data_r5j4nsf
# 
_audit.revision_id     1_0 
_audit.creation_date   2016-08-31 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      5j4n 
_cell.length_a      104.7650 
_cell.length_b      175.6350 
_cell.length_c      72.8680 
_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   1.00000 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   2.594 
_diffrn_reflns.pdbx_d_res_low    49.440 
_diffrn_reflns.limit_h_max       39 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       67 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       28 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            41806 
_diffrn_reflns.pdbx_number_obs   41806 
# 
_entry.id   5j4n 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               5j4n 
_symmetry.space_group_name_H-M   "P 21 21 2" 
_symmetry.Int_Tables_number      18 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 "X,  Y,  Z"           
2 "-X,  -Y,  Z"         
3 "X+1/2,  -Y+1/2,  -Z" 
4 "-X+1/2,  Y+1/2,  -Z" 
# 
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.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  o 30.41000  0.4721000     30.41000  0.4721000     30.41000  0.4721000     -0.000000      0.000000  
1 1 1 0  0  3  o 13.05000  0.2249000     13.05000  0.2249000     13.05000  0.2249000     0.000000       0.000000  
1 1 1 0  0  4  o 26.51000  0.4212000     26.51000  0.4212000     26.51000  0.4212000     0.000000       0.000000  
1 1 1 0  0  5  o 30.23000  0.6795000     30.23000  0.6795000     30.23000  0.6795000     0.000000       0.000000  
1 1 1 0  0  6  o 12.80000  0.2529000     12.80000  0.2529000     12.80000  0.2529000     0.000000       0.000000  
1 1 1 0  0  7  o 0.9137000 0.5666000     0.9137000 0.5666000     0.9137000 0.5666000     0.000000       0.000000  
1 1 1 0  0  8  o 5.853000  0.2741000     5.853000  0.2741000     5.853000  0.2741000     0.000000       0.000000  
1 1 1 0  0  9  o 62.74000  0.9798000     62.74000  0.9798000     62.74000  0.9798000     0.000000       0.000000  
1 1 1 0  0  10 o 0.7318000 0.5174000     0.7318000 0.5174000     0.7318000 0.5174000     0.000000       0.000000  
1 1 1 0  0  11 o 1.621000  0.8481000     1.621000  0.8481000     1.621000  0.8481000     0.000000       0.000000  
1 1 1 0  0  12 o 16.02000  0.3637000     16.02000  0.3637000     16.02000  0.3637000     0.000000       0.000000  
1 1 1 0  0  13 o 3.658000  0.8166000     3.658000  0.8166000     3.658000  0.8166000     -0.000000      0.000000  
1 1 1 0  0  14 o 8.864000  0.4206000     8.864000  0.4206000     8.864000  0.4206000     0.000000       0.000000  
1 1 1 0  0  15 o 6.652000  0.5323000     6.652000  0.5323000     6.652000  0.5323000     0.000000       0.000000  
1 1 1 0  0  16 o 2.681000  1.178000      2.681000  1.178000      2.681000  1.178000      -0.000000      0.000000  
1 1 1 0  0  17 o 26.15000  0.5125000     26.15000  0.5125000     26.15000  0.5125000     -0.000000      0.000000  
1 1 1 0  0  18 o 15.47000  0.4587000     15.47000  0.4587000     15.47000  0.4587000     -0.000000      0.000000  
1 1 1 0  0  19 o 2.271000  1.272000      2.271000  1.272000      2.271000  1.272000      -0.000000      0.000000  
1 1 1 0  0  20 o 14.03000  0.5262000     14.03000  0.5262000     14.03000  0.5262000     -0.000000      0.000000  
1 1 1 0  0  21 o 2.760000  1.401000      2.760000  1.401000      2.760000  1.401000      0.000000       0.000000  
1 1 1 0  0  22 o 1.434000  0.9741000     1.434000  0.9741000     1.434000  0.9741000     0.000000       0.000000  
1 1 1 0  0  23 o 6.630000  0.6853000     6.630000  0.6853000     6.630000  0.6853000     0.000000       0.000000  
1 1 1 0  0  24 o 2.652000  1.182000      2.652000  1.182000      2.652000  1.182000      -0.000000      0.000000  
1 1 1 0  0  25 o 1.674000  1.073000      1.674000  1.073000      1.674000  1.073000      0.000000       0.000000  
1 1 1 0  0  26 o 1.542000  0.9701000     1.542000  0.9701000     1.542000  0.9701000     0.000000       0.000000  
1 1 1 0  0  27 o 1.550000  0.9658000     1.550000  0.9658000     1.550000  0.9658000     -0.000000      0.000000  
1 1 1 0  0  28 o 1.683000  1.068000      1.683000  1.068000      1.683000  1.068000      0.000000       0.000000  
1 1 1 0  1  2  o 20.61000  0.2310000     20.61000  0.2310000     20.61000  0.2310000     -0.000000      0.000000  
1 1 1 0  1  3  o 5.446000  0.1088000     5.446000  0.1088000     5.446000  0.1088000     0.000000       0.000000  
1 1 1 0  1  4  o 31.34000  0.3481000     31.34000  0.3481000     31.34000  0.3481000     0.000000       0.000000  
1 1 1 0  1  5  o 22.26000  0.3647000     22.26000  0.3647000     22.26000  0.3647000     0.000000       0.000000  
1 1 1 0  1  6  o 2.039000  0.3470000     2.039000  0.3470000     2.039000  0.3470000     -0.000000      0.000000  
1 1 1 0  1  7  o 8.641000  0.1690000     8.641000  0.1690000     8.641000  0.1690000     -0.000000      0.000000  
1 1 1 0  1  8  o 3.820000  0.2495000     3.820000  0.2495000     3.820000  0.2495000     0.000000       0.000000  
1 1 1 0  1  9  o 12.91000  0.2066000     12.91000  0.2066000     12.91000  0.2066000     -0.000000      0.000000  
1 1 1 0  1  10 o 2.306000  0.5850000     2.306000  0.5850000     2.306000  0.5850000     0.000000       0.000000  
1 1 1 0  1  11 o 0.6535000 0.4622000     0.6535000 0.4622000     0.6535000 0.4622000     0.000000       0.000000  
1 1 1 0  1  12 f 1.999000  0.8127000     1.999000  0.8127000     1.999000  0.8127000     0.000000       0.000000  
1 1 1 0  1  13 f 7.792000  0.2933000     7.792000  0.2933000     7.792000  0.2933000     -0.000000      0.000000  
1 1 1 0  1  14 o 3.921000  0.5741000     3.921000  0.5741000     3.921000  0.5741000     -0.000000      0.000000  
1 1 1 0  1  15 o 3.250000  0.7590000     3.250000  0.7590000     3.250000  0.7590000     -0.000000      0.000000  
1 1 1 0  1  16 o 16.86000  0.3065000     16.86000  0.3065000     16.86000  0.3065000     0.000000       0.000000  
1 1 1 0  1  17 o 13.12000  0.3193000     13.12000  0.3193000     13.12000  0.3193000     0.000000       0.000000  
1 1 1 0  1  18 o 1.693000  1.000000      1.693000  1.000000      1.693000  1.000000      0.000000       0.000000  
1 1 1 0  1  19 f 5.249000  0.6829000     5.249000  0.6829000     5.249000  0.6829000     -0.000000      0.000000  
1 1 1 0  1  20 o 3.138000  1.188000      3.138000  1.188000      3.138000  1.188000      -0.000000      0.000000  
1 1 1 0  1  21 o 1.096000  0.7754000     1.096000  0.7754000     1.096000  0.7754000     -0.000000      0.000000  
1 1 1 0  1  22 o 1.522000  0.9677000     1.522000  0.9677000     1.522000  0.9677000     0.000000       0.000000  
1 1 1 0  1  23 o 1.075000  0.7434000     1.075000  0.7434000     1.075000  0.7434000     -0.000000      0.000000  
1 1 1 0  1  24 o 1.038000  0.7085000     1.038000  0.7085000     1.038000  0.7085000     0.000000       0.000000  
1 1 1 0  1  25 o 1.471000  0.9357000     1.471000  0.9357000     1.471000  0.9357000     0.000000       0.000000  
1 1 1 0  1  26 o 0.9587000 0.6659000     0.9587000 0.6659000     0.9587000 0.6659000     -0.000000      0.000000  
1 1 1 0  1  27 f 1.136000  0.7532000     1.136000  0.7532000     1.136000  0.7532000     0.000000       0.000000  
1 1 1 0  1  28 o 1.459000  0.9223000     1.459000  0.9223000     1.459000  0.9223000     0.000000       0.000000  
1 1 1 0  2  2  o 29.36000  0.3225000     29.36000  0.3225000     29.36000  0.3225000     0.000000       0.000000  
1 1 1 0  2  3  o 25.97000  0.2890000     25.97000  0.2890000     25.97000  0.2890000     -0.000000      0.000000  
1 1 1 0  2  4  o 14.18000  0.1765000     14.18000  0.1765000     14.18000  0.1765000     -0.000000      0.000000  
1 1 1 0  2  5  o 1.759000  0.5130000     1.759000  0.5130000     1.759000  0.5130000     -0.000000      0.000000  
1 1 1 0  2  6  o 1.533000  0.4783000     1.533000  0.4783000     1.533000  0.4783000     -0.000000      0.000000  
1 1 1 0  2  7  o 10.87000  0.1763000     10.87000  0.1763000     10.87000  0.1763000     0.000000       0.000000  
1 1 1 0  2  8  o 11.90000  0.1891000     11.90000  0.1891000     11.90000  0.1891000     0.000000       0.000000  
1 1 1 0  2  9  o 17.99000  0.2392000     17.99000  0.2392000     17.99000  0.2392000     0.000000       0.000000  
1 1 1 0  2  10 o 1.722000  0.6826000     1.722000  0.6826000     1.722000  0.6826000     0.000000       0.000000  
1 1 1 0  2  11 o 5.783000  0.2819000     5.783000  0.2819000     5.783000  0.2819000     0.000000       0.000000  
1 1 1 0  2  12 o 2.791000  0.6623000     2.791000  0.6623000     2.791000  0.6623000     -0.000000      0.000000  
1 1 1 0  2  13 o 1.394000  0.7958000     1.394000  0.7958000     1.394000  0.7958000     -0.000000      0.000000  
1 1 1 0  2  14 o 2.553000  0.8310000     2.553000  0.8310000     2.553000  0.8310000     0.000000       0.000000  
1 1 1 0  2  15 f 4.540000  0.5027000     4.540000  0.5027000     4.540000  0.5027000     0.000000       0.000000  
1 1 1 0  2  16 o 5.983000  0.4390000     5.983000  0.4390000     5.983000  0.4390000     -0.000000      0.000000  
1 1 1 0  2  17 o 2.646000  1.023000      2.646000  1.023000      2.646000  1.023000      0.000000       0.000000  
1 1 1 0  2  18 o 8.032000  0.4129000     8.032000  0.4129000     8.032000  0.4129000     0.000000       0.000000  
1 1 1 0  2  19 o 1.895000  1.083000      1.895000  1.083000      1.895000  1.083000      0.000000       0.000000  
1 1 1 0  2  20 o 1.414000  0.9298000     1.414000  0.9298000     1.414000  0.9298000     -0.000000      0.000000  
1 1 1 0  2  21 o 7.299000  0.5429000     7.299000  0.5429000     7.299000  0.5429000     0.000000       0.000000  
1 1 1 0  2  22 o 1.515000  0.9611000     1.515000  0.9611000     1.515000  0.9611000     -0.000000      0.000000  
1 1 1 0  2  23 f 1.336000  0.8740000     1.336000  0.8740000     1.336000  0.8740000     -0.000000      0.000000  
1 1 1 0  2  24 o 1.260000  0.8094000     1.260000  0.8094000     1.260000  0.8094000     0.000000       0.000000  
1 1 1 0  2  25 o 1.112000  0.7696000     1.112000  0.7696000     1.112000  0.7696000     0.000000       0.000000  
1 1 1 0  2  26 o 1.090000  0.7325000     1.090000  0.7325000     1.090000  0.7325000     0.000000       0.000000  
1 1 1 0  2  27 o 1.735000  0.9357000     1.735000  0.9357000     1.735000  0.9357000     -0.000000      0.000000  
1 1 1 0  2  28 o 1.669000  0.9880000     1.669000  0.9880000     1.669000  0.9880000     0.000000       0.000000  
1 1 1 0  3  1  f 51.54000  0.6456000     51.54000  0.6456000     51.54000  0.6456000     -0.000000      0.000000  
1 1 1 0  3  2  o 73.23000  0.7928000     73.23000  0.7928000     73.23000  0.7928000     0.000000       0.000000  
1 1 1 0  3  3  o 20.04000  0.2286000     20.04000  0.2286000     20.04000  0.2286000     0.000000       0.000000  
1 1 1 0  3  4  o 55.18000  0.6017000     55.18000  0.6017000     55.18000  0.6017000     -0.000000      0.000000  
1 1 1 0  3  5  o 27.62000  0.4427000     27.62000  0.4427000     27.62000  0.4427000     0.000000       0.000000  
1 1 1 0  3  6  o 8.713000  0.1593000     8.713000  0.1593000     8.713000  0.1593000     0.000000       0.000000  
1 1 1 0  3  7  o 33.57000  0.3787000     33.57000  0.3787000     33.57000  0.3787000     0.000000       0.000000  
1 1 1 0  3  8  o 11.88000  0.1896000     11.88000  0.1896000     11.88000  0.1896000     -0.000000      0.000000  
1 1 1 0  3  9  o 5.809000  0.2277000     5.809000  0.2277000     5.809000  0.2277000     -0.000000      0.000000  
1 1 1 0  3  10 f 11.53000  0.2125000     11.53000  0.2125000     11.53000  0.2125000     0.000000       0.000000  
1 1 1 0  3  11 f 7.193000  0.2509000     7.193000  0.2509000     7.193000  0.2509000     -0.000000      0.000000  
1 1 1 0  3  12 o 3.527000  0.5036000     3.527000  0.5036000     3.527000  0.5036000     0.000000       0.000000  
1 1 1 0  3  13 o 10.47000  0.2634000     10.47000  0.2634000     10.47000  0.2634000     -0.000000      0.000000  
1 1 1 0  3  14 o 11.85000  0.2770000     11.85000  0.2770000     11.85000  0.2770000     0.000000       0.000000  
1 1 1 0  3  15 o 3.244000  0.7674000     3.244000  0.7674000     3.244000  0.7674000     -0.000000      0.000000  
1 1 1 0  3  16 o 1.429000  0.8709000     1.429000  0.8709000     1.429000  0.8709000     0.000000       0.000000  
1 1 1 0  3  17 o 2.861000  0.9994000     2.861000  0.9994000     2.861000  0.9994000     -0.000000      0.000000  
1 1 1 0  3  18 f 4.862000  0.6324000     4.862000  0.6324000     4.862000  0.6324000     -0.000000      0.000000  
1 1 1 0  3  19 o 2.058000  1.123000      2.058000  1.123000      2.058000  1.123000      0.000000       0.000000  
1 1 1 0  3  20 o 1.671000  1.035000      1.671000  1.035000      1.671000  1.035000      -0.000000      0.000000  
1 1 1 0  3  21 o 0.9578000 0.6904000     0.9578000 0.6904000     0.9578000 0.6904000     -0.000000      0.000000  
1 1 1 0  3  22 o 1.483000  0.9494000     1.483000  0.9494000     1.483000  0.9494000     -0.000000      0.000000  
1 1 1 0  3  23 o 2.468000  1.105000      2.468000  1.105000      2.468000  1.105000      -0.000000      0.000000  
1 1 1 0  3  24 o 1.196000  0.7850000     1.196000  0.7850000     1.196000  0.7850000     -0.000000      0.000000  
1 1 1 0  3  25 o 1.008000  0.7153000     1.008000  0.7153000     1.008000  0.7153000     -0.000000      0.000000  
1 1 1 0  3  26 o 1.055000  0.7194000     1.055000  0.7194000     1.055000  0.7194000     -0.000000      0.000000  
1 1 1 0  3  27 o 1.000000  0.6888000     1.000000  0.6888000     1.000000  0.6888000     -0.000000      0.000000  
1 1 1 0  3  28 o 0.9194000 0.6574000     0.9194000 0.6574000     0.9194000 0.6574000     0.000000       0.000000  
1 1 1 0  4  1  o 8.863000  0.1625000     8.863000  0.1625000     8.863000  0.1625000     -0.000000      0.000000  
1 1 1 0  4  2  o 24.71000  0.2736000     24.71000  0.2736000     24.71000  0.2736000     -0.000000      0.000000  
1 1 1 0  4  3  o 16.33000  0.1902000     16.33000  0.1902000     16.33000  0.1902000     -0.000000      0.000000  
1 1 1 0  4  4  o 7.863000  0.1338000     7.863000  0.1338000     7.863000  0.1338000     -0.000000      0.000000  
1 1 1 0  4  6  o 60.08000  0.6574000     60.08000  0.6574000     60.08000  0.6574000     -0.000000      0.000000  
1 1 1 0  4  7  o 34.81000  0.3917000     34.81000  0.3917000     34.81000  0.3917000     0.000000       0.000000  
1 1 1 0  4  8  o 7.492000  0.1876000     7.492000  0.1876000     7.492000  0.1876000     0.000000       0.000000  
1 1 1 0  4  9  o 3.409000  0.3413000     3.409000  0.3413000     3.409000  0.3413000     0.000000       0.000000  
1 1 1 0  4  10 o 12.66000  0.3042000     12.66000  0.3042000     12.66000  0.3042000     0.000000       0.000000  
1 1 1 0  4  11 o 16.35000  0.2486000     16.35000  0.2486000     16.35000  0.2486000     0.000000       0.000000  
1 1 1 0  4  12 o 19.43000  0.2785000     19.43000  0.2785000     19.43000  0.2785000     0.000000       0.000000  
1 1 1 0  4  13 o 2.636000  0.8090000     2.636000  0.8090000     2.636000  0.8090000     -0.000000      0.000000  
1 1 1 0  4  14 o 3.157000  0.7218000     3.157000  0.7218000     3.157000  0.7218000     0.000000       0.000000  
1 1 1 0  4  15 o 9.438000  0.3182000     9.438000  0.3182000     9.438000  0.3182000     0.000000       0.000000  
1 1 1 0  4  16 o 4.760000  0.5732000     4.760000  0.5732000     4.760000  0.5732000     -0.000000      0.000000  
1 1 1 0  4  17 o 3.230000  0.9638000     3.230000  0.9638000     3.230000  0.9638000     -0.000000      0.000000  
1 1 1 0  4  18 o 9.348000  0.3926000     9.348000  0.3926000     9.348000  0.3926000     0.000000       0.000000  
1 1 1 0  4  19 o 2.256000  1.154000      2.256000  1.154000      2.256000  1.154000      -0.000000      0.000000  
1 1 1 0  4  20 o 1.469000  0.9662000     1.469000  0.9662000     1.469000  0.9662000     -0.000000      0.000000  
1 1 1 0  4  21 o 1.824000  1.093000      1.824000  1.093000      1.824000  1.093000      0.000000       0.000000  
1 1 1 0  4  22 o 1.532000  0.9762000     1.532000  0.9762000     1.532000  0.9762000     0.000000       0.000000  
1 1 1 0  4  23 o 2.238000  1.101000      2.238000  1.101000      2.238000  1.101000      -0.000000      0.000000  
1 1 1 0  4  24 f 1.074000  0.7306000     1.074000  0.7306000     1.074000  0.7306000     -0.000000      0.000000  
1 1 1 0  4  25 o 1.396000  0.8976000     1.396000  0.8976000     1.396000  0.8976000     0.000000       0.000000  
1 1 1 0  4  26 o 1.271000  0.8159000     1.271000  0.8159000     1.271000  0.8159000     -0.000000      0.000000  
1 1 1 0  4  27 o 1.231000  0.7979000     1.231000  0.7979000     1.231000  0.7979000     -0.000000      0.000000  
1 1 1 0  4  28 o 1.202000  0.8128000     1.202000  0.8128000     1.202000  0.8128000     0.000000       0.000000  
1 1 1 0  5  1  f 10.33000  0.1489000     10.33000  0.1489000     10.33000  0.1489000     0.000000       0.000000  
1 1 1 0  5  2  o 7.548000  0.1232000     7.548000  0.1232000     7.548000  0.1232000     0.000000       0.000000  
1 1 1 0  5  3  o 7.753000  0.1172000     7.753000  0.1172000     7.753000  0.1172000     0.000000       0.000000  
1 1 1 0  5  4  o 15.37000  0.1868000     15.37000  0.1868000     15.37000  0.1868000     -0.000000      0.000000  
1 1 1 0  5  5  o 11.05000  0.2320000     11.05000  0.2320000     11.05000  0.2320000     0.000000       0.000000  
1 1 1 0  5  6  o 4.985000  0.1845000     4.985000  0.1845000     4.985000  0.1845000     -0.000000      0.000000  
1 1 1 0  5  7  o 5.088000  0.2056000     5.088000  0.2056000     5.088000  0.2056000     -0.000000      0.000000  
1 1 1 0  5  8  o 29.94000  0.3448000     29.94000  0.3448000     29.94000  0.3448000     0.000000       0.000000  
1 1 1 0  5  9  o 7.697000  0.2059000     7.697000  0.2059000     7.697000  0.2059000     -0.000000      0.000000  
1 1 1 0  5  10 o 10.23000  0.2942000     10.23000  0.2942000     10.23000  0.2942000     0.000000       0.000000  
1 1 1 0  5  11 o 10.60000  0.2277000     10.60000  0.2277000     10.60000  0.2277000     0.000000       0.000000  
1 1 1 0  5  12 o 10.63000  0.2563000     10.63000  0.2563000     10.63000  0.2563000     0.000000       0.000000  
1 1 1 0  5  13 o 7.231000  0.3149000     7.231000  0.3149000     7.231000  0.3149000     -0.000000      0.000000  
1 1 1 0  5  14 o 0.9536000 0.6544000     0.9536000 0.6544000     0.9536000 0.6544000     -0.000000      0.000000  
1 1 1 0  5  15 o 6.995000  0.3836000     6.995000  0.3836000     6.995000  0.3836000     0.000000       0.000000  
1 1 1 0  5  16 o 1.320000  0.8458000     1.320000  0.8458000     1.320000  0.8458000     0.000000       0.000000  
1 1 1 0  5  17 o 3.092000  0.9927000     3.092000  0.9927000     3.092000  0.9927000     0.000000       0.000000  
1 1 1 0  5  18 o 1.388000  0.8956000     1.388000  0.8956000     1.388000  0.8956000     -0.000000      0.000000  
1 1 1 0  5  19 o 2.889000  1.183000      2.889000  1.183000      2.889000  1.183000      -0.000000      0.000000  
1 1 1 0  5  20 o 1.651000  1.047000      1.651000  1.047000      1.651000  1.047000      -0.000000      0.000000  
1 1 1 0  5  21 o 5.406000  0.7268000     5.406000  0.7268000     5.406000  0.7268000     -0.000000      0.000000  
1 1 1 0  5  22 o 2.025000  1.105000      2.025000  1.105000      2.025000  1.105000      -0.000000      0.000000  
1 1 1 0  5  23 o 2.498000  1.102000      2.498000  1.102000      2.498000  1.102000      0.000000       0.000000  
1 1 1 0  5  24 o 1.297000  0.8372000     1.297000  0.8372000     1.297000  0.8372000     0.000000       0.000000  
1 1 1 0  5  25 o 1.354000  0.8915000     1.354000  0.8915000     1.354000  0.8915000     0.000000       0.000000  
1 1 1 0  5  26 o 1.556000  0.8953000     1.556000  0.8953000     1.556000  0.8953000     0.000000       0.000000  
1 1 1 0  5  27 o 2.436000  0.9742000     2.436000  0.9742000     2.436000  0.9742000     -0.000000      0.000000  
1 1 1 0  5  28 o 0.9563000 0.7021000     0.9563000 0.7021000     0.9563000 0.7021000     -0.000000      0.000000  
1 1 1 0  6  1  o 15.62000  0.1803000     15.62000  0.1803000     15.62000  0.1803000     0.000000       0.000000  
1 1 1 0  6  2  o 67.09000  0.7274000     67.09000  0.7274000     67.09000  0.7274000     -0.000000      0.000000  
1 1 1 0  6  3  o 14.21000  0.2509000     14.21000  0.2509000     14.21000  0.2509000     0.000000       0.000000  
1 1 1 0  6  4  o 25.20000  0.2848000     25.20000  0.2848000     25.20000  0.2848000     -0.000000      0.000000  
1 1 1 0  6  5  o 5.842000  0.2146000     5.842000  0.2146000     5.842000  0.2146000     0.000000       0.000000  
1 1 1 0  6  6  o 35.28000  0.3951000     35.28000  0.3951000     35.28000  0.3951000     0.000000       0.000000  
1 1 1 0  6  7  f 19.50000  0.2417000     19.50000  0.2417000     19.50000  0.2417000     -0.000000      0.000000  
1 1 1 0  6  8  o 4.161000  0.2587000     4.161000  0.2587000     4.161000  0.2587000     0.000000       0.000000  
1 1 1 0  6  9  o 24.88000  0.3011000     24.88000  0.3011000     24.88000  0.3011000     -0.000000      0.000000  
1 1 1 0  6  10 o 16.01000  0.3303000     16.01000  0.3303000     16.01000  0.3303000     -0.000000      0.000000  
1 1 1 0  6  11 o 4.188000  0.3675000     4.188000  0.3675000     4.188000  0.3675000     0.000000       0.000000  
1 1 1 0  6  12 o 9.895000  0.2557000     9.895000  0.2557000     9.895000  0.2557000     0.000000       0.000000  
1 1 1 0  6  13 o 3.257000  0.6866000     3.257000  0.6866000     3.257000  0.6866000     -0.000000      0.000000  
1 1 1 0  6  14 o 7.850000  0.3156000     7.850000  0.3156000     7.850000  0.3156000     0.000000       0.000000  
1 1 1 0  6  15 o 15.02000  0.3375000     15.02000  0.3375000     15.02000  0.3375000     -0.000000      0.000000  
1 1 1 0  6  16 o 8.954000  0.3541000     8.954000  0.3541000     8.954000  0.3541000     -0.000000      0.000000  
1 1 1 0  6  17 o 3.645000  0.8661000     3.645000  0.8661000     3.645000  0.8661000     0.000000       0.000000  
1 1 1 0  6  18 o 6.993000  0.4831000     6.993000  0.4831000     6.993000  0.4831000     0.000000       0.000000  
