907      59.17097 27.91505  61.75898 13.37647  -2.588013      30.95448  
1 1 1 23 14 8  o 36.41782 17.38227  -1.963881      2.355085      2.368119       5.094331      -3.141347      2.655933      61.50351 28.05513  35.93760 17.47268  25.56591       33.05125  
1 1 1 23 14 9  o 51.92746 22.79899  1.271891       3.033999      -4.129440      4.670667      5.214804       3.990590      46.29709 22.65312  70.41122 28.13862  -24.11413      36.12404  
1 1 1 23 14 10 o 56.40195 26.26044  0.8424426      4.801074      -0.4098919     15.73544      0.9709939      5.041469      67.32551 34.14791  57.34333 26.76890  9.982174       43.38956  
1 1 1 23 15 0  o 34.64438 17.96745  1.286982       1.072782      1.286982       1.072782      1.286982       1.072782      34.64438 17.96745  34.64438 17.96745  0.000000       0.000000  
1 1 1 23 15 1  o 55.23162 12.93161  2.301038       0.9348562     -0.7424408     2.131819      3.025660       1.040210      38.67252 17.82774  63.64133 12.71131  -24.96881      21.89534  
1 1 1 23 15 2  o 25.73106 11.96414  -0.7023717     0.9913078     7.305463       8.392961      -0.8156647     0.9982956     74.73431 34.77057  25.25269 11.82853  49.48161       36.72747  
1 1 1 23 15 3  o 98.24078 7.294562  6.660245       0.9481009     0.000000       0.000000      6.660245       0.9481009     ?        ?         98.24078 7.294562  0.000000       7.294562  
1 1 1 23 15 4  o 92.72617 13.26203  6.400510       1.592036      4.020439       4.850276      6.687900       1.685415      66.27047 28.96832  94.41699 13.80418  -28.14652      32.08923  
1 1 1 23 15 5  o 26.99776 13.34448  -3.327389      1.760222      0.2329579E-01  5.582660      -3.697269      1.854834      57.38276 27.20944  27.21121 13.49406  30.17155       30.37175  
1 1 1 23 15 6  o 36.27074 14.48305  0.6746463      1.056310      -0.9470486     4.661847      0.7624122      1.084517      52.24698 24.80040  37.31803 14.74797  14.92896       28.85416  
1 1 1 23 15 7  o 63.85506 21.29132  3.584806       2.123280      -0.5052670     7.801512      3.912004       2.206576      60.85424 29.66736  66.25552 21.68912  -5.401272      36.75010  
1 1 1 23 16 0  o 20.80409 13.89669  -0.2465807     1.056823      -0.2465807     1.056823      -0.2465807     1.056823      20.80409 13.89669  20.80409 13.89669  0.000000       0.000000  
1 1 1 23 16 1  o 56.80671 9.960025  2.332205       0.7264611     2.868006       1.113846      1.935566       0.9583430     61.11407 13.98151  50.19164 13.86862  10.92243       19.69318  
1 1 1 23 16 2  o 67.00888 11.70924  3.308357       1.007489      3.806045       2.871772      3.238506       1.075870      64.38058 24.38248  65.72791 12.74398  -1.347328      27.51208  
1 1 1 24 0  0  o 379.2484 18.52762  98.69100       9.311861      98.69100       9.311861      98.69100       9.311861      379.2484 18.52762  379.2484 18.52762  0.000000       0.000000  
1 1 1 24 0  1  o 135.8905 23.09117  14.05556       3.818956      14.05556       3.818956      14.05556       3.818956      135.8905 23.09117  135.8905 23.09117  0.000000       0.000000  
1 1 1 24 0  2  o 38.12060 26.37238  -2.699721      4.569923      -2.699721      4.569923      -2.699721      4.569923      38.12060 26.37238  38.12060 26.37238  0.000000       0.000000  
1 1 1 24 0  3  o 150.7497 30.02521  18.32260       5.355454      18.32260       5.355454      18.32260       5.355454      150.7497 30.02521  150.7497 30.02521  0.000000       0.000000  
1 1 1 24 0  4  o 31.40613 22.28508  -4.440464      3.934352      -4.440464      3.934352      -4.440464      3.934352      31.40613 22.28508  31.40613 22.28508  0.000000       0.000000  
1 1 1 24 0  5  o 151.6240 17.73638  16.60811       3.455384      16.60811       3.455384      16.60811       3.455384      151.6240 17.73638  151.6240 17.73638  0.000000       0.000000  
1 1 1 24 0  6  o 208.7649 31.34230  34.85386       8.139496      34.85386       8.139496      34.85386       8.139496      208.7649 31.34230  208.7649 31.34230  0.000000       0.000000  
1 1 1 24 0  7  f 152.4565 27.87417  18.58450       5.103297      18.58450       5.103297      18.58450       5.103297      152.4565 27.87417  152.4565 27.87417  0.000000       0.000000  
1 1 1 24 0  8  o 35.59230 25.24219  -4.994507      5.024555      -4.994507      5.024555      -4.994507      5.024555      35.59230 25.24219  35.59230 25.24219  0.000000       0.000000  
1 1 1 24 0  9  o 52.49417 35.73327  -0.3040139     7.648467      -0.3040139     7.648467      -0.3040139     7.648467      52.49417 35.73327  52.49417 35.73327  0.000000       0.000000  
1 1 1 24 0  10 o 146.9990 77.38004  51.45549       20.11609      51.45549       20.11609      51.45549       20.11609      146.9990 77.38004  146.9990 77.38004  0.000000       0.000000  
1 1 1 24 0  11 o 124.3082 14.23905  11.11201       2.278512      11.11201       2.278512      11.11201       2.278512      124.3082 14.23905  124.3082 14.23905  0.000000       0.000000  
1 1 1 24 0  12 o 94.86185 13.32898  6.554986       1.589396      6.554986       1.589396      6.554986       1.589396      94.86185 13.32898  94.86185 13.32898  0.000000       0.000000  
1 1 1 24 0  13 o 113.1117 8.677237  8.823045       1.289705      8.823045       1.289705      8.823045       1.289705      113.1117 8.677237  113.1117 8.677237  0.000000       0.000000  
1 1 1 24 0  14 o 58.01732 13.06068  2.629097       0.8811020     2.629097       0.8811020     2.629097       0.8811020     58.01732 13.06068  58.01732 13.06068  0.000000       0.000000  
1 1 1 24 0  15 o 64.87553 19.89882  3.725054       1.503543      3.725054       1.503543      3.725054       1.503543      64.87553 19.89882  64.87553 19.89882  0.000000       0.000000  
1 1 1 24 0  16 o 47.21106 24.52185  2.607702       2.000323      2.607702       2.000323      2.607702       2.000323      47.21106 24.52185  47.21106 24.52185  0.000000       0.000000  
1 1 1 24 0  17 o 83.20235 10.25768  4.959833       1.090908      4.959833       1.090908      4.959833       1.090908      83.20235 10.25768  83.20235 10.25768  0.000000       0.000000  
1 1 1 24 1  0  o 64.22618 32.86634  4.662818       3.558454      4.662818       3.558454      4.662818       3.558454      64.22618 32.86634  64.22618 32.86634  0.000000       0.000000  
1 1 1 24 1  1  o 81.35400 21.82841  5.153593       2.415281      5.028471       2.912488      5.429134       4.322057      79.47042 24.80529  82.01636 30.13682  -2.545937      39.03242  
1 1 1 24 1  2  o 85.27803 25.48338  5.893154       3.117769      2.920382       6.243718      6.880621       3.598519      76.25722 33.10646  90.96083 27.42270  -14.70361      42.98886  
1 1 1 24 1  3  o 183.3785 22.03363  25.66516       5.276320      24.09055       6.792021      28.06165       8.379142      167.1072 31.66079  172.7357 37.48264  -5.628433      49.06479  
1 1 1 24 1  4  o 51.89514 22.50673  0.4235162      2.879570      -1.947265      3.626346      4.469728       4.737484      49.10655 22.84991  77.36441 30.74406  -28.25786      38.30556  
1 1 1 24 1  5  o 168.2364 13.93637  20.07508       3.096224      19.19006       3.201745      32.84190       12.16050      163.8179 14.82776  157.7041 50.86448  6.113739       52.98167  
1 1 1 24 1  6  o 176.0521 9.402278  21.28494       2.197707      0.000000       0.000000      21.28494       2.197707      ?        ?         176.0521 9.402278  0.000000       9.402278  
1 1 1 24 1  7  o 179.5995 14.91962  23.21972       3.538348      18.50184       8.595955      24.18219       3.882530      123.8285 42.81936  182.1481 16.16385  -58.31965      45.76863  
1 1 1 24 1  8  o 51.51178 23.10842  -0.1396890     3.289056      -0.3490633     3.746676      0.5637913      6.867686      53.62074 24.30231  68.90829 31.84875  -15.28754      40.06176  
1 1 1 24 1  9  o 55.25841 21.68112  1.933716       2.329024      1.215977       2.452689      8.517617       7.428496      51.74007 21.52707  88.68932 37.22216  -36.94925      42.99889  
1 1 1 24 1  10 o 133.4220 15.72242  13.16992       2.741640      3.088461       16.21482      13.46662       2.781691      81.96329 40.51088  134.8872 15.77371  -52.92390      43.47345  
1 1 1 24 1  11 o 119.7437 9.375438  9.967410       1.484033      18.31887       2.644815      6.129716       1.792871      160.1361 12.49340  90.50639 15.41825  69.62974       19.84459  
1 1 1 24 1  12 o 43.65570 13.50870  1.390393       0.8658573     1.873258       1.247001      0.9408636      1.203188      50.09163 16.29876  40.56957 15.67752  9.522060       22.61491  
1 1 1 24 1  13 o 134.8213 6.002572  12.34275       1.075670      15.48242       1.916685      10.89922       1.299636      148.8316 9.717705  125.8643 7.787129  22.96725       12.45284  
1 1 1 24 1  14 o 31.14447 13.61653  -0.3243445E-01 1.072094      1.151023       1.452229      -1.449974      1.589375      43.82801 17.14276  30.72621 14.55448  13.10180       22.48793  
1 1 1 24 1  15 o 88.72421 3.748515  5.294710       0.4421762     7.376355       0.6924827     3.861665       0.5745602     104.3889 4.992771  75.23225 5.775532  29.15670       7.634431  
1 1 1 24 1  16 o 37.23122 14.21564  0.8410666      0.9811026     -1.874870      1.239286      5.401349       1.605859      24.48265 11.91063  83.83054 14.92287  -59.34789      19.09333  
1 1 1 24 1  17 o 23.90149 11.69897  -2.077447      1.248905      0.5698387E-01  1.653558      -4.912039      1.905565      37.57692 16.65016  25.32816 12.72643  12.24876       20.95686  
1 1 1 24 2  0  o 146.5317 22.31018  16.11463       4.057153      16.11463       4.057153      16.11463       4.057153      146.5317 22.31018  146.5317 22.31018  0.000000       0.000000  
1 1 1 24 2  1  o 53.36359 23.80978  -0.2427306     3.441391      -0.4583674     4.786376      -0.1195422E-01 4.951550      60.64767 27.47950  62.74107 28.23245  -2.093399      39.39790  
1 1 1 24 2  2  o 81.07023 27.53042  5.358120       3.549314      3.013688       5.802816      6.759509       4.486411      75.02259 32.23938  88.66633 30.91892  -13.64374      44.66942  
1 1 1 24 2  3  o 195.9427 9.485709  26.29702       2.469337      25.11061       5.155404      26.65024       2.813015      181.4322 21.75779  196.4784 10.78581  -15.04625      24.28446  
1 1 1 24 2  4  o 220.7158 13.41692  34.28958       3.927384      33.01675       4.468784      38.60851       8.231764      214.4283 15.74977  213.9623 29.66974  0.4660339      33.59091  
1 1 1 24 2  5  o 90.79520 28.59418  7.135012       3.861507      3.056768       4.368921      21.69637       8.255409      69.91486 28.87742  142.5137 41.17075  -72.59886      50.28853  
1 1 1 24 2  6  o 126.8468 13.55883  11.46116       2.256289      13.02370       3.067477      9.619190       3.330473      132.3410 17.84921  109.3248 23.55749  23.01614       29.55588  
1 1 1 24 2  7  o 59.95850 18.02759  2.723924       1.556697      3.893072       1.828205      -0.3588968     2.968686      70.89735 18.97712  48.72963 21.89963  22.16771       28.97801  
1 1 1 24 2  8  o 119.3892 18.01750  10.76130       2.777230      9.054235       3.536982      13.50593       4.484861      103.0254 25.81849  124.6686 27.71499  -21.64314      37.87763  
1 1 1 24 2  9  o 132.7747 20.79003  13.86356       3.557660      15.24203       4.075033      9.445387       7.295497      136.9116 23.16175  91.35403 37.48070  45.55755       44.05984  
1 1 1 24 2  10 o 101.8589 15.03192  7.666165       1.979030      31.06043       10.69828      6.837254       2.013786      145.2464 47.76880  95.19427 16.47157  50.05209       50.52891  
1 1 1 24 2  11 o 67.08850 15.70779  3.430592       1.379330      0.6511724      7.141093      3.538306       1.405803      66.96019 31.45088  68.11138 15.79647  -1.151192      35.19498  