1 1 1 0  6  19 o 1.252000  0.8527000     1.252000  0.8527000     1.252000  0.8527000     -0.000000      0.000000  
1 1 1 0  6  20 o 2.088000  1.232000      2.088000  1.232000      2.088000  1.232000      0.000000       0.000000  
1 1 1 0  6  21 o 2.044000  1.144000      2.044000  1.144000      2.044000  1.144000      -0.000000      0.000000  
1 1 1 0  6  22 o 3.198000  1.119000      3.198000  1.119000      3.198000  1.119000      -0.000000      0.000000  
1 1 1 0  6  23 o 3.713000  0.9080000     3.713000  0.9080000     3.713000  0.9080000     0.000000       0.000000  
1 1 1 0  6  24 o 2.108000  1.027000      2.108000  1.027000      2.108000  1.027000      0.000000       0.000000  
1 1 1 0  6  25 o 1.864000  1.074000      1.864000  1.074000      1.864000  1.074000      0.000000       0.000000  
1 1 1 0  6  26 o 1.116000  0.7495000     1.116000  0.7495000     1.116000  0.7495000     0.000000       0.000000  
1 1 1 0  6  27 o 0.8532000 0.6093000     0.8532000 0.6093000     0.8532000 0.6093000     0.000000       0.000000  
1 1 1 0  7  1  o 48.22000  0.5248000     48.22000  0.5248000     48.22000  0.5248000     -0.000000      0.000000  
1 1 1 0  7  2  o 6.115000  0.1085000     6.115000  0.1085000     6.115000  0.1085000     0.000000       0.000000  
1 1 1 0  7  3  o 23.07000  0.2616000     23.07000  0.2616000     23.07000  0.2616000     0.000000       0.000000  
1 1 1 0  7  4  o 1.296000  0.4183000     1.296000  0.4183000     1.296000  0.4183000     -0.000000      0.000000  
1 1 1 0  7  5  o 34.54000  0.4424000     34.54000  0.4424000     34.54000  0.4424000     0.000000       0.000000  
1 1 1 0  7  6  o 13.18000  0.2157000     13.18000  0.2157000     13.18000  0.2157000     -0.000000      0.000000  
1 1 1 0  7  7  o 22.07000  0.2651000     22.07000  0.2651000     22.07000  0.2651000     -0.000000      0.000000  
1 1 1 0  7  8  f 2.069000  0.5419000     2.069000  0.5419000     2.069000  0.5419000     -0.000000      0.000000  
1 1 1 0  7  9  o 23.34000  0.2876000     23.34000  0.2876000     23.34000  0.2876000     0.000000       0.000000  
1 1 1 0  7  11 o 17.20000  0.2540000     17.20000  0.2540000     17.20000  0.2540000     0.000000       0.000000  
1 1 1 0  7  12 o 1.108000  0.6915000     1.108000  0.6915000     1.108000  0.6915000     -0.000000      0.000000  
1 1 1 0  7  13 o 8.444000  0.2927000     8.444000  0.2927000     8.444000  0.2927000     0.000000       0.000000  
1 1 1 0  7  14 o 12.19000  0.2791000     12.19000  0.2791000     12.19000  0.2791000     0.000000       0.000000  
1 1 1 0  7  15 o 2.569000  1.146000      2.569000  1.146000      2.569000  1.146000      0.000000       0.000000  
1 1 1 0  7  16 o 1.317000  0.8345000     1.317000  0.8345000     1.317000  0.8345000     0.000000       0.000000  
1 1 1 0  7  17 f 7.743000  0.4057000     7.743000  0.4057000     7.743000  0.4057000     0.000000       0.000000  
1 1 1 0  7  18 o 7.231000  0.4801000     7.231000  0.4801000     7.231000  0.4801000     -0.000000      0.000000  
1 1 1 0  7  19 f 9.923000  0.4051000     9.923000  0.4051000     9.923000  0.4051000     -0.000000      0.000000  
1 1 1 0  7  20 o 1.328000  0.9379000     1.328000  0.9379000     1.328000  0.9379000     -0.000000      0.000000  
1 1 1 0  7  21 o 1.890000  1.106000      1.890000  1.106000      1.890000  1.106000      -0.000000      0.000000  
1 1 1 0  7  22 o 5.162000  0.6847000     5.162000  0.6847000     5.162000  0.6847000     -0.000000      0.000000  
1 1 1 0  7  23 o 3.559000  0.9685000     3.559000  0.9685000     3.559000  0.9685000     -0.000000      0.000000  
1 1 1 0  7  24 o 1.147000  0.7711000     1.147000  0.7711000     1.147000  0.7711000     -0.000000      0.000000  
1 1 1 0  7  26 o 0.8707000 0.6187000     0.8707000 0.6187000     0.8707000 0.6187000     0.000000       0.000000  
1 1 1 0  7  27 o 1.179000  0.7706000     1.179000  0.7706000     1.179000  0.7706000     0.000000       0.000000  
1 1 1 0  8  0  o 12.74000  0.2218000     12.74000  0.2218000     12.74000  0.2218000     -0.000000      0.000000  
1 1 1 0  8  1  o 25.84000  0.2886000     25.84000  0.2886000     25.84000  0.2886000     -0.000000      0.000000  
1 1 1 0  8  2  o 36.85000  0.4050000     36.85000  0.4050000     36.85000  0.4050000     -0.000000      0.000000  
1 1 1 0  8  3  o 14.73000  0.1798000     14.73000  0.1798000     14.73000  0.1798000     0.000000       0.000000  
1 1 1 0  8  5  o 20.49000  0.2753000     20.49000  0.2753000     20.49000  0.2753000     0.000000       0.000000  
1 1 1 0  8  6  o 28.72000  0.3275000     28.72000  0.3275000     28.72000  0.3275000     0.000000       0.000000  
1 1 1 0  8  7  o 18.74000  0.2338000     18.74000  0.2338000     18.74000  0.2338000     0.000000       0.000000  
1 1 1 0  8  8  o 7.795000  0.1906000     7.795000  0.1906000     7.795000  0.1906000     0.000000       0.000000  
1 1 1 0  8  9  o 18.16000  0.2449000     18.16000  0.2449000     18.16000  0.2449000     -0.000000      0.000000  
1 1 1 0  8  11 o 4.885000  0.3353000     4.885000  0.3353000     4.885000  0.3353000     -0.000000      0.000000  
1 1 1 0  8  12 o 1.938000  0.8588000     1.938000  0.8588000     1.938000  0.8588000     -0.000000      0.000000  
1 1 1 0  8  13 o 2.504000  0.8348000     2.504000  0.8348000     2.504000  0.8348000     -0.000000      0.000000  
1 1 1 0  8  14 o 1.320000  0.8070000     1.320000  0.8070000     1.320000  0.8070000     -0.000000      0.000000  
1 1 1 0  8  15 o 5.752000  0.6328000     5.752000  0.6328000     5.752000  0.6328000     -0.000000      0.000000  
1 1 1 0  8  16 f 6.600000  0.4429000     6.600000  0.4429000     6.600000  0.4429000     -0.000000      0.000000  
1 1 1 0  8  17 o 1.415000  0.8935000     1.415000  0.8935000     1.415000  0.8935000     0.000000       0.000000  
1 1 1 0  8  18 o 12.10000  0.3510000     12.10000  0.3510000     12.10000  0.3510000     0.000000       0.000000  
1 1 1 0  8  19 o 9.257000  0.4323000     9.257000  0.4323000     9.257000  0.4323000     0.000000       0.000000  
1 1 1 0  8  20 o 1.583000  1.075000      1.583000  1.075000      1.583000  1.075000      -0.000000      0.000000  
1 1 1 0  8  21 o 3.993000  1.081000      3.993000  1.081000      3.993000  1.081000      -0.000000      0.000000  
1 1 1 0  8  22 o 2.802000  1.176000      2.802000  1.176000      2.802000  1.176000      0.000000       0.000000  
1 1 1 0  8  23 o 1.066000  0.7430000     1.066000  0.7430000     1.066000  0.7430000     0.000000       0.000000  
1 1 1 0  8  24 o 0.8646000 0.6175000     0.8646000 0.6175000     0.8646000 0.6175000     -0.000000      0.000000  
1 1 1 0  8  26 o 1.518000  0.8899000     1.518000  0.8899000     1.518000  0.8899000     -0.000000      0.000000  
1 1 1 0  8  27 o 0.8749000 0.6161000     0.8749000 0.6161000     0.8749000 0.6161000     0.000000       0.000000  
1 1 1 0  9  1  o 11.65000  0.1495000     11.65000  0.1495000     11.65000  0.1495000     -0.000000      0.000000  
1 1 1 0  9  2  o 20.34000  0.2340000     20.34000  0.2340000     20.34000  0.2340000     -0.000000      0.000000  
1 1 1 0  9  3  o 8.619000  0.1325000     8.619000  0.1325000     8.619000  0.1325000     0.000000       0.000000  
1 1 1 0  9  4  o 16.62000  0.2855000     16.62000  0.2855000     16.62000  0.2855000     -0.000000      0.000000  
1 1 1 0  9  5  o 14.57000  0.1866000     14.57000  0.1866000     14.57000  0.1866000     -0.000000      0.000000  
1 1 1 0  9  6  o 24.29000  0.2812000     24.29000  0.2812000     24.29000  0.2812000     0.000000       0.000000  
1 1 1 0  9  7  f 17.18000  0.2504000     17.18000  0.2504000     17.18000  0.2504000     -0.000000      0.000000  
1 1 1 0  9  8  o 15.86000  0.2561000     15.86000  0.2561000     15.86000  0.2561000     0.000000       0.000000  
1 1 1 0  9  9  f 20.83000  0.2662000     20.83000  0.2662000     20.83000  0.2662000     -0.000000      0.000000  
1 1 1 0  9  10 o 4.805000  0.4395000     4.805000  0.4395000     4.805000  0.4395000     0.000000       0.000000  
1 1 1 0  9  11 o 9.294000  0.2466000     9.294000  0.2466000     9.294000  0.2466000     0.000000       0.000000  
1 1 1 0  9  12 o 2.773000  0.7541000     2.773000  0.7541000     2.773000  0.7541000     -0.000000      0.000000  
1 1 1 0  9  13 o 1.818000  0.8685000     1.818000  0.8685000     1.818000  0.8685000     -0.000000      0.000000  
1 1 1 0  9  14 o 1.975000  0.9290000     1.975000  0.9290000     1.975000  0.9290000     0.000000       0.000000  
1 1 1 0  9  15 o 11.01000  0.4375000     11.01000  0.4375000     11.01000  0.4375000     0.000000       0.000000  
1 1 1 0  9  16 o 2.172000  1.041000      2.172000  1.041000      2.172000  1.041000      -0.000000      0.000000  
1 1 1 0  9  17 o 3.934000  0.7877000     3.934000  0.7877000     3.934000  0.7877000     -0.000000      0.000000  
1 1 1 0  9  18 o 10.20000  0.3836000     10.20000  0.3836000     10.20000  0.3836000     0.000000       0.000000  
1 1 1 0  9  19 o 7.670000  0.5022000     7.670000  0.5022000     7.670000  0.5022000     0.000000       0.000000  
1 1 1 0  9  20 o 1.745000  1.155000      1.745000  1.155000      1.745000  1.155000      0.000000       0.000000  
1 1 1 0  9  21 o 2.201000  1.153000      2.201000  1.153000      2.201000  1.153000      -0.000000      0.000000  
1 1 1 0  9  22 o 3.308000  1.125000      3.308000  1.125000      3.308000  1.125000      0.000000       0.000000  
1 1 1 0  9  23 f 1.118000  0.7641000     1.118000  0.7641000     1.118000  0.7641000     0.000000       0.000000  
1 1 1 0  9  24 o 1.657000  0.9417000     1.657000  0.9417000     1.657000  0.9417000     0.000000       0.000000  
1 1 1 0  9  25 f 1.229000  0.8793000     1.229000  0.8793000     1.229000  0.8793000     -0.000000      0.000000  
1 1 1 0  9  26 o 1.372000  0.8491000     1.372000  0.8491000     1.372000  0.8491000     -0.000000      0.000000  
1 1 1 0  9  27 o 1.052000  0.7127000     1.052000  0.7127000     1.052000  0.7127000     0.000000       0.000000  
1 1 1 0  10 0  f 19.37000  0.3178000     19.37000  0.3178000     19.37000  0.3178000     -0.000000      0.000000  
1 1 1 0  10 1  o 0.5365000 0.3297000     0.5365000 0.3297000     0.5365000 0.3297000     0.000000       0.000000  
1 1 1 0  10 2  o 2.854000  0.1618000     2.854000  0.1618000     2.854000  0.1618000     0.000000       0.000000  
1 1 1 0  10 3  o 0.4585000 0.3200000     0.4585000 0.3200000     0.4585000 0.3200000     -0.000000      0.000000  
1 1 1 0  10 4  o 26.05000  0.2963000     26.05000  0.2963000     26.05000  0.2963000     0.000000       0.000000  
1 1 1 0  10 5  o 28.07000  0.3693000     28.07000  0.3693000     28.07000  0.3693000     0.000000       0.000000  
1 1 1 0  10 6  o 40.00000  0.4443000     40.00000  0.4443000     40.00000  0.4443000     0.000000       0.000000  
1 1 1 0  10 7  o 8.057000  0.1941000     8.057000  0.1941000     8.057000  0.1941000     -0.000000      0.000000  
1 1 1 0  10 8  o 32.80000  0.3750000     32.80000  0.3750000     32.80000  0.3750000     -0.000000      0.000000  
1 1 1 0  10 9  o 8.029000  0.1877000     8.029000  0.1877000     8.029000  0.1877000     -0.000000      0.000000  
1 1 1 0  10 10 o 8.002000  0.2799000     8.002000  0.2799000     8.002000  0.2799000     0.000000       0.000000  
1 1 1 0  10 11 o 13.91000  0.2430000     13.91000  0.2430000     13.91000  0.2430000     -0.000000      0.000000  
1 1 1 0  10 12 o 1.109000  0.7038000     1.109000  0.7038000     1.109000  0.7038000     -0.000000      0.000000  
1 1 1 0  10 13 o 3.851000  0.5205000     3.851000  0.5205000     3.851000  0.5205000     0.000000       0.000000  
1 1 1 0  10 14 o 3.608000  0.6673000     3.608000  0.6673000     3.608000  0.6673000     0.000000       0.000000  
1 1 1 0  10 16 o 1.821000  1.001000      1.821000  1.001000      1.821000  1.001000      -0.000000      0.000000  
1 1 1 0  10 17 o 1.039000  0.7273000     1.039000  0.7273000     1.039000  0.7273000     -0.000000      0.000000  
1 1 1 0  10 18 o 7.727000  0.4444000     7.727000  0.4444000     7.727000  0.4444000     0.000000       0.000000  
1 1 1 0  10 19 o 1.561000  0.9935000     1.561000  0.9935000     1.561000  0.9935000     0.000000       0.000000  
1 1 1 0  10 20 o 9.546000  1.166000      9.546000  1.166000      9.546000  1.166000      -0.000000      0.000000  
1 1 1 0  10 21 o 1.756000  1.066000      1.756000  1.066000      1.756000  1.066000      0.000000       0.000000  
1 1 1 0  10 22 o 4.676000  0.7615000     4.676000  0.7615000     4.676000  0.7615000     0.000000       0.000000  
1 1 1 0  10 23 o 0.8885000 0.6352000     0.8885000 0.6352000     0.8885000 0.6352000     0.000000       0.000000  
1 1 1 0  10 24 o 1.225000  0.7988000     1.225000  0.7988000     1.225000  0.7988000     -0.000000      0.000000  
1 1 1 0  10 25 o 1.572000  1.011000      1.572000  1.011000      1.572000  1.011000      0.000000       0.000000  
1 1 1 0  10 26 o 1.330000  0.8173000     1.330000  0.8173000     1.330000  0.8173000     0.000000       0.000000  
1 1 1 0  10 27 o 1.363000  0.8331000     1.363000  0.8331000     1.363000  0.8331000     0.000000       0.000000  
1 1 1 0  11 1  o 4.176000  0.1309000     4.176000  0.1309000     4.176000  0.1309000     -0.000000      0.000000  
1 1 1 0  11 2  o 24.32000  0.3913000     24.32000  0.3913000     24.32000  0.3913000     0.000000       0.000000  
1 1 1 0  11 3  f 13.42000  0.2453000     13.42000  0.2453000     13.42000  0.2453000     -0.000000      0.000000  
1 1 1 0  11 4  o 7.117000  0.1392000     7.117000  0.1392000     7.117000  0.1392000     -0.000000      0.000000  
1 1 1 0  11 5  o 10.77000  0.1598000     10.77000  0.1598000     10.77000  0.1598000     0.000000       0.000000  
1 1 1 0  11 6  o 2.720000  0.2285000     2.720000  0.2285000     2.720000  0.2285000     0.000000       0.000000  
1 1 1 0  11 7  o 23.10000  0.2736000     23.10000  0.2736000     23.10000  0.2736000     0.000000       0.000000  
1 1 1 0  11 8  o 28.07000  0.3279000     28.07000  0.3279000     28.07000  0.3279000     0.000000       0.000000  
1 1 1 0  11 9  o 5.696000  0.2148000     5.696000  0.2148000     5.696000  0.2148000     -0.000000      0.000000  
1 1 1 0  11 10 o 3.405000  0.3208000     3.405000  0.3208000     3.405000  0.3208000     -0.000000      0.000000  
1 1 1 0  11 11 o 12.30000  0.2408000     12.30000  0.2408000     12.30000  0.2408000     -0.000000      0.000000  
1 1 1 0  11 12 o 3.418000  0.5754000     3.418000  0.5754000     3.418000  0.5754000     -0.000000      0.000000  
1 1 1 0  11 13 o 1.132000  0.7199000     1.132000  0.7199000     1.132000  0.7199000     0.000000       0.000000  
1 1 1 0  11 14 o 4.260000  0.5369000     4.260000  0.5369000     4.260000  0.5369000     0.000000       0.000000  
1 1 1 0  11 15 o 17.28000  0.4448000     17.28000  0.4448000     17.28000  0.4448000     0.000000       0.000000  
1 1 1 0  11 16 o 15.69000  0.3220000     15.69000  0.3220000     15.69000  0.3220000     -0.000000      0.000000  
1 1 1 0  11 17 o 8.846000  0.3956000     8.846000  0.3956000     8.846000  0.3956000     0.000000       0.000000  
1 1 1 0  11 18 o 7.417000  0.4735000     7.417000  0.4735000     7.417000  0.4735000     0.000000       0.000000  
1 1 1 0  11 19 o 2.383000  1.214000      2.383000  1.214000      2.383000  1.214000      -0.000000      0.000000  
1 1 1 0  11 21 o 6.089000  0.6390000     6.089000  0.6390000     6.089000  0.6390000     -0.000000      0.000000  
1 1 1 0  11 22 o 1.072000  0.7546000     1.072000  0.7546000     1.072000  0.7546000     0.000000       0.000000  
1 1 1 0  11 23 o 2.095000  1.040000      2.095000  1.040000      2.095000  1.040000      0.000000       0.000000  
1 1 1 0  11 24 o 1.076000  0.7252000     1.076000  0.7252000     1.076000  0.7252000     -0.000000      0.000000  
1 1 1 0  11 25 o 1.304000  0.8883000     1.304000  0.8883000     1.304000  0.8883000     -0.000000      0.000000  
1 1 1 0  11 26 o 0.9198000 0.6434000     0.9198000 0.6434000     0.9198000 0.6434000     -0.000000      0.000000  
1 1 1 0  11 27 o 0.8007000 0.5751000     0.8007000 0.5751000     0.8007000 0.5751000     0.000000       0.000000  
1 1 1 0  12 0  o 31.46000  0.7042000     31.46000  0.7042000     31.46000  0.7042000     -0.000000      0.000000  
1 1 1 0  12 1  o 13.52000  0.2448000     13.52000  0.2448000     13.52000  0.2448000     0.000000       0.000000  
1 1 1 0  12 2  o 3.892000  0.2110000     3.892000  0.2110000     3.892000  0.2110000     -0.000000      0.000000  
1 1 1 0  12 3  o 1.093000  0.4317000     1.093000  0.4317000     1.093000  0.4317000     0.000000       0.000000  
1 1 1 0  12 4  o 9.031000  0.1468000     9.031000  0.1468000     9.031000  0.1468000     -0.000000      0.000000  
1 1 1 0  12 5  o 6.751000  0.2395000     6.751000  0.2395000     6.751000  0.2395000     -0.000000      0.000000  
1 1 1 0  12 6  o 20.94000  0.2505000     20.94000  0.2505000     20.94000  0.2505000     0.000000       0.000000  
1 1 1 0  12 7  o 17.44000  0.2227000     17.44000  0.2227000     17.44000  0.2227000     0.000000       0.000000  
1 1 1 0  12 8  o 17.71000  0.2286000     17.71000  0.2286000     17.71000  0.2286000     -0.000000      0.000000  
1 1 1 0  12 9  o 8.350000  0.2544000     8.350000  0.2544000     8.350000  0.2544000     0.000000       0.000000  
1 1 1 0  12 10 o 3.778000  0.3057000     3.778000  0.3057000     3.778000  0.3057000     0.000000       0.000000  
1 1 1 0  12 11 o 4.990000  0.2825000     4.990000  0.2825000     4.990000  0.2825000     -0.000000      0.000000  
1 1 1 0  12 12 o 3.015000  0.5079000     3.015000  0.5079000     3.015000  0.5079000     -0.000000      0.000000  
1 1 1 0  12 13 o 6.281000  0.3569000     6.281000  0.3569000     6.281000  0.3569000     0.000000       0.000000  
1 1 1 0  12 14 o 3.379000  0.7210000     3.379000  0.7210000     3.379000  0.7210000     0.000000       0.000000  
1 1 1 0  12 15 o 14.55000  0.4300000     14.55000  0.4300000     14.55000  0.4300000     -0.000000      0.000000  
1 1 1 0  12 16 o 1.403000  0.8870000     1.403000  0.8870000     1.403000  0.8870000     -0.000000      0.000000  
1 1 1 0  12 17 o 5.430000  0.5699000     5.430000  0.5699000     5.430000  0.5699000     0.000000       0.000000  
1 1 1 0  12 18 o 1.334000  0.8814000     1.334000  0.8814000     1.334000  0.8814000     -0.000000      0.000000  
1 1 1 0  12 19 o 7.154000  0.5502000     7.154000  0.5502000     7.154000  0.5502000     -0.000000      0.000000  
1 1 1 0  12 20 o 2.094000  1.265000      2.094000  1.265000      2.094000  1.265000      -0.000000      0.000000  
1 1 1 0  12 21 o 2.161000  1.164000      2.161000  1.164000      2.161000  1.164000      0.000000       0.000000  
1 1 1 0  12 22 o 5.251000  0.6276000     5.251000  0.6276000     5.251000  0.6276000     -0.000000      0.000000  
1 1 1 0  12 23 o 2.662000  0.9960000     2.662000  0.9960000     2.662000  0.9960000     -0.000000      0.000000  
1 1 1 0  12 24 o 1.262000  0.8115000     1.262000  0.8115000     1.262000  0.8115000     0.000000       0.000000  
1 1 1 0  12 25 o 1.432000  0.9307000     1.432000  0.9307000     1.432000  0.9307000     0.000000       0.000000  
1 1 1 0  12 26 o 0.8669000 0.6130000     0.8669000 0.6130000     0.8669000 0.6130000     0.000000       0.000000  
1 1 1 0  12 27 o 0.8500000 0.6032000     0.8500000 0.6032000     0.8500000 0.6032000     -0.000000      0.000000  
1 1 1 0  13 1  o 20.52000  0.3396000     20.52000  0.3396000     20.52000  0.3396000     0.000000       0.000000  
1 1 1 0  13 2  o 6.367000  0.1372000     6.367000  0.1372000     6.367000  0.1372000     -0.000000      0.000000  
1 1 1 0  13 3  o 0.9991000 0.4508000     0.9991000 0.4508000     0.9991000 0.4508000     -0.000000      0.000000  
1 1 1 0  13 4  o 12.03000  0.1689000     12.03000  0.1689000     12.03000  0.1689000     -0.000000      0.000000  
1 1 1 0  13 5  o 0.8651000 0.4610000     0.8651000 0.4610000     0.8651000 0.4610000     -0.000000      0.000000  
1 1 1 0  13 6  o 15.63000  0.2761000     15.63000  0.2761000     15.63000  0.2761000     0.000000       0.000000  
1 1 1 0  13 7  o 23.90000  0.2845000     23.90000  0.2845000     23.90000  0.2845000     0.000000       0.000000  
1 1 1 0  13 8  o 9.458000  0.1757000     9.458000  0.1757000     9.458000  0.1757000     -0.000000      0.000000  
1 1 1 0  13 10 o 19.99000  0.2638000     19.99000  0.2638000     19.99000  0.2638000     0.000000       0.000000  
1 1 1 0  13 11 o 13.51000  0.2305000     13.51000  0.2305000     13.51000  0.2305000     0.000000       0.000000  
1 1 1 0  13 12 o 5.186000  0.3044000     5.186000  0.3044000     5.186000  0.3044000     0.000000       0.000000  
1 1 1 0  13 13 o 3.922000  0.4208000     3.922000  0.4208000     3.922000  0.4208000     -0.000000      0.000000  
1 1 1 0  13 14 o 2.462000  0.9613000     2.462000  0.9613000     2.462000  0.9613000     0.000000       0.000000  
1 1 1 0  13 15 o 2.684000  1.075000      2.684000  1.075000      2.684000  1.075000      -0.000000      0.000000  
1 1 1 0  13 16 o 10.28000  0.3604000     10.28000  0.3604000     10.28000  0.3604000     0.000000       0.000000  
1 1 1 0  13 17 o 1.033000  0.7232000     1.033000  0.7232000     1.033000  0.7232000     0.000000       0.000000  
1 1 1 0  13 18 o 1.153000  0.7944000     1.153000  0.7944000     1.153000  0.7944000     0.000000       0.000000  
1 1 1 0  13 19 o 2.425000  1.202000      2.425000  1.202000      2.425000  1.202000      -0.000000      0.000000  
1 1 1 0  13 20 o 7.479000  0.7681000     7.479000  0.7681000     7.479000  0.7681000     0.000000       0.000000  
1 1 1 0  13 21 o 2.158000  1.145000      2.158000  1.145000      2.158000  1.145000      -0.000000      0.000000  
1 1 1 0  13 22 o 2.531000  1.126000      2.531000  1.126000      2.531000  1.126000      -0.000000      0.000000  
1 1 1 0  13 23 o 1.083000  0.7371000     1.083000  0.7371000     1.083000  0.7371000     0.000000       0.000000  
1 1 1 0  13 24 o 0.9494000 0.6620000     0.9494000 0.6620000     0.9494000 0.6620000     -0.000000      0.000000  
1 1 1 0  13 25 o 1.326000  0.8601000     1.326000  0.8601000     1.326000  0.8601000     0.000000       0.000000  
1 1 1 0  13 26 o 1.280000  0.8128000     1.280000  0.8128000     1.280000  0.8128000     0.000000       0.000000  
1 1 1 0  13 27 o 1.840000  0.9504000     1.840000  0.9504000     1.840000  0.9504000     0.000000       0.000000  
1 1 1 0  14 0  o 15.28000  0.2735000     15.28000  0.2735000     15.28000  0.2735000     -0.000000      0.000000  
1 1 1 0  14 1  o 12.36000  0.1682000     12.36000  0.1682000     12.36000  0.1682000     -0.000000      0.000000  
1 1 1 0  14 2  o 12.97000  0.1732000     12.97000  0.1732000     12.97000  0.1732000     -0.000000      0.000000  
1 1 1 0  14 3  o 1.980000  0.2925000     1.980000  0.2925000     1.980000  0.2925000     0.000000       0.000000  
1 1 1 0  14 4  o 25.99000  0.2985000     25.99000  0.2985000     25.99000  0.2985000     0.000000       0.000000  
1 1 1 0  14 5  o 10.86000  0.1662000     10.86000  0.1662000     10.86000  0.1662000     -0.000000      0.000000  
1 1 1 0  14 6  o 43.47000  0.4830000     43.47000  0.4830000     43.47000  0.4830000     0.000000       0.000000  
1 1 1 0  14 7  o 19.75000  0.2458000     19.75000  0.2458000     19.75000  0.2458000     -0.000000      0.000000  
1 1 1 0  14 8  o 11.54000  0.2232000     11.54000  0.2232000     11.54000  0.2232000     -0.000000      0.000000  
1 1 1 0  14 9  o 27.09000  0.4549000     27.09000  0.4549000     27.09000  0.4549000     0.000000       0.000000  
1 1 1 0  14 10 o 12.08000  0.2149000     12.08000  0.2149000     12.08000  0.2149000     0.000000       0.000000  
1 1 1 0  14 11 o 8.507000  0.2314000     8.507000  0.2314000     8.507000  0.2314000     -0.000000      0.000000  
1 1 1 0  14 12 f 2.389000  0.6605000     2.389000  0.6605000     2.389000  0.6605000     0.000000       0.000000  
1 1 1 0  14 13 o 8.931000  0.2627000     8.931000  0.2627000     8.931000  0.2627000     0.000000       0.000000  
1 1 1 0  14 14 o 11.81000  0.2639000     11.81000  0.2639000     11.81000  0.2639000     -0.000000      0.000000  
1 1 1 0  14 15 o 13.68000  0.2789000     13.68000  0.2789000     13.68000  0.2789000     -0.000000      0.000000  
1 1 1 0  14 16 o 6.121000  0.5203000     6.121000  0.5203000     6.121000  0.5203000     -0.000000      0.000000  
1 1 1 0  14 17 o 8.684000  0.4069000     8.684000  0.4069000     8.684000  0.4069000     -0.000000      0.000000  
1 1 1 0  14 18 o 6.016000  0.5808000     6.016000  0.5808000     6.016000  0.5808000     -0.000000      0.000000  
1 1 1 0  14 19 f 9.382000  0.4725000     9.382000  0.4725000     9.382000  0.4725000     -0.000000      0.000000  
1 1 1 0  14 20 o 4.217000  1.156000      4.217000  1.156000      4.217000  1.156000      -0.000000      0.000000  
1 1 1 0  14 21 o 1.291000  0.8670000     1.291000  0.8670000     1.291000  0.8670000     -0.000000      0.000000  
1 1 1 0  14 22 o 1.987000  1.083000      1.987000  1.083000      1.987000  1.083000      0.000000       0.000000  
1 1 1 0  14 23 f 3.309000  0.8765000     3.309000  0.8765000     3.309000  0.8765000     -0.000000      0.000000  
1 1 1 0  14 24 o 1.317000  0.8257000     1.317000  0.8257000     1.317000  0.8257000     0.000000       0.000000  
1 1 1 0  14 25 o 1.220000  0.7855000     1.220000  0.7855000     1.220000  0.7855000     -0.000000      0.000000  
1 1 1 0  14 26 o 1.799000  0.9313000     1.799000  0.9313000     1.799000  0.9313000     0.000000       0.000000  
1 1 1 0  14 27 o 1.315000  0.8202000     1.315000  0.8202000     1.315000  0.8202000     0.000000       0.000000  
1 1 1 0  15 1  o 17.08000  0.2101000     17.08000  0.2101000     17.08000  0.2101000     -0.000000      0.000000  
1 1 1 0  15 2  o 12.47000  0.1715000     12.47000  0.1715000     12.47000  0.1715000     -0.000000      0.000000  
1 1 1 0  15 3  o 10.52000  0.1611000     10.52000  0.1611000     10.52000  0.1611000     0.000000       0.000000  
1 1 1 0  15 4  o 1.641000  0.4114000     1.641000  0.4114000     1.641000  0.4114000     0.000000       0.000000  
1 1 1 0  15 5  o 11.01000  0.2003000     11.01000  0.2003000     11.01000  0.2003000     0.000000       0.000000  
1 1 1 0  15 6  o 6.092000  0.1876000     6.092000  0.1876000     6.092000  0.1876000     0.000000       0.000000  
1 1 1 0  15 7  o 13.82000  0.1964000     13.82000  0.1964000     13.82000  0.1964000     0.000000       0.000000  
1 1 1 0  15 8  o 15.22000  0.3026000     15.22000  0.3026000     15.22000  0.3026000     -0.000000      0.000000  
1 1 1 0  15 9  o 2.343000  0.3824000     2.343000  0.3824000     2.343000  0.3824000     -0.000000      0.000000  
1 1 1 0  15 10 o 9.954000  0.2193000     9.954000  0.2193000     9.954000  0.2193000     0.000000       0.000000  
1 1 1 0  15 11 o 6.892000  0.2487000     6.892000  0.2487000     6.892000  0.2487000     0.000000       0.000000  
1 1 1 0  15 12 f 6.198000  0.2823000     6.198000  0.2823000     6.198000  0.2823000     0.000000       0.000000  
1 1 1 0  15 13 o 25.79000  0.3324000     25.79000  0.3324000     25.79000  0.3324000     -0.000000      0.000000  
1 1 1 0  15 14 o 18.59000  0.3799000     18.59000  0.3799000     18.59000  0.3799000     0.000000       0.000000  
1 1 1 0  15 15 o 5.102000  0.4607000     5.102000  0.4607000     5.102000  0.4607000     -0.000000      0.000000  
1 1 1 0  15 16 o 1.717000  0.9408000     1.717000  0.9408000     1.717000  0.9408000     -0.000000      0.000000  
1 1 1 0  15 17 o 1.116000  0.7737000     1.116000  0.7737000     1.116000  0.7737000     -0.000000      0.000000  
1 1 1 0  15 18 o 7.018000  0.5467000     7.018000  0.5467000     7.018000  0.5467000     0.000000       0.000000  
1 1 1 0  15 19 o 1.393000  0.9325000     1.393000  0.9325000     1.393000  0.9325000     -0.000000      0.000000  
1 1 1 0  15 20 o 4.561000  0.8738000     4.561000  0.8738000     4.561000  0.8738000     -0.000000      0.000000  
1 1 1 0  15 21 o 1.599000  0.9890000     1.599000  0.9890000     1.599000  0.9890000     -0.000000      0.000000  
1 1 1 0  15 22 o 2.136000  1.105000      2.136000  1.105000      2.136000  1.105000      0.000000       0.000000  
1 1 1 0  15 23 o 1.752000  0.9452000     1.752000  0.9452000     1.752000  0.9452000     0.000000       0.000000  
1 1 1 0  15 24 o 1.513000  0.8772000     1.513000  0.8772000     1.513000  0.8772000     0.000000       0.000000  
1 1 1 0  15 25 f 1.195000  0.7791000     1.195000  0.7791000     1.195000  0.7791000     -0.000000      0.000000  
1 1 1 0  15 26 o 1.152000  0.7552000     1.152000  0.7552000     1.152000  0.7552000     0.000000       0.000000  
1 1 1 0  15 27 o 0.7175000 0.5218000     0.7175000 0.5218000     0.7175000 0.5218000     -0.000000      0.000000  
1 1 1 0  16 0  o 15.64000  0.2811000     15.64000  0.2811000     15.64000  0.2811000     -0.000000      0.000000  
1 1 1 0  16 1  o 23.58000  0.2735000     23.58000  0.2735000     23.58000  0.2735000     -0.000000      0.000000  
1 1 1 0  16 2  o 2.185000  0.2683000     2.185000  0.2683000     2.185000  0.2683000     -0.000000      0.000000  
1 1 1 0  16 3  o 10.01000  0.1595000     10.01000  0.1595000     10.01000  0.1595000     -0.000000      0.000000  
1 1 1 0  16 4  o 11.39000  0.1706000     11.39000  0.1706000     11.39000  0.1706000     -0.000000      0.000000  
1 1 1 0  16 5  o 9.952000  0.1669000     9.952000  0.1669000     9.952000  0.1669000     -0.000000      0.000000  
1 1 1 0  16 6  o 3.835000  0.2147000     3.835000  0.2147000     3.835000  0.2147000     -0.000000      0.000000  
1 1 1 0  16 7  o 16.81000  0.2623000     16.81000  0.2623000     16.81000  0.2623000     -0.000000      0.000000  
1 1 1 0  16 9  o 6.246000  0.1980000     6.246000  0.1980000     6.246000  0.1980000     -0.000000      0.000000  
1 1 1 0  16 10 o 8.048000  0.2572000     8.048000  0.2572000     8.048000  0.2572000     -0.000000      0.000000  
1 1 1 0  16 11 o 2.409000  0.8781000     2.409000  0.8781000     2.409000  0.8781000     0.000000       0.000000  
1 1 1 0  16 12 o 13.61000  0.2459000     13.61000  0.2459000     13.61000  0.2459000     -0.000000      0.000000  
1 1 1 0  16 13 o 6.686000  0.3011000     6.686000  0.3011000     6.686000  0.3011000     0.000000       0.000000  
1 1 1 0  16 15 o 12.88000  0.2965000     12.88000  0.2965000     12.88000  0.2965000     0.000000       0.000000  
1 1 1 0  16 16 o 4.009000  0.6147000     4.009000  0.6147000     4.009000  0.6147000     -0.000000      0.000000  
1 1 1 0  16 17 o 1.077000  0.7242000     1.077000  0.7242000     1.077000  0.7242000     -0.000000      0.000000  
1 1 1 0  16 18 o 2.680000  1.070000      2.680000  1.070000      2.680000  1.070000      0.000000       0.000000  
1 1 1 0  16 19 o 1.458000  0.9897000     1.458000  0.9897000     1.458000  0.9897000     0.000000       0.000000  
1 1 1 0  16 20 o 1.182000  0.8223000     1.182000  0.8223000     1.182000  0.8223000     0.000000       0.000000  
1 1 1 0  16 21 o 2.553000  1.157000      2.553000  1.157000      2.553000  1.157000      0.000000       0.000000  
1 1 1 0  16 22 o 3.800000  0.8881000     3.800000  0.8881000     3.800000  0.8881000     0.000000       0.000000  
1 1 1 0  16 23 o 0.7865000 0.5665000     0.7865000 0.5665000     0.7865000 0.5665000     -0.000000      0.000000  
1 1 1 0  16 24 o 1.426000  0.8816000     1.426000  0.8816000     1.426000  0.8816000     0.000000       0.000000  
1 1 1 0  16 25 o 1.667000  0.9131000     1.667000  0.9131000     1.667000  0.9131000     -0.000000      0.000000  
1 1 1 0  16 26 f 1.570000  0.8861000     1.570000  0.8861000     1.570000  0.8861000     0.000000       0.000000  
1 1 1 0  16 27 o 1.128000  0.7451000     1.128000  0.7451000     1.128000  0.7451000     0.000000       0.000000  
1 1 1 0  17 1  o 5.582000  0.1545000     5.582000  0.1545000     5.582000  0.1545000     0.000000       0.000000  
1 1 1 0  17 2  o 7.549000  0.1515000     7.549000  0.1515000     7.549000  0.1515000     -0.000000      0.000000  
1 1 1 0  17 3  o 19.65000  0.2373000     19.65000  0.2373000     19.65000  0.2373000     0.000000       0.000000  
1 1 1 0  17 4  o 5.134000  0.1689000     5.134000  0.1689000     5.134000  0.1689000     0.000000       0.000000  
1 1 1 0  17 5  o 4.941000  0.1834000     4.941000  0.1834000     4.941000  0.1834000     -0.000000      0.000000  
1 1 1 0  17 6  o 10.84000  0.1794000     10.84000  0.1794000     10.84000  0.1794000     0.000000       0.000000  
1 1 1 0  17 7  o 25.73000  0.3045000     25.73000  0.3045000     25.73000  0.3045000     -0.000000      0.000000  
1 1 1 0  17 8  o 9.062000  0.2606000     9.062000  0.2606000     9.062000  0.2606000     -0.000000      0.000000  
1 1 1 0  17 9  o 0.8044000 0.5052000     0.8044000 0.5052000     0.8044000 0.5052000     0.000000       0.000000  
1 1 1 0  17 10 o 8.694000  0.2044000     8.694000  0.2044000     8.694000  0.2044000     0.000000       0.000000  
1 1 1 0  17 11 o 6.333000  0.2289000     6.333000  0.2289000     6.333000  0.2289000     -0.000000      0.000000  
1 1 1 0  17 12 o 6.089000  0.2987000     6.089000  0.2987000     6.089000  0.2987000     -0.000000      0.000000  
1 1 1 0  17 13 o 10.87000  0.2568000     10.87000  0.2568000     10.87000  0.2568000     0.000000       0.000000  
1 1 1 0  17 14 o 29.17000  0.7582000     29.17000  0.7582000     29.17000  0.7582000     0.000000       0.000000  
1 1 1 0  17 15 o 8.647000  0.3429000     8.647000  0.3429000     8.647000  0.3429000     -0.000000      0.000000  
1 1 1 0  17 16 o 6.004000  0.4257000     6.004000  0.4257000     6.004000  0.4257000     -0.000000      0.000000  
1 1 1 0  17 17 o 11.04000  0.3219000     11.04000  0.3219000     11.04000  0.3219000     -0.000000      0.000000  
1 1 1 0  17 18 o 1.262000  0.8416000     1.262000  0.8416000     1.262000  0.8416000     0.000000       0.000000  
1 1 1 0  17 19 o 1.199000  0.8415000     1.199000  0.8415000     1.199000  0.8415000     0.000000       0.000000  
1 1 1 0  17 20 o 4.768000  0.6620000     4.768000  0.6620000     4.768000  0.6620000     0.000000       0.000000  
1 1 1 0  17 21 o 1.823000  1.045000      1.823000  1.045000      1.823000  1.045000      -0.000000      0.000000  
1 1 1 0  17 22 o 1.985000  1.044000      1.985000  1.044000      1.985000  1.044000      0.000000       0.000000  
1 1 1 0  17 23 o 2.556000  0.9598000     2.556000  0.9598000     2.556000  0.9598000     -0.000000      0.000000  
1 1 1 0  17 24 o 1.395000  0.8997000     1.395000  0.8997000     1.395000  0.8997000     -0.000000      0.000000  
1 1 1 0  17 25 o 0.9476000 0.6576000     0.9476000 0.6576000     0.9476000 0.6576000     -0.000000      0.000000  
1 1 1 0  17 26 o 1.445000  0.8610000     1.445000  0.8610000     1.445000  0.8610000     -0.000000      0.000000  
1 1 1 0  17 27 o 1.116000  0.7368000     1.116000  0.7368000     1.116000  0.7368000     -0.000000      0.000000  
1 1 1 0  18 0  o 1.982000  0.5041000     1.982000  0.5041000     1.982000  0.5041000     0.000000       0.000000  
1 1 1 0  18 1  o 3.708000  0.1904000     3.708000  0.1904000     3.708000  0.1904000     0.000000       0.000000  
1 1 1 0  18 2  o 2.359000  0.2727000     2.359000  0.2727000     2.359000  0.2727000     0.000000       0.000000  
1 1 1 0  18 3  o 10.92000  0.1689000     10.92000  0.1689000     10.92000  0.1689000     -0.000000      0.000000  
1 1 1 0  18 4  o 18.52000  0.2307000     18.52000  0.2307000     18.52000  0.2307000     -0.000000      0.000000  
1 1 1 0  18 5  o 13.08000  0.1901000     13.08000  0.1901000     13.08000  0.1901000     0.000000       0.000000  
1 1 1 0  18 6  o 5.114000  0.2123000     5.114000  0.2123000     5.114000  0.2123000     0.000000       0.000000  
1 1 1 0  18 7  o 1.518000  0.6804000     1.518000  0.6804000     1.518000  0.6804000     0.000000       0.000000  
1 1 1 0  18 8  o 0.8723000 0.5137000     0.8723000 0.5137000     0.8723000 0.5137000     -0.000000      0.000000  
1 1 1 0  18 9  o 8.367000  0.2386000     8.367000  0.2386000     8.367000  0.2386000     -0.000000      0.000000  
1 1 1 0  18 10 o 8.393000  0.2068000     8.393000  0.2068000     8.393000  0.2068000     -0.000000      0.000000  
1 1 1 0  18 11 o 11.58000  0.2151000     11.58000  0.2151000     11.58000  0.2151000     -0.000000      0.000000  
1 1 1 0  18 12 o 8.063000  0.2660000     8.063000  0.2660000     8.063000  0.2660000     -0.000000      0.000000  
1 1 1 0  18 13 o 4.786000  0.3815000     4.786000  0.3815000     4.786000  0.3815000     0.000000       0.000000  
1 1 1 0  18 14 o 3.693000  1.091000      3.693000  1.091000      3.693000  1.091000      0.000000       0.000000  
1 1 1 0  18 15 o 10.94000  0.3145000     10.94000  0.3145000     10.94000  0.3145000     0.000000       0.000000  
1 1 1 0  18 16 o 5.459000  0.4437000     5.459000  0.4437000     5.459000  0.4437000     0.000000       0.000000  
1 1 1 0  18 17 o 2.253000  1.028000      2.253000  1.028000      2.253000  1.028000      0.000000       0.000000  
1 1 1 0  18 18 o 13.11000  0.3438000     13.11000  0.3438000     13.11000  0.3438000     0.000000       0.000000  
1 1 1 0  18 20 o 3.054000  0.9898000     3.054000  0.9898000     3.054000  0.9898000     0.000000       0.000000  
1 1 1 0  18 21 o 1.319000  0.8433000     1.319000  0.8433000     1.319000  0.8433000     0.000000       0.000000  
1 1 1 0  18 22 o 1.126000  0.7467000     1.126000  0.7467000     1.126000  0.7467000     -0.000000      0.000000  
1 1 1 0  18 23 o 0.7015000 0.5084000     0.7015000 0.5084000     0.7015000 0.5084000     -0.000000      0.000000  
1 1 1 0  18 24 o 0.9981000 0.7219000     0.9981000 0.7219000     0.9981000 0.7219000     -0.000000      0.000000  
1 1 1 0  18 25 o 2.437000  0.9318000     2.437000  0.9318000     2.437000  0.9318000     -0.000000      0.000000  
1 1 1 0  18 26 o 0.7970000 0.5700000     0.7970000 0.5700000     0.7970000 0.5700000     -0.000000      0.000000  
1 1 1 0  18 27 o 0.8778000 0.6247000     0.8778000 0.6247000     0.8778000 0.6247000     -0.000000      0.000000  
1 1 1 0  19 1  o 9.013000  0.1598000     9.013000  0.1598000     9.013000  0.1598000     -0.000000      0.000000  
1 1 1 0  19 2  o 3.872000  0.2017000     3.872000  0.2017000     3.872000  0.2017000     0.000000       0.000000  
1 1 1 0  19 3  o 18.40000  0.2294000     18.40000  0.2294000     18.40000  0.2294000     -0.000000      0.000000  
1 1 1 0  19 4  o 17.02000  0.2562000     17.02000  0.2562000     17.02000  0.2562000     0.000000       0.000000  
1 1 1 0  19 5  o 8.770000  0.1721000     8.770000  0.1721000     8.770000  0.1721000     -0.000000      0.000000  
1 1 1 0  19 6  o 7.622000  0.1789000     7.622000  0.1789000     7.622000  0.1789000     0.000000       0.000000  
1 1 1 0  19 7  o 5.907000  0.5219000     5.907000  0.5219000     5.907000  0.5219000     0.000000       0.000000  
1 1 1 0  19 8  o 2.908000  0.3168000     2.908000  0.3168000     2.908000  0.3168000     -0.000000      0.000000  
1 1 1 0  19 9  o 4.181000  0.2612000     4.181000  0.2612000     4.181000  0.2612000     0.000000       0.000000  
1 1 1 0  19 10 o 9.628000  0.2035000     9.628000  0.2035000     9.628000  0.2035000     0.000000       0.000000  
1 1 1 0  19 11 o 2.982000  0.4238000     2.982000  0.4238000     2.982000  0.4238000     -0.000000      0.000000  
1 1 1 0  19 12 o 3.554000  0.4040000     3.554000  0.4040000     3.554000  0.4040000     0.000000       0.000000  
1 1 1 0  19 13 f 12.67000  0.2955000     12.67000  0.2955000     12.67000  0.2955000     -0.000000      0.000000  
1 1 1 0  19 14 o 13.36000  0.3566000     13.36000  0.3566000     13.36000  0.3566000     0.000000       0.000000  
1 1 1 0  19 15 o 23.79000  0.3358000     23.79000  0.3358000     23.79000  0.3358000     0.000000       0.000000  
1 1 1 0  19 16 o 1.736000  0.9373000     1.736000  0.9373000     1.736000  0.9373000     -0.000000      0.000000  
1 1 1 0  19 17 o 9.013000  0.3657000     9.013000  0.3657000     9.013000  0.3657000     0.000000       0.000000  
1 1 1 0  19 18 o 5.431000  0.6050000     5.431000  0.6050000     5.431000  0.6050000     -0.000000      0.000000  
1 1 1 0  19 19 o 14.28000  0.7700000     14.28000  0.7700000     14.28000  0.7700000     -0.000000      0.000000  
1 1 1 0  19 20 o 7.034000  0.4680000     7.034000  0.4680000     7.034000  0.4680000     -0.000000      0.000000  
1 1 1 0  19 21 o 3.975000  0.7181000     3.975000  0.7181000     3.975000  0.7181000     -0.000000      0.000000  
1 1 1 0  19 22 o 0.9834000 0.6747000     0.9834000 0.6747000     0.9834000 0.6747000     -0.000000      0.000000  
1 1 1 0  19 23 o 1.139000  0.7359000     1.139000  0.7359000     1.139000  0.7359000     -0.000000      0.000000  
1 1 1 0  19 24 o 1.966000  1.230000      1.966000  1.230000      1.966000  1.230000      0.000000       0.000000  
1 1 1 0  19 25 o 1.318000  0.7932000     1.318000  0.7932000     1.318000  0.7932000     0.000000       0.000000  
1 1 1 0  19 26 o 1.125000  0.7304000     1.125000  0.7304000     1.125000  0.7304000     -0.000000      0.000000  
1 1 1 0  20 0  o 30.88000  0.4969000     30.88000  0.4969000     30.88000  0.4969000     0.000000       0.000000  
1 1 1 0  20 1  o 14.24000  0.1945000     14.24000  0.1945000     14.24000  0.1945000     -0.000000      0.000000  
1 1 1 0  20 2  o 2.309000  0.3155000     2.309000  0.3155000     2.309000  0.3155000     -0.000000      0.000000  
1 1 1 0  20 3  o 3.024000  0.2521000     3.024000  0.2521000     3.024000  0.2521000     0.000000       0.000000  
1 1 1 0  20 4  o 14.54000  0.2001000     14.54000  0.2001000     14.54000  0.2001000     -0.000000      0.000000  
1 1 1 0  20 5  o 17.78000  0.2296000     17.78000  0.2296000     17.78000  0.2296000     0.000000       0.000000  
1 1 1 0  20 6  o 9.948000  0.2601000     9.948000  0.2601000     9.948000  0.2601000     0.000000       0.000000  
1 1 1 0  20 7  o 6.886000  0.1919000     6.886000  0.1919000     6.886000  0.1919000     -0.000000      0.000000  
1 1 1 0  20 8  o 0.9976000 0.5634000     0.9976000 0.5634000     0.9976000 0.5634000     -0.000000      0.000000  
1 1 1 0  20 9  o 3.985000  0.2834000     3.985000  0.2834000     3.985000  0.2834000     0.000000       0.000000  
1 1 1 0  20 10 o 1.182000  0.6445000     1.182000  0.6445000     1.182000  0.6445000     -0.000000      0.000000  
1 1 1 0  20 11 o 3.391000  0.3693000     3.391000  0.3693000     3.391000  0.3693000     0.000000       0.000000  
1 1 1 0  20 12 o 7.474000  0.2432000     7.474000  0.2432000     7.474000  0.2432000     -0.000000      0.000000  
1 1 1 0  20 13 o 22.46000  0.4280000     22.46000  0.4280000     22.46000  0.4280000     -0.000000      0.000000  
1 1 1 0  20 14 o 8.999000  0.3143000     8.999000  0.3143000     8.999000  0.3143000     0.000000       0.000000  
1 1 1 0  20 15 o 11.53000  0.3433000     11.53000  0.3433000     11.53000  0.3433000     0.000000       0.000000  
1 1 1 0  20 16 o 1.261000  0.8063000     1.261000  0.8063000     1.261000  0.8063000     0.000000       0.000000  
1 1 1 0  20 17 o 9.939000  0.3574000     9.939000  0.3574000     9.939000  0.3574000     0.000000       0.000000  
1 1 1 0  20 18 o 5.336000  0.6453000     5.336000  0.6453000     5.336000  0.6453000     -0.000000      0.000000  
1 1 1 0  20 19 o 1.540000  1.045000      1.540000  1.045000      1.540000  1.045000      -0.000000      0.000000  
1 1 1 0  20 20 o 1.129000  0.7694000     1.129000  0.7694000     1.129000  0.7694000     0.000000       0.000000  
1 1 1 0  20 21 o 1.356000  0.8695000     1.356000  0.8695000     1.356000  0.8695000     -0.000000      0.000000  
1 1 1 0  20 22 f 2.664000  0.9545000     2.664000  0.9545000     2.664000  0.9545000     0.000000       0.000000  
1 1 1 0  20 23 o 0.7368000 0.5309000     0.7368000 0.5309000     0.7368000 0.5309000     -0.000000      0.000000  
1 1 1 0  20 24 o 1.467000  0.9512000     1.467000  0.9512000     1.467000  0.9512000     -0.000000      0.000000  
1 1 1 0  20 25 o 0.9456000 0.6465000     0.9456000 0.6465000     0.9456000 0.6465000     -0.000000      0.000000  
1 1 1 0  20 26 o 0.7629000 0.5426000     0.7629000 0.5426000     0.7629000 0.5426000     -0.000000      0.000000  
1 1 1 0  21 1  f 7.488000  0.1657000     7.488000  0.1657000     7.488000  0.1657000     -0.000000      0.000000  
1 1 1 0  21 2  o 15.26000  0.2047000     15.26000  0.2047000     15.26000  0.2047000     -0.000000      0.000000  
1 1 1 0  21 3  o 6.441000  0.1713000     6.441000  0.1713000     6.441000  0.1713000     -0.000000      0.000000  