1 1 1 24 2  12 o 89.05874 9.182627  5.538737       1.074121      11.46872       2.178904      3.635051       1.234551      125.7600 13.19880  69.94337 13.73652  55.81659       19.04994  
1 1 1 24 2  13 o 63.14189 9.398718  2.821394       0.7667188     -3.878418      1.670679      4.608949       0.8629612     25.03072 12.47752  81.54640 8.046432  -56.51569      14.84700  
1 1 1 24 2  14 o 90.01946 7.045673  5.568503       0.8384184     8.492286       1.301287      3.493326       1.096297      110.3330 8.927217  68.90144 12.39636  41.43158       15.27628  
1 1 1 24 2  15 o 48.73675 13.75849  1.806054       0.9324046     2.133932       1.103713      0.9888291      1.742489      52.49697 15.01916  44.24014 18.25146  8.256828       23.63664  
1 1 1 24 2  16 o 92.00188 7.713594  5.877568       0.9369447     10.71697       1.770360      3.994694       1.104272      122.0684 11.00184  73.82019 11.60890  48.24824       15.99397  
1 1 1 24 2  17 o 29.13453 12.46025  0.1303248      0.8591679     3.432518       1.177332      -3.631719      1.256636      67.00742 13.64974  20.16090 10.15677  46.84652       17.01398  
1 1 1 24 3  0  o 41.71338 25.53953  1.341580       2.712332      1.341580       2.712332      1.341580       2.712332      41.71338 25.53953  41.71338 25.53953  0.000000       0.000000  
1 1 1 24 3  1  o 202.1360 12.58734  28.55170       3.373577      30.34476       5.994493      27.72057       4.081234      198.0180 23.15487  196.6523 15.70509  1.365723       27.97853  
1 1 1 24 3  2  o 210.1542 14.51003  31.34339       4.038364      31.85204       6.127784      30.95287       5.369302      202.8061 23.08555  203.3156 20.08055  -0.5094299     30.59692  
1 1 1 24 3  3  o 61.42698 22.45453  2.647393       2.394567      6.173310       3.394535      -0.8450414     3.378380      86.04068 26.76760  50.57072 22.98191  35.46996       35.27991  
1 1 1 24 3  4  f 40.76433 18.33061  -0.5597757     2.083304      -0.7493059     2.603782      -0.2225826     3.473000      44.77831 20.28060  53.16906 23.80691  -8.390751      31.27414  
1 1 1 24 3  5  f 143.0603 24.74902  16.50447       4.547225      16.07781       5.510402      17.41515       8.050613      133.9699 31.41548  124.1991 41.45952  9.770798       52.01753  
1 1 1 24 3  6  f 144.3498 19.76971  15.86524       3.702878      10.82644       4.597673      25.16725       6.246869      109.2018 30.45378  172.1545 28.20745  -62.95277      41.51016  
1 1 1 24 3  7  o 103.2248 33.25969  10.45826       5.200324      5.552664       7.562437      14.85881       7.162580      82.14131 36.03174  114.9107 39.10760  -32.76939      53.17603  
1 1 1 24 3  8  o 75.80687 27.53863  4.921082       3.593638      1.728498       6.954722      6.083994       4.197416      71.01498 32.53952  81.82889 29.75700  -10.81390      44.09421  
1 1 1 24 3  9  o 42.91464 17.01852  0.9484811      1.448801      -0.5240813     4.680111      1.104555       1.523646      57.24078 26.39739  44.70418 17.53739  12.53661       31.69199  
1 1 1 24 3  10 o 109.9287 12.26448  8.643364       1.765959      8.958592       7.522082      8.624976       1.816735      87.45962 37.11826  109.5599 12.67786  -22.10028      39.22363  
1 1 1 24 3  11 o 36.88419 16.68744  -0.4982985     1.757268      -6.373606      5.759717      0.1047288      1.845246      50.50740 24.80390  40.72831 17.83389  9.779095       30.54965  
1 1 1 24 3  12 o 63.00389 11.02238  2.860944       0.8916870     1.477522       1.871511      3.267219       1.014203      49.08382 19.38115  67.09615 11.77282  -18.01234      22.67660  
1 1 1 24 3  13 o 79.61077 9.776555  4.476851       1.015375      4.128101       1.444161      4.817789       1.427892      73.59126 15.22939  80.50874 13.80680  -6.917480      20.55632  
1 1 1 24 3  14 o 22.98959 11.23138  -1.908509      1.135097      -2.451838      1.362195      -0.6741402     2.053196      24.53469 12.05160  38.51166 17.65891  -13.97697      21.37938  
1 1 1 24 3  15 o 44.00624 13.32967  1.450024       0.8488212     0.5819083      1.401364      1.953090       1.066781      38.81361 16.21981  50.31731 14.87447  -11.50370      22.00755  
1 1 1 24 3  16 o 48.26744 12.33707  1.757050       0.7963976     0.9518431      0.9236814     4.089679       1.572141      37.94104 13.93357  71.29298 16.82229  -33.35195      21.84339  
1 1 1 24 3  17 o 38.25184 15.47097  0.7580093      1.221865      0.1957413      1.258238      10.06360       5.118738      34.45670 14.91077  87.20955 32.65509  -52.75285      35.89827  
1 1 1 24 4  0  o 53.93470 33.13326  2.700569       4.600190      2.700569       4.600190      2.700569       4.600190      53.93470 33.13326  53.93470 33.13326  0.000000       0.000000  
1 1 1 24 4  1  o 115.6475 16.63896  9.793148       2.490397      11.38947       4.106990      8.864855       3.131887      117.0006 26.90505  105.8799 22.86798  11.12071       35.31043  
1 1 1 24 4  2  o 210.5584 12.06967  30.93411       3.372238      30.99676       4.163754      30.81468       5.749146      208.1436 15.11534  200.2646 21.90061  7.879044       26.61034  
1 1 1 24 4  3  o 141.8634 12.05748  14.10073       2.257719      15.89072       2.934671      11.50496       3.534002      148.7135 15.01474  120.8182 22.78670  27.89530       27.28876  
1 1 1 24 4  4  o 150.9588 20.57046  17.41985       4.030321      14.48899       6.257141      19.49802       5.268886      120.5908 36.11673  153.4993 26.73029  -32.90855      44.93246  
1 1 1 24 4  5  o 105.5004 17.23395  8.294890       2.339203      6.901122       4.182829      8.929156       2.821696      87.75574 29.88522  107.3169 20.47882  -19.56112      36.22856  
1 1 1 24 4  6  f 117.2961 27.97597  11.96690       4.311072      13.24107       5.377186      9.674176       7.212998      117.5797 32.98697  94.72580 37.83890  22.85390       50.19883  
1 1 1 24 4  7  o 64.24662 24.88537  2.986289       3.036839      2.124754       3.289523      7.956611       7.901122      60.65110 25.05494  87.76633 37.66600  -27.11523      45.23801  
1 1 1 24 4  8  o 182.7400 12.02099  23.57648       2.910912      19.67986       9.194750      24.01052       3.068755      119.2362 43.93192  183.9167 12.59790  -64.68045      45.70252  
1 1 1 24 4  9  o 143.9609 13.13843  14.87704       2.492606      23.02189       14.06611      14.61299       2.532689      105.5692 47.53751  142.3800 13.51102  -36.81083      49.42027  
1 1 1 24 4  10 o 37.74255 14.81701  0.7295223      1.088284      -2.402318      3.517705      1.061003       1.144429      45.41375 21.55286  41.36389 15.45030  4.049866       26.51863  
1 1 1 24 4  11 o 26.01526 12.52990  -1.711006      1.286924      -6.049079      4.210290      -1.263934      1.351612      42.59542 20.97506  28.62510 13.51804  13.97032       24.95377  
1 1 1 24 4  12 o 158.8631 8.256227  17.40099       1.741748      20.95417       6.075535      17.08282       1.818060      144.0294 32.43850  157.0967 8.719158  -13.06729      33.58987  
1 1 1 24 4  13 o 88.63113 5.460517  5.331491       0.6417708     6.414413       2.110452      5.221148       0.6736741     89.83174 18.25401  87.60188 5.803881  2.229866       19.15448  
1 1 1 24 4  14 o 69.50568 12.15304  3.552010       1.084625      6.629233       1.918447      2.106308       1.314952      92.61817 16.13043  52.05874 16.72011  40.55943       23.23258  
1 1 1 24 4  15 o 36.48978 14.63970  0.6621791      1.084540      0.7796348      1.093090      -6.758393      8.688352      37.61993 14.82510  56.65186 28.27389  -19.03194      31.92486  
1 1 1 24 4  16 o 51.58213 12.28828  2.005856       0.8325287     -0.4164470     1.162316      4.557872       1.193031      29.64250 13.47461  78.78663 11.72022  -49.14413      17.85858  
1 1 1 24 4  17 o 29.70437 14.21126  -1.622099      1.594019      -0.2000865     1.798387      -6.833678      3.442834      37.53219 16.94041  34.98195 17.50978  2.550240       24.36329  
1 1 1 24 5  0  f 50.85874 30.68240  2.509568       3.792426      2.509568       3.792426      2.509568       3.792426      50.85874 30.68240  50.85874 30.68240  0.000000       0.000000  
1 1 1 24 5  1  o 51.13457 21.88070  0.6875422      2.651925      4.967088       3.380084      -6.164698      4.277056      77.60797 26.85008  44.28574 21.67079  33.32224       34.50434  
1 1 1 24 5  2  o 38.75835 17.44771  -0.5500779     1.893303      -1.148397      2.455405      0.3273228      2.973415      41.83678 19.23061  51.69004 22.63598  -9.853264      29.70191  
1 1 1 24 5  3  o 173.3357 15.01481  21.62968       3.433849      22.72984       5.307878      20.83782       4.503139      168.1770 24.39682  164.5054 21.02264  3.671585       32.20491  
1 1 1 24 5  4  o 127.2142 17.36536  12.02970       2.866929      10.89920       5.294419      12.49871       3.410166      105.8452 33.50106  126.9272 20.88865  -21.08205      39.47983  
1 1 1 24 5  5  o 63.60342 20.12589  3.128916       1.910893      2.624128       2.008898      7.927007       6.193528      59.43515 20.69195  89.25823 35.25344  -29.82308      40.87740  
1 1 1 24 5  6  o 56.97994 23.73762  1.639058       2.987804      1.639058       2.987804      0.000000       0.000000      56.97994 23.73762  ?        ?         0.000000       23.73762  
1 1 1 24 5  7  o 60.96337 26.95056  1.228180       4.308121      1.476443       5.120444      0.6265742      7.970916      64.74050 28.95351  70.77625 33.23845  -6.035751      44.08061  
1 1 1 24 5  8  o 132.8746 12.42050  12.58290       2.173667      20.39411       5.919400      11.36544       2.336930      147.6633 31.06932  124.9427 14.29352  22.72054       34.19952  
1 1 1 24 5  9  o 145.9948 11.02687  15.00301       2.129318      10.65098       15.54365      15.08624       2.149583      86.76351 42.20346  146.3453 11.10597  -59.58181      43.64029  
1 1 1 24 5  10 o 149.2328 7.609565  15.25465       1.508209      10.02936       4.519337      15.90953       1.599932      99.98501 30.84906  152.2416 7.913857  -52.25658      31.84797  
1 1 1 24 5  11 o 150.4011 5.329062  15.28795       1.066322      14.18905       6.903476      15.31481       1.079275      104.7111 38.14952  150.5087 5.390122  -45.79765      38.52843  
1 1 1 24 5  12 o 186.3384 4.490274  23.36220       1.114933      21.25278       7.507451      23.40978       1.127435      128.3237 39.78903  186.5092 4.536469  -58.18544      40.04680  
1 1 1 24 5  13 o 23.60307 11.54467  -2.060414      1.209726      -5.625321      1.728875      1.359300       1.693302      22.55066 11.42490  46.79727 18.44862  -24.24661      21.69977  
1 1 1 24 5  14 o 27.04974 12.77497  -1.100049      1.207487      -1.261804      1.218317      7.877510       9.076356      26.52013 12.61418  75.96606 35.60970  -49.44594      37.77789  
1 1 1 24 5  15 o 97.21630 8.067399  6.581580       1.035669      6.763403       1.554757      6.436542       1.388600      95.80972 12.47399  94.24545 11.28099  1.564262       16.81848  
1 1 1 24 5  16 o 42.53184 16.42960  1.178628       1.321030      0.6517674      1.398195      5.560462       4.032254      38.95994 16.23514  71.29455 28.35330  -32.33461      32.67245  
1 1 1 24 6  0  o 28.64236 19.85964  -1.825759      2.628520      -1.825759      2.628520      -1.825759      2.628520      28.64236 19.85964  28.64236 19.85964  0.000000       0.000000  
1 1 1 24 6  1  o 181.8566 13.28167  23.46060       3.196320      26.64675       3.987472      17.73325       5.346151      191.5444 15.76199  142.7419 29.09523  48.80241       33.09037  
1 1 1 24 6  2  o 73.24312 21.85471  4.292667       2.294389      5.375175       3.422595      3.409162       3.092037      79.41872 27.03353  67.25695 25.33841  12.16177       37.05194  