1 1 1 0  21 4  o 4.621000  0.2046000     4.621000  0.2046000     4.621000  0.2046000     0.000000       0.000000  
1 1 1 0  21 5  o 4.443000  0.2098000     4.443000  0.2098000     4.443000  0.2098000     -0.000000      0.000000  
1 1 1 0  21 6  o 7.933000  0.2627000     7.933000  0.2627000     7.933000  0.2627000     -0.000000      0.000000  
1 1 1 0  21 7  o 11.58000  0.2327000     11.58000  0.2327000     11.58000  0.2327000     0.000000       0.000000  
1 1 1 0  21 8  o 7.988000  0.2047000     7.988000  0.2047000     7.988000  0.2047000     0.000000       0.000000  
1 1 1 0  21 9  o 0.7121000 0.4765000     0.7121000 0.4765000     0.7121000 0.4765000     -0.000000      0.000000  
1 1 1 0  21 10 o 10.38000  0.2131000     10.38000  0.2131000     10.38000  0.2131000     0.000000       0.000000  
1 1 1 0  21 11 o 4.831000  0.2855000     4.831000  0.2855000     4.831000  0.2855000     -0.000000      0.000000  
1 1 1 0  21 12 o 2.893000  0.5218000     2.893000  0.5218000     2.893000  0.5218000     -0.000000      0.000000  
1 1 1 0  21 13 o 1.495000  0.8658000     1.495000  0.8658000     1.495000  0.8658000     -0.000000      0.000000  
1 1 1 0  21 14 o 7.177000  0.3592000     7.177000  0.3592000     7.177000  0.3592000     -0.000000      0.000000  
1 1 1 0  21 15 o 5.528000  0.4534000     5.528000  0.4534000     5.528000  0.4534000     0.000000       0.000000  
1 1 1 0  21 16 o 4.206000  0.6177000     4.206000  0.6177000     4.206000  0.6177000     -0.000000      0.000000  
1 1 1 0  21 17 o 6.500000  0.4774000     6.500000  0.4774000     6.500000  0.4774000     0.000000       0.000000  
1 1 1 0  21 18 o 5.783000  0.5857000     5.783000  0.5857000     5.783000  0.5857000     0.000000       0.000000  
1 1 1 0  21 20 o 1.355000  0.8618000     1.355000  0.8618000     1.355000  0.8618000     -0.000000      0.000000  
1 1 1 0  21 21 o 1.275000  0.8171000     1.275000  0.8171000     1.275000  0.8171000     0.000000       0.000000  
1 1 1 0  21 22 o 2.109000  0.9748000     2.109000  0.9748000     2.109000  0.9748000     -0.000000      0.000000  
1 1 1 0  21 23 o 2.392000  0.9059000     2.392000  0.9059000     2.392000  0.9059000     0.000000       0.000000  
1 1 1 0  21 24 o 0.7519000 0.5400000     0.7519000 0.5400000     0.7519000 0.5400000     -0.000000      0.000000  
1 1 1 0  21 25 o 1.058000  0.6961000     1.058000  0.6961000     1.058000  0.6961000     -0.000000      0.000000  
1 1 1 0  21 26 o 1.355000  0.8102000     1.355000  0.8102000     1.355000  0.8102000     -0.000000      0.000000  
1 1 1 0  22 0  o 4.786000  0.2706000     4.786000  0.2706000     4.786000  0.2706000     -0.000000      0.000000  
1 1 1 0  22 1  o 1.776000  0.4522000     1.776000  0.4522000     1.776000  0.4522000     0.000000       0.000000  
1 1 1 0  22 2  o 7.686000  0.1702000     7.686000  0.1702000     7.686000  0.1702000     0.000000       0.000000  
1 1 1 0  22 3  o 2.605000  0.3052000     2.605000  0.3052000     2.605000  0.3052000     -0.000000      0.000000  
1 1 1 0  22 4  o 10.74000  0.1815000     10.74000  0.1815000     10.74000  0.1815000     -0.000000      0.000000  
1 1 1 0  22 6  o 5.028000  0.2170000     5.028000  0.2170000     5.028000  0.2170000     -0.000000      0.000000  
1 1 1 0  22 7  o 5.277000  0.2197000     5.277000  0.2197000     5.277000  0.2197000     -0.000000      0.000000  
1 1 1 0  22 8  o 1.038000  0.5887000     1.038000  0.5887000     1.038000  0.5887000     0.000000       0.000000  
1 1 1 0  22 9  o 6.376000  0.2253000     6.376000  0.2253000     6.376000  0.2253000     -0.000000      0.000000  
1 1 1 0  22 10 f 15.64000  0.2343000     15.64000  0.2343000     15.64000  0.2343000     0.000000       0.000000  
1 1 1 0  22 11 o 19.02000  0.2640000     19.02000  0.2640000     19.02000  0.2640000     -0.000000      0.000000  
1 1 1 0  22 12 o 12.08000  0.2322000     12.08000  0.2322000     12.08000  0.2322000     0.000000       0.000000  
1 1 1 0  22 13 o 6.304000  0.3857000     6.304000  0.3857000     6.304000  0.3857000     -0.000000      0.000000  
1 1 1 0  22 14 o 3.727000  0.6887000     3.727000  0.6887000     3.727000  0.6887000     -0.000000      0.000000  
1 1 1 0  22 15 o 3.271000  0.7852000     3.271000  0.7852000     3.271000  0.7852000     0.000000       0.000000  
1 1 1 0  22 16 o 2.205000  0.9949000     2.205000  0.9949000     2.205000  0.9949000     0.000000       0.000000  
1 1 1 0  22 17 o 2.227000  1.086000      2.227000  1.086000      2.227000  1.086000      0.000000       0.000000  
1 1 1 0  22 18 o 3.711000  1.154000      3.711000  1.154000      3.711000  1.154000      0.000000       0.000000  
1 1 1 0  22 19 o 5.645000  0.5455000     5.645000  0.5455000     5.645000  0.5455000     -0.000000      0.000000  
1 1 1 0  22 20 o 6.007000  0.5060000     6.007000  0.5060000     6.007000  0.5060000     0.000000       0.000000  
1 1 1 0  22 21 o 2.828000  0.9499000     2.828000  0.9499000     2.828000  0.9499000     0.000000       0.000000  
1 1 1 0  22 22 o 1.669000  0.8981000     1.669000  0.8981000     1.669000  0.8981000     0.000000       0.000000  
1 1 1 0  22 23 f 1.785000  0.9015000     1.785000  0.9015000     1.785000  0.9015000     -0.000000      0.000000  
1 1 1 0  22 24 o 1.571000  0.8628000     1.571000  0.8628000     1.571000  0.8628000     -0.000000      0.000000  
1 1 1 0  22 25 o 0.7562000 0.5414000     0.7562000 0.5414000     0.7562000 0.5414000     -0.000000      0.000000  
1 1 1 0  22 26 o 0.9143000 0.6301000     0.9143000 0.6301000     0.9143000 0.6301000     -0.000000      0.000000  
1 1 1 0  23 1  o 6.046000  0.1802000     6.046000  0.1802000     6.046000  0.1802000     0.000000       0.000000  
1 1 1 0  23 2  o 22.37000  0.2701000     22.37000  0.2701000     22.37000  0.2701000     -0.000000      0.000000  
1 1 1 0  23 3  f 8.283000  0.1763000     8.283000  0.1763000     8.283000  0.1763000     0.000000       0.000000  
1 1 1 0  23 4  o 7.714000  0.2664000     7.714000  0.2664000     7.714000  0.2664000     0.000000       0.000000  
1 1 1 0  23 5  o 6.506000  0.2643000     6.506000  0.2643000     6.506000  0.2643000     -0.000000      0.000000  
1 1 1 0  23 6  o 1.001000  0.5603000     1.001000  0.5603000     1.001000  0.5603000     -0.000000      0.000000  
1 1 1 0  23 7  o 6.960000  0.2049000     6.960000  0.2049000     6.960000  0.2049000     0.000000       0.000000  
1 1 1 0  23 8  o 14.33000  0.2207000     14.33000  0.2207000     14.33000  0.2207000     -0.000000      0.000000  
1 1 1 0  23 9  o 3.641000  0.3178000     3.641000  0.3178000     3.641000  0.3178000     -0.000000      0.000000  
1 1 1 0  23 10 o 5.907000  0.2487000     5.907000  0.2487000     5.907000  0.2487000     -0.000000      0.000000  
1 1 1 0  23 11 o 9.091000  0.2335000     9.091000  0.2335000     9.091000  0.2335000     -0.000000      0.000000  
1 1 1 0  23 13 o 5.901000  0.3144000     5.901000  0.3144000     5.901000  0.3144000     0.000000       0.000000  
1 1 1 0  23 14 o 6.962000  0.3290000     6.962000  0.3290000     6.962000  0.3290000     0.000000       0.000000  
1 1 1 0  23 15 o 6.666000  0.3882000     6.666000  0.3882000     6.666000  0.3882000     0.000000       0.000000  
1 1 1 0  23 16 o 4.839000  0.5616000     4.839000  0.5616000     4.839000  0.5616000     0.000000       0.000000  
1 1 1 0  23 17 o 1.870000  1.037000      1.870000  1.037000      1.870000  1.037000      -0.000000      0.000000  
1 1 1 0  23 18 o 3.852000  1.356000      3.852000  1.356000      3.852000  1.356000      -0.000000      0.000000  
1 1 1 0  23 19 o 3.956000  0.8092000     3.956000  0.8092000     3.956000  0.8092000     0.000000       0.000000  
1 1 1 0  23 20 o 3.081000  0.9996000     3.081000  0.9996000     3.081000  0.9996000     0.000000       0.000000  
1 1 1 0  23 21 o 2.074000  0.9815000     2.074000  0.9815000     2.074000  0.9815000     -0.000000      0.000000  
1 1 1 0  23 22 o 1.318000  0.8209000     1.318000  0.8209000     1.318000  0.8209000     0.000000       0.000000  
1 1 1 0  23 23 o 1.821000  0.9577000     1.821000  0.9577000     1.821000  0.9577000     -0.000000      0.000000  
1 1 1 0  23 24 o 1.405000  0.8124000     1.405000  0.8124000     1.405000  0.8124000     -0.000000      0.000000  
1 1 1 0  23 25 o 0.7285000 0.5240000     0.7285000 0.5240000     0.7285000 0.5240000     0.000000       0.000000  
1 1 1 0  23 26 o 1.430000  0.8210000     1.430000  0.8210000     1.430000  0.8210000     -0.000000      0.000000  
1 1 1 0  24 0  o 12.32000  0.2671000     12.32000  0.2671000     12.32000  0.2671000     0.000000       0.000000  
1 1 1 0  24 1  o 0.8171000 0.4925000     0.8171000 0.4925000     0.8171000 0.4925000     -0.000000      0.000000  
1 1 1 0  24 2  o 17.19000  0.3202000     17.19000  0.3202000     17.19000  0.3202000     0.000000       0.000000  
1 1 1 0  24 4  o 6.055000  0.2693000     6.055000  0.2693000     6.055000  0.2693000     0.000000       0.000000  
1 1 1 0  24 5  o 4.177000  0.2431000     4.177000  0.2431000     4.177000  0.2431000     0.000000       0.000000  
1 1 1 0  24 6  o 9.054000  0.1916000     9.054000  0.1916000     9.054000  0.1916000     0.000000       0.000000  
1 1 1 0  24 7  o 7.237000  0.2067000     7.237000  0.2067000     7.237000  0.2067000     -0.000000      0.000000  
1 1 1 0  24 8  o 1.022000  0.5922000     1.022000  0.5922000     1.022000  0.5922000     0.000000       0.000000  
1 1 1 0  24 9  o 20.03000  0.2652000     20.03000  0.2652000     20.03000  0.2652000     0.000000       0.000000  
1 1 1 0  24 10 o 16.29000  0.2432000     16.29000  0.2432000     16.29000  0.2432000     0.000000       0.000000  
1 1 1 0  24 11 f 19.17000  0.3167000     19.17000  0.3167000     19.17000  0.3167000     -0.000000      0.000000  
1 1 1 0  24 13 o 9.364000  0.2647000     9.364000  0.2647000     9.364000  0.2647000     0.000000       0.000000  
1 1 1 0  24 14 o 8.991000  0.2788000     8.991000  0.2788000     8.991000  0.2788000     -0.000000      0.000000  
1 1 1 0  24 15 o 11.80000  0.2938000     11.80000  0.2938000     11.80000  0.2938000     0.000000       0.000000  
1 1 1 0  24 16 o 4.936000  0.5436000     4.936000  0.5436000     4.936000  0.5436000     0.000000       0.000000  
1 1 1 0  24 17 o 5.578000  0.5547000     5.578000  0.5547000     5.578000  0.5547000     -0.000000      0.000000  
1 1 1 0  24 18 o 1.565000  1.089000      1.565000  1.089000      1.565000  1.089000      -0.000000      0.000000  
1 1 1 0  24 19 o 4.532000  0.6731000     4.532000  0.6731000     4.532000  0.6731000     -0.000000      0.000000  
1 1 1 0  24 20 o 1.512000  0.9196000     1.512000  0.9196000     1.512000  0.9196000     0.000000       0.000000  
1 1 1 0  24 21 o 1.505000  0.8941000     1.505000  0.8941000     1.505000  0.8941000     0.000000       0.000000  
1 1 1 0  24 22 o 1.115000  0.7355000     1.115000  0.7355000     1.115000  0.7355000     -0.000000      0.000000  
1 1 1 0  24 23 o 1.348000  0.8607000     1.348000  0.8607000     1.348000  0.8607000     0.000000       0.000000  
1 1 1 0  24 24 o 1.620000  0.8829000     1.620000  0.8829000     1.620000  0.8829000     0.000000       0.000000  
1 1 1 0  24 25 o 0.7494000 0.5373000     0.7494000 0.5373000     0.7494000 0.5373000     0.000000       0.000000  
1 1 1 0  24 26 o 0.6721000 0.4901000     0.6721000 0.4901000     0.6721000 0.4901000     0.000000       0.000000  
1 1 1 0  25 2  o 7.027000  0.2682000     7.027000  0.2682000     7.027000  0.2682000     0.000000       0.000000  
1 1 1 0  25 3  o 14.71000  0.2475000     14.71000  0.2475000     14.71000  0.2475000     -0.000000      0.000000  
1 1 1 0  25 4  o 3.886000  0.2453000     3.886000  0.2453000     3.886000  0.2453000     -0.000000      0.000000  
1 1 1 0  25 5  o 16.83000  0.2296000     16.83000  0.2296000     16.83000  0.2296000     -0.000000      0.000000  
1 1 1 0  25 6  o 4.947000  0.2407000     4.947000  0.2407000     4.947000  0.2407000     -0.000000      0.000000  
1 1 1 0  25 7  o 6.192000  0.2220000     6.192000  0.2220000     6.192000  0.2220000     0.000000       0.000000  
1 1 1 0  25 8  o 12.87000  0.2180000     12.87000  0.2180000     12.87000  0.2180000     -0.000000      0.000000  
1 1 1 0  25 9  o 5.095000  0.2599000     5.095000  0.2599000     5.095000  0.2599000     -0.000000      0.000000  
1 1 1 0  25 10 o 8.889000  0.2320000     8.889000  0.2320000     8.889000  0.2320000     -0.000000      0.000000  
1 1 1 0  25 11 o 1.165000  0.6752000     1.165000  0.6752000     1.165000  0.6752000     0.000000       0.000000  
1 1 1 0  25 12 o 5.141000  0.4778000     5.141000  0.4778000     5.141000  0.4778000     -0.000000      0.000000  
1 1 1 0  25 13 o 6.475000  0.3311000     6.475000  0.3311000     6.475000  0.3311000     -0.000000      0.000000  
1 1 1 0  25 14 o 8.605000  0.2775000     8.605000  0.2775000     8.605000  0.2775000     0.000000       0.000000  
1 1 1 0  25 15 o 2.057000  0.8747000     2.057000  0.8747000     2.057000  0.8747000     -0.000000      0.000000  
1 1 1 0  25 16 o 2.807000  1.009000      2.807000  1.009000      2.807000  1.009000      -0.000000      0.000000  
1 1 1 0  25 17 o 9.107000  0.3937000     9.107000  0.3937000     9.107000  0.3937000     0.000000       0.000000  
1 1 1 0  25 18 o 3.357000  1.463000      3.357000  1.463000      3.357000  1.463000      0.000000       0.000000  
1 1 1 0  25 19 o 6.527000  0.4720000     6.527000  0.4720000     6.527000  0.4720000     0.000000       0.000000  
1 1 1 0  25 20 o 2.530000  1.016000      2.530000  1.016000      2.530000  1.016000      0.000000       0.000000  
1 1 1 0  25 21 o 0.8461000 0.6029000     0.8461000 0.6029000     0.8461000 0.6029000     0.000000       0.000000  
1 1 1 0  25 22 o 1.250000  0.7913000     1.250000  0.7913000     1.250000  0.7913000     -0.000000      0.000000  
1 1 1 0  25 23 o 1.378000  0.9708000     1.378000  0.9708000     1.378000  0.9708000     -0.000000      0.000000  
1 1 1 0  25 24 o 0.8413000 0.5922000     0.8413000 0.5922000     0.8413000 0.5922000     0.000000       0.000000  
1 1 1 0  25 25 o 0.7477000 0.5363000     0.7477000 0.5363000     0.7477000 0.5363000     -0.000000      0.000000  
1 1 1 0  25 26 o 1.274000  0.8033000     1.274000  0.8033000     1.274000  0.8033000     -0.000000      0.000000  
1 1 1 0  26 0  o 13.87000  0.4073000     13.87000  0.4073000     13.87000  0.4073000     0.000000       0.000000  
1 1 1 0  26 1  o 6.808000  0.1902000     6.808000  0.1902000     6.808000  0.1902000     0.000000       0.000000  
1 1 1 0  26 2  o 6.763000  0.1909000     6.763000  0.1909000     6.763000  0.1909000     -0.000000      0.000000  
1 1 1 0  26 3  o 3.587000  0.2605000     3.587000  0.2605000     3.587000  0.2605000     -0.000000      0.000000  
1 1 1 0  26 4  o 5.447000  0.2167000     5.447000  0.2167000     5.447000  0.2167000     -0.000000      0.000000  
1 1 1 0  26 5  o 11.32000  0.1996000     11.32000  0.1996000     11.32000  0.1996000     -0.000000      0.000000  
1 1 1 0  26 6  o 3.875000  0.2797000     3.875000  0.2797000     3.875000  0.2797000     -0.000000      0.000000  
1 1 1 0  26 7  o 17.87000  0.2463000     17.87000  0.2463000     17.87000  0.2463000     0.000000       0.000000  
1 1 1 0  26 8  o 7.302000  0.2195000     7.302000  0.2195000     7.302000  0.2195000     -0.000000      0.000000  
1 1 1 0  26 9  o 8.294000  0.2643000     8.294000  0.2643000     8.294000  0.2643000     0.000000       0.000000  
1 1 1 0  26 10 o 17.85000  0.2581000     17.85000  0.2581000     17.85000  0.2581000     0.000000       0.000000  
1 1 1 0  26 11 o 15.73000  0.3561000     15.73000  0.3561000     15.73000  0.3561000     -0.000000      0.000000  
1 1 1 0  26 12 o 3.659000  0.5186000     3.659000  0.5186000     3.659000  0.5186000     -0.000000      0.000000  
1 1 1 0  26 13 f 12.78000  0.2605000     12.78000  0.2605000     12.78000  0.2605000     -0.000000      0.000000  
1 1 1 0  26 14 o 1.490000  0.8100000     1.490000  0.8100000     1.490000  0.8100000     0.000000       0.000000  
1 1 1 0  26 15 o 5.242000  0.4073000     5.242000  0.4073000     5.242000  0.4073000     -0.000000      0.000000  
1 1 1 0  26 16 o 8.456000  0.3681000     8.456000  0.3681000     8.456000  0.3681000     -0.000000      0.000000  
1 1 1 0  26 17 o 1.448000  0.9361000     1.448000  0.9361000     1.448000  0.9361000     0.000000       0.000000  
1 1 1 0  26 18 o 6.136000  0.4846000     6.136000  0.4846000     6.136000  0.4846000     -0.000000      0.000000  
1 1 1 0  26 19 o 4.910000  0.5894000     4.910000  0.5894000     4.910000  0.5894000     -0.000000      0.000000  
1 1 1 0  26 20 o 0.8536000 0.6091000     0.8536000 0.6091000     0.8536000 0.6091000     0.000000       0.000000  
1 1 1 0  26 21 o 1.207000  0.7792000     1.207000  0.7792000     1.207000  0.7792000     0.000000       0.000000  
1 1 1 0  26 22 o 1.045000  0.7054000     1.045000  0.7054000     1.045000  0.7054000     0.000000       0.000000  
1 1 1 0  26 23 o 1.140000  0.7953000     1.140000  0.7953000     1.140000  0.7953000     -0.000000      0.000000  
1 1 1 0  26 24 o 1.790000  0.9233000     1.790000  0.9233000     1.790000  0.9233000     -0.000000      0.000000  
1 1 1 0  26 25 o 1.044000  0.6951000     1.044000  0.6951000     1.044000  0.6951000     0.000000       0.000000  
1 1 1 0  27 1  o 5.821000  0.2008000     5.821000  0.2008000     5.821000  0.2008000     0.000000       0.000000  
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1 1 1 0  27 3  o 3.167000  0.3033000     3.167000  0.3033000     3.167000  0.3033000     -0.000000      0.000000  
1 1 1 0  27 4  o 0.7439000 0.4865000     0.7439000 0.4865000     0.7439000 0.4865000     0.000000       0.000000  
1 1 1 0  27 5  f 19.97000  0.2587000     19.97000  0.2587000     19.97000  0.2587000     0.000000       0.000000  
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1 1 1 0  27 8  o 0.9867000 0.5960000     0.9867000 0.5960000     0.9867000 0.5960000     -0.000000      0.000000  
1 1 1 0  27 9  f 9.559000  0.2243000     9.559000  0.2243000     9.559000  0.2243000     0.000000       0.000000  
1 1 1 0  27 10 o 6.457000  0.2561000     6.457000  0.2561000     6.457000  0.2561000     0.000000       0.000000  
1 1 1 0  27 11 o 7.770000  0.3537000     7.770000  0.3537000     7.770000  0.3537000     -0.000000      0.000000  
1 1 1 0  27 12 o 23.34000  0.3091000     23.34000  0.3091000     23.34000  0.3091000     0.000000       0.000000  
1 1 1 0  27 13 o 7.319000  0.3048000     7.319000  0.3048000     7.319000  0.3048000     0.000000       0.000000  
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1 1 1 0  27 19 o 1.016000  0.7047000     1.016000  0.7047000     1.016000  0.7047000     0.000000       0.000000  
1 1 1 0  27 20 o 3.667000  0.6987000     3.667000  0.6987000     3.667000  0.6987000     0.000000       0.000000  
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1 1 1 0  27 23 o 1.886000  0.9437000     1.886000  0.9437000     1.886000  0.9437000     -0.000000      0.000000  
1 1 1 0  27 24 o 0.8409000 0.5924000     0.8409000 0.5924000     0.8409000 0.5924000     0.000000       0.000000  
1 1 1 0  27 25 o 1.826000  0.9130000     1.826000  0.9130000     1.826000  0.9130000     -0.000000      0.000000  
1 1 1 0  28 0  o 8.451000  0.2675000     8.451000  0.2675000     8.451000  0.2675000     -0.000000      0.000000  
1 1 1 0  28 1  o 0.8701000 0.5236000     0.8701000 0.5236000     0.8701000 0.5236000     0.000000       0.000000  
1 1 1 0  28 2  o 2.779000  0.3640000     2.779000  0.3640000     2.779000  0.3640000     0.000000       0.000000  
1 1 1 0  28 3  o 6.672000  0.2039000     6.672000  0.2039000     6.672000  0.2039000     -0.000000      0.000000  
1 1 1 0  28 4  o 4.353000  0.2561000     4.353000  0.2561000     4.353000  0.2561000     -0.000000      0.000000  
1 1 1 0  28 5  o 6.314000  0.2200000     6.314000  0.2200000     6.314000  0.2200000     -0.000000      0.000000  
1 1 1 0  28 6  o 5.041000  0.2535000     5.041000  0.2535000     5.041000  0.2535000     -0.000000      0.000000  
1 1 1 0  28 7  o 9.780000  0.2098000     9.780000  0.2098000     9.780000  0.2098000     0.000000       0.000000  
1 1 1 0  28 8  o 2.230000  0.6067000     2.230000  0.6067000     2.230000  0.6067000     0.000000       0.000000  
1 1 1 0  28 9  o 2.558000  0.5719000     2.558000  0.5719000     2.558000  0.5719000     -0.000000      0.000000  
1 1 1 0  28 10 o 1.905000  0.8781000     1.905000  0.8781000     1.905000  0.8781000     0.000000       0.000000  
1 1 1 0  28 11 o 1.632000  0.7643000     1.632000  0.7643000     1.632000  0.7643000     -0.000000      0.000000  
1 1 1 0  28 12 o 0.9980000 0.6528000     0.9980000 0.6528000     0.9980000 0.6528000     -0.000000      0.000000  
1 1 1 0  28 13 o 1.202000  0.7264000     1.202000  0.7264000     1.202000  0.7264000     0.000000       0.000000  
1 1 1 0  28 14 o 3.537000  0.5605000     3.537000  0.5605000     3.537000  0.5605000     0.000000       0.000000  
1 1 1 0  28 15 o 0.9032000 0.6253000     0.9032000 0.6253000     0.9032000 0.6253000     0.000000       0.000000  
1 1 1 0  28 16 o 1.918000  0.9704000     1.918000  0.9704000     1.918000  0.9704000     0.000000       0.000000  
1 1 1 0  28 17 o 7.414000  1.065000      7.414000  1.065000      7.414000  1.065000      -0.000000      0.000000  
1 1 1 0  28 18 o 1.856000  1.003000      1.856000  1.003000      1.856000  1.003000      0.000000       0.000000  
1 1 1 0  28 19 o 1.884000  0.9906000     1.884000  0.9906000     1.884000  0.9906000     0.000000       0.000000  
1 1 1 0  28 20 o 2.322000  0.9583000     2.322000  0.9583000     2.322000  0.9583000     0.000000       0.000000  
1 1 1 0  28 21 o 0.9317000 0.6458000     0.9317000 0.6458000     0.9317000 0.6458000     0.000000       0.000000  
1 1 1 0  28 22 o 3.014000  0.9258000     3.014000  0.9258000     3.014000  0.9258000     0.000000       0.000000  
1 1 1 0  28 23 o 1.022000  0.6884000     1.022000  0.6884000     1.022000  0.6884000     0.000000       0.000000  
1 1 1 0  28 24 o 1.444000  0.8391000     1.444000  0.8391000     1.444000  0.8391000     -0.000000      0.000000  
1 1 1 0  28 25 o 0.9906000 0.6696000     0.9906000 0.6696000     0.9906000 0.6696000     -0.000000      0.000000  
1 1 1 0  29 1  f 0.7854000 0.5021000     0.7854000 0.5021000     0.7854000 0.5021000     0.000000       0.000000  
1 1 1 0  29 2  o 9.014000  0.1975000     9.014000  0.1975000     9.014000  0.1975000     -0.000000      0.000000  
1 1 1 0  29 3  o 7.724000  0.2026000     7.724000  0.2026000     7.724000  0.2026000     0.000000       0.000000  
1 1 1 0  29 4  o 6.648000  0.2149000     6.648000  0.2149000     6.648000  0.2149000     -0.000000      0.000000  
1 1 1 0  29 5  o 6.771000  0.2189000     6.771000  0.2189000     6.771000  0.2189000     0.000000       0.000000  
1 1 1 0  29 6  o 0.8356000 0.5400000     0.8356000 0.5400000     0.8356000 0.5400000     -0.000000      0.000000  
1 1 1 0  29 7  o 8.178000  0.2178000     8.178000  0.2178000     8.178000  0.2178000     -0.000000      0.000000  
1 1 1 0  29 8  o 0.9670000 0.5985000     0.9670000 0.5985000     0.9670000 0.5985000     -0.000000      0.000000  
1 1 1 0  29 9  o 18.76000  0.2631000     18.76000  0.2631000     18.76000  0.2631000     0.000000       0.000000  
1 1 1 0  29 10 o 18.86000  0.3768000     18.86000  0.3768000     18.86000  0.3768000     -0.000000      0.000000  
1 1 1 0  29 11 o 12.61000  0.2457000     12.61000  0.2457000     12.61000  0.2457000     -0.000000      0.000000  
1 1 1 0  29 12 f 1.196000  0.7265000     1.196000  0.7265000     1.196000  0.7265000     0.000000       0.000000  
1 1 1 0  29 13 o 4.864000  0.3882000     4.864000  0.3882000     4.864000  0.3882000     -0.000000      0.000000  
1 1 1 0  29 14 o 6.951000  0.3225000     6.951000  0.3225000     6.951000  0.3225000     -0.000000      0.000000  
1 1 1 0  29 15 o 2.337000  0.9185000     2.337000  0.9185000     2.337000  0.9185000     0.000000       0.000000  
1 1 1 0  29 16 o 1.310000  0.8197000     1.310000  0.8197000     1.310000  0.8197000     -0.000000      0.000000  
1 1 1 0  29 17 o 8.826000  0.3813000     8.826000  0.3813000     8.826000  0.3813000     0.000000       0.000000  
1 1 1 0  29 18 o 8.743000  0.3819000     8.743000  0.3819000     8.743000  0.3819000     -0.000000      0.000000  
1 1 1 0  29 19 o 0.8297000 0.5959000     0.8297000 0.5959000     0.8297000 0.5959000     0.000000       0.000000  
1 1 1 0  29 20 o 2.989000  0.8633000     2.989000  0.8633000     2.989000  0.8633000     0.000000       0.000000  
1 1 1 0  29 21 o 3.818000  0.6637000     3.818000  0.6637000     3.818000  0.6637000     0.000000       0.000000  
1 1 1 0  29 22 o 1.214000  0.8087000     1.214000  0.8087000     1.214000  0.8087000     0.000000       0.000000  
1 1 1 0  29 23 o 0.7112000 0.5156000     0.7112000 0.5156000     0.7112000 0.5156000     0.000000       0.000000  
1 1 1 0  29 24 o 1.171000  0.7468000     1.171000  0.7468000     1.171000  0.7468000     -0.000000      0.000000  
1 1 1 0  29 25 o 1.771000  0.8945000     1.771000  0.8945000     1.771000  0.8945000     0.000000       0.000000  
1 1 1 0  30 0  o 14.82000  0.3091000     14.82000  0.3091000     14.82000  0.3091000     -0.000000      0.000000  
1 1 1 0  30 1  o 8.515000  0.1996000     8.515000  0.1996000     8.515000  0.1996000     0.000000       0.000000  
1 1 1 0  30 2  o 11.65000  0.2045000     11.65000  0.2045000     11.65000  0.2045000     -0.000000      0.000000  
1 1 1 0  30 3  o 3.824000  0.2997000     3.824000  0.2997000     3.824000  0.2997000     -0.000000      0.000000  
1 1 1 0  30 4  o 3.268000  0.3447000     3.268000  0.3447000     3.268000  0.3447000     -0.000000      0.000000  
1 1 1 0  30 5  o 10.90000  0.2085000     10.90000  0.2085000     10.90000  0.2085000     0.000000       0.000000  
1 1 1 0  30 6  o 10.04000  0.2134000     10.04000  0.2134000     10.04000  0.2134000     0.000000       0.000000  
1 1 1 0  30 7  o 20.40000  0.2712000     20.40000  0.2712000     20.40000  0.2712000     0.000000       0.000000  
1 1 1 0  30 8  o 14.11000  0.2321000     14.11000  0.2321000     14.11000  0.2321000     -0.000000      0.000000  
1 1 1 0  30 9  o 7.588000  0.3523000     7.588000  0.3523000     7.588000  0.3523000     -0.000000      0.000000  
1 1 1 0  30 10 o 1.493000  0.7506000     1.493000  0.7506000     1.493000  0.7506000     -0.000000      0.000000  
1 1 1 0  30 11 o 12.55000  0.2756000     12.55000  0.2756000     12.55000  0.2756000     0.000000       0.000000  
1 1 1 0  30 12 o 11.77000  0.2502000     11.77000  0.2502000     11.77000  0.2502000     -0.000000      0.000000  
1 1 1 0  30 13 o 5.521000  0.3471000     5.521000  0.3471000     5.521000  0.3471000     0.000000       0.000000  
1 1 1 0  30 14 o 5.365000  0.3973000     5.365000  0.3973000     5.365000  0.3973000     0.000000       0.000000  
1 1 1 0  30 15 o 7.648000  0.3445000     7.648000  0.3445000     7.648000  0.3445000     0.000000       0.000000  
1 1 1 0  30 16 o 10.54000  0.4398000     10.54000  0.4398000     10.54000  0.4398000     -0.000000      0.000000  
1 1 1 0  30 17 o 4.244000  0.5647000     4.244000  0.5647000     4.244000  0.5647000     0.000000       0.000000  
1 1 1 0  30 18 o 1.484000  0.8953000     1.484000  0.8953000     1.484000  0.8953000     -0.000000      0.000000  
1 1 1 0  30 19 o 5.096000  0.5263000     5.096000  0.5263000     5.096000  0.5263000     -0.000000      0.000000  
1 1 1 0  30 20 o 0.8251000 0.5869000     0.8251000 0.5869000     0.8251000 0.5869000     0.000000       0.000000  
1 1 1 0  30 21 o 1.119000  0.7338000     1.119000  0.7338000     1.119000  0.7338000     0.000000       0.000000  
1 1 1 0  30 22 o 1.172000  0.8424000     1.172000  0.8424000     1.172000  0.8424000     0.000000       0.000000  
1 1 1 0  30 23 o 1.714000  0.8998000     1.714000  0.8998000     1.714000  0.8998000     -0.000000      0.000000  
1 1 1 0  30 24 o 1.323000  0.7971000     1.323000  0.7971000     1.323000  0.7971000     -0.000000      0.000000  
1 1 1 0  30 25 o 1.199000  0.7511000     1.199000  0.7511000     1.199000  0.7511000     0.000000       0.000000  
1 1 1 0  31 1  o 6.762000  0.2507000     6.762000  0.2507000     6.762000  0.2507000     -0.000000      0.000000  
1 1 1 0  31 2  o 25.03000  0.3057000     25.03000  0.3057000     25.03000  0.3057000     0.000000       0.000000  
1 1 1 0  31 3  o 17.48000  0.2418000     17.48000  0.2418000     17.48000  0.2418000     0.000000       0.000000  
1 1 1 0  31 4  o 10.59000  0.2090000     10.59000  0.2090000     10.59000  0.2090000     -0.000000      0.000000  
1 1 1 0  31 5  o 3.523000  0.3535000     3.523000  0.3535000     3.523000  0.3535000     0.000000       0.000000  
1 1 1 0  31 6  o 0.8799000 0.5635000     0.8799000 0.5635000     0.8799000 0.5635000     0.000000       0.000000  
1 1 1 0  31 7  o 11.63000  0.2494000     11.63000  0.2494000     11.63000  0.2494000     -0.000000      0.000000  
1 1 1 0  31 8  o 4.686000  0.3130000     4.686000  0.3130000     4.686000  0.3130000     0.000000       0.000000  
1 1 1 0  31 9  o 7.989000  0.3336000     7.989000  0.3336000     7.989000  0.3336000     0.000000       0.000000  
1 1 1 0  31 10 o 1.572000  0.7654000     1.572000  0.7654000     1.572000  0.7654000     0.000000       0.000000  
1 1 1 0  31 11 o 22.49000  0.3026000     22.49000  0.3026000     22.49000  0.3026000     -0.000000      0.000000  
1 1 1 0  31 12 f 10.80000  0.2541000     10.80000  0.2541000     10.80000  0.2541000     0.000000       0.000000  
1 1 1 0  31 13 o 1.917000  0.8466000     1.917000  0.8466000     1.917000  0.8466000     -0.000000      0.000000  
1 1 1 0  31 14 o 5.107000  0.4150000     5.107000  0.4150000     5.107000  0.4150000     -0.000000      0.000000  
1 1 1 0  31 15 o 3.182000  0.7931000     3.182000  0.7931000     3.182000  0.7931000     -0.000000      0.000000  
1 1 1 0  31 16 o 1.956000  1.109000      1.956000  1.109000      1.956000  1.109000      0.000000       0.000000  
1 1 1 0  31 17 o 1.705000  0.9093000     1.705000  0.9093000     1.705000  0.9093000     -0.000000      0.000000  
1 1 1 0  31 18 o 1.229000  0.8015000     1.229000  0.8015000     1.229000  0.8015000     -0.000000      0.000000  
1 1 1 0  31 19 o 1.598000  0.9198000     1.598000  0.9198000     1.598000  0.9198000     0.000000       0.000000  
1 1 1 0  31 20 o 5.008000  0.4922000     5.008000  0.4922000     5.008000  0.4922000     -0.000000      0.000000  
1 1 1 0  31 21 o 1.668000  0.9039000     1.668000  0.9039000     1.668000  0.9039000     0.000000       0.000000  
1 1 1 0  31 22 o 1.497000  0.9495000     1.497000  0.9495000     1.497000  0.9495000     0.000000       0.000000  
1 1 1 0  31 23 o 2.668000  0.8627000     2.668000  0.8627000     2.668000  0.8627000     -0.000000      0.000000  
1 1 1 0  31 24 o 0.8942000 0.6244000     0.8942000 0.6244000     0.8942000 0.6244000     0.000000       0.000000  
1 1 1 0  32 0  f 1.102000  0.6729000     1.102000  0.6729000     1.102000  0.6729000     0.000000       0.000000  
1 1 1 0  32 1  o 3.663000  0.3224000     3.663000  0.3224000     3.663000  0.3224000     0.000000       0.000000  
1 1 1 0  32 2  o 8.827000  0.2088000     8.827000  0.2088000     8.827000  0.2088000     -0.000000      0.000000  
1 1 1 0  32 3  o 12.85000  0.2160000     12.85000  0.2160000     12.85000  0.2160000     -0.000000      0.000000  
1 1 1 0  32 4  o 10.07000  0.2109000     10.07000  0.2109000     10.07000  0.2109000     -0.000000      0.000000  
1 1 1 0  32 5  o 4.231000  0.3063000     4.231000  0.3063000     4.231000  0.3063000     0.000000       0.000000  
1 1 1 0  32 6  o 4.105000  0.3288000     4.105000  0.3288000     4.105000  0.3288000     0.000000       0.000000  
1 1 1 0  32 7  o 11.65000  0.2241000     11.65000  0.2241000     11.65000  0.2241000     0.000000       0.000000  
1 1 1 0  32 9  o 2.717000  0.5966000     2.717000  0.5966000     2.717000  0.5966000     0.000000       0.000000  
1 1 1 0  32 10 o 16.07000  0.2578000     16.07000  0.2578000     16.07000  0.2578000     -0.000000      0.000000  
1 1 1 0  32 11 o 4.078000  0.4194000     4.078000  0.4194000     4.078000  0.4194000     -0.000000      0.000000  
1 1 1 0  32 12 o 1.414000  0.7750000     1.414000  0.7750000     1.414000  0.7750000     -0.000000      0.000000  
1 1 1 0  32 13 f 2.609000  0.7802000     2.609000  0.7802000     2.609000  0.7802000     -0.000000      0.000000  
1 1 1 0  32 14 o 5.941000  0.3923000     5.941000  0.3923000     5.941000  0.3923000     0.000000       0.000000  
1 1 1 0  32 15 o 1.942000  0.9460000     1.942000  0.9460000     1.942000  0.9460000     0.000000       0.000000  
1 1 1 0  32 16 o 2.800000  1.064000      2.800000  1.064000      2.800000  1.064000      -0.000000      0.000000  
1 1 1 0  32 17 o 4.351000  0.5330000     4.351000  0.5330000     4.351000  0.5330000     0.000000       0.000000  
1 1 1 0  32 18 o 1.705000  0.8863000     1.705000  0.8863000     1.705000  0.8863000     0.000000       0.000000  
1 1 1 0  32 19 o 2.780000  0.8924000     2.780000  0.8924000     2.780000  0.8924000     0.000000       0.000000  
1 1 1 0  32 20 o 1.020000  0.6927000     1.020000  0.6927000     1.020000  0.6927000     0.000000       0.000000  
1 1 1 0  32 21 o 3.411000  0.7982000     3.411000  0.7982000     3.411000  0.7982000     -0.000000      0.000000  
1 1 1 0  32 22 o 2.012000  0.9347000     2.012000  0.9347000     2.012000  0.9347000     -0.000000      0.000000  
1 1 1 0  32 23 o 1.176000  0.7478000     1.176000  0.7478000     1.176000  0.7478000     -0.000000      0.000000  
1 1 1 0  32 24 o 0.9619000 0.6543000     0.9619000 0.6543000     0.9619000 0.6543000     -0.000000      0.000000  
1 1 1 0  33 1  o 0.9009000 0.5586000     0.9009000 0.5586000     0.9009000 0.5586000     0.000000       0.000000  
1 1 1 0  33 2  o 1.081000  0.6254000     1.081000  0.6254000     1.081000  0.6254000     0.000000       0.000000  
1 1 1 0  33 3  o 6.941000  0.2259000     6.941000  0.2259000     6.941000  0.2259000     0.000000       0.000000  
1 1 1 0  33 4  o 2.987000  0.4175000     2.987000  0.4175000     2.987000  0.4175000     0.000000       0.000000  
1 1 1 0  33 5  o 5.360000  0.2667000     5.360000  0.2667000     5.360000  0.2667000     0.000000       0.000000  
1 1 1 0  33 6  o 6.271000  0.2482000     6.271000  0.2482000     6.271000  0.2482000     0.000000       0.000000  
1 1 1 0  33 7  o 19.12000  0.3813000     19.12000  0.3813000     19.12000  0.3813000     -0.000000      0.000000  
1 1 1 0  33 8  f 3.960000  0.5137000     3.960000  0.5137000     3.960000  0.5137000     0.000000       0.000000  
1 1 1 0  33 9  o 15.25000  0.2492000     15.25000  0.2492000     15.25000  0.2492000     0.000000       0.000000  
1 1 1 0  33 10 o 3.500000  0.4831000     3.500000  0.4831000     3.500000  0.4831000     -0.000000      0.000000  
1 1 1 0  33 11 o 22.66000  0.3039000     22.66000  0.3039000     22.66000  0.3039000     0.000000       0.000000  
1 1 1 0  33 12 o 8.905000  0.2770000     8.905000  0.2770000     8.905000  0.2770000     0.000000       0.000000  
1 1 1 0  33 13 o 1.381000  0.7951000     1.381000  0.7951000     1.381000  0.7951000     -0.000000      0.000000  
1 1 1 0  33 14 o 2.913000  0.8172000     2.913000  0.8172000     2.913000  0.8172000     -0.000000      0.000000  
1 1 1 0  33 15 o 1.658000  0.9890000     1.658000  0.9890000     1.658000  0.9890000     -0.000000      0.000000  
1 1 1 0  33 16 o 4.063000  0.5795000     4.063000  0.5795000     4.063000  0.5795000     0.000000       0.000000  
1 1 1 0  33 17 o 2.827000  0.8679000     2.827000  0.8679000     2.827000  0.8679000     0.000000       0.000000  
1 1 1 0  33 18 o 3.466000  0.6990000     3.466000  0.6990000     3.466000  0.6990000     0.000000       0.000000  
1 1 1 0  33 19 o 1.709000  0.9277000     1.709000  0.9277000     1.709000  0.9277000     -0.000000      0.000000  
1 1 1 0  33 20 o 2.457000  0.9144000     2.457000  0.9144000     2.457000  0.9144000     -0.000000      0.000000  
1 1 1 0  33 21 o 1.088000  0.7658000     1.088000  0.7658000     1.088000  0.7658000     0.000000       0.000000  
1 1 1 0  33 22 o 2.156000  0.9423000     2.156000  0.9423000     2.156000  0.9423000     -0.000000      0.000000  
1 1 1 0  33 23 o 1.642000  0.8908000     1.642000  0.8908000     1.642000  0.8908000     -0.000000      0.000000  
1 1 1 0  33 24 o 1.585000  0.8645000     1.585000  0.8645000     1.585000  0.8645000     0.000000       0.000000  
1 1 1 0  34 0  o 9.838000  0.3051000     9.838000  0.3051000     9.838000  0.3051000     -0.000000      0.000000  
1 1 1 0  34 1  o 9.667000  0.2124000     9.667000  0.2124000     9.667000  0.2124000     -0.000000      0.000000  
1 1 1 0  34 2  o 12.77000  0.2191000     12.77000  0.2191000     12.77000  0.2191000     0.000000       0.000000  
1 1 1 0  34 3  o 12.03000  0.2174000     12.03000  0.2174000     12.03000  0.2174000     0.000000       0.000000  
1 1 1 0  34 4  o 2.718000  0.4778000     2.718000  0.4778000     2.718000  0.4778000     0.000000       0.000000  
1 1 1 0  34 5  o 4.642000  0.3026000     4.642000  0.3026000     4.642000  0.3026000     -0.000000      0.000000  
1 1 1 0  34 6  f 11.08000  0.3224000     11.08000  0.3224000     11.08000  0.3224000     -0.000000      0.000000  
1 1 1 0  34 7  o 12.17000  0.3180000     12.17000  0.3180000     12.17000  0.3180000     -0.000000      0.000000  
1 1 1 0  34 8  o 18.82000  0.2676000     18.82000  0.2676000     18.82000  0.2676000     -0.000000      0.000000  
1 1 1 0  34 9  o 16.51000  0.2561000     16.51000  0.2561000     16.51000  0.2561000     -0.000000      0.000000  
1 1 1 0  34 10 o 26.01000  0.3321000     26.01000  0.3321000     26.01000  0.3321000     0.000000       0.000000  
1 1 1 0  34 11 o 12.77000  0.2786000     12.77000  0.2786000     12.77000  0.2786000     -0.000000      0.000000  
1 1 1 0  34 12 o 5.208000  0.4411000     5.208000  0.4411000     5.208000  0.4411000     0.000000       0.000000  
1 1 1 0  34 13 o 14.70000  0.2756000     14.70000  0.2756000     14.70000  0.2756000     -0.000000      0.000000  
1 1 1 0  34 14 o 1.615000  0.8856000     1.615000  0.8856000     1.615000  0.8856000     0.000000       0.000000  
1 1 1 0  34 15 f 4.818000  0.7550000     4.818000  0.7550000     4.818000  0.7550000     -0.000000      0.000000  
1 1 1 0  34 16 o 1.344000  0.8219000     1.344000  0.8219000     1.344000  0.8219000     0.000000       0.000000  
1 1 1 0  34 17 o 7.092000  0.3495000     7.092000  0.3495000     7.092000  0.3495000     0.000000       0.000000  
1 1 1 0  34 18 o 1.006000  0.6771000     1.006000  0.6771000     1.006000  0.6771000     0.000000       0.000000  
1 1 1 0  34 19 o 1.577000  0.8867000     1.577000  0.8867000     1.577000  0.8867000     0.000000       0.000000  
1 1 1 0  34 20 o 1.122000  0.7358000     1.122000  0.7358000     1.122000  0.7358000     0.000000       0.000000  
1 1 1 0  34 21 o 2.011000  1.230000      2.011000  1.230000      2.011000  1.230000      0.000000       0.000000  
1 1 1 0  34 22 o 0.7891000 0.5635000     0.7891000 0.5635000     0.7891000 0.5635000     -0.000000      0.000000  
1 1 1 0  34 23 o 1.374000  0.8235000     1.374000  0.8235000     1.374000  0.8235000     -0.000000      0.000000  
1 1 1 0  34 24 o 1.843000  0.9119000     1.843000  0.9119000     1.843000  0.9119000     0.000000       0.000000  
1 1 1 0  35 1  o 33.72000  0.3944000     33.72000  0.3944000     33.72000  0.3944000     0.000000       0.000000  
1 1 1 0  35 2  o 18.07000  0.2532000     18.07000  0.2532000     18.07000  0.2532000     0.000000       0.000000  
1 1 1 0  35 3  f 6.612000  0.2410000     6.612000  0.2410000     6.612000  0.2410000     0.000000       0.000000  
1 1 1 0  35 4  o 7.857000  0.2291000     7.857000  0.2291000     7.857000  0.2291000     -0.000000      0.000000  
1 1 1 0  35 5  o 10.38000  0.3208000     10.38000  0.3208000     10.38000  0.3208000     -0.000000      0.000000  
1 1 1 0  35 6  o 16.46000  0.3490000     16.46000  0.3490000     16.46000  0.3490000     0.000000       0.000000  
1 1 1 0  35 7  o 8.746000  0.2396000     8.746000  0.2396000     8.746000  0.2396000     -0.000000      0.000000  
1 1 1 0  35 8  f 3.312000  0.4656000     3.312000  0.4656000     3.312000  0.4656000     0.000000       0.000000  
1 1 1 0  35 9  o 7.963000  0.2592000     7.963000  0.2592000     7.963000  0.2592000     0.000000       0.000000  
1 1 1 0  35 10 o 9.702000  0.2479000     9.702000  0.2479000     9.702000  0.2479000     0.000000       0.000000  
1 1 1 0  35 11 o 8.845000  0.2656000     8.845000  0.2656000     8.845000  0.2656000     0.000000       0.000000  
1 1 1 0  35 12 o 14.71000  0.2664000     14.71000  0.2664000     14.71000  0.2664000     -0.000000      0.000000  
1 1 1 0  35 13 o 1.595000  0.8598000     1.595000  0.8598000     1.595000  0.8598000     -0.000000      0.000000  
1 1 1 0  35 14 f 3.658000  0.9065000     3.658000  0.9065000     3.658000  0.9065000     0.000000       0.000000  
1 1 1 0  35 15 o 3.100000  0.7961000     3.100000  0.7961000     3.100000  0.7961000     -0.000000      0.000000  
1 1 1 0  35 16 o 2.991000  0.8344000     2.991000  0.8344000     2.991000  0.8344000     0.000000       0.000000  
1 1 1 0  35 17 o 0.9478000 0.6506000     0.9478000 0.6506000     0.9478000 0.6506000     -0.000000      0.000000  
1 1 1 0  35 18 o 1.809000  0.8960000     1.809000  0.8960000     1.809000  0.8960000     0.000000       0.000000  
1 1 1 0  35 19 o 2.021000  0.8963000     2.021000  0.8963000     2.021000  0.8963000     -0.000000      0.000000  
1 1 1 0  35 20 o 1.381000  0.8284000     1.381000  0.8284000     1.381000  0.8284000     -0.000000      0.000000  
1 1 1 0  35 21 o 1.696000  0.8908000     1.696000  0.8908000     1.696000  0.8908000     0.000000       0.000000  
1 1 1 0  35 22 o 1.572000  0.8654000     1.572000  0.8654000     1.572000  0.8654000     0.000000       0.000000  
1 1 1 0  35 23 o 0.9745000 0.6613000     0.9745000 0.6613000     0.9745000 0.6613000     -0.000000      0.000000  
1 1 1 0  35 24 o 1.025000  0.7527000     1.025000  0.7527000     1.025000  0.7527000     -0.000000      0.000000  
1 1 1 0  36 0  o 1.351000  0.7742000     1.351000  0.7742000     1.351000  0.7742000     -0.000000      0.000000  
1 1 1 0  36 1  f 15.56000  0.2379000     15.56000  0.2379000     15.56000  0.2379000     0.000000       0.000000  
1 1 1 0  36 2  o 28.02000  0.3402000     28.02000  0.3402000     28.02000  0.3402000     -0.000000      0.000000  
1 1 1 0  36 3  o 14.12000  0.3337000     14.12000  0.3337000     14.12000  0.3337000     -0.000000      0.000000  
1 1 1 0  36 5  o 8.254000  0.3342000     8.254000  0.3342000     8.254000  0.3342000     0.000000       0.000000  
1 1 1 0  36 6  o 16.35000  0.2865000     16.35000  0.2865000     16.35000  0.2865000     0.000000       0.000000  
1 1 1 0  36 7  o 10.68000  0.2384000     10.68000  0.2384000     10.68000  0.2384000     0.000000       0.000000  
1 1 1 0  36 8  o 11.71000  0.2395000     11.71000  0.2395000     11.71000  0.2395000     -0.000000      0.000000  
1 1 1 0  36 9  o 18.62000  0.2724000     18.62000  0.2724000     18.62000  0.2724000     0.000000       0.000000  
1 1 1 0  36 10 o 12.46000  0.2449000     12.46000  0.2449000     12.46000  0.2449000     0.000000       0.000000  
1 1 1 0  36 11 o 1.323000  0.7659000     1.323000  0.7659000     1.323000  0.7659000     -0.000000      0.000000  
1 1 1 0  36 12 o 1.054000  0.6901000     1.054000  0.6901000     1.054000  0.6901000     -0.000000      0.000000  
1 1 1 0  36 13 o 1.076000  0.7087000     1.076000  0.7087000     1.076000  0.7087000     -0.000000      0.000000  
1 1 1 0  36 15 o 7.641000  0.3312000     7.641000  0.3312000     7.641000  0.3312000     -0.000000      0.000000  
1 1 1 0  36 16 o 1.945000  0.9379000     1.945000  0.9379000     1.945000  0.9379000     -0.000000      0.000000  
1 1 1 0  36 17 o 5.400000  0.4289000     5.400000  0.4289000     5.400000  0.4289000     0.000000       0.000000  
1 1 1 0  36 18 o 1.484000  0.8462000     1.484000  0.8462000     1.484000  0.8462000     -0.000000      0.000000  
1 1 1 0  36 19 o 0.8448000 0.5909000     0.8448000 0.5909000     0.8448000 0.5909000     0.000000       0.000000  
1 1 1 0  36 20 o 1.104000  0.7536000     1.104000  0.7536000     1.104000  0.7536000     0.000000       0.000000  