1 1 1 24 6  3  o 57.55188 24.08714  1.594676       3.097608      5.301053       6.219447      0.3719937      3.572183      80.01665 33.84619  55.10568 24.44179  24.91097       41.74884  
1 1 1 24 6  4  o 199.5822 17.06741  29.47904       4.495506      30.86543       7.336632      28.64557       5.688509      185.5530 30.74849  189.3847 23.01313  -3.831680      38.40668  
1 1 1 24 6  5  o 108.3391 20.62586  9.238494       2.868900      8.757528       2.959444      16.73980       11.68751      104.3262 21.98310  103.4611 45.10118  0.8650360      50.17343  
1 1 1 24 6  6  o 100.1032 27.31832  8.935912       3.744859      7.299296       4.339699      13.70858       7.410830      87.54033 30.41632  106.0025 39.37056  -18.46219      49.75132  
1 1 1 24 6  7  o 114.5057 14.23202  9.557240       2.124808      10.35478       6.329718      9.455956       2.255698      95.48031 36.19013  113.1186 15.36147  -17.63828      39.31540  
1 1 1 24 6  8  o 105.7539 12.10448  7.993475       1.675056      8.819646       6.664917      7.937772       1.730604      88.00132 35.93200  105.0850 12.61062  -17.08367      38.08065  
1 1 1 24 6  9  o 126.8824 7.411711  11.01947       1.247666      17.27065       7.293253      10.83101       1.266334      117.1439 39.46553  125.7057 7.595399  -8.561806      40.18977  
1 1 1 24 6  10 o 107.3751 7.059640  7.888188       1.004486      13.20060       10.51210      7.839234       1.009103      90.69966 40.94566  107.0174 7.116757  -16.31778      41.55954  
1 1 1 24 6  11 o 73.89107 13.65666  4.056962       1.295133      -2.923938      7.257920      4.286561       1.316259      60.03146 29.11656  76.09974 13.47330  -16.06828      32.08277  
1 1 1 24 6  12 o 68.71212 19.00671  3.856206       1.798895      -0.7976291     6.095186      4.300251       1.882761      59.30916 28.21139  72.47877 19.19372  -13.16961      34.12157  
1 1 1 24 6  13 o 39.07907 14.86984  0.9349931      1.071134      -9.019174      5.409522      1.341198       1.092771      44.15015 22.07639  43.40234 15.25043  0.7478065      26.83174  
1 1 1 24 6  14 o 39.01720 14.37582  1.003317       0.9845711     -0.6467335     1.566875      2.079919       1.265649      33.49670 15.38417  51.52009 16.38853  -18.02339      22.47791  
1 1 1 24 6  15 o 36.28154 15.99022  0.5992546E-01  1.505567      -0.9011749E-01 1.738282      0.5104634      3.012161      37.69750 16.86371  48.81128 21.98729  -11.11378      27.70967  
1 1 1 24 6  16 o 24.84221 11.74448  -0.9599265     1.025435      -1.186821      1.096673      0.6182520      2.892302      24.90882 11.88141  48.31130 21.67149  -23.40248      24.71480  
1 1 1 24 7  0  o 192.9128 16.37148  26.50182       4.136028      26.50182       4.136028      26.50182       4.136028      192.9128 16.37148  192.9128 16.37148  0.000000       0.000000  
1 1 1 24 7  1  o 79.90266 24.77737  5.394166       2.911157      5.382288       3.465974      5.422619       5.364182      78.79659 27.19245  79.02765 32.24785  -0.2310562     42.18238  
1 1 1 24 7  2  o 135.0293 17.99361  13.75416       3.157062      14.79529       4.335453      12.57885       4.606373      132.9444 25.39900  117.8409 29.42606  15.10351       38.87161  
1 1 1 24 7  3  f 117.6125 15.75604  10.20364       2.407240      10.52137       8.140918      10.17320       2.519926      94.05785 39.18349  116.7916 16.66409  -22.73376      42.57978  
1 1 1 24 7  4  o 73.59393 24.74718  4.558633       2.867774      3.452089       3.480949      6.896327       5.059494      67.33670 26.48009  84.31314 32.26005  -16.97644      41.73615  
1 1 1 24 7  5  o 51.83332 22.42217  0.7978669      2.843168      1.109372       2.956507      -3.032926      10.36789      53.86525 23.07731  70.17702 34.20977  -16.31177      41.26585  
1 1 1 24 7  6  o 88.63935 15.18309  5.845541       1.728857      4.506187       4.433306      6.085757       1.877504      72.95324 29.48248  89.80239 16.28959  -16.84915      33.68333  
1 1 1 24 7  7  o 33.59071 13.88284  0.3550987      1.010601      1.048416       5.608511      0.3318322      1.027418      63.98946 29.28307  33.60144 13.95251  30.38802       32.43718  
1 1 1 24 7  8  o 116.4083 9.009363  9.400040       1.386630      4.025504       8.443004      9.549026       1.405718      75.14875 34.93309  117.3044 9.063362  -42.15564      36.08968  
1 1 1 24 7  9  o 23.91620 11.66195  -1.986784      1.207275      1.918427       20.01474      -2.001044      1.209477      79.05191 39.91263  23.90185 11.65883  55.15006       41.58060  
1 1 1 24 7  10 f 157.6454 6.884284  16.96265       1.442664      12.18374       3.806147      17.76441       1.558993      117.7193 25.03507  161.1082 7.280756  -43.38899      26.07228  
1 1 1 24 7  11 o 82.97800 7.010361  4.731175       0.7678890     -4.950165      7.078735      4.846457       0.7724473     56.25860 27.60178  84.00627 6.963047  -27.74767      28.46651  
1 1 1 24 7  12 o 110.4050 11.82705  8.802343       1.712875      12.02459       6.586200      8.568591       1.773916      93.12988 36.48359  108.4339 12.50589  -15.30404      38.56747  
1 1 1 24 7  13 o 35.65670 16.04475  -0.2772365     1.599173      4.879783       5.130443      -0.8322053     1.683022      69.60793 30.11554  33.99271 15.73055  35.61521       33.97640  
1 1 1 24 7  14 o 73.36406 19.12746  4.526291       1.888795      4.735332       2.134571      3.772120       4.054436      73.62753 20.82832  64.33444 27.27524  9.293091       34.31848  
1 1 1 24 7  15 o 66.55980 15.39577  3.494699       1.338302      3.288284       1.502619      4.286670       2.943280      63.30132 17.31662  66.65130 24.80075  -3.349979      30.24801  
1 1 1 24 8  0  o 45.97038 29.95651  0.9967403      4.454315      0.9967403      4.454315      0.9967403      4.454315      45.97038 29.95651  45.97038 29.95651  0.000000       0.000000  
1 1 1 24 8  1  o 61.66015 23.20979  2.830871       2.593109      5.560407       3.286331      -1.672340      4.221124      79.44341 26.48832  52.00443 24.34750  27.43898       35.97821  
1 1 1 24 8  2  o 98.94553 27.21919  8.777349       3.700712      6.488957       8.617548      9.294795       4.097806      82.32137 37.12632  99.91746 29.04846  -17.59609      47.13997  
1 1 1 24 8  3  o 70.40797 25.79191  4.146310       3.161803      2.716282       3.382921      14.02495       8.891357      63.02796 25.65035  100.4984 41.32064  -37.47040      48.63472  
1 1 1 24 8  4  o 80.23017 27.08182  5.808380       3.434309      7.916070       4.358748      2.357743       5.577095      89.93156 30.50890  67.69421 30.24980  22.23735       42.96328  
1 1 1 24 8  5  o 61.13845 28.28375  0.6586955E-01  5.434700      -2.316681      6.456183      5.859466       10.06767      60.02386 28.68521  80.44794 37.64389  -20.42408      47.32762  
1 1 1 24 8  6  f 85.07836 27.44350  6.710233       3.539918      13.41413       4.324748      -6.899773      6.162063      122.3702 27.22472  51.75544 25.46410  70.61476       37.27742  
1 1 1 24 8  7  o 46.43906 15.28603  1.569264       1.095417      5.145836       3.673324      1.220160       1.147633      75.00375 27.74406  42.89790 15.56547  32.10585       31.81221  
1 1 1 24 8  8  o 36.11378 15.58847  0.1495998      1.368351      -7.903212      8.162829      0.3824303      1.387992      57.29496 28.39429  37.85937 16.00045  19.43559       32.59218  
1 1 1 24 8  9  o 58.16619 27.20728  -0.3370705     5.250782      -0.8080582     7.105355      0.2296007      7.793751      62.85565 30.05328  66.06369 31.55665  -3.208038      43.57777  
1 1 1 24 8  10 o 100.1913 6.953312  6.880859       0.9225553     -16.96843      12.84213      7.004577       0.9249451     60.42076 30.66714  101.1108 6.906540  -40.69001      31.43523  
1 1 1 24 8  11 o 121.3142 9.731938  10.35389       1.560015      0.9185717      3.702894      12.38995       1.720119      54.56425 24.49516  132.7202 9.795328  -78.15593      26.38108  
1 1 1 24 8  12 o 20.75960 10.47727  -4.140035      1.371451      -1.112389      5.533856      -4.338160      1.415613      55.67142 26.59209  20.95244 10.58302  34.71899       28.62062  
1 1 1 24 8  13 o 92.29804 8.926492  5.991740       1.084174      7.528831       4.960636      5.914636       1.111033      78.76781 31.40790  91.53032 9.235551  -12.76251      32.73762  
1 1 1 24 8  14 o 41.96982 19.30334  -0.4816917     2.479169      4.603108       5.763412      -1.636175      2.746228      67.22282 30.33537  40.23666 19.08057  26.98616       35.83717  
1 1 1 24 9  0  o 99.15547 40.95001  11.46724       5.366785      11.46724       5.366785      11.46724       5.366785      99.15547 40.95001  99.15547 40.95001  0.000000       0.000000  
1 1 1 24 9  1  o 76.25388 23.17818  4.927837       2.563402      5.820398       3.577115      3.985619       3.675273      79.71494 27.61941  69.48483 27.24387  10.23010       38.79510  
1 1 1 24 9  2  f 109.5580 34.16632  12.79743       5.526805      19.56363       15.08735      11.74874       5.939679      96.60831 45.48194  101.8873 35.57285  -5.279022      57.74110  
1 1 1 24 9  3  o 76.78194 26.06157  5.251644       3.180643      9.318904       4.173754      -0.3819664     4.912124      98.41338 29.50268  57.88086 26.81613  40.53252       39.86870  
1 1 1 24 9  4  o 65.64462 25.24041  3.454684       3.107521      1.601721       3.591975      8.967838       6.195836      58.29613 25.21016  88.58537 35.17334  -30.28924      43.27489  
1 1 1 24 9  5  o 55.59881 24.70360  0.8309878      3.665079      -1.863756      8.016229      1.543166       4.121029      64.65058 31.17173  59.94418 26.43551  4.706398       40.87191  
1 1 1 24 9  6  o 147.5988 27.32332  19.56825       5.176033      20.42211       6.167860      17.53503       9.517714      141.6451 33.25140  103.6879 42.70411  37.95724       54.12297  
1 1 1 24 9  7  o 74.20440 12.30931  4.010559       1.174500      14.96305       4.861937      3.331803       1.210346      124.7416 29.68216  66.65860 14.06900  58.08302       32.84764  
1 1 1 24 9  8  o 126.3844 5.367853  10.81007       0.9019395     -3.738418      10.93584      10.90971       0.9050229     66.69944 33.02123  126.9689 5.361264  -60.26946      33.45362  
1 1 1 24 9  9  f 67.14946 12.02790  3.301192       1.036705      -5.758954      7.251382      3.490240       1.047465      55.64214 27.42407  69.20784 11.77984  -13.56570      29.84701  
1 1 1 24 9  10 o 69.34328 16.16652  3.766230       1.466150      6.208705       13.15612      3.735514       1.475340      74.96601 36.94639  68.96487 16.31166  6.001137       40.38696  
1 1 1 24 9  11 o 44.58966 18.63762  0.9379020      1.850894      13.08494       5.649994      -0.5223906     1.958992      101.7566 34.73162  38.03874 17.36910  63.71781       38.83260  
1 1 1 24 9  12 o 27.70046 12.93487  -0.8501840     1.178527      -11.07153      9.533733      -0.6915674     1.187636      54.90116 27.69801  28.60106 13.22800  26.30010       30.69462  
1 1 1 24 9  13 o 36.50991 17.01877  -0.9901437     2.025886      10.73791       5.671565      -2.705407      2.168979      88.14838 34.04475  32.61338 15.84115  55.53500       37.54979  
1 1 1 24 10 0  o 72.69021 34.16596  6.312232       3.718428      6.312232       3.718428      6.312232       3.718428      72.69021 34.16596  72.69021 34.16596  0.000000       0.000000  
1 1 1 24 10 1  o 78.59550 27.83432  5.778301       3.645700      6.778233       5.350039      4.911459       4.981286      80.94424 32.50135  73.80962 30.69140  7.134621       44.70235  
1 1 1 24 10 2  o 139.5259 20.95754  15.67054       3.776142      17.05253       4.495096      12.35671       6.960678      140.9880 24.83354  98.13651 37.76495  42.85145       45.19841  
1 1 1 24 10 3  o 85.44165 37.05430  9.121971       7.804514      14.03069       10.01754      1.541177       12.44900      93.48509 41.22200  74.91848 36.72533  18.56661       55.20872  
1 1 1 24 10 4  o 136.9339 13.87114  13.70506       2.496151      6.134117       9.299578      14.29287       2.591241      78.21813 36.46146  139.6420 14.11952  -61.42384      39.09986  
1 1 1 24 10 5  o 57.68037 17.01144  2.594870       1.396663      2.154120       2.928753      2.724607       1.588980      57.55534 23.69500  58.73360 18.32030  -1.178265      29.95140  
1 1 1 24 10 6  o 64.42843 26.26915  3.286073       3.556036      -2.767322      4.687569      11.49236       5.457849      50.57899 24.24409  99.86365 34.13472  -49.28466      41.86831  
1 1 1 24 10 7  o 125.1089 30.18771  15.51488       4.974379      21.47724       6.403696      6.442984       7.898977      140.8338 34.41918  76.52461 34.91758  64.30922       49.02976  
1 1 1 24 10 8  o 56.47298 15.53421  2.475337       1.205398      2.477678       3.247263      2.474962       1.298149      59.23055 24.71656  56.21055 16.35198  3.020004       29.63605  
1 1 1 24 10 9  o 89.79707 14.95658  6.130539       1.726731      1.971581       7.801891      6.344752       1.770642      66.36483 31.66538  91.28816 15.08225  -24.92333      35.07378  
1 1 1 24 10 10 o 37.93592 12.94142  1.009951       0.7844250     -2.467981      8.057725      1.043228       0.7881687     59.96791 29.42715  38.39193 12.97379  21.57598       32.16017  
1 1 1 24 10 11 o 40.16626 16.33355  0.8208038      1.370448      6.377475       16.10739      0.7802861      1.375435      72.06265 36.31166  39.89958 16.31109  32.16307       39.80688  
1 1 1 24 10 12 o 38.92458 18.70470  -2.386745      2.829985      -2.909370      6.170666      -2.247542      3.184650      53.67377 26.21432  41.70857 19.98980  11.96520       32.96639  
1 1 1 24 11 0  o 64.94985 41.44579  6.220490       7.959599      6.220490       7.959599      6.220490       7.959599      64.94985 41.44579  64.94985 41.44579  0.000000       0.000000  
1 1 1 24 11 1  o 52.08001 20.61879  1.762700       2.123316      10.85780       9.888616      1.323092       2.174026      85.51715 39.03904  49.62170 20.42041  35.89545       44.05723  
1 1 1 24 11 2  o 93.08216 21.01994  7.176664       2.545319      7.326303       2.784729      6.416938       6.274637      92.45207 22.75945  77.59428 33.43642  14.85779       40.44733  
1 1 1 24 11 3  o 57.94792 16.43008  2.616452       1.326723      3.486654       2.748663      2.352132       1.514874      64.47492 23.97142  54.97943 17.96930  9.495487       29.95872  
1 1 1 24 11 4  o 30.58960 14.46322  -1.390793      1.555943      -5.660203      10.81320      -1.300525      1.572306      64.39216 32.04105  31.13276 14.66482  33.25940       35.23756  
1 1 1 24 11 5  o 99.96119 8.409128  6.940635       1.109722      9.776606       4.276261      6.735858       1.149089      97.22203 30.00996  98.24090 8.873402  -1.018867      31.29433  
1 1 1 24 11 6  o 66.36710 26.35235  3.894244       3.477970      -2.055588      5.851739      7.143992       4.324715      55.86553 26.85871  81.61134 30.11877  -25.74581      40.35505  
1 1 1 24 11 7  o 74.37202 27.73741  5.538306       3.685695      5.984457       4.475724      4.598341       6.496483      75.08886 29.86868  70.21571 31.89371  4.873154       43.69608  
1 1 1 24 11 8  o 130.8069 12.21536  12.43676       2.104550      10.67509       5.866667      12.69694       2.254615      89.60423 34.62046  131.4237 13.04640  -41.81946      36.99709  
1 1 1 24 11 9  o 129.0123 9.086755  11.67141       1.552124      5.327693       9.762262      11.83593       1.572122      71.11652 34.31672  129.8829 9.142053  -58.76638      35.51358  
1 1 1 24 11 10 o 45.03548 16.30181  1.465593       1.257788      19.34747       10.37340      1.198773       1.267137      91.66820 41.08731  42.57344 16.17940  49.09476       44.15813  
1 1 1 24 11 11 o 78.52856 27.47733  6.523454       3.544999      -6.891039      15.70961      7.243190       3.638857      64.53326 32.86748  82.38937 27.87645  -17.85611      43.09719  
1 1 1 24 12 0  o 113.6722 45.20767  16.17566       6.614070      16.17566       6.614070      16.17566       6.614070      113.6722 45.20767  113.6722 45.20767  0.000000       0.000000  
1 1 1 24 12 1  o 54.45774 23.07056  1.701496       2.897086      5.605577       8.377011      1.171118       3.087609      73.94985 34.51617  52.95713 23.13149  20.99273       41.55036  
1 1 1 24 12 2  o 25.48871 12.42363  -2.145993      1.366168      -2.563387      4.524054      -2.104110      1.433072      49.52193 23.75853  26.49796 12.87203  23.02397       27.02142  
1 1 1 24 12 3  o 69.38404 14.18834  3.647593       1.267495      0.5197288      4.105367      3.977158       1.332597      54.89371 25.09527  72.45630 14.31014  -17.56259      28.88863  
1 1 1 24 12 4  o 66.11909 13.42286  3.284913       1.142182      7.746555       9.782818      3.223254       1.150047      76.42856 36.17511  65.36319 13.64547  11.06537       38.66312  
1 1 1 24 12 5  o 122.3163 7.572791  10.32038       1.228227      2.161443       3.997960      11.17067       1.290642      59.35249 26.11135  127.2290 7.648141  -67.87653      27.20840  
1 1 1 24 12 6  o 118.5280 9.701330  9.914553       1.518843      9.288206       6.847353      9.946964       1.557646      81.26883 34.97351  118.5514 9.952042  -37.28256      36.36192  
1 1 1 24 12 7  o 157.0265 24.07131  21.99742       4.876350      17.77594       6.848612      26.33831       6.944794      111.5552 38.23428  151.0463 35.16455  -39.49111      51.94619  
1 1 1 24 12 8  o 89.87348 31.07907  9.410247       4.528472      14.69257       7.273458      6.066486       5.786901      95.07214 37.99047  72.22378 31.60462  22.84836       49.41789  
1 1 1 24 12 9  o 89.44688 11.30251  5.810963       1.317119      6.060086       8.848061      5.805318       1.331960      70.94236 33.81391  89.30490 11.45645  -18.36254      35.70197  
1 1 1 24 13 0  o 148.9995 22.28006  17.56244       4.132366      17.56244       4.132366      17.56244       4.132366      148.9995 22.28006  148.9995 22.28006  0.000000       0.000000  
1 1 1 24 13 1  o 89.87798 33.33961  10.10870       5.311176      27.11482       12.86601      6.615404       5.831213      98.63834 44.83522  74.94865 32.26422  23.68968       55.23746  
1 1 1 24 13 2  o 121.5617 10.38278  10.51029       1.665752      9.833302       3.335835      10.73518       1.922613      103.7041 24.52712  121.5827 12.02446  -17.87856      27.31606  
1 1 1 24 13 3  o 33.92072 13.93161  0.4522334      1.009314      6.489659       5.158892      0.2119399      1.029204      75.04560 31.22189  32.18683 13.69769  42.85877       34.09447  
1 1 1 24 13 4  f 24.59428 11.67870  -1.072644      1.035695      -0.6461620     10.12026      -1.077158      1.041162      64.84714 32.04253  24.65868 11.70934  40.18845       34.11499  
1 1 1 24 13 5  o 63.18275 17.52172  3.252466       1.526633      5.151449       4.447930      2.998890       1.625368      70.21633 29.08232  60.24940 18.48439  9.966927       34.45946  
1 1 1 24 13 6  o 82.27124 2.996363  4.539704       0.3279366     4.734328       4.778102      4.538783       0.3287117     68.26344 29.29342  82.26152 3.003826  -13.99808      29.44702  
1 1 1 24 13 7  o 42.94163 20.29732  -1.488593      3.060050      4.023921       5.359299      -4.155097      3.727385      66.05019 29.57416  41.30111 20.21453  24.74908       35.82259  
1 1 1 24 14 0  o 94.30795 23.42460  7.637138       2.547405      7.637138       2.547405      7.637138       2.547405      94.30795 23.42460  94.30795 23.42460  0.000000       0.000000  
1 1 1 24 14 1  o 113.1145 11.41275  9.252809       1.696713      7.098704       3.626332      9.856552       1.919819      82.24880 27.82844  115.7648 12.65115  -33.51597      30.56916  
1 1 1 24 14 2  o 82.82609 10.82727  4.952332       1.166396      9.322939       9.220103      4.881248       1.175842      76.49764 35.86902  82.10873 11.02536  -5.611092      37.52526  
1 1 1 25 0  1  o 58.85780 32.30384  4.164779       3.643594      4.164779       3.643594      4.164779       3.643594      58.85780 32.30384  58.85780 32.30384  0.000000       0.000000  
1 1 1 25 0  2  o 69.27708 46.64923  5.689830       12.35180      5.689830       12.35180      5.689830       12.35180      69.27708 46.64923  69.27708 46.64923  0.000000       0.000000  
1 1 1 25 0  3  o 67.10199 40.59614  6.123027       6.677842      6.123027       6.677842      6.123027       6.677842      67.10199 40.59614  67.10199 40.59614  0.000000       0.000000  
1 1 1 25 0  4  o 205.6109 39.61335  38.24625       9.691056      38.24625       9.691056      38.24625       9.691056      205.6109 39.61335  205.6109 39.61335  0.000000       0.000000  
1 1 1 25 0  5  o 30.90829 20.44957  -0.1760650     2.198421      -0.1760650     2.198421      -0.1760650     2.198421      30.90829 20.44957  30.90829 20.44957  0.000000       0.000000  
1 1 1 25 0  6  o 25.44478 17.88332  -2.186513      2.343159      -2.186513      2.343159      -2.186513      2.343159      25.44478 17.88332  25.44478 17.88332  0.000000       0.000000  
1 1 1 25 0  7  o 149.4797 26.64221  18.12531       4.804688      18.12531       4.804688      18.12531       4.804688      149.4797 26.64221  149.4797 26.64221  0.000000       0.000000  
1 1 1 25 0  8  o 41.25086 26.97626  0.6289262      3.658432      0.6289262      3.658432      0.6289262      3.658432      41.25086 26.97626  41.25086 26.97626  0.000000       0.000000  
1 1 1 25 0  9  o 65.29617 38.21382  6.045468       5.561468      6.045468       5.561468      6.045468       5.561468      65.29617 38.21382  65.29617 38.21382  0.000000       0.000000  
1 1 1 25 0  10 o 41.46519 29.73929  -7.231576      7.765156      -7.231576      7.765156      -7.231576      7.765156      41.46519 29.73929  41.46519 29.73929  0.000000       0.000000  
1 1 1 25 0  11 o 94.01019 15.53863  6.661571       1.786855      6.661571       1.786855      6.661571       1.786855      94.01019 15.53863  94.01019 15.53863  0.000000       0.000000  
1 1 1 25 0  12 o 27.93689 18.49803  -0.1288486     1.804517      -0.1288486     1.804517      -0.1288486     1.804517      27.93689 18.49803  27.93689 18.49803  0.000000       0.000000  
1 1 1 25 0  13 o 88.83228 11.51020  5.701952       1.299502      5.701952       1.299502      5.701952       1.299502      88.83228 11.51020  88.83228 11.51020  0.000000       0.000000  
1 1 1 25 0  14 o 95.45524 47.72153  15.22594       7.407017      15.22594       7.407017      15.22594       7.407017      95.45524 47.72153  95.45524 47.72153  0.000000       0.000000  
1 1 1 25 1  0  o 42.56349 27.07864  1.129775       3.367112      1.129775       3.367112      1.129775       3.367112      42.56349 27.07864  42.56349 27.07864  0.000000       0.000000  
1 1 1 25 1  1  o 86.18843 26.27027  6.536768       3.289919      0.8864124      5.268294      10.14882       4.212204      63.50708 28.79684  104.9913 29.10050  -41.48420      40.94016  
1 1 1 25 1  2  o 83.05159 30.87215  6.545379       4.558565      15.14813       8.872881      3.460353       5.313435      105.1181 41.97507  71.09402 30.70293  34.02410       52.00554  
1 1 1 25 1  3  o 123.0389 25.16535  12.83327       3.986632      14.47539       5.893178      11.44773       5.413245      117.4262 35.02263  104.7988 33.94801  12.62746       48.77552  
1 1 1 25 1  4  f 164.2192 14.15587  19.53735       3.067456      20.53840       5.409049      19.06279       3.724220      152.9842 27.54682  158.4676 17.95275  -5.483414      32.88052  
1 1 1 25 1  5  o 130.1746 22.72552  13.87046       3.798633      16.70469       5.397945      11.08992       5.346579      132.4470 31.11692  102.3468 33.77471  30.10020       45.92378  