1 1 1 0  36 21 o 1.070000  0.7065000     1.070000  0.7065000     1.070000  0.7065000     0.000000       0.000000  
1 1 1 0  36 22 o 1.387000  0.8183000     1.387000  0.8183000     1.387000  0.8183000     0.000000       0.000000  
1 1 1 0  36 23 o 1.049000  0.6990000     1.049000  0.6990000     1.049000  0.6990000     0.000000       0.000000  
1 1 1 0  37 1  o 41.42000  0.6731000     41.42000  0.6731000     41.42000  0.6731000     -0.000000      0.000000  
1 1 1 0  37 3  o 5.201000  0.4348000     5.201000  0.4348000     5.201000  0.4348000     0.000000       0.000000  
1 1 1 0  37 4  o 25.79000  0.3778000     25.79000  0.3778000     25.79000  0.3778000     0.000000       0.000000  
1 1 1 0  37 5  o 3.886000  0.3725000     3.886000  0.3725000     3.886000  0.3725000     -0.000000      0.000000  
1 1 1 0  37 6  o 33.92000  0.4016000     33.92000  0.4016000     33.92000  0.4016000     0.000000       0.000000  
1 1 1 0  37 7  o 12.70000  0.2395000     12.70000  0.2395000     12.70000  0.2395000     0.000000       0.000000  
1 1 1 0  37 8  o 11.64000  0.2401000     11.64000  0.2401000     11.64000  0.2401000     -0.000000      0.000000  
1 1 1 0  37 9  o 1.553000  0.7722000     1.553000  0.7722000     1.553000  0.7722000     0.000000       0.000000  
1 1 1 0  37 10 f 4.673000  0.3826000     4.673000  0.3826000     4.673000  0.3826000     -0.000000      0.000000  
1 1 1 0  37 11 o 5.132000  0.3846000     5.132000  0.3846000     5.132000  0.3846000     -0.000000      0.000000  
1 1 1 0  37 12 o 7.016000  0.3283000     7.016000  0.3283000     7.016000  0.3283000     0.000000       0.000000  
1 1 1 0  37 13 o 1.157000  0.7880000     1.157000  0.7880000     1.157000  0.7880000     0.000000       0.000000  
1 1 1 0  37 14 o 2.603000  1.047000      2.603000  1.047000      2.603000  1.047000      0.000000       0.000000  
1 1 1 0  37 15 o 3.042000  0.7776000     3.042000  0.7776000     3.042000  0.7776000     0.000000       0.000000  
1 1 1 0  37 16 o 5.446000  0.4331000     5.446000  0.4331000     5.446000  0.4331000     0.000000       0.000000  
1 1 1 0  37 17 o 1.120000  0.7270000     1.120000  0.7270000     1.120000  0.7270000     0.000000       0.000000  
1 1 1 0  37 18 o 2.344000  0.8938000     2.344000  0.8938000     2.344000  0.8938000     -0.000000      0.000000  
1 1 1 0  37 19 o 1.400000  0.8107000     1.400000  0.8107000     1.400000  0.8107000     -0.000000      0.000000  
1 1 1 0  37 21 o 1.849000  0.9170000     1.849000  0.9170000     1.849000  0.9170000     -0.000000      0.000000  
1 1 1 0  37 22 o 0.8293000 0.5848000     0.8293000 0.5848000     0.8293000 0.5848000     -0.000000      0.000000  
1 1 1 0  37 23 o 0.9726000 0.6608000     0.9726000 0.6608000     0.9726000 0.6608000     -0.000000      0.000000  
1 1 1 0  38 0  o 32.45000  0.7732000     32.45000  0.7732000     32.45000  0.7732000     -0.000000      0.000000  
1 1 1 0  38 1  o 5.304000  0.4219000     5.304000  0.4219000     5.304000  0.4219000     0.000000       0.000000  
1 1 1 0  38 2  o 4.544000  0.3215000     4.544000  0.3215000     4.544000  0.3215000     0.000000       0.000000  
1 1 1 0  38 3  o 31.64000  0.3779000     31.64000  0.3779000     31.64000  0.3779000     0.000000       0.000000  
1 1 1 0  38 4  o 27.73000  0.3416000     27.73000  0.3416000     27.73000  0.3416000     0.000000       0.000000  
1 1 1 0  38 5  o 15.40000  0.2474000     15.40000  0.2474000     15.40000  0.2474000     0.000000       0.000000  
1 1 1 0  38 6  o 7.403000  0.2626000     7.403000  0.2626000     7.403000  0.2626000     0.000000       0.000000  
1 1 1 0  38 7  o 17.92000  0.2656000     17.92000  0.2656000     17.92000  0.2656000     -0.000000      0.000000  
1 1 1 0  38 8  o 8.506000  0.2537000     8.506000  0.2537000     8.506000  0.2537000     0.000000       0.000000  
1 1 1 0  38 9  o 12.66000  0.2465000     12.66000  0.2465000     12.66000  0.2465000     0.000000       0.000000  
1 1 1 0  38 10 o 4.150000  0.4258000     4.150000  0.4258000     4.150000  0.4258000     -0.000000      0.000000  
1 1 1 0  38 11 o 1.207000  0.7430000     1.207000  0.7430000     1.207000  0.7430000     -0.000000      0.000000  
1 1 1 0  38 12 o 0.9042000 0.6247000     0.9042000 0.6247000     0.9042000 0.6247000     0.000000       0.000000  
1 1 1 0  38 14 o 2.512000  0.9013000     2.512000  0.9013000     2.512000  0.9013000     -0.000000      0.000000  
1 1 1 0  38 15 o 3.098000  0.7831000     3.098000  0.7831000     3.098000  0.7831000     -0.000000      0.000000  
1 1 1 0  38 16 o 1.620000  0.8763000     1.620000  0.8763000     1.620000  0.8763000     -0.000000      0.000000  
1 1 1 0  38 17 o 1.131000  0.7350000     1.131000  0.7350000     1.131000  0.7350000     -0.000000      0.000000  
1 1 1 0  38 18 o 1.398000  0.8109000     1.398000  0.8109000     1.398000  0.8109000     -0.000000      0.000000  
1 1 1 0  38 19 o 1.885000  0.8594000     1.885000  0.8594000     1.885000  0.8594000     -0.000000      0.000000  
1 1 1 0  38 20 o 4.516000  0.5820000     4.516000  0.5820000     4.516000  0.5820000     0.000000       0.000000  
1 1 1 0  38 21 o 1.820000  0.9123000     1.820000  0.9123000     1.820000  0.9123000     -0.000000      0.000000  
1 1 1 0  38 22 o 1.412000  0.8300000     1.412000  0.8300000     1.412000  0.8300000     -0.000000      0.000000  
1 1 1 0  38 23 o 0.9378000 0.6454000     0.9378000 0.6454000     0.9378000 0.6454000     0.000000       0.000000  
1 1 1 0  39 1  o 5.966000  0.2720000     5.966000  0.2720000     5.966000  0.2720000     -0.000000      0.000000  
1 1 1 0  39 2  o 17.19000  0.2545000     17.19000  0.2545000     17.19000  0.2545000     0.000000       0.000000  
1 1 1 0  39 3  o 7.309000  0.2512000     7.309000  0.2512000     7.309000  0.2512000     -0.000000      0.000000  
1 1 1 0  39 4  f 13.60000  0.2399000     13.60000  0.2399000     13.60000  0.2399000     -0.000000      0.000000  
1 1 1 0  39 5  o 21.36000  0.2887000     21.36000  0.2887000     21.36000  0.2887000     0.000000       0.000000  
1 1 1 0  39 6  o 22.77000  0.3018000     22.77000  0.3018000     22.77000  0.3018000     0.000000       0.000000  
1 1 1 0  39 7  o 15.29000  0.2507000     15.29000  0.2507000     15.29000  0.2507000     -0.000000      0.000000  
1 1 1 0  39 8  o 20.83000  0.2875000     20.83000  0.2875000     20.83000  0.2875000     -0.000000      0.000000  
1 1 1 0  39 9  o 12.18000  0.2483000     12.18000  0.2483000     12.18000  0.2483000     -0.000000      0.000000  
1 1 1 0  39 10 o 4.982000  0.3751000     4.982000  0.3751000     4.982000  0.3751000     -0.000000      0.000000  
1 1 1 0  39 11 o 7.399000  0.3086000     7.399000  0.3086000     7.399000  0.3086000     -0.000000      0.000000  
1 1 1 0  39 12 o 2.019000  1.050000      2.019000  1.050000      2.019000  1.050000      -0.000000      0.000000  
1 1 1 0  39 13 o 5.662000  0.5769000     5.662000  0.5769000     5.662000  0.5769000     0.000000       0.000000  
1 1 1 0  39 14 o 7.025000  0.3557000     7.025000  0.3557000     7.025000  0.3557000     0.000000       0.000000  
1 1 1 0  39 15 o 1.100000  0.7204000     1.100000  0.7204000     1.100000  0.7204000     -0.000000      0.000000  
1 1 1 0  39 16 o 7.731000  0.3231000     7.731000  0.3231000     7.731000  0.3231000     0.000000       0.000000  
1 1 1 0  39 17 o 1.217000  0.7563000     1.217000  0.7563000     1.217000  0.7563000     0.000000       0.000000  
1 1 1 0  39 18 o 1.399000  0.8244000     1.399000  0.8244000     1.399000  0.8244000     -0.000000      0.000000  
1 1 1 0  39 19 o 0.9100000 0.6489000     0.9100000 0.6489000     0.9100000 0.6489000     -0.000000      0.000000  
1 1 1 0  39 20 o 0.9813000 0.6549000     0.9813000 0.6549000     0.9813000 0.6549000     -0.000000      0.000000  
1 1 1 0  39 21 o 0.9488000 0.6501000     0.9488000 0.6501000     0.9488000 0.6501000     -0.000000      0.000000  
1 1 1 0  39 22 o 1.381000  0.8203000     1.381000  0.8203000     1.381000  0.8203000     0.000000       0.000000  
1 1 1 0  40 0  o 31.94000  0.5408000     31.94000  0.5408000     31.94000  0.5408000     -0.000000      0.000000  
1 1 1 0  40 1  o 9.314000  0.2346000     9.314000  0.2346000     9.314000  0.2346000     -0.000000      0.000000  
1 1 1 0  40 2  o 2.726000  0.5807000     2.726000  0.5807000     2.726000  0.5807000     -0.000000      0.000000  
1 1 1 0  40 3  o 8.302000  0.2458000     8.302000  0.2458000     8.302000  0.2458000     0.000000       0.000000  
1 1 1 0  40 4  o 7.085000  0.2621000     7.085000  0.2621000     7.085000  0.2621000     -0.000000      0.000000  
1 1 1 0  40 5  o 1.259000  0.7073000     1.259000  0.7073000     1.259000  0.7073000     -0.000000      0.000000  
1 1 1 0  40 6  o 11.22000  0.2831000     11.22000  0.2831000     11.22000  0.2831000     0.000000       0.000000  
1 1 1 0  40 7  o 11.69000  0.2435000     11.69000  0.2435000     11.69000  0.2435000     -0.000000      0.000000  
1 1 1 0  40 8  o 6.046000  0.3042000     6.046000  0.3042000     6.046000  0.3042000     0.000000       0.000000  
1 1 1 0  40 9  o 6.213000  0.3261000     6.213000  0.3261000     6.213000  0.3261000     0.000000       0.000000  
1 1 1 0  40 10 o 1.937000  0.8528000     1.937000  0.8528000     1.937000  0.8528000     0.000000       0.000000  
1 1 1 0  40 11 o 1.142000  0.7227000     1.142000  0.7227000     1.142000  0.7227000     0.000000       0.000000  
1 1 1 0  40 13 o 3.372000  0.6873000     3.372000  0.6873000     3.372000  0.6873000     0.000000       0.000000  
1 1 1 0  40 14 o 1.231000  0.7756000     1.231000  0.7756000     1.231000  0.7756000     -0.000000      0.000000  
1 1 1 0  40 15 f 6.523000  0.3685000     6.523000  0.3685000     6.523000  0.3685000     0.000000       0.000000  
1 1 1 0  40 16 o 1.520000  0.8455000     1.520000  0.8455000     1.520000  0.8455000     -0.000000      0.000000  
1 1 1 0  40 17 o 2.490000  0.8770000     2.490000  0.8770000     2.490000  0.8770000     0.000000       0.000000  
1 1 1 0  40 18 o 3.157000  0.7313000     3.157000  0.7313000     3.157000  0.7313000     0.000000       0.000000  
1 1 1 0  40 19 o 1.489000  0.8973000     1.489000  0.8973000     1.489000  0.8973000     0.000000       0.000000  
1 1 1 0  40 20 o 2.570000  0.8156000     2.570000  0.8156000     2.570000  0.8156000     -0.000000      0.000000  
1 1 1 0  40 21 o 0.9722000 0.6450000     0.9722000 0.6450000     0.9722000 0.6450000     0.000000       0.000000  
1 1 1 0  40 22 o 0.8904000 0.6185000     0.8904000 0.6185000     0.8904000 0.6185000     0.000000       0.000000  
1 1 1 0  41 1  o 1.448000  0.7443000     1.448000  0.7443000     1.448000  0.7443000     -0.000000      0.000000  
1 1 1 0  41 2  o 18.36000  0.2661000     18.36000  0.2661000     18.36000  0.2661000     0.000000       0.000000  
1 1 1 0  41 3  o 24.53000  0.3148000     24.53000  0.3148000     24.53000  0.3148000     -0.000000      0.000000  
1 1 1 0  41 4  o 5.891000  0.2978000     5.891000  0.2978000     5.891000  0.2978000     0.000000       0.000000  
1 1 1 0  41 5  o 22.46000  0.2985000     22.46000  0.2985000     22.46000  0.2985000     -0.000000      0.000000  
1 1 1 0  41 6  o 10.76000  0.2425000     10.76000  0.2425000     10.76000  0.2425000     0.000000       0.000000  
1 1 1 0  41 7  o 19.00000  0.2774000     19.00000  0.2774000     19.00000  0.2774000     0.000000       0.000000  
1 1 1 0  41 8  o 18.69000  0.2793000     18.69000  0.2793000     18.69000  0.2793000     -0.000000      0.000000  
1 1 1 0  41 9  o 1.413000  0.7866000     1.413000  0.7866000     1.413000  0.7866000     0.000000       0.000000  
1 1 1 0  41 10 o 2.110000  0.8506000     2.110000  0.8506000     2.110000  0.8506000     -0.000000      0.000000  
1 1 1 0  41 11 o 3.911000  0.8430000     3.911000  0.8430000     3.911000  0.8430000     0.000000       0.000000  
1 1 1 0  41 12 o 5.394000  0.4168000     5.394000  0.4168000     5.394000  0.4168000     0.000000       0.000000  
1 1 1 0  41 13 o 8.353000  0.3241000     8.353000  0.3241000     8.353000  0.3241000     -0.000000      0.000000  
1 1 1 0  41 14 o 1.282000  0.7890000     1.282000  0.7890000     1.282000  0.7890000     -0.000000      0.000000  
1 1 1 0  41 15 o 1.297000  0.7964000     1.297000  0.7964000     1.297000  0.7964000     -0.000000      0.000000  
1 1 1 0  41 16 o 2.929000  0.7866000     2.929000  0.7866000     2.929000  0.7866000     0.000000       0.000000  
1 1 1 0  41 17 o 4.543000  0.4808000     4.543000  0.4808000     4.543000  0.4808000     0.000000       0.000000  
1 1 1 0  41 18 o 1.093000  0.7118000     1.093000  0.7118000     1.093000  0.7118000     -0.000000      0.000000  
1 1 1 0  41 19 o 3.345000  0.6543000     3.345000  0.6543000     3.345000  0.6543000     0.000000       0.000000  
1 1 1 0  41 20 o 1.312000  0.7802000     1.312000  0.7802000     1.312000  0.7802000     -0.000000      0.000000  
1 1 1 0  41 21 o 1.233000  0.7477000     1.233000  0.7477000     1.233000  0.7477000     0.000000       0.000000  
1 1 1 0  41 22 o 0.9724000 0.6599000     0.9724000 0.6599000     0.9724000 0.6599000     -0.000000      0.000000  
1 1 1 0  42 0  o 30.23000  0.5198000     30.23000  0.5198000     30.23000  0.5198000     0.000000       0.000000  
1 1 1 0  42 1  o 15.78000  0.2513000     15.78000  0.2513000     15.78000  0.2513000     -0.000000      0.000000  
1 1 1 0  42 2  o 4.578000  0.3563000     4.578000  0.3563000     4.578000  0.3563000     -0.000000      0.000000  
1 1 1 0  42 3  o 17.17000  0.2600000     17.17000  0.2600000     17.17000  0.2600000     -0.000000      0.000000  
1 1 1 0  42 4  o 9.584000  0.2454000     9.584000  0.2454000     9.584000  0.2454000     -0.000000      0.000000  
1 1 1 0  42 5  o 2.147000  0.7484000     2.147000  0.7484000     2.147000  0.7484000     -0.000000      0.000000  
1 1 1 0  42 6  o 22.49000  0.3019000     22.49000  0.3019000     22.49000  0.3019000     0.000000       0.000000  
1 1 1 0  42 7  o 9.572000  0.2609000     9.572000  0.2609000     9.572000  0.2609000     -0.000000      0.000000  
1 1 1 0  42 8  o 9.624000  0.2679000     9.624000  0.2679000     9.624000  0.2679000     -0.000000      0.000000  
1 1 1 0  42 9  o 10.09000  0.2713000     10.09000  0.2713000     10.09000  0.2713000     -0.000000      0.000000  
1 1 1 0  42 10 o 12.03000  0.3123000     12.03000  0.3123000     12.03000  0.3123000     0.000000       0.000000  
1 1 1 0  42 12 o 9.748000  0.2918000     9.748000  0.2918000     9.748000  0.2918000     0.000000       0.000000  
1 1 1 0  42 13 o 5.178000  0.4457000     5.178000  0.4457000     5.178000  0.4457000     0.000000       0.000000  
1 1 1 0  42 14 o 4.681000  0.4772000     4.681000  0.4772000     4.681000  0.4772000     0.000000       0.000000  
1 1 1 0  42 15 o 4.863000  0.4614000     4.863000  0.4614000     4.863000  0.4614000     0.000000       0.000000  
1 1 1 0  42 16 o 0.8294000 0.5838000     0.8294000 0.5838000     0.8294000 0.5838000     0.000000       0.000000  
1 1 1 0  42 17 o 3.073000  0.7489000     3.073000  0.7489000     3.073000  0.7489000     -0.000000      0.000000  
1 1 1 0  42 18 o 1.330000  0.8918000     1.330000  0.8918000     1.330000  0.8918000     0.000000       0.000000  
1 1 1 0  42 19 o 0.8537000 0.5896000     0.8537000 0.5896000     0.8537000 0.5896000     0.000000       0.000000  
1 1 1 0  42 20 o 1.047000  0.6801000     1.047000  0.6801000     1.047000  0.6801000     -0.000000      0.000000  
1 1 1 0  42 21 o 2.358000  0.8175000     2.358000  0.8175000     2.358000  0.8175000     -0.000000      0.000000  
1 1 1 0  42 22 o 1.359000  0.9303000     1.359000  0.9303000     1.359000  0.9303000     -0.000000      0.000000  
1 1 1 0  43 1  o 1.680000  0.7758000     1.680000  0.7758000     1.680000  0.7758000     0.000000       0.000000  
1 1 1 0  43 2  o 10.74000  0.2397000     10.74000  0.2397000     10.74000  0.2397000     -0.000000      0.000000  
1 1 1 0  43 3  o 1.997000  0.7564000     1.997000  0.7564000     1.997000  0.7564000     0.000000       0.000000  
1 1 1 0  43 4  o 7.439000  0.2713000     7.439000  0.2713000     7.439000  0.2713000     -0.000000      0.000000  
1 1 1 0  43 5  o 11.20000  0.2474000     11.20000  0.2474000     11.20000  0.2474000     -0.000000      0.000000  
1 1 1 0  43 6  o 2.129000  0.7977000     2.129000  0.7977000     2.129000  0.7977000     -0.000000      0.000000  
1 1 1 0  43 7  o 11.91000  0.2588000     11.91000  0.2588000     11.91000  0.2588000     0.000000       0.000000  
1 1 1 0  43 8  o 11.73000  0.2629000     11.73000  0.2629000     11.73000  0.2629000     -0.000000      0.000000  
1 1 1 0  43 9  f 5.554000  0.3767000     5.554000  0.3767000     5.554000  0.3767000     0.000000       0.000000  
1 1 1 0  43 11 o 2.972000  0.7431000     2.972000  0.7431000     2.972000  0.7431000     -0.000000      0.000000  
1 1 1 0  43 12 o 4.170000  0.5148000     4.170000  0.5148000     4.170000  0.5148000     -0.000000      0.000000  
1 1 1 0  43 13 o 6.799000  0.3578000     6.799000  0.3578000     6.799000  0.3578000     -0.000000      0.000000  
1 1 1 0  43 14 o 2.304000  0.8957000     2.304000  0.8957000     2.304000  0.8957000     0.000000       0.000000  
1 1 1 0  43 15 o 6.588000  0.3664000     6.588000  0.3664000     6.588000  0.3664000     -0.000000      0.000000  
1 1 1 0  43 16 o 4.674000  0.4762000     4.674000  0.4762000     4.674000  0.4762000     0.000000       0.000000  
1 1 1 0  43 17 o 1.193000  0.7450000     1.193000  0.7450000     1.193000  0.7450000     -0.000000      0.000000  
1 1 1 0  43 18 o 1.225000  0.7971000     1.225000  0.7971000     1.225000  0.7971000     -0.000000      0.000000  
1 1 1 0  43 19 o 4.533000  0.4642000     4.533000  0.4642000     4.533000  0.4642000     0.000000       0.000000  
1 1 1 0  43 20 o 1.460000  0.7965000     1.460000  0.7965000     1.460000  0.7965000     -0.000000      0.000000  
1 1 1 0  43 21 o 0.6505000 0.4710000     0.6505000 0.4710000     0.6505000 0.4710000     0.000000       0.000000  
1 1 1 0  44 0  o 9.006000  0.3553000     9.006000  0.3553000     9.006000  0.3553000     0.000000       0.000000  
1 1 1 0  44 1  o 2.247000  0.7516000     2.247000  0.7516000     2.247000  0.7516000     0.000000       0.000000  
1 1 1 0  44 2  o 0.8531000 0.5741000     0.8531000 0.5741000     0.8531000 0.5741000     0.000000       0.000000  
1 1 1 0  44 3  o 12.92000  0.2488000     12.92000  0.2488000     12.92000  0.2488000     -0.000000      0.000000  
1 1 1 0  44 4  o 7.191000  0.2828000     7.191000  0.2828000     7.191000  0.2828000     0.000000       0.000000  
1 1 1 0  44 5  f 25.78000  0.3330000     25.78000  0.3330000     25.78000  0.3330000     -0.000000      0.000000  
1 1 1 0  44 6  o 10.37000  0.2592000     10.37000  0.2592000     10.37000  0.2592000     -0.000000      0.000000  
1 1 1 0  44 7  o 5.312000  0.3679000     5.312000  0.3679000     5.312000  0.3679000     0.000000       0.000000  
1 1 1 0  44 8  o 6.033000  0.3501000     6.033000  0.3501000     6.033000  0.3501000     0.000000       0.000000  
1 1 1 0  44 9  o 7.418000  0.6199000     7.418000  0.6199000     7.418000  0.6199000     0.000000       0.000000  
1 1 1 0  44 10 o 2.436000  0.9625000     2.436000  0.9625000     2.436000  0.9625000     -0.000000      0.000000  
1 1 1 0  44 11 o 5.405000  0.4051000     5.405000  0.4051000     5.405000  0.4051000     0.000000       0.000000  
1 1 1 0  44 12 o 2.406000  0.8778000     2.406000  0.8778000     2.406000  0.8778000     -0.000000      0.000000  
1 1 1 0  44 13 o 0.8253000 0.5818000     0.8253000 0.5818000     0.8253000 0.5818000     0.000000       0.000000  
1 1 1 0  44 14 o 1.207000  0.7601000     1.207000  0.7601000     1.207000  0.7601000     0.000000       0.000000  
1 1 1 0  44 15 o 1.060000  0.7023000     1.060000  0.7023000     1.060000  0.7023000     -0.000000      0.000000  
1 1 1 0  44 16 o 1.808000  0.9102000     1.808000  0.9102000     1.808000  0.9102000     0.000000       0.000000  
1 1 1 0  44 18 o 1.349000  0.7953000     1.349000  0.7953000     1.349000  0.7953000     0.000000       0.000000  
1 1 1 0  44 19 o 1.282000  0.7695000     1.282000  0.7695000     1.282000  0.7695000     0.000000       0.000000  
1 1 1 0  44 20 o 1.007000  0.6610000     1.007000  0.6610000     1.007000  0.6610000     -0.000000      0.000000  
1 1 1 0  44 21 o 2.386000  0.8434000     2.386000  0.8434000     2.386000  0.8434000     0.000000       0.000000  
1 1 1 0  45 1  o 8.050000  0.2682000     8.050000  0.2682000     8.050000  0.2682000     -0.000000      0.000000  
1 1 1 0  45 2  o 14.26000  0.2534000     14.26000  0.2534000     14.26000  0.2534000     0.000000       0.000000  
1 1 1 0  45 3  o 1.957000  0.8067000     1.957000  0.8067000     1.957000  0.8067000     0.000000       0.000000  
1 1 1 0  45 4  o 15.69000  0.2622000     15.69000  0.2622000     15.69000  0.2622000     -0.000000      0.000000  
1 1 1 0  45 5  o 9.500000  0.2662000     9.500000  0.2662000     9.500000  0.2662000     0.000000       0.000000  
1 1 1 0  45 6  o 4.757000  0.3968000     4.757000  0.3968000     4.757000  0.3968000     -0.000000      0.000000  
1 1 1 0  45 7  o 6.580000  0.3272000     6.580000  0.3272000     6.580000  0.3272000     -0.000000      0.000000  
1 1 1 0  45 8  o 11.02000  0.4149000     11.02000  0.4149000     11.02000  0.4149000     0.000000       0.000000  
1 1 1 0  45 9  o 15.93000  0.3846000     15.93000  0.3846000     15.93000  0.3846000     0.000000       0.000000  
1 1 1 0  45 10 f 5.415000  0.3984000     5.415000  0.3984000     5.415000  0.3984000     -0.000000      0.000000  
1 1 1 0  45 11 o 7.063000  0.3365000     7.063000  0.3365000     7.063000  0.3365000     -0.000000      0.000000  
1 1 1 0  45 12 o 3.201000  0.6813000     3.201000  0.6813000     3.201000  0.6813000     0.000000       0.000000  
1 1 1 0  45 13 o 2.584000  0.8598000     2.584000  0.8598000     2.584000  0.8598000     -0.000000      0.000000  
1 1 1 0  45 14 o 1.121000  0.7262000     1.121000  0.7262000     1.121000  0.7262000     -0.000000      0.000000  
1 1 1 0  45 15 o 1.358000  0.8154000     1.358000  0.8154000     1.358000  0.8154000     0.000000       0.000000  
1 1 1 0  45 16 f 4.453000  0.4964000     4.453000  0.4964000     4.453000  0.4964000     0.000000       0.000000  
1 1 1 0  45 17 o 1.546000  0.9355000     1.546000  0.9355000     1.546000  0.9355000     0.000000       0.000000  
1 1 1 0  45 18 o 1.272000  0.7711000     1.272000  0.7711000     1.272000  0.7711000     0.000000       0.000000  
1 1 1 0  45 19 o 2.309000  0.8267000     2.309000  0.8267000     2.309000  0.8267000     -0.000000      0.000000  
1 1 1 0  45 20 o 1.090000  0.6988000     1.090000  0.6988000     1.090000  0.6988000     -0.000000      0.000000  
1 1 1 0  46 0  o 18.35000  0.3941000     18.35000  0.3941000     18.35000  0.3941000     -0.000000      0.000000  
1 1 1 0  46 1  o 13.39000  0.2571000     13.39000  0.2571000     13.39000  0.2571000     -0.000000      0.000000  
1 1 1 0  46 2  o 9.032000  0.2639000     9.032000  0.2639000     9.032000  0.2639000     0.000000       0.000000  
1 1 1 0  46 3  o 13.64000  0.2566000     13.64000  0.2566000     13.64000  0.2566000     0.000000       0.000000  
1 1 1 0  46 4  f 8.889000  0.2737000     8.889000  0.2737000     8.889000  0.2737000     0.000000       0.000000  
1 1 1 0  46 5  o 7.032000  0.3071000     7.032000  0.3071000     7.032000  0.3071000     0.000000       0.000000  
1 1 1 0  46 6  o 15.18000  0.2671000     15.18000  0.2671000     15.18000  0.2671000     -0.000000      0.000000  
1 1 1 0  46 7  o 6.129000  0.5385000     6.129000  0.5385000     6.129000  0.5385000     0.000000       0.000000  
1 1 1 0  46 8  o 4.642000  0.6030000     4.642000  0.6030000     4.642000  0.6030000     0.000000       0.000000  
1 1 1 0  46 9  o 2.770000  0.7972000     2.770000  0.7972000     2.770000  0.7972000     -0.000000      0.000000  
1 1 1 0  46 10 o 1.486000  0.8353000     1.486000  0.8353000     1.486000  0.8353000     0.000000       0.000000  
1 1 1 0  46 11 o 3.346000  0.6665000     3.346000  0.6665000     3.346000  0.6665000     0.000000       0.000000  
1 1 1 0  46 12 o 1.467000  0.8290000     1.467000  0.8290000     1.467000  0.8290000     -0.000000      0.000000  
1 1 1 0  46 13 o 1.142000  0.7310000     1.142000  0.7310000     1.142000  0.7310000     0.000000       0.000000  
1 1 1 0  46 14 o 1.083000  0.7103000     1.083000  0.7103000     1.083000  0.7103000     0.000000       0.000000  
1 1 1 0  46 15 o 3.369000  0.6877000     3.369000  0.6877000     3.369000  0.6877000     -0.000000      0.000000  
1 1 1 0  46 16 o 0.9913000 0.7006000     0.9913000 0.7006000     0.9913000 0.7006000     -0.000000      0.000000  
1 1 1 0  46 17 o 2.760000  0.8124000     2.760000  0.8124000     2.760000  0.8124000     0.000000       0.000000  
1 1 1 0  46 18 o 0.7053000 0.5066000     0.7053000 0.5066000     0.7053000 0.5066000     0.000000       0.000000  
1 1 1 0  46 19 o 1.019000  0.6696000     1.019000  0.6696000     1.019000  0.6696000     -0.000000      0.000000  
1 1 1 0  46 20 o 0.8516000 0.5872000     0.8516000 0.5872000     0.8516000 0.5872000     0.000000       0.000000  
1 1 1 0  47 1  o 11.79000  0.2571000     11.79000  0.2571000     11.79000  0.2571000     -0.000000      0.000000  
1 1 1 0  47 2  o 6.588000  0.3021000     6.588000  0.3021000     6.588000  0.3021000     0.000000       0.000000  
1 1 1 0  47 3  o 0.9588000 0.6370000     0.9588000 0.6370000     0.9588000 0.6370000     0.000000       0.000000  
1 1 1 0  47 4  o 12.14000  0.2631000     12.14000  0.2631000     12.14000  0.2631000     -0.000000      0.000000  
1 1 1 0  47 5  o 1.743000  0.9658000     1.743000  0.9658000     1.743000  0.9658000     0.000000       0.000000  
1 1 1 0  47 7  o 5.895000  0.5146000     5.895000  0.5146000     5.895000  0.5146000     -0.000000      0.000000  
1 1 1 0  47 8  o 2.772000  0.8053000     2.772000  0.8053000     2.772000  0.8053000     -0.000000      0.000000  
1 1 1 0  47 9  o 9.313000  0.2952000     9.313000  0.2952000     9.313000  0.2952000     0.000000       0.000000  
1 1 1 0  47 10 o 1.418000  0.8208000     1.418000  0.8208000     1.418000  0.8208000     -0.000000      0.000000  
1 1 1 0  47 11 o 0.8232000 0.5783000     0.8232000 0.5783000     0.8232000 0.5783000     -0.000000      0.000000  
1 1 1 0  47 12 o 1.267000  0.7727000     1.267000  0.7727000     1.267000  0.7727000     -0.000000      0.000000  
1 1 1 0  47 13 o 2.128000  0.8917000     2.128000  0.8917000     2.128000  0.8917000     0.000000       0.000000  
1 1 1 0  47 14 o 1.465000  0.8309000     1.465000  0.8309000     1.465000  0.8309000     0.000000       0.000000  
1 1 1 0  47 15 o 1.772000  0.8881000     1.772000  0.8881000     1.772000  0.8881000     0.000000       0.000000  
1 1 1 0  47 16 o 2.626000  1.094000      2.626000  1.094000      2.626000  1.094000      -0.000000      0.000000  
1 1 1 0  47 17 o 1.543000  0.8464000     1.543000  0.8464000     1.543000  0.8464000     -0.000000      0.000000  
1 1 1 0  47 18 o 1.845000  0.8812000     1.845000  0.8812000     1.845000  0.8812000     0.000000       0.000000  
1 1 1 0  47 19 o 0.9022000 0.6175000     0.9022000 0.6175000     0.9022000 0.6175000     0.000000       0.000000  
1 1 1 0  47 20 o 0.9033000 0.6230000     0.9033000 0.6230000     0.9033000 0.6230000     -0.000000      0.000000  
1 1 1 0  48 0  o 11.24000  0.3753000     11.24000  0.3753000     11.24000  0.3753000     0.000000       0.000000  
1 1 1 0  48 1  o 2.675000  0.7439000     2.675000  0.7439000     2.675000  0.7439000     -0.000000      0.000000  
1 1 1 0  48 2  o 6.009000  0.3400000     6.009000  0.3400000     6.009000  0.3400000     0.000000       0.000000  
1 1 1 0  48 3  o 11.92000  0.3836000     11.92000  0.3836000     11.92000  0.3836000     0.000000       0.000000  
1 1 1 0  48 4  o 12.64000  0.3945000     12.64000  0.3945000     12.64000  0.3945000     -0.000000      0.000000  
1 1 1 0  48 5  o 8.544000  0.3982000     8.544000  0.3982000     8.544000  0.3982000     -0.000000      0.000000  
1 1 1 0  48 6  o 8.676000  0.2924000     8.676000  0.2924000     8.676000  0.2924000     0.000000       0.000000  
1 1 1 0  48 7  o 10.38000  0.2815000     10.38000  0.2815000     10.38000  0.2815000     -0.000000      0.000000  
1 1 1 0  48 8  o 10.59000  0.2869000     10.59000  0.2869000     10.59000  0.2869000     -0.000000      0.000000  
1 1 1 0  48 9  o 0.9058000 0.6237000     0.9058000 0.6237000     0.9058000 0.6237000     0.000000       0.000000  
1 1 1 0  48 10 o 6.737000  0.3459000     6.737000  0.3459000     6.737000  0.3459000     0.000000       0.000000  
1 1 1 0  48 11 o 2.767000  0.8088000     2.767000  0.8088000     2.767000  0.8088000     -0.000000      0.000000  
1 1 1 0  48 12 f 4.507000  0.4604000     4.507000  0.4604000     4.507000  0.4604000     -0.000000      0.000000  
1 1 1 0  48 13 o 0.9285000 0.6350000     0.9285000 0.6350000     0.9285000 0.6350000     -0.000000      0.000000  
1 1 1 0  48 14 o 4.361000  0.5007000     4.361000  0.5007000     4.361000  0.5007000     -0.000000      0.000000  
1 1 1 0  48 15 o 1.737000  1.013000      1.737000  1.013000      1.737000  1.013000      0.000000       0.000000  
1 1 1 0  48 16 o 1.211000  0.7575000     1.211000  0.7575000     1.211000  0.7575000     0.000000       0.000000  
1 1 1 0  48 17 o 0.7646000 0.5455000     0.7646000 0.5455000     0.7646000 0.5455000     0.000000       0.000000  
1 1 1 0  48 18 o 1.611000  0.8470000     1.611000  0.8470000     1.611000  0.8470000     -0.000000      0.000000  
1 1 1 0  48 19 o 0.7436000 0.5286000     0.7436000 0.5286000     0.7436000 0.5286000     -0.000000      0.000000  
1 1 1 0  49 3  o 1.194000  0.7895000     1.194000  0.7895000     1.194000  0.7895000     -0.000000      0.000000  
1 1 1 0  49 4  o 9.523000  0.3927000     9.523000  0.3927000     9.523000  0.3927000     0.000000       0.000000  
1 1 1 0  49 5  o 8.263000  0.2970000     8.263000  0.2970000     8.263000  0.2970000     0.000000       0.000000  
1 1 1 0  49 6  o 8.936000  0.2955000     8.936000  0.2955000     8.936000  0.2955000     0.000000       0.000000  
1 1 1 0  49 7  o 2.286000  0.8782000     2.286000  0.8782000     2.286000  0.8782000     0.000000       0.000000  
1 1 1 0  49 8  o 7.980000  0.3190000     7.980000  0.3190000     7.980000  0.3190000     -0.000000      0.000000  
1 1 1 0  49 9  f 0.9664000 0.6575000     0.9664000 0.6575000     0.9664000 0.6575000     -0.000000      0.000000  
1 1 1 0  49 10 o 2.228000  0.8852000     2.228000  0.8852000     2.228000  0.8852000     0.000000       0.000000  
1 1 1 0  49 11 o 1.216000  0.7584000     1.216000  0.7584000     1.216000  0.7584000     0.000000       0.000000  
1 1 1 0  49 12 o 1.048000  0.6911000     1.048000  0.6911000     1.048000  0.6911000     -0.000000      0.000000  
1 1 1 0  49 13 o 2.229000  0.8938000     2.229000  0.8938000     2.229000  0.8938000     0.000000       0.000000  
1 1 1 0  49 14 o 1.256000  0.7718000     1.256000  0.7718000     1.256000  0.7718000     0.000000       0.000000  
1 1 1 0  49 15 o 4.537000  0.6491000     4.537000  0.6491000     4.537000  0.6491000     -0.000000      0.000000  
1 1 1 0  49 16 o 2.410000  0.8777000     2.410000  0.8777000     2.410000  0.8777000     -0.000000      0.000000  
1 1 1 0  49 17 o 1.853000  0.8838000     1.853000  0.8838000     1.853000  0.8838000     -0.000000      0.000000  
1 1 1 0  49 18 o 0.6960000 0.5010000     0.6960000 0.5010000     0.6960000 0.5010000     0.000000       0.000000  
1 1 1 0  49 19 o 0.9437000 0.6349000     0.9437000 0.6349000     0.9437000 0.6349000     0.000000       0.000000  
1 1 1 0  50 0  o 2.564000  1.194000      2.564000  1.194000      2.564000  1.194000      -0.000000      0.000000  
1 1 1 0  50 1  o 7.089000  0.3409000     7.089000  0.3409000     7.089000  0.3409000     -0.000000      0.000000  
1 1 1 0  50 2  o 11.79000  0.2766000     11.79000  0.2766000     11.79000  0.2766000     0.000000       0.000000  
1 1 1 0  50 3  o 10.98000  0.2763000     10.98000  0.2763000     10.98000  0.2763000     0.000000       0.000000  
1 1 1 0  50 4  o 1.233000  0.7633000     1.233000  0.7633000     1.233000  0.7633000     -0.000000      0.000000  
1 1 1 0  50 5  o 10.68000  0.2761000     10.68000  0.2761000     10.68000  0.2761000     -0.000000      0.000000  
1 1 1 0  50 6  o 4.979000  0.4172000     4.979000  0.4172000     4.979000  0.4172000     0.000000       0.000000  
1 1 1 0  50 7  o 7.116000  0.3369000     7.116000  0.3369000     7.116000  0.3369000     -0.000000      0.000000  
1 1 1 0  50 8  o 7.486000  0.3320000     7.486000  0.3320000     7.486000  0.3320000     -0.000000      0.000000  
1 1 1 0  50 9  o 0.8963000 0.6200000     0.8963000 0.6200000     0.8963000 0.6200000     0.000000       0.000000  
1 1 1 0  50 10 f 1.694000  0.8738000     1.694000  0.8738000     1.694000  0.8738000     -0.000000      0.000000  
1 1 1 0  50 11 o 2.943000  0.7566000     2.943000  0.7566000     2.943000  0.7566000     0.000000       0.000000  
1 1 1 0  50 12 o 1.435000  0.8251000     1.435000  0.8251000     1.435000  0.8251000     -0.000000      0.000000  
1 1 1 0  50 13 o 4.146000  0.5183000     4.146000  0.5183000     4.146000  0.5183000     0.000000       0.000000  
1 1 1 0  50 14 o 1.540000  0.9514000     1.540000  0.9514000     1.540000  0.9514000     0.000000       0.000000  
1 1 1 0  50 15 o 0.9986000 0.6626000     0.9986000 0.6626000     0.9986000 0.6626000     -0.000000      0.000000  
1 1 1 0  50 16 o 1.081000  0.7009000     1.081000  0.7009000     1.081000  0.7009000     -0.000000      0.000000  
1 1 1 0  50 17 o 0.9344000 0.6335000     0.9344000 0.6335000     0.9344000 0.6335000     0.000000       0.000000  
1 1 1 0  50 18 o 1.957000  0.9032000     1.957000  0.9032000     1.957000  0.9032000     -0.000000      0.000000  
1 1 1 0  51 1  o 13.80000  0.2742000     13.80000  0.2742000     13.80000  0.2742000     0.000000       0.000000  
1 1 1 0  51 2  o 12.78000  0.2729000     12.78000  0.2729000     12.78000  0.2729000     0.000000       0.000000  
1 1 1 0  51 3  o 0.9854000 0.6602000     0.9854000 0.6602000     0.9854000 0.6602000     0.000000       0.000000  
1 1 1 0  51 4  o 1.462000  0.8220000     1.462000  0.8220000     1.462000  0.8220000     -0.000000      0.000000  
1 1 1 0  51 5  o 9.140000  0.3400000     9.140000  0.3400000     9.140000  0.3400000     0.000000       0.000000  
1 1 1 0  51 6  o 2.828000  0.7464000     2.828000  0.7464000     2.828000  0.7464000     0.000000       0.000000  
1 1 1 0  51 7  f 4.451000  0.4636000     4.451000  0.4636000     4.451000  0.4636000     0.000000       0.000000  
1 1 1 0  51 8  f 7.481000  0.3333000     7.481000  0.3333000     7.481000  0.3333000     0.000000       0.000000  
1 1 1 0  51 9  o 1.099000  0.7132000     1.099000  0.7132000     1.099000  0.7132000     -0.000000      0.000000  
1 1 1 0  51 10 o 2.399000  0.8711000     2.399000  0.8711000     2.399000  0.8711000     -0.000000      0.000000  
1 1 1 0  51 11 o 1.310000  0.7918000     1.310000  0.7918000     1.310000  0.7918000     -0.000000      0.000000  
1 1 1 0  51 12 o 1.323000  0.7959000     1.323000  0.7959000     1.323000  0.7959000     -0.000000      0.000000  
1 1 1 0  51 13 o 1.063000  0.7385000     1.063000  0.7385000     1.063000  0.7385000     0.000000       0.000000  
1 1 1 0  51 14 o 1.290000  0.8252000     1.290000  0.8252000     1.290000  0.8252000     -0.000000      0.000000  
1 1 1 0  51 15 o 1.689000  0.8595000     1.689000  0.8595000     1.689000  0.8595000     0.000000       0.000000  
1 1 1 0  51 16 o 3.476000  0.6338000     3.476000  0.6338000     3.476000  0.6338000     0.000000       0.000000  
1 1 1 0  51 17 o 1.038000  0.6848000     1.038000  0.6848000     1.038000  0.6848000     -0.000000      0.000000  
1 1 1 0  51 18 o 2.086000  0.8932000     2.086000  0.8932000     2.086000  0.8932000     -0.000000      0.000000  
1 1 1 0  52 0  o 5.474000  0.5319000     5.474000  0.5319000     5.474000  0.5319000     0.000000       0.000000  
1 1 1 0  52 1  o 5.834000  0.3621000     5.834000  0.3621000     5.834000  0.3621000     -0.000000      0.000000  
1 1 1 0  52 2  o 1.729000  0.8647000     1.729000  0.8647000     1.729000  0.8647000     0.000000       0.000000  
1 1 1 0  52 3  o 4.875000  0.4230000     4.875000  0.4230000     4.875000  0.4230000     -0.000000      0.000000  
1 1 1 0  52 4  o 3.849000  0.5403000     3.849000  0.5403000     3.849000  0.5403000     -0.000000      0.000000  
1 1 1 0  52 5  o 11.93000  0.2756000     11.93000  0.2756000     11.93000  0.2756000     0.000000       0.000000  
1 1 1 0  52 6  o 1.249000  0.7659000     1.249000  0.7659000     1.249000  0.7659000     -0.000000      0.000000  
1 1 1 0  52 7  o 3.057000  0.6797000     3.057000  0.6797000     3.057000  0.6797000     -0.000000      0.000000  
1 1 1 0  52 8  o 3.754000  0.5730000     3.754000  0.5730000     3.754000  0.5730000     -0.000000      0.000000  
1 1 1 0  52 9  o 0.9161000 0.6301000     0.9161000 0.6301000     0.9161000 0.6301000     -0.000000      0.000000  
1 1 1 0  52 10 o 0.8345000 0.5861000     0.8345000 0.5861000     0.8345000 0.5861000     -0.000000      0.000000  
1 1 1 0  52 11 o 1.138000  0.7320000     1.138000  0.7320000     1.138000  0.7320000     -0.000000      0.000000  
1 1 1 0  52 12 o 1.057000  0.7005000     1.057000  0.7005000     1.057000  0.7005000     0.000000       0.000000  
1 1 1 0  52 13 o 3.118000  1.472000      3.118000  1.472000      3.118000  1.472000      0.000000       0.000000  
1 1 1 0  52 14 o 1.939000  0.8751000     1.939000  0.8751000     1.939000  0.8751000     0.000000       0.000000  
1 1 1 0  52 15 o 1.181000  0.7447000     1.181000  0.7447000     1.181000  0.7447000     0.000000       0.000000  
1 1 1 0  52 16 o 2.124000  0.8797000     2.124000  0.8797000     2.124000  0.8797000     0.000000       0.000000  
1 1 1 0  52 17 o 0.9571000 0.6424000     0.9571000 0.6424000     0.9571000 0.6424000     0.000000       0.000000  
1 1 1 0  53 1  o 6.044000  0.3643000     6.044000  0.3643000     6.044000  0.3643000     0.000000       0.000000  
1 1 1 0  53 2  o 0.7285000 0.5223000     0.7285000 0.5223000     0.7285000 0.5223000     -0.000000      0.000000  
1 1 1 0  53 3  o 1.216000  0.7498000     1.216000  0.7498000     1.216000  0.7498000     0.000000       0.000000  
1 1 1 0  53 4  o 1.150000  0.7249000     1.150000  0.7249000     1.150000  0.7249000     0.000000       0.000000  
1 1 1 0  53 5  o 1.192000  0.7443000     1.192000  0.7443000     1.192000  0.7443000     -0.000000      0.000000  
1 1 1 0  53 6  o 1.198000  0.7448000     1.198000  0.7448000     1.198000  0.7448000     0.000000       0.000000  
1 1 1 0  53 7  o 3.482000  0.5769000     3.482000  0.5769000     3.482000  0.5769000     0.000000       0.000000  
1 1 1 0  53 8  o 6.159000  0.3832000     6.159000  0.3832000     6.159000  0.3832000     -0.000000      0.000000  
1 1 1 0  53 9  o 1.359000  0.8155000     1.359000  0.8155000     1.359000  0.8155000     0.000000       0.000000  
1 1 1 0  53 10 o 3.842000  0.5738000     3.842000  0.5738000     3.842000  0.5738000     0.000000       0.000000  
1 1 1 0  53 11 o 8.363000  0.3220000     8.363000  0.3220000     8.363000  0.3220000     0.000000       0.000000  
1 1 1 0  53 12 o 1.517000  0.9918000     1.517000  0.9918000     1.517000  0.9918000     -0.000000      0.000000  
1 1 1 0  53 13 f 1.471000  0.8259000     1.471000  0.8259000     1.471000  0.8259000     0.000000       0.000000  
1 1 1 0  53 14 o 3.196000  0.7256000     3.196000  0.7256000     3.196000  0.7256000     0.000000       0.000000  
1 1 1 0  53 15 o 6.278000  0.3788000     6.278000  0.3788000     6.278000  0.3788000     -0.000000      0.000000  
1 1 1 0  53 16 o 2.430000  0.8409000     2.430000  0.8409000     2.430000  0.8409000     -0.000000      0.000000  
1 1 1 0  53 17 o 0.9001000 0.6166000     0.9001000 0.6166000     0.9001000 0.6166000     0.000000       0.000000  
1 1 1 0  54 0  o 9.473000  0.4091000     9.473000  0.4091000     9.473000  0.4091000     0.000000       0.000000  
1 1 1 0  54 1  o 1.112000  0.7074000     1.112000  0.7074000     1.112000  0.7074000     -0.000000      0.000000  
1 1 1 0  54 2  o 2.661000  0.7780000     2.661000  0.7780000     2.661000  0.7780000     -0.000000      0.000000  
1 1 1 0  54 3  o 1.131000  0.7243000     1.131000  0.7243000     1.131000  0.7243000     0.000000       0.000000  
1 1 1 0  54 4  o 0.8042000 0.5673000     0.8042000 0.5673000     0.8042000 0.5673000     -0.000000      0.000000  
1 1 1 0  54 5  o 1.370000  0.7986000     1.370000  0.7986000     1.370000  0.7986000     -0.000000      0.000000  
1 1 1 0  54 6  o 1.687000  0.8529000     1.687000  0.8529000     1.687000  0.8529000     0.000000       0.000000  
1 1 1 0  54 7  o 5.648000  0.3884000     5.648000  0.3884000     5.648000  0.3884000     -0.000000      0.000000  
1 1 1 0  54 8  o 1.180000  0.7514000     1.180000  0.7514000     1.180000  0.7514000     -0.000000      0.000000  
1 1 1 0  54 9  o 4.190000  0.5226000     4.190000  0.5226000     4.190000  0.5226000     -0.000000      0.000000  
1 1 1 0  54 10 o 1.136000  0.7287000     1.136000  0.7287000     1.136000  0.7287000     0.000000       0.000000  
1 1 1 0  54 11 f 1.208000  0.8009000     1.208000  0.8009000     1.208000  0.8009000     -0.000000      0.000000  
1 1 1 0  54 12 o 2.443000  1.043000      2.443000  1.043000      2.443000  1.043000      -0.000000      0.000000  
1 1 1 0  54 13 o 3.329000  0.6871000     3.329000  0.6871000     3.329000  0.6871000     0.000000       0.000000  
1 1 1 0  54 14 o 2.142000  0.8999000     2.142000  0.8999000     2.142000  0.8999000     0.000000       0.000000  
1 1 1 0  54 15 o 1.508000  0.8299000     1.508000  0.8299000     1.508000  0.8299000     -0.000000      0.000000  
1 1 1 0  54 16 f 0.9559000 0.6456000     0.9559000 0.6456000     0.9559000 0.6456000     -0.000000      0.000000  
1 1 1 0  55 1  o 0.6271000 0.4575000     0.6271000 0.4575000     0.6271000 0.4575000     0.000000       0.000000  
1 1 1 0  55 2  o 1.591000  0.8471000     1.591000  0.8471000     1.591000  0.8471000     0.000000       0.000000  
1 1 1 0  55 3  o 5.605000  0.3794000     5.605000  0.3794000     5.605000  0.3794000     -0.000000      0.000000  
1 1 1 0  55 4  o 10.13000  0.2897000     10.13000  0.2897000     10.13000  0.2897000     -0.000000      0.000000  
1 1 1 0  55 5  o 5.229000  0.4220000     5.229000  0.4220000     5.229000  0.4220000     0.000000       0.000000  
1 1 1 0  55 6  o 1.234000  0.7635000     1.234000  0.7635000     1.234000  0.7635000     -0.000000      0.000000  
1 1 1 0  55 7  o 2.433000  0.8668000     2.433000  0.8668000     2.433000  0.8668000     -0.000000      0.000000  
1 1 1 0  55 8  o 1.460000  0.8339000     1.460000  0.8339000     1.460000  0.8339000     0.000000       0.000000  
1 1 1 0  55 9  o 3.062000  0.7610000     3.062000  0.7610000     3.062000  0.7610000     0.000000       0.000000  
1 1 1 0  55 10 o 1.800000  1.024000      1.800000  1.024000      1.800000  1.024000      -0.000000      0.000000  
1 1 1 0  55 11 o 7.422000  0.4744000     7.422000  0.4744000     7.422000  0.4744000     -0.000000      0.000000  
1 1 1 0  55 12 o 0.7999000 0.5656000     0.7999000 0.5656000     0.7999000 0.5656000     0.000000       0.000000  
1 1 1 0  55 13 o 3.347000  0.6778000     3.347000  0.6778000     3.347000  0.6778000     -0.000000      0.000000  
1 1 1 0  55 14 o 1.108000  0.7110000     1.108000  0.7110000     1.108000  0.7110000     -0.000000      0.000000  
1 1 1 0  55 15 o 2.921000  0.7858000     2.921000  0.7858000     2.921000  0.7858000     -0.000000      0.000000  
1 1 1 0  55 16 o 3.621000  0.5937000     3.621000  0.5937000     3.621000  0.5937000     -0.000000      0.000000  
1 1 1 0  56 0  o 1.598000  0.9298000     1.598000  0.9298000     1.598000  0.9298000     -0.000000      0.000000  
1 1 1 0  56 1  o 2.909000  0.7502000     2.909000  0.7502000     2.909000  0.7502000     -0.000000      0.000000  
1 1 1 0  56 2  o 6.723000  0.3430000     6.723000  0.3430000     6.723000  0.3430000     0.000000       0.000000  
1 1 1 0  56 3  o 9.155000  0.3027000     9.155000  0.3027000     9.155000  0.3027000     0.000000       0.000000  
1 1 1 0  56 4  o 1.407000  0.8240000     1.407000  0.8240000     1.407000  0.8240000     -0.000000      0.000000  
1 1 1 0  56 5  o 7.961000  0.3259000     7.961000  0.3259000     7.961000  0.3259000     0.000000       0.000000  