1 1 1 25 1  6  o 95.40249 34.08673  9.933963       5.478760      16.15352       7.997789      4.434600       7.520492      109.2765 40.83852  75.65160 34.34413  33.62494       53.36014  
1 1 1 25 1  7  o 42.50757 18.20192  0.4393677      1.837507      -1.572404      2.903976      1.782671       2.372962      43.17106 20.20632  53.79822 21.63025  -10.62716      29.60005  
1 1 1 25 1  8  o 220.7622 14.05533  35.48086       4.113183      34.79427       6.707280      35.89470       5.207250      200.1842 25.73948  215.9093 18.27074  -15.72511      31.56486  
1 1 1 25 1  9  o 50.13958 21.50749  0.9753662      2.573790      -1.105434      2.892659      8.883245       5.639129      44.19477 20.51093  87.80457 33.93779  -43.60981      39.65441  
1 1 1 25 1  10 o 45.28066 18.86952  0.9148755      1.888829      9.166583       6.524339      0.1600060      1.973334      85.50279 35.29981  41.77124 18.36182  43.73155       39.78986  
1 1 1 25 1  11 o 34.03214 14.46633  0.2490017      1.145667      2.675626       6.731432      0.1766130      1.162630      67.03573 31.17198  33.70725 14.45693  33.32848       34.36125  
1 1 1 25 1  12 o 40.87659 14.28679  1.174003       0.9582143     1.496885       1.314578      0.8079727      1.399660      45.82912 16.65483  40.51671 16.49529  5.312412       23.44094  
1 1 1 25 1  13 o 66.14493 12.58178  3.263782       1.068439      0.5781330      1.505591      5.988387       1.516471      39.59863 16.69629  89.77104 13.05993  -50.17241      21.19735  
1 1 1 25 1  14 o 57.58167 10.90714  2.432090       0.8062608     -1.703024      1.435641      4.337152       0.9744434     27.62844 13.28829  78.03961 9.570747  -50.41117      16.37614  
1 1 1 25 2  0  o 38.46812 25.40509  0.5290548E-01  3.368451      0.5290548E-01  3.368451      0.5290548E-01  3.368451      38.46812 25.40509  38.46812 25.40509  0.000000       0.000000  
1 1 1 25 2  1  o 56.23861 23.27931  1.710518       2.847656      3.314999       5.390849      1.089532       3.353752      70.73818 30.73596  55.94411 24.27584  14.79408       39.16651  
1 1 1 25 2  2  o 195.9958 16.67781  28.55682       4.314381      24.69598       7.667524      30.34554       5.218968      151.6423 38.02053  197.5897 20.10154  -45.94736      43.00735  
1 1 1 25 2  3  o 224.6056 20.14643  39.27303       5.965666      44.73351       7.840566      31.76553       9.193478      229.0848 26.15287  165.4976 41.70971  63.58723       49.23081  
1 1 1 25 2  4  o 64.64578 29.25532  1.378352       5.405196      -1.639705      6.072874      12.88410       11.85736      60.18830 28.49234  92.41660 42.39866  -32.22829      51.08287  
1 1 1 25 2  5  f 88.89814 22.66637  6.611169       2.692848      7.160407       2.876199      2.710645       7.664784      91.99525 23.40886  72.53927 33.56892  19.45598       40.92489  
1 1 1 25 2  6  o 132.0391 21.01636  13.96690       3.573899      0.000000       0.000000      13.96690       3.573899      ?        ?         132.0391 21.01636  0.000000       21.01636  
1 1 1 25 2  7  o 153.5792 15.70717  17.54706       3.169206      6.285047       6.670535      20.83028       3.601660      79.00326 34.25945  166.6168 16.43605  -87.61356      37.99807  
1 1 1 25 2  8  o 55.06013 22.92654  1.722652       2.785126      -2.843076      4.784232      4.063133       3.425388      51.35938 24.58463  68.82967 26.49087  -17.47029      36.14098  
1 1 1 25 2  9  o 161.5070 17.53463  20.05003       3.713165      19.48845       4.404838      21.42899       6.902383      153.4703 22.18208  136.9232 36.97199  16.54706       43.11581  
1 1 1 25 2  10 f 37.24636 15.69657  0.4061443      1.329613      7.076428       6.015143      0.6348780E-01  1.363337      79.06887 33.35733  35.34474 15.40578  43.72413       36.74302  
1 1 1 25 2  11 o 112.0234 14.58928  9.399089       2.126102      25.13018       9.557565      8.580108       2.180743      119.2653 44.62892  105.8810 15.95135  13.38434       47.39394  
1 1 1 25 2  12 o 63.50221 10.40464  2.909137       0.8499560     0.6050940      1.631048      3.768059       0.9958602     40.96076 17.32967  72.31699 10.65319  -31.35624      20.34227  
1 1 1 25 2  13 f 136.2643 7.184081  12.78035       1.299839      6.504138       10.11914      12.88565       1.310698      72.24710 34.88107  136.8068 7.215387  -64.55974      35.61953  
1 1 1 25 2  14 o 30.87017 13.28934  0.1220097      0.9893208     -2.474064      1.244556      4.578478       1.630615      22.71940 11.22813  75.65254 16.62960  -52.93314      20.06526  
1 1 1 25 3  0  o 80.01820 42.01179  8.811742       5.917700      8.811742       5.917700      8.811742       5.917700      80.01820 42.01179  80.01820 42.01179  0.000000       0.000000  
1 1 1 25 3  1  o 178.6280 15.24478  23.36599       3.593997      25.98127       5.519054      21.44038       4.735749      177.5245 23.94066  163.0762 22.38333  14.44827       32.77451  
1 1 1 25 3  2  o 77.62337 25.60860  5.255075       3.073794      5.644114       5.200283      5.046165       3.810749      78.25280 31.81879  75.50984 28.19564  2.742958       42.51387  
1 1 1 25 3  3  o 54.29667 24.86835  -0.3838234     4.056251      -1.648704      4.360401      7.745818       11.05446      52.57804 24.65768  84.50998 39.51239  -31.93194      46.57500  
1 1 1 25 3  4  o 106.4549 34.65086  12.24645       5.635917      13.00719       6.713819      10.43126       10.37089      104.1172 37.66659  88.69505 40.29127  15.42219       55.15576  
1 1 1 25 3  5  o 91.22857 30.67670  8.274981       4.406672      9.522412       5.382110      5.738043       7.675368      93.82580 33.75342  78.72614 35.31010  15.09966       48.84769  
1 1 1 25 3  6  o 131.9641 13.25642  12.58646       2.299531      16.91223       3.874913      10.23489       2.856993      145.8476 20.50368  113.9564 19.51625  31.89127       28.30697  
1 1 1 25 3  7  o 34.35901 15.78753  -0.7960314     1.652754      0.2847544      1.715223      -14.82814      6.180338      40.47227 17.46120  43.38116 21.93533  -2.908894      28.03662  
1 1 1 25 3  8  o 54.65191 23.02273  1.596262       2.858634      -2.340014      5.342996      3.174918       3.383653      54.72252 26.13628  64.01466 25.79709  -9.292145      36.72322  
1 1 1 25 3  9  o 57.38319 18.38148  2.595794       1.590011      -0.8775883     4.327145      3.137975       1.709611      53.02402 24.76820  62.42425 18.91918  -9.400223      31.16727  
1 1 1 25 3  10 o 143.5945 12.69960  14.95009       2.404949      -14.57860      13.30464      15.94751       2.445228      62.23506 31.54811  148.5471 12.46821  -86.31201      33.92255  
1 1 1 25 3  11 o 137.9573 9.825877  13.39638       1.794475      19.48617       5.762703      12.74247       1.888363      135.7044 32.33084  133.8969 10.67205  1.807480       34.04667  
1 1 1 25 3  12 o 48.31837 22.85009  -1.387441      3.887185      1.456844       5.279444      -4.754988      5.744583      60.22314 27.86611  50.48606 24.78896  9.737076       37.29628  
1 1 1 25 3  13 f 37.23416 15.25385  0.6238427      1.206106      0.9513975      1.562450      0.1408602      1.897273      42.50724 17.38177  40.31887 17.85158  2.188370       24.91595  
1 1 1 25 3  14 o 27.62242 12.54094  -0.3820679     1.003013      1.631158       1.681447      -1.494160      1.249704      47.96985 18.53434  25.91439 12.44683  22.05546       22.32589  
1 1 1 25 4  0  f 56.59616 33.82199  3.787061       4.522701      3.787061       4.522701      3.787061       4.522701      56.59616 33.82199  56.59616 33.82199  0.000000       0.000000  
1 1 1 25 4  1  o 75.08967 24.42832  4.830379       2.801269      2.511381       5.000531      5.890946       3.381700      66.68600 29.27447  80.91438 26.86693  -14.22838      39.73445  
1 1 1 25 4  2  o 115.2896 27.11838  11.83220       4.095855      14.56321       6.939324      10.37209       5.073969      109.7089 38.43959  100.0239 32.89745  9.685051       50.59490  
1 1 1 25 4  3  o 95.87644 27.06464  8.338776       3.608108      10.29802       8.555125      7.914884       3.979327      89.86567 38.88446  91.19031 29.06539  -1.324638      48.54686  
1 1 1 25 4  4  o 72.40612 32.21634  3.773499       6.255350      -0.6698940     9.165036      7.648543       8.558845      69.49269 33.46202  83.18594 37.30051  -13.69325      50.11023  
1 1 1 25 4  5  o 78.24506 24.53182  5.350913       2.845353      8.658826       5.754857      4.280630       3.273458      88.41432 34.25420  70.53603 26.17221  17.87830       43.10841  
1 1 1 25 4  6  o 103.3678 23.73598  9.120372       3.200288      9.799356       4.197661      8.177897       4.945521      100.5630 29.44685  87.95222 32.25064  12.61083       43.67174  
1 1 1 25 4  7  o 97.44474 35.28830  11.18077       5.894666      35.10683       12.36385      4.142357       6.705875      134.6432 50.68047  72.62766 32.75288  62.01553       60.34286  
1 1 1 25 4  8  o 64.90477 25.04354  3.475354       3.066844      2.715734       3.349910      7.408840       7.622956      61.50133 25.33277  80.08554 35.60276  -18.58421      43.69561  
1 1 1 25 4  9  o 123.8073 13.12617  11.17573       2.132546      6.324775       8.260540      11.52212       2.207371      76.57200 35.22450  125.4981 13.40716  -48.92608      37.68975  
1 1 1 25 4  10 o 120.0364 9.458932  10.10136       1.500747      4.238015       3.676673      11.27356       1.643931      68.22420 27.09309  126.6040 9.821331  -58.37977      28.81829  
1 1 1 25 4  11 o 121.7290 10.29723  10.51120       1.654622      10.65521       5.814594      10.49852       1.725979      90.36619 34.58179  121.2988 10.79090  -30.93257      36.22629  
1 1 1 25 4  12 o 122.4274 6.414003  10.25085       1.042711      1.251829       3.976672      10.91523       1.080516      55.75929 25.17690  126.3290 6.440060  -70.56975      25.98751  
1 1 1 25 4  13 o 78.26433 11.55298  4.479877       1.168668      7.059227       2.310339      3.592933       1.354779      91.92640 19.46770  67.69214 15.37152  24.23426       24.80474  
1 1 1 25 4  14 o 32.77908 12.68097  0.5957884      0.7878380     0.2073560      0.8509544     2.926686       2.084540      29.70844 12.54057  58.51175 21.01152  -28.80332      24.46937  
1 1 1 25 5  0  o 53.54173 34.56120  2.479430       5.739613      2.479430       5.739613      2.479430       5.739613      53.54173 34.56120  53.54173 34.56120  0.000000       0.000000  
1 1 1 25 5  1  o 46.66318 21.94153  -1.870583      3.492321      -0.3886085     5.768853      -2.727876      4.387667      61.24885 28.60619  50.05689 23.84576  11.19196       37.24157  
1 1 1 25 5  2  o 207.3097 12.71144  30.70013       3.494580      30.91957       4.811699      30.45519       5.083673      201.2611 18.13611  197.7576 19.54711  3.503464       26.66473  
1 1 1 25 5  3  o 61.17469 23.13857  2.848688       2.584281      2.923808       3.341769      2.736927       4.076108      63.38283 25.60334  64.47440 27.34188  -1.091576      37.45811  
1 1 1 25 5  4  o 81.16644 26.95142  6.052485       3.402996      4.409186       5.758120      6.934503       4.218529      73.10446 31.76490  84.00747 29.92205  -10.90301      43.63872  
1 1 1 25 5  5  o 122.0670 15.25907  11.07266       2.427925      6.083247       4.449039      13.18874       2.897394      78.91286 30.23694  131.8880 16.87242  -52.97516      34.62587  
1 1 1 25 5  6  o 49.83022 20.39334  1.343431       2.153021      1.301903       2.192983      2.451852       11.32960      49.81133 20.50498  74.70930 36.26888  -24.89797      41.66396  
1 1 1 25 5  7  o 68.03145 30.03628  3.327188       5.334550      5.590535       6.622976      -0.8534808     9.001204      75.65012 33.43073  67.05584 32.50037  8.594276       46.62497  
1 1 1 25 5  8  o 50.65874 17.20949  1.928474       1.386945      -7.264148      6.454359      2.373498       1.420120      51.43151 25.44553  55.18844 17.33501  -3.756927      30.78924  
1 1 1 25 5  9  o 62.49712 16.53346  3.072294       1.397936      -1.519726      3.724684      3.825193       1.508189      47.86349 22.55351  69.89082 16.46666  -22.02733      27.92511  
1 1 1 25 5  10 o 27.21709 12.12794  -0.2074843     0.8898744     17.32697       18.79875      -0.2468634     0.8908731     80.90121 40.55485  26.95934 12.06542  53.94186       42.31158  
1 1 1 25 5  11 o 22.45271 11.01156  -1.999451      1.123234      6.681326       12.00352      -2.076134      1.128184      73.55671 36.05870  22.28600 10.95116  51.27071       37.68498  
1 1 1 25 5  12 o 63.17678 19.08824  3.350491       1.742186      -1.884948      7.917345      3.616893       1.785961      59.76579 29.29545  65.51485 19.21396  -5.749069      35.03427  
1 1 1 25 5  13 o 108.7104 17.24652  9.415653       2.414994      6.480721       8.043388      9.706445       2.531807      71.37832 33.47928  109.6900 17.94135  -38.31171      37.98360  
1 1 1 25 6  0  o 93.59229 41.83615  10.95898       5.547238      10.95898       5.547238      10.95898       5.547238      93.59229 41.83615  93.59229 41.83615  0.000000       0.000000  
1 1 1 25 6  1  o 111.8324 24.89256  10.81485       3.613996      7.113371       4.301652      19.69650       6.663375      84.73378 30.21167  134.1440 36.37092  -49.41017      47.28201  
1 1 1 25 6  2  o 68.36665 22.07565  3.884583       2.290179      4.551271       3.557887      3.412923       2.992580      71.89524 27.15940  65.14223 24.83842  6.753014       36.80462  
1 1 1 25 6  3  o 100.5443 21.22217  8.263108       2.753844      13.49041       4.428735      4.967854       3.516297      121.3172 27.96842  74.11324 27.19116  47.20393       39.00759  
1 1 1 25 6  4  o 51.54642 19.41969  1.837499       1.816233      5.911448       6.419167      1.482980       1.893610      77.35123 33.57500  49.33607 19.49072  28.01516       38.82227  
1 1 1 25 6  5  o 56.35131 20.83624  2.380899       2.071486      2.676347       2.099641      -8.414376      12.69176      58.61893 21.08284  66.70433 33.42154  -8.085400      39.51563  
1 1 1 25 6  6  o 91.49702 27.24112  7.912732       3.567803      6.189491       4.038295      14.04235       7.616258      79.17307 29.12417  99.55447 39.16307  -20.38140      48.80537  
1 1 1 25 6  7  o 55.31116 18.56446  2.384532       1.613883      7.501263       3.843811      1.289475       1.778214      86.80136 28.63715  47.01247 18.78491  39.78889       34.24850  
1 1 1 25 6  8  o 94.18250 11.73767  6.401124       1.441196      1.323131       6.899503      6.632798       1.473706      65.03787 30.66138  95.86230 11.78460  -30.82442      32.84809  
1 1 1 25 6  9  o 101.7932 8.841228  7.240059       1.187354      1.223818       4.426780      7.706434       1.232517      58.01203 26.34144  105.0137 8.891410  -47.00167      27.80160  
1 1 1 25 6  10 f 35.73089 14.26862  0.6316305      1.025345      -0.3611774     4.248952      0.6930206      1.056570      52.63505 24.57230  36.59065 14.52606  16.04440       28.54478  
1 1 1 25 6  11 o 92.87487 15.44397  6.648650       1.844212      0.5617139      6.204246      7.238604       1.931518      60.07029 28.54173  96.95216 15.47053  -36.88187      32.46487  
1 1 1 25 6  12 o 58.10674 14.35420  2.616945       1.104828      0.9033905      4.905835      2.708497       1.133958      57.11115 26.57539  59.04803 14.51579  -1.936878      30.28134  
1 1 1 25 7  0  o 83.43874 34.64003  7.781040       3.835531      7.781040       3.835531      7.781040       3.835531      83.43874 34.64003  83.43874 34.64003  0.000000       0.000000  
1 1 1 25 7  1  o 58.64530 25.25870  1.807262       3.577351      4.755887       4.447959      -3.593540      6.019773      72.59258 29.46047  55.44358 26.80136  17.14899       39.82753  
1 1 1 25 7  2  o 60.39161 24.27630  2.626973       2.988404      3.885535       4.462829      1.603911       4.023686      68.96336 28.89089  59.45760 26.17503  9.505764       38.98481  
1 1 1 25 7  3  o 62.85497 24.29264  3.127126       2.889158      3.422032       7.454546      3.074998       3.134119      71.66473 33.14351  63.00476 25.01627  8.659969       41.52477  
1 1 1 25 7  4  o 79.33432 22.73476  5.422853       2.526960      4.674790       5.289306      5.644089       2.876460      72.23962 30.90635  79.40833 24.63013  -7.168709      39.52020  
1 1 1 25 7  5  o 97.62266 27.83148  9.123594       3.796505      7.770245       4.310962      13.80034       8.013847      86.52084 30.29882  96.39527 39.38501  -9.874435      49.69102  
1 1 1 25 7  6  o 103.4009 14.49622  7.970055       1.942552      6.471395       3.943958      8.450070       2.232073      80.18245 28.88778  104.9449 16.50592  -24.76243      33.27084  
1 1 1 25 7  7  o 28.19753 13.13109  -0.8530645     1.201321      11.49157       4.223768      -1.939567      1.253073      107.9119 28.82693  24.61589 11.97573  83.29606       31.21554  
1 1 1 25 7  8  o 123.0893 10.04966  10.70158       1.634000      2.696292       7.661151      11.08309       1.672484      67.71884 32.04081  125.2350 10.10800  -57.51620      33.59740  
1 1 1 25 7  9  o 37.87280 16.67702  0.7123423E-01  1.634349      8.926412       12.77202      -0.7617962E-01 1.647897      76.10218 37.28343  37.21887 16.54926  38.88331       40.79132  
1 1 1 25 7  10 o 89.53247 6.472186  5.497053       0.7669440     5.322008       5.147979      5.501027       0.7755995     70.69303 30.37216  89.53600 6.546026  -18.84296      31.06958  
1 1 1 25 7  11 o 35.17912 14.65721  0.4475240      1.139344      -5.470691      5.213714      0.7443192      1.167563      46.86007 23.12560  37.87157 15.19121  8.988499       27.66887  
1 1 1 25 7  12 o 38.41296 15.94906  0.6297647      1.342332      6.325370       5.324495      0.2432005      1.387137      72.76086 31.06600  36.20720 15.66209  36.55366       34.79076  
1 1 1 25 8  0  f 87.62096 26.29612  6.965467       2.674656      6.965467       2.674656      6.965467       2.674656      87.62096 26.29612  87.62096 26.29612  0.000000       0.000000  
1 1 1 25 8  1  o 34.87301 17.19713  -4.816005      2.864799      -8.899119      3.652649      1.710174       4.617869      34.77728 17.49366  61.29517 27.44817  -26.51789      32.54889  
1 1 1 25 8  2  f 89.74511 25.50510  7.355524       3.193341      7.566082       4.223359      7.074460       4.879501      85.73279 29.99180  81.33851 31.53374  4.394279       43.51879  
1 1 1 25 8  3  o 99.09982 28.38528  9.555476       3.940076      7.192133       6.972044      10.66440       4.775820      79.06194 34.64117  99.66417 31.84986  -20.60223      47.05767  
1 1 1 25 8  4  o 43.99174 19.87984  -0.2346454     2.485332      -2.834676      3.174907      3.879986       3.993992      41.28205 19.83087  67.29689 27.68442  -26.01484      34.05423  
1 1 1 25 8  5  f 97.74581 36.63568  12.69371       6.445961      11.25258       9.709370      13.82949       8.619559      84.12136 38.50837  92.19366 39.44890  -8.072304      55.12812  
1 1 1 25 8  6  f 171.3742 14.13117  21.73502       3.198336      29.75597       6.353687      19.01275       3.701505      178.4917 27.60362  155.2872 18.23538  23.20450       33.08306  
1 1 1 25 8  7  o 67.45382 16.28261  3.582799       1.446742      10.05242       4.208867      2.715961       1.540617      97.96179 29.68395  58.05788 18.02827  39.90391       34.72975  
1 1 1 25 8  8  o 41.30622 17.18565  0.7453302      1.563126      -4.211925      8.089175      0.9376163      1.593153      58.27775 28.76869  42.84135 17.53892  15.43640       33.69349  
1 1 1 25 8  9  o 92.22881 7.462889  5.885178       0.9093366     9.381480       14.79501      5.871920       0.9110590     74.74556 37.23919  92.11333 7.487006  -17.36777      37.98437  
1 1 1 25 8  10 o 32.00350 14.52490  -0.4148529     1.344015      4.417014       6.994594      -0.6000938     1.369536      68.07764 31.69662  31.37316 14.39925  36.70449       34.81400  
1 1 1 25 8  11 o 69.11176 19.53789  4.073077       1.878904      10.63909       6.270563      3.425408       1.969392      85.17510 34.82428  62.91406 20.48354  22.26104       40.40180  
1 1 1 25 9  0  o 122.4701 35.01046  14.51022       4.951186      14.51022       4.951186      14.51022       4.951186      122.4701 35.01046  122.4701 35.01046  0.000000       0.000000  
1 1 1 25 9  1  f 35.45679 17.30305  -3.631246      2.672742      -2.509155      4.457264      -4.261230      3.339792      49.50734 23.70657  39.33821 19.22845  10.16914       30.52433  
1 1 1 25 9  2  o 41.65936 20.42035  -4.827125      3.847059      0.1157243      7.206264      -6.797304      4.549612      63.37090 30.29047  42.77481 21.19834  20.59608       36.97137  
1 1 1 25 9  3  o 82.97051 24.45530  6.298197       2.887123      6.038325       3.700592      6.702414       4.615286      77.66295 27.98202  78.69814 30.62403  -1.035194      41.48282  
1 1 1 25 9  4  o 47.05872 20.85698  0.4144984      2.596368      3.960557       4.147003      -1.871583      3.329716      66.89402 27.92436  44.36019 21.02839  22.53383       34.95658  
1 1 1 25 9  5  o 87.94200 14.41489  5.831928       1.630728      -1.394818      11.98736      5.968189       1.646030      67.57185 33.64163  89.01482 14.36621  -21.44296      36.58070  
1 1 1 25 9  6  o 101.9330 12.66679  7.624314       1.683493      7.886726       4.797886      7.587471       1.797798      82.31843 31.43512  100.9070 13.72596  -18.58858      34.30115  
1 1 1 25 9  7  o 194.7790 9.335428  26.58999       2.415926      30.04473       7.126395      26.14138       2.567997      166.4819 33.28810  192.3722 10.05283  -25.89026      34.77293  
1 1 1 25 9  8  o 192.8737 6.816788  25.48959       1.749214      32.10194       7.206990      25.07568       1.803130      173.3248 32.39549  191.0808 7.093997  -17.75604      33.16312  
1 1 1 25 9  9  o 31.35232 14.80530  -1.293997      1.620953      2.336390       15.33132      -1.335038      1.630090      69.48778 35.06530  31.30250 14.80135  38.18527       38.06121  
1 1 1 25 10 0  o 62.31143 37.00746  5.732509       5.352100      5.732509       5.352100      5.732509       5.352100      62.31143 37.00746  62.31143 37.00746  0.000000       0.000000  
1 1 1 25 10 1  o 94.48555 22.94621  7.872106       2.859850      8.140615       4.080928      7.612990       4.008910      87.35637 29.52139  84.70161 29.24416  2.654755       41.55397  
1 1 1 25 10 2  o 79.36289 30.08187  6.907871       4.373412      6.961933       13.86618      6.901899       4.608644      74.76026 37.04230  78.66317 30.60436  -3.902908      48.04955  
1 1 1 25 10 3  o 71.42411 23.55435  4.647456       2.600516      2.404400       3.513690      7.364306       3.867019      58.95603 25.20585  83.68099 28.72867  -24.72496      38.21873  
1 1 1 25 10 4  f 103.4224 16.20567  8.288032       2.160039      19.21351       7.331541      7.249527       2.260369      114.3173 39.54422  94.55950 18.60207  19.75781       43.70105  
1 1 1 25 10 5  o 38.14654 18.50156  -3.167787      2.930196      0.4991385      17.51002      -3.273435      2.972107      70.54854 35.80779  38.22743 18.56236  32.32111       40.33310  
1 1 1 25 10 6  o 56.99973 13.42470  2.472317       1.002715      2.816183       4.230741      2.451852       1.032122      61.50757 26.96631  56.58234 13.81190  4.925232       30.29770  
1 1 1 25 10 7  o 180.8186 6.438619  22.34563       1.548873      10.91242       4.814333      23.66565       1.635843      95.91716 32.06190  185.9617 6.612052  -90.04454      32.73659  
1 1 1 25 10 8  x ?        ?         ?              ?             ?              ?             ?              ?             ?        ?         ?        ?         ?              ?         
1 1 1 25 11 0  o 56.54034 41.20572  -6.122430      18.21608      -6.122430      18.21608      -6.122430      18.21608      56.54034 41.20572  56.54034 41.20572  0.000000       0.000000  
1 1 1 25 11 1  o 65.97983 26.43805  4.042086       3.532439      3.537415       6.274099      4.276309       4.274265      66.48441 30.62550  67.11795 28.20582  -0.6335449     41.63520  
1 1 1 25 11 2  o 39.33106 18.55811  -1.518773      2.537454      -0.9963093     2.942981      -3.032398      5.009201      43.82748 20.45714  50.03896 24.25087  -6.211487      31.72695  
1 1 1 25 11 3  o 46.26372 22.56151  -3.919052      4.522141      -10.18898      16.40828      -3.403666      4.704330      65.00185 33.14990  48.00661 23.32071  16.99525       40.53112  
1 1 1 25 11 4  o 82.75349 35.63935  10.41282       7.120870      1.064839       8.512462      32.20097       12.99590      64.57020 31.36778  104.5964 46.49357  -40.02620      56.08556  
1 1 1 25 11 5  o 148.5457 9.622849  15.56079       1.894497      12.02373       8.901377      15.72861       1.938920      82.06523 37.29847  149.1889 9.807656  -67.12364      38.56638  
1 1 1 26 0  0  o 146.3024 34.12251  17.86905       5.783408      17.86905       5.783408      17.86905       5.783408      146.3024 34.12251  146.3024 34.12251  0.000000       0.000000  
1 1 1 26 0  1  o 76.15791 31.91854  6.395207       3.249893      6.395207       3.249893      6.395207       3.249893      76.15791 31.91854  76.15791 31.91854  0.000000       0.000000  
1 1 1 26 0  2  o 173.4321 33.40549  26.40942       6.893649      26.40942       6.893649      26.40942       6.893649      173.4321 33.40549  173.4321 33.40549  0.000000       0.000000  
1 1 1 26 0  3  o 49.89256 33.27378  1.285973       6.016684      1.285973       6.016684      1.285973       6.016684      49.89256 33.27378  49.89256 33.27378  0.000000       0.000000  
1 1 1 26 0  4  o 35.10081 24.58093  -2.781544      4.309523      -2.781544      4.309523      -2.781544      4.309523      35.10081 24.58093  35.10081 24.58093  0.000000       0.000000  
1 1 1 26 0  5  o 46.63792 26.35651  2.503371       2.511574      2.503371       2.511574      2.503371       2.511574      46.63792 26.35651  46.63792 26.35651  0.000000       0.000000  
1 1 1 26 0  6  o 23.64934 16.17887  -0.7955772     1.610578      -0.7955772     1.610578      -0.7955772     1.610578      23.64934 16.17887  23.64934 16.17887  0.000000       0.000000  
1 1 1 26 0  7  o 49.39630 33.66520  0.6338889      6.832185      0.6338889      6.832185      0.6338889      6.832185      49.39630 33.66520  49.39630 33.66520  0.000000       0.000000  
1 1 1 26 0  8  o 29.39841 20.74800  -2.835677      3.258510      -2.835677      3.258510      -2.835677      3.258510      29.39841 20.74800  29.39841 20.74800  0.000000       0.000000  
1 1 1 26 0  9  o 79.64046 41.26345  9.609566       5.654315      9.609566       5.654315      9.609566       5.654315      79.64046 41.26345  79.64046 41.26345  0.000000       0.000000  
1 1 1 26 0  10 o 71.91438 39.31028  8.011659       5.372436      8.011659       5.372436      8.011659       5.372436      71.91438 39.31028  71.91438 39.31028  0.000000       0.000000  
1 1 1 26 0  11 o 121.1557 23.14339  12.04962       3.341157      12.04962       3.341157      12.04962       3.341157      121.1557 23.14339  121.1557 23.14339  0.000000       0.000000  
1 1 1 26 1  0  o 158.9074 22.35878  19.57737       4.465260      19.57737       4.465260      19.57737       4.465260      158.9074 22.35878  158.9074 22.35878  0.000000       0.000000  
1 1 1 26 1  1  o 53.06551 23.87619  0.4259177      3.540376      -9.313585      11.04636      1.540904       3.737538      62.64948 31.35925  57.84729 25.35412  4.802197       40.32659  
1 1 1 26 1  2  o 82.89484 35.89034  8.505525       7.297377      0.000000       0.000000      8.505525       7.297377      ?        ?         82.89484 35.89034  0.000000       35.89034  
1 1 1 26 1  3  o 115.4484 38.28106  17.02709       6.866017      0.000000       0.000000      17.02709       6.866017      ?        ?         115.4484 38.28106  0.000000       38.28106  
1 1 1 26 1  4  o 87.24709 30.94925  8.149127       4.508931      0.000000       0.000000      8.149127       4.508931      ?        ?         87.24709 30.94925  0.000000       30.94925  
1 1 1 26 1  5  o 84.17102 27.58565  6.951017       3.568998      6.315489       4.789124      7.744823       5.352366      77.27081 30.84381  82.13082 32.66529  -4.860016      44.92619  
1 1 1 26 1  6  o 61.60698 22.28615  3.167211       2.350271      2.575396       2.456180      9.589133       8.090949      57.76635 22.37883  82.15160 36.59062  -24.38524      42.89156  
1 1 1 26 1  7  o 54.44376 23.57164  1.533874       3.147563      -1.399896      5.970772      2.662931       3.704039      57.04877 27.34969  60.79491 25.93265  -3.746140      37.68962  
1 1 1 26 1  8  f 37.16848 17.50663  -1.455178      2.240003      4.972110       4.816925      -3.228584      2.530230      70.27048 29.75796  34.88500 16.98202  35.38549       34.26259  
1 1 1 26 1  9  o 129.2666 17.81161  13.27530       2.986590      12.45074       3.392840      16.11319       6.294352      120.3784 21.96041  109.7504 36.65987  10.62801       42.73412  
1 1 1 26 1  10 o 123.8207 27.96197  15.13859       4.504086      15.20255       5.291073      14.97028       8.583430      114.7657 32.90044  89.60078 38.85871  25.16488       50.91599  
1 1 1 26 2  0  o 43.80685 27.50706  1.634964       3.348470      1.634964       3.348470      1.634964       3.348470      43.80685 27.50706  43.80685 27.50706  0.000000       0.000000  
1 1 1 26 2  1  o 153.8928 19.23944  18.72387       3.859377      24.92530       9.425780      17.47480       4.230229      125.1461 44.71029  144.4098 22.73409  -19.26373      50.15824  
1 1 1 26 2  2  o 67.81486 24.95661  4.007657       2.965775      10.93730       6.708263      2.324134       3.306467      91.51676 36.51301  59.37196 24.86996  32.14480       44.17822  
1 1 1 26 2  3  o 97.45930 31.63091  10.18874       4.698210      11.31431       5.911796      8.259227       7.740315      95.99709 35.25083  81.16401 35.99038  14.83308       50.37785  
1 1 1 26 2  4  o 50.79961 18.66756  1.872318       1.658377      2.820455       3.394525      1.575076       1.900634      61.56989 25.44474  49.55529 19.54251  12.01461       32.08340  
1 1 1 26 2  5  o 91.33227 23.34190  7.344714       2.851083      6.589720       3.556365      8.702765       4.769714      81.77466 27.55883  88.16442 31.76769  -6.389763      42.05562  
1 1 1 26 2  6  o 113.2600 28.82225  12.66166       4.360021      13.58108       4.972741      9.605186       9.066683      112.5449 31.77429  80.72397 37.04943  31.82091       48.80846  
1 1 1 26 2  7  f 79.27743 18.17705  5.080224       1.879150      4.535238       3.012290      5.427431       2.404352      69.81062 25.23361  78.71632 22.04856  -8.905701      33.50931  
1 1 1 26 2  8  o 45.40833 19.86768  0.5518744      2.286179      -9.017944      5.786712      2.321824       2.488631      45.59182 22.80262  55.75899 22.24175  -10.16718      31.85365  
1 1 1 26 2  9  o 97.60921 26.95961  9.395042       3.622276      15.12038       4.382174      -2.955266      6.436175      125.7332 26.96465  55.14957 26.89953  70.58363       38.08775  
1 1 1 26 2  10 o 108.8689 34.28067  14.66533       5.550301      20.74767       7.727393      8.183406       7.977188      113.9456 40.50661  75.52819 34.69697  38.41742       53.33541  
1 1 1 26 3  0  o 107.9060 43.17771  14.07915       6.020986      14.07915       6.020986      14.07915       6.020986      107.9060 43.17771  107.9060 43.17771  0.000000       0.000000  
1 1 1 26 3  1  o 59.81586 24.45026  2.569134       3.090174      1.579371       6.124847      2.907113       3.579102      64.59124 29.93161  62.59295 26.02044  1.998287       39.66062  
1 1 1 26 3  2  o 129.6414 23.55824  14.40944       3.919820      21.01152       9.809841      13.15504       4.276021      108.0725 43.79073  118.5917 27.58162  -10.51917      51.75301  
1 1 1 26 3  3  o 66.87685 29.23900  3.446384       4.943417      7.483411       7.777469      0.7099125      6.403286      78.80805 35.42943  63.11910 29.68905  15.68895       46.22428  
1 1 1 26 3  4  o 67.76413 27.62924  4.067811       3.933802      9.025439       5.204712      -2.537732      6.007781      87.95763 32.92963  55.89157 26.95778  32.06605       42.55681  
1 1 1 26 3  5  o 113.2767 20.79285  10.62174       3.022921      8.712722       3.851851      13.68291       4.877623      93.15229 28.43182  114.3564 31.16486  -21.20410      42.18551  
1 1 1 26 3  6  o 48.14182 21.23256  0.5931456      2.659056      0.000000       0.000000      0.5931456      2.659056      ?        ?         48.14182 21.23256  0.000000       21.23256  
1 1 1 26 3  7  o 68.21789 25.53645  4.331570       3.129808      0.000000       0.000000      4.331570       3.129808      ?        ?         68.21789 25.53645  0.000000       25.53645  
1 1 1 26 3  8  o 44.20333 21.15106  -2.303010      3.533806      -0.5596840     4.320502      -5.826304      6.142136      52.28986 24.52956  50.56393 24.98075  1.725933       35.01054  
1 1 1 26 3  9  o 163.7507 13.83817  19.95921       2.991264      2.757760       7.580351      23.13175       3.255444      66.02888 31.42291  176.1466 13.98425  -110.1177      34.39417  
1 1 1 26 3  10 o 74.48755 16.04444  4.376288       1.545426      21.10247       9.857689      3.954834       1.564776      98.21420 42.10946  70.08926 16.94327  28.12494       45.39032  
1 1 1 26 4  0  o 55.24232 35.87495  3.293526       6.311691      3.293526       6.311691      3.293526       6.311691      55.24232 35.87495  55.24232 35.87495  0.000000       0.000000  
1 1 1 26 4  1  o 51.07188 23.93354  -1.066806      4.095094      0.3322619      6.736875      -1.886709      5.157276      63.09584 29.91016  54.02214 25.76757  9.073696       39.47892  
1 1 1 26 4  2  o 60.29256 25.37293  2.531312       3.466410      -0.1963857E-01 10.83441      2.822217       3.658726      69.10582 33.95383  62.00919 26.07965  7.096626       42.81368  
1 1 1 26 4  3  o 53.25743 22.74852  1.459055       2.857236      0.000000       0.000000      1.459055       2.857236      ?        ?         53.25743 22.74852  0.000000       22.74852  
1 1 1 26 4  4  o 71.33680 30.19407  4.973108       4.954928      -3.054169      7.757119      10.50572       6.439931      59.89473 29.28244  88.58347 35.62734  -28.68874      46.11691  
1 1 1 26 4  5  o 75.15274 30.85493  6.091529       4.948484      7.555565       6.473707      4.033680       7.675097      78.33305 33.85966  70.13930 32.83563  8.193756       47.16624  
1 1 1 26 4  6  o 36.69310 17.30261  -1.505093      2.199476      0.6889897      5.570593      -1.910315      2.393984      59.68753 27.95276  37.16954 17.68033  22.51799       33.07492  
1 1 1 26 4  7  o 106.7501 33.36466  13.39162       5.267406      18.85726       6.709064      4.608620       8.504781      119.2910 37.70642  70.48402 33.46874  48.80695       50.41756  
1 1 1 26 4  8  o 161.3013 22.16041  22.33070       4.637331      19.61120       5.613530      28.17490       8.229143      135.7182 31.62809  140.9869 41.21498  -5.268646      51.95201  
1 1 1 26 4  9  o 42.99586 16.38266  1.219233       1.301290      -0.3774642     6.127645      1.294642       1.331665      58.04110 27.79375  43.82992 16.60259  14.21118       32.37497  
1 1 1 26 5  0  o 40.33165 28.68826  -5.011650      6.663854      -5.011650      6.663854      -5.011650      6.663854      40.33165 28.68826  40.33165 28.68826  0.000000       0.000000  
1 1 1 26 5  1  o 56.48141 24.79954  1.549390       3.590172      2.435133       4.312716      -0.4499568     6.479494      61.77506 27.15042  60.58649 28.89414  1.188564       39.64866  
1 1 1 26 5  2  o 59.93566 22.15567  2.934409       2.341867      8.319360       4.538006      0.9797733      2.734055      86.80144 31.02150  50.37086 21.88752  36.43057       37.96574  
1 1 1 26 5  3  o 77.99281 22.06206  5.304048       2.395000      4.095698       3.265607      6.710479       3.523117      67.25597 25.87072  82.16936 27.42663  -14.91340      37.70297  
1 1 1 26 5  4  o 53.51397 22.93329  1.532255       2.921242      1.115918       3.417681      2.661266       5.628052      53.90057 23.90732  64.62164 29.48158  -10.72107      37.95686  
1 1 1 26 5  5  o 54.04346 23.08669  1.664024       2.943373      3.840688       4.891313      0.4284036      3.685295      66.63146 29.10911  52.56570 23.93319  14.06576       37.68472  
1 1 1 26 5  6  o 64.69255 26.37353  3.710450       3.583807      3.956170       3.728036      0.7178294      13.01025      65.90197 26.88677  69.15827 34.52848  -3.256302      43.76202  
1 1 1 26 5  7  f 83.91213 30.75031  8.088199       4.495005      6.901291       4.999202      13.09797       10.27073      76.87080 31.21946  82.44508 38.39373  -5.574287      49.48468  
1 1 1 26 5  8  o 75.38752 17.79573  4.622307       1.758774      6.339862       4.898302      4.368103       1.884438      74.39966 30.63800  72.10882 19.25126  2.290840       36.18422  
1 1 1 26 5  9  f 30.60123 14.85107  -2.470472      1.895546      -9.083129      5.477665      -1.570875      2.020372      43.76229 21.93095  34.55691 16.38095  9.205379       27.37338  
1 1 1 26 6  0  o 54.29527 33.97557  3.662534       5.061877      3.662534       5.061877      3.662534       5.061877      54.29527 33.97557  54.29527 33.97557  0.000000       0.000000  
1 1 1 26 6  1  o 62.13249 24.76560  3.200901       3.083182      4.054891       3.377869      -1.062792      7.547611      66.81853 26.14196  61.59282 29.83072  5.225712       39.66451  
1 1 1 26 6  2  o 39.17681 19.09450  -3.804542      3.226067      -6.046318      4.523067      -1.483164      4.602669      43.39408 21.43824  51.81189 24.60791  -8.417812      32.63660  
1 1 1 26 6  3  o 46.52906 20.78770  0.2738245      2.632334      2.884187       4.523944      -1.062352      3.236672      63.03826 27.75281  45.77634 21.39531  17.26192       35.04251  
1 1 1 26 6  4  o 86.52324 29.86995  8.156133       4.182277      0.9216145      7.282084      11.71696       5.108886      63.55491 30.39768  99.56926 33.02152  -36.01435      44.88251  
1 1 1 26 6  5  o 49.23103 17.84560  1.804602       1.507985      2.656753       3.123131      1.545535       1.722021      58.98648 24.39453  47.93734 18.69124  11.04915       30.73200  
1 1 1 26 6  6  o 89.83793 27.83403  8.265891       3.674641      12.03061       4.369954      -0.8223004     6.789683      107.2779 29.60437  59.30754 28.61855  47.97033       41.17572  
1 1 1 26 6  7  o 92.53892 16.87135  6.768513       2.003776      5.241564       4.312034      7.189055       2.262949      70.75881 28.89796  93.71663 18.77597  -22.95782      34.46200  
1 1 1 26 6  8  f 48.50601 15.71190  1.813467       1.159553      3.364000       5.329821      1.736431       1.188009      64.50266 29.13395  47.68208 15.92667  16.82059       33.20309  
1 1 1 26 7  0  o 40.99648 28.67022  -2.375014      5.804940      -2.375014      5.804940      -2.375014      5.804940      40.99648 28.67022  40.99648 28.67022  0.000000       0.000000  
1 1 1 26 7  1  o 83.44993 28.28294  7.235029       3.745842      8.528104       4.615830      4.740916       6.410560      86.15212 31.22280  69.91866 31.72850  16.23347       44.51473  
1 1 1 26 7  2  f 65.89592 29.01230  3.694454       4.944428      -0.6279318     11.29296      4.719554       5.499576      66.76064 33.13932  69.39149 30.57272  -2.630852      45.08775  
1 1 1 26 7  3  o 62.94030 21.80619  3.422419       2.229777      8.682771       4.252624      1.427897       2.618598      88.73032 30.13481  51.38294 21.85732  37.34738       37.22700  
1 1 1 26 7  4  o 39.42474 17.10155  0.3159260      1.663181      -1.019029      6.440481      0.4113113      1.721574      58.22874 28.04139  40.46510 17.47597  17.76365       33.04132  
1 1 1 26 7  5  o 62.66441 25.24884  3.417006       3.240784      5.379616       3.429762      -12.93465      9.899833      73.15309 26.85191  54.76064 27.69768  18.39246       38.57702  
1 1 1 26 7  6  o 59.12985 27.39116  1.330222       5.122512      -0.2881300     6.032141      5.515441       9.700501      58.09234 27.75259  71.16571 34.30738  -13.07337      44.12711  
1 1 1 26 8  0  o 59.28148 34.38804  4.965738       4.439526      4.965738       4.439526      4.965738       4.439526      59.28148 34.38804  59.28148 34.38804  0.000000       0.000000  
1 1 1 26 8  1  o 75.68633 28.68037  6.098561       3.974741      7.412735       4.747410      3.017834       7.268701      79.66683 31.04274  66.46573 31.37607  13.20110       44.13739  
1 1 1 26 8  2  o 53.22261 25.17773  -0.7914269     4.726854      9.276521       12.76301      -2.391909      5.088713      75.38537 37.00142  51.47928 24.82479  23.90609       44.55755  
1 1 1 26 8  3  o 41.80509 19.75380  -1.570937      2.894051      5.770221       6.264478      -3.562831      3.263140      71.69926 32.04823  39.64068 19.29443  32.05859       37.40807  
1 1 1 26 8  4  o 128.1277 16.54904  12.78988       2.759537      18.96434       5.558290      10.77014       3.178997      132.6092 31.85516  111.3408 22.20618  21.26836       38.83125  
1 1 1 27 0  1  o 58.93929 36.84633  5.066477       5.938536      5.066477       5.938536      5.066477       5.938536      58.93929 36.84633  58.93929 36.84633  0.000000       0.000000  
1 1 1 27 0  2  o 38.76611 27.20021  -2.725835      5.352416      -2.725835      5.352416      -2.725835      5.352416      38.76611 27.20021  38.76611 27.20021  0.000000       0.000000  
1 1 1 27 0  3  f 60.33426 40.13055  5.438528       8.653193      5.438528       8.653193      5.438528       8.653193      60.33426 40.13055  60.33426 40.13055  0.000000       0.000000  
1 1 1 27 1  0  f 36.82723 25.14876  -0.8213499     3.853404      -0.8213499     3.853404      -0.8213499     3.853404      36.82723 25.14876  36.82723 25.14876  0.000000       0.000000  
1 1 1 27 1  1  o 72.74286 25.17060  5.057992       2.970505      4.391570       5.419585      5.344173       3.551497      68.10886 30.16284  72.86134 27.21705  -4.752480      40.62714  
1 1 1 27 1  2  o 49.03688 23.41937  -1.917061      4.288587      4.160573       6.177270      -7.572013      5.958594      67.92795 30.95014  47.74509 23.76208  20.18285       39.01983  
1 1 1 27 1  3  o 86.33731 33.66241  9.708342       5.585195      10.22723       9.899177      9.466025       6.764745      78.34292 36.86987  81.57105 34.92661  -3.228134      50.78637  
1 1 1 27 2  0  o 47.57972 32.50925  0.3897321      6.458258      0.3897321      6.458258      0.3897321      6.458258      47.57972 32.50925  47.57972 32.50925  0.000000       0.000000  
1 1 1 27 2  1  o 44.86432 21.25379  -1.657493      3.391047      -5.182992      5.947595      0.4055676E-01  4.127684      50.60970 24.92309  52.96545 24.55376  -2.355747      34.98639  
1 1 1 27 2  2  o 61.39665 27.78709  2.310101       4.877399      5.003458       7.468807      0.3074669      6.440283      70.33118 32.74842  60.40878 28.80860  9.922409       43.61644  
1 1 1 27 2  3  o 47.99025 23.54176  -4.699192      5.143683      -16.18611      17.37043      -3.595150      5.385200      63.80293 32.66478  50.66985 24.69037  13.13308       40.94633  
1 1 1 27 3  0  o 61.72951 37.01240  5.769201       5.451181      5.769201       5.451181      5.769201       5.451181      61.72951 37.01240  61.72951 37.01240  0.000000       0.000000  
1 1 1 27 3  1  o 69.23907 23.97267  4.431200       2.694656      2.209731       4.776937      5.467999       3.263447      60.88984 27.53424  74.31871 26.33327  -13.42887      38.09955  
# 
#END OF REFLECTIONS