1 1 1 0  56 6  o 0.9855000 0.6637000     0.9855000 0.6637000     0.9855000 0.6637000     0.000000       0.000000  
1 1 1 0  56 7  o 1.840000  0.8843000     1.840000  0.8843000     1.840000  0.8843000     -0.000000      0.000000  
1 1 1 0  56 8  o 1.875000  0.8892000     1.875000  0.8892000     1.875000  0.8892000     0.000000       0.000000  
1 1 1 0  56 9  o 3.217000  1.057000      3.217000  1.057000      3.217000  1.057000      0.000000       0.000000  
1 1 1 0  56 10 f 2.339000  1.097000      2.339000  1.097000      2.339000  1.097000      -0.000000      0.000000  
1 1 1 0  56 11 o 2.251000  0.8990000     2.251000  0.8990000     2.251000  0.8990000     -0.000000      0.000000  
1 1 1 0  56 12 o 3.460000  0.6321000     3.460000  0.6321000     3.460000  0.6321000     0.000000       0.000000  
1 1 1 0  56 13 o 3.664000  0.6085000     3.664000  0.6085000     3.664000  0.6085000     0.000000       0.000000  
1 1 1 0  56 14 o 6.054000  0.3817000     6.054000  0.3817000     6.054000  0.3817000     -0.000000      0.000000  
1 1 1 0  56 15 o 2.849000  0.8110000     2.849000  0.8110000     2.849000  0.8110000     0.000000       0.000000  
1 1 1 0  57 1  f 5.476000  0.4131000     5.476000  0.4131000     5.476000  0.4131000     -0.000000      0.000000  
1 1 1 0  57 2  o 9.221000  0.3112000     9.221000  0.3112000     9.221000  0.3112000     0.000000       0.000000  
1 1 1 0  57 3  o 1.651000  0.8805000     1.651000  0.8805000     1.651000  0.8805000     0.000000       0.000000  
1 1 1 0  57 4  o 1.470000  0.8362000     1.470000  0.8362000     1.470000  0.8362000     0.000000       0.000000  
1 1 1 0  57 5  f 5.458000  0.4135000     5.458000  0.4135000     5.458000  0.4135000     0.000000       0.000000  
1 1 1 0  57 6  o 5.182000  0.4288000     5.182000  0.4288000     5.182000  0.4288000     -0.000000      0.000000  
1 1 1 0  57 7  o 0.8029000 0.5672000     0.8029000 0.5672000     0.8029000 0.5672000     0.000000       0.000000  
1 1 1 0  57 8  o 0.9828000 0.6951000     0.9828000 0.6951000     0.9828000 0.6951000     0.000000       0.000000  
1 1 1 0  57 9  o 1.027000  0.7082000     1.027000  0.7082000     1.027000  0.7082000     -0.000000      0.000000  
1 1 1 0  57 10 o 3.829000  0.5780000     3.829000  0.5780000     3.829000  0.5780000     0.000000       0.000000  
1 1 1 0  57 11 o 1.001000  0.6712000     1.001000  0.6712000     1.001000  0.6712000     0.000000       0.000000  
1 1 1 0  57 12 o 0.9882000 0.6689000     0.9882000 0.6689000     0.9882000 0.6689000     -0.000000      0.000000  
1 1 1 0  57 13 o 0.7945000 0.5609000     0.7945000 0.5609000     0.7945000 0.5609000     0.000000       0.000000  
1 1 1 0  57 14 o 1.126000  0.7185000     1.126000  0.7185000     1.126000  0.7185000     -0.000000      0.000000  
1 1 1 0  57 15 o 1.339000  0.9209000     1.339000  0.9209000     1.339000  0.9209000     -0.000000      0.000000  
1 1 1 0  58 0  o 2.714000  1.056000      2.714000  1.056000      2.714000  1.056000      0.000000       0.000000  
1 1 1 0  58 1  o 0.7334000 0.5277000     0.7334000 0.5277000     0.7334000 0.5277000     0.000000       0.000000  
1 1 1 0  58 2  o 5.952000  0.3888000     5.952000  0.3888000     5.952000  0.3888000     -0.000000      0.000000  
1 1 1 0  58 3  o 3.331000  0.6857000     3.331000  0.6857000     3.331000  0.6857000     -0.000000      0.000000  
1 1 1 0  58 4  f 0.9245000 0.6324000     0.9245000 0.6324000     0.9245000 0.6324000     0.000000       0.000000  
1 1 1 0  58 5  o 1.148000  0.7323000     1.148000  0.7323000     1.148000  0.7323000     -0.000000      0.000000  
1 1 1 0  58 6  o 1.655000  0.9173000     1.655000  0.9173000     1.655000  0.9173000     0.000000       0.000000  
1 1 1 0  58 7  o 2.271000  1.238000      2.271000  1.238000      2.271000  1.238000      0.000000       0.000000  
1 1 1 0  58 8  o 1.271000  0.8322000     1.271000  0.8322000     1.271000  0.8322000     0.000000       0.000000  
1 1 1 0  58 9  o 1.179000  0.7446000     1.179000  0.7446000     1.179000  0.7446000     0.000000       0.000000  
1 1 1 0  58 10 o 2.695000  0.8421000     2.695000  0.8421000     2.695000  0.8421000     0.000000       0.000000  
1 1 1 0  58 11 o 0.9896000 0.6649000     0.9896000 0.6649000     0.9896000 0.6649000     -0.000000      0.000000  
1 1 1 0  58 12 o 1.718000  0.8749000     1.718000  0.8749000     1.718000  0.8749000     -0.000000      0.000000  
1 1 1 0  58 13 o 1.081000  0.7052000     1.081000  0.7052000     1.081000  0.7052000     0.000000       0.000000  
1 1 1 0  58 14 o 0.9361000 0.6480000     0.9361000 0.6480000     0.9361000 0.6480000     -0.000000      0.000000  
1 1 1 0  59 1  o 8.889000  0.3203000     8.889000  0.3203000     8.889000  0.3203000     -0.000000      0.000000  
1 1 1 0  59 2  o 7.124000  0.3515000     7.124000  0.3515000     7.124000  0.3515000     0.000000       0.000000  
1 1 1 0  59 3  f 2.809000  0.8150000     2.809000  0.8150000     2.809000  0.8150000     -0.000000      0.000000  
1 1 1 0  59 4  o 1.211000  0.8132000     1.211000  0.8132000     1.211000  0.8132000     -0.000000      0.000000  
1 1 1 0  59 5  o 0.9113000 0.6514000     0.9113000 0.6514000     0.9113000 0.6514000     -0.000000      0.000000  
1 1 1 0  59 6  o 1.305000  0.8557000     1.305000  0.8557000     1.305000  0.8557000     -0.000000      0.000000  
1 1 1 0  59 7  o 1.775000  0.9402000     1.775000  0.9402000     1.775000  0.9402000     -0.000000      0.000000  
1 1 1 0  59 8  o 0.8757000 0.6082000     0.8757000 0.6082000     0.8757000 0.6082000     -0.000000      0.000000  
1 1 1 0  59 9  o 1.524000  0.8476000     1.524000  0.8476000     1.524000  0.8476000     0.000000       0.000000  
1 1 1 0  59 10 o 1.631000  0.8620000     1.631000  0.8620000     1.631000  0.8620000     0.000000       0.000000  
1 1 1 0  59 11 o 0.9320000 0.6359000     0.9320000 0.6359000     0.9320000 0.6359000     -0.000000      0.000000  
1 1 1 0  59 12 o 4.698000  0.4858000     4.698000  0.4858000     4.698000  0.4858000     0.000000       0.000000  
1 1 1 0  59 13 o 1.452000  0.8278000     1.452000  0.8278000     1.452000  0.8278000     -0.000000      0.000000  
1 1 1 0  60 0  o 1.107000  0.7852000     1.107000  0.7852000     1.107000  0.7852000     -0.000000      0.000000  
1 1 1 0  60 1  o 3.375000  1.030000      3.375000  1.030000      3.375000  1.030000      -0.000000      0.000000  
1 1 1 0  60 2  o 0.8910000 0.6409000     0.8910000 0.6409000     0.8910000 0.6409000     0.000000       0.000000  
1 1 1 0  60 4  o 3.067000  1.066000      3.067000  1.066000      3.067000  1.066000      0.000000       0.000000  
1 1 1 0  60 5  o 0.8442000 0.6062000     0.8442000 0.6062000     0.8442000 0.6062000     0.000000       0.000000  
1 1 1 0  60 6  o 1.100000  0.7131000     1.100000  0.7131000     1.100000  0.7131000     0.000000       0.000000  
1 1 1 0  60 7  o 1.478000  0.8378000     1.478000  0.8378000     1.478000  0.8378000     -0.000000      0.000000  
1 1 1 0  60 8  f 2.475000  0.9183000     2.475000  0.9183000     2.475000  0.9183000     -0.000000      0.000000  
1 1 1 0  60 9  o 3.036000  0.8228000     3.036000  0.8228000     3.036000  0.8228000     -0.000000      0.000000  
1 1 1 0  60 10 o 2.915000  0.7948000     2.915000  0.7948000     2.915000  0.7948000     -0.000000      0.000000  
1 1 1 0  60 11 o 4.609000  0.4782000     4.609000  0.4782000     4.609000  0.4782000     0.000000       0.000000  
1 1 1 0  60 12 o 1.472000  0.8359000     1.472000  0.8359000     1.472000  0.8359000     -0.000000      0.000000  
1 1 1 0  61 1  o 2.979000  1.041000      2.979000  1.041000      2.979000  1.041000      -0.000000      0.000000  
1 1 1 0  61 2  o 2.081000  1.050000      2.081000  1.050000      2.081000  1.050000      0.000000       0.000000  
1 1 1 0  61 3  o 8.655000  0.3368000     8.655000  0.3368000     8.655000  0.3368000     -0.000000      0.000000  
1 1 1 0  61 4  o 0.8693000 0.6045000     0.8693000 0.6045000     0.8693000 0.6045000     -0.000000      0.000000  
1 1 1 0  61 5  o 4.195000  0.5241000     4.195000  0.5241000     4.195000  0.5241000     -0.000000      0.000000  
1 1 1 0  61 6  o 3.945000  0.5849000     3.945000  0.5849000     3.945000  0.5849000     -0.000000      0.000000  
1 1 1 0  61 7  f 3.728000  0.6414000     3.728000  0.6414000     3.728000  0.6414000     0.000000       0.000000  
1 1 1 0  61 8  o 5.809000  0.4140000     5.809000  0.4140000     5.809000  0.4140000     -0.000000      0.000000  
1 1 1 0  61 9  o 8.266000  0.3403000     8.266000  0.3403000     8.266000  0.3403000     0.000000       0.000000  
1 1 1 0  61 10 o 4.552000  0.5021000     4.552000  0.5021000     4.552000  0.5021000     0.000000       0.000000  
1 1 1 0  61 11 o 3.180000  0.7511000     3.180000  0.7511000     3.180000  0.7511000     -0.000000      0.000000  
1 1 1 0  61 12 o 1.253000  0.8683000     1.253000  0.8683000     1.253000  0.8683000     0.000000       0.000000  
1 1 1 0  62 0  o 1.620000  0.9688000     1.620000  0.9688000     1.620000  0.9688000     0.000000       0.000000  
1 1 1 0  62 1  o 0.8504000 0.5970000     0.8504000 0.5970000     0.8504000 0.5970000     -0.000000      0.000000  
1 1 1 0  62 2  o 1.671000  0.8851000     1.671000  0.8851000     1.671000  0.8851000     0.000000       0.000000  
1 1 1 0  62 3  o 1.701000  0.8820000     1.701000  0.8820000     1.701000  0.8820000     0.000000       0.000000  
1 1 1 0  62 4  o 1.067000  0.7056000     1.067000  0.7056000     1.067000  0.7056000     0.000000       0.000000  
1 1 1 0  62 5  o 1.131000  0.7332000     1.131000  0.7332000     1.131000  0.7332000     0.000000       0.000000  
1 1 1 0  62 6  o 1.908000  0.9190000     1.908000  0.9190000     1.908000  0.9190000     0.000000       0.000000  
1 1 1 0  62 7  o 3.262000  0.7433000     3.262000  0.7433000     3.262000  0.7433000     -0.000000      0.000000  
1 1 1 0  62 8  o 4.785000  0.4857000     4.785000  0.4857000     4.785000  0.4857000     0.000000       0.000000  
1 1 1 0  62 9  o 3.265000  0.7290000     3.265000  0.7290000     3.265000  0.7290000     -0.000000      0.000000  
1 1 1 0  62 10 o 1.982000  0.9088000     1.982000  0.9088000     1.982000  0.9088000     -0.000000      0.000000  
1 1 1 0  62 11 o 1.039000  0.7238000     1.039000  0.7238000     1.039000  0.7238000     -0.000000      0.000000  
1 1 1 0  63 1  o 1.390000  0.8319000     1.390000  0.8319000     1.390000  0.8319000     -0.000000      0.000000  
1 1 1 0  63 2  o 4.473000  0.5079000     4.473000  0.5079000     4.473000  0.5079000     -0.000000      0.000000  
1 1 1 0  63 3  o 1.313000  0.7998000     1.313000  0.7998000     1.313000  0.7998000     -0.000000      0.000000  
1 1 1 0  63 4  o 1.015000  0.6822000     1.015000  0.6822000     1.015000  0.6822000     -0.000000      0.000000  
1 1 1 0  63 5  o 0.9717000 0.6591000     0.9717000 0.6591000     0.9717000 0.6591000     0.000000       0.000000  
1 1 1 0  63 6  o 3.123000  0.7036000     3.123000  0.7036000     3.123000  0.7036000     0.000000       0.000000  
1 1 1 0  63 7  f 1.537000  0.8537000     1.537000  0.8537000     1.537000  0.8537000     -0.000000      0.000000  
1 1 1 0  63 8  o 0.9403000 0.6433000     0.9403000 0.6433000     0.9403000 0.6433000     0.000000       0.000000  
1 1 1 0  63 9  f 1.157000  0.7469000     1.157000  0.7469000     1.157000  0.7469000     -0.000000      0.000000  
1 1 1 0  63 10 o 0.9236000 0.6508000     0.9236000 0.6508000     0.9236000 0.6508000     -0.000000      0.000000  
1 1 1 0  64 0  o 6.930000  0.5198000     6.930000  0.5198000     6.930000  0.5198000     -0.000000      0.000000  
1 1 1 0  64 1  o 0.8159000 0.5760000     0.8159000 0.5760000     0.8159000 0.5760000     -0.000000      0.000000  
1 1 1 0  64 2  o 1.288000  0.7944000     1.288000  0.7944000     1.288000  0.7944000     -0.000000      0.000000  
1 1 1 0  64 3  o 0.7910000 0.5631000     0.7910000 0.5631000     0.7910000 0.5631000     0.000000       0.000000  
1 1 1 0  64 4  o 0.7058000 0.5102000     0.7058000 0.5102000     0.7058000 0.5102000     0.000000       0.000000  
1 1 1 0  64 5  o 3.538000  0.6540000     3.538000  0.6540000     3.538000  0.6540000     -0.000000      0.000000  
1 1 1 0  64 6  o 2.347000  0.8690000     2.347000  0.8690000     2.347000  0.8690000     0.000000       0.000000  
1 1 1 0  64 7  o 1.042000  0.6944000     1.042000  0.6944000     1.042000  0.6944000     0.000000       0.000000  
1 1 1 0  64 8  o 1.074000  0.7090000     1.074000  0.7090000     1.074000  0.7090000     -0.000000      0.000000  
1 1 1 0  65 1  o 0.9648000 0.6587000     0.9648000 0.6587000     0.9648000 0.6587000     -0.000000      0.000000  
1 1 1 0  65 2  o 1.371000  0.8234000     1.371000  0.8234000     1.371000  0.8234000     -0.000000      0.000000  
1 1 1 0  65 3  o 0.8010000 0.5672000     0.8010000 0.5672000     0.8010000 0.5672000     -0.000000      0.000000  
1 1 1 0  65 4  o 1.195000  0.7501000     1.195000  0.7501000     1.195000  0.7501000     0.000000       0.000000  
1 1 1 0  65 5  o 4.209000  0.5370000     4.209000  0.5370000     4.209000  0.5370000     -0.000000      0.000000  
1 1 1 0  65 6  o 7.652000  0.3571000     7.652000  0.3571000     7.652000  0.3571000     0.000000       0.000000  
1 1 1 0  65 7  f 7.956000  0.3517000     7.956000  0.3517000     7.956000  0.3517000     -0.000000      0.000000  
1 1 1 0  66 0  o 1.812000  1.028000      1.812000  1.028000      1.812000  1.028000      -0.000000      0.000000  
1 1 1 0  66 1  o 2.440000  0.9048000     2.440000  0.9048000     2.440000  0.9048000     0.000000       0.000000  
1 1 1 0  66 2  o 6.070000  0.4111000     6.070000  0.4111000     6.070000  0.4111000     0.000000       0.000000  
1 1 1 0  66 3  o 6.871000  0.3807000     6.871000  0.3807000     6.871000  0.3807000     0.000000       0.000000  
1 1 1 0  66 4  o 2.813000  0.8447000     2.813000  0.8447000     2.813000  0.8447000     0.000000       0.000000  
1 1 1 0  66 5  o 4.788000  0.4891000     4.788000  0.4891000     4.788000  0.4891000     0.000000       0.000000  
1 1 1 0  67 1  o 2.980000  0.8057000     2.980000  0.8057000     2.980000  0.8057000     -0.000000      0.000000  
1 1 1 0  67 2  o 0.6034000 0.4451000     0.6034000 0.4451000     0.6034000 0.4451000     0.000000       0.000000  
1 1 1 0  67 3  o 1.187000  0.7538000     1.187000  0.7538000     1.187000  0.7538000     0.000000       0.000000  
1 1 1 1  0  2  o 31.70000  0.3469000     31.70000  0.3469000     31.70000  0.3469000     0.000000       0.000000  
1 1 1 1  0  3  o 20.66000  0.2338000     20.66000  0.2338000     20.66000  0.2338000     0.000000       0.000000  
1 1 1 1  0  4  o 36.66000  0.4038000     36.66000  0.4038000     36.66000  0.4038000     0.000000       0.000000  
1 1 1 1  0  5  o 18.32000  0.3104000     18.32000  0.3104000     18.32000  0.3104000     0.000000       0.000000  
1 1 1 1  0  6  o 2.852000  0.2456000     2.852000  0.2456000     2.852000  0.2456000     -0.000000      0.000000  
1 1 1 1  0  7  o 14.21000  0.1960000     14.21000  0.1960000     14.21000  0.1960000     0.000000       0.000000  
1 1 1 1  0  8  o 4.889000  0.2123000     4.889000  0.2123000     4.889000  0.2123000     -0.000000      0.000000  
1 1 1 1  0  9  o 7.784000  0.1995000     7.784000  0.1995000     7.784000  0.1995000     0.000000       0.000000  
1 1 1 1  0  10 o 3.874000  0.3754000     3.874000  0.3754000     3.874000  0.3754000     0.000000       0.000000  
1 1 1 1  0  11 o 5.684000  0.2798000     5.684000  0.2798000     5.684000  0.2798000     -0.000000      0.000000  
1 1 1 1  0  12 o 5.153000  0.3502000     5.153000  0.3502000     5.153000  0.3502000     -0.000000      0.000000  
1 1 1 1  0  13 o 8.782000  0.2805000     8.782000  0.2805000     8.782000  0.2805000     0.000000       0.000000  
1 1 1 1  0  14 o 1.456000  0.8364000     1.456000  0.8364000     1.456000  0.8364000     -0.000000      0.000000  
1 1 1 1  0  15 o 4.435000  0.5293000     4.435000  0.5293000     4.435000  0.5293000     0.000000       0.000000  
1 1 1 1  0  16 o 1.026000  0.7030000     1.026000  0.7030000     1.026000  0.7030000     -0.000000      0.000000  
1 1 1 1  0  17 o 8.783000  0.3726000     8.783000  0.3726000     8.783000  0.3726000     -0.000000      0.000000  
1 1 1 1  0  18 o 4.839000  0.6277000     4.839000  0.6277000     4.839000  0.6277000     -0.000000      0.000000  
1 1 1 1  0  19 o 6.253000  0.5493000     6.253000  0.5493000     6.253000  0.5493000     0.000000       0.000000  
1 1 1 1  0  20 o 5.087000  0.7475000     5.087000  0.7475000     5.087000  0.7475000     -0.000000      0.000000  
1 1 1 1  0  21 o 4.314000  0.9138000     4.314000  0.9138000     4.314000  0.9138000     -0.000000      0.000000  
1 1 1 1  0  22 o 1.634000  1.005000      1.634000  1.005000      1.634000  1.005000      0.000000       0.000000  
1 1 1 1  0  23 o 3.629000  0.9074000     3.629000  0.9074000     3.629000  0.9074000     -0.000000      0.000000  
1 1 1 1  0  24 o 0.9101000 0.6418000     0.9101000 0.6418000     0.9101000 0.6418000     0.000000       0.000000  
1 1 1 1  0  25 o 0.9977000 0.7029000     0.9977000 0.7029000     0.9977000 0.7029000     0.000000       0.000000  
1 1 1 1  0  26 o 2.915000  0.8903000     2.915000  0.8903000     2.915000  0.8903000     -0.000000      0.000000  
1 1 1 1  0  27 o 1.146000  0.7574000     1.146000  0.7574000     1.146000  0.7574000     0.000000       0.000000  
1 1 1 1  0  28 o 1.261000  0.8354000     1.261000  0.8354000     1.261000  0.8354000     0.000000       0.000000  
1 1 1 1  1  2  o 62.76000  0.4811000     62.63000  0.6794000     62.88000  0.6814000     -0.2527000     0.9622000 
1 1 1 1  1  3  o 56.83000  0.4366000     56.91000  0.6183000     56.76000  0.6166000     0.1574000      0.8732000 
1 1 1 1  1  4  o 17.97000  0.1497000     17.94000  0.2116000     18.01000  0.2119000     -0.7116000E-01 0.2994000 
1 1 1 1  1  5  o 7.474000  0.1416000     7.363000  0.2002000     7.585000  0.2003000     -0.2214000     0.2832000 
1 1 1 1  1  6  f 24.06000  0.1975000     24.01000  0.2787000     24.11000  0.2799000     -0.1036000     0.3950000 
1 1 1 1  1  7  o 7.557000  0.1203000     7.574000  0.1690000     7.540000  0.1711000     0.3366000E-01  0.2405000 
1 1 1 1  1  8  f 5.122000  0.1476000     5.005000  0.2099000     5.239000  0.2076000     -0.2347000     0.2952000 
1 1 1 1  1  9  f 15.93000  0.1582000     16.06000  0.2244000     15.81000  0.2230000     0.2543000      0.3164000 
1 1 1 1  1  10 o 2.373000  0.3500000     3.027000  0.3991000     1.718000  0.5750000     1.309000       0.6999000 
1 1 1 1  1  11 o 14.60000  0.1669000     14.74000  0.2371000     14.47000  0.2349000     0.2680000      0.3338000 
1 1 1 1  1  12 f 12.20000  0.1884000     12.13000  0.2854000     12.27000  0.2459000     -0.1455000     0.3767000 
1 1 1 1  1  13 o 2.614000  0.4704000     2.802000  0.6414000     2.425000  0.6882000     0.3764000      0.9408000 
1 1 1 1  1  14 o 4.416000  0.3510000     4.573000  0.4826000     4.258000  0.5099000     0.3144000      0.7021000 
1 1 1 1  1  15 o 8.455000  0.2351000     8.217000  0.3382000     8.693000  0.3268000     -0.4760000     0.4703000 
1 1 1 1  1  16 o 2.733000  0.5750000     3.152000  0.7916000     2.315000  0.8342000     0.8372000      1.150000  
1 1 1 1  1  17 o 21.02000  0.2347000     21.10000  0.3314000     20.95000  0.3324000     0.1485000      0.4694000 
1 1 1 1  1  18 o 7.254000  0.3173000     7.485000  0.4450000     7.024000  0.4523000     0.4612000      0.6345000 
1 1 1 1  1  19 f 2.414000  0.6360000     1.881000  0.8332000     2.946000  0.9610000     -1.064000      1.272000  
1 1 1 1  1  20 o 5.846000  0.4512000     5.524000  0.6687000     6.168000  0.6060000     -0.6434000     0.9024000 
1 1 1 1  1  21 o 6.880000  0.4067000     6.090000  0.6316000     7.670000  0.5124000     -1.580000      0.8133000 
1 1 1 1  1  22 o 1.988000  0.5976000     2.401000  0.9317000     1.574000  0.7487000     0.8266000      1.195000  
1 1 1 1  1  23 o 5.784000  0.3882000     5.682000  0.5507000     5.886000  0.5474000     -0.2039000     0.7765000 
1 1 1 1  1  24 o 1.797000  0.5311000     1.975000  0.7854000     1.618000  0.7151000     0.3572000      1.062000  
1 1 1 1  1  25 o 2.651000  0.5922000     3.501000  0.8716000     1.802000  0.8020000     1.699000       1.184000  
1 1 1 1  1  26 o 1.964000  0.5484000     1.782000  0.7514000     2.147000  0.7990000     -0.3645000     1.097000  
1 1 1 1  1  27 o 1.162000  0.4007000     1.239000  0.5939000     1.086000  0.5381000     0.1527000      0.8014000 
1 1 1 1  1  28 o 1.328000  0.4582000     1.396000  0.6751000     1.259000  0.6198000     0.1377000      0.9165000 
1 1 1 1  2  1  o 23.16000  0.2539000     23.19000  0.3585000     23.14000  0.3597000     0.5439000E-01  0.5079000 
1 1 1 1  2  3  o 15.46000  0.1291000     15.57000  0.1836000     15.34000  0.1815000     0.2340000      0.2582000 
1 1 1 1  2  4  o 48.95000  0.3785000     48.64000  0.5318000     49.26000  0.5388000     -0.6169000     0.7571000 
1 1 1 1  2  5  o 15.32000  0.1922000     15.42000  0.2728000     15.22000  0.2709000     0.1983000      0.3844000 
1 1 1 1  2  6  o 3.306000  0.1559000     3.277000  0.2245000     3.335000  0.2163000     -0.5741000E-01 0.3118000 
1 1 1 1  2  7  o 17.88000  0.1595000     17.80000  0.2250000     17.96000  0.2261000     -0.1625000     0.3190000 
1 1 1 1  2  8  o 13.10000  0.1384000     13.09000  0.1955000     13.10000  0.1959000     -0.1231000E-01 0.2767000 
1 1 1 1  2  9  o 5.693000  0.1595000     5.679000  0.2244000     5.706000  0.2267000     -0.2672000E-01 0.3190000 
1 1 1 1  2  10 o 6.869000  0.1653000     7.057000  0.2321000     6.681000  0.2353000     0.3758000      0.3305000 
1 1 1 1  2  11 o 13.75000  0.1640000     13.90000  0.2332000     13.60000  0.2307000     0.3004000      0.3280000 
1 1 1 1  2  12 o 3.680000  0.3398000     3.119000  0.5397000     4.242000  0.4132000     -1.123000      0.6797000 
1 1 1 1  2  13 o 12.58000  0.1832000     12.45000  0.2570000     12.71000  0.2612000     -0.2653000     0.3664000 
1 1 1 1  2  14 o 5.486000  0.2819000     5.288000  0.4112000     5.684000  0.3858000     -0.3963000     0.5639000 
1 1 1 1  2  15 o 1.868000  0.5249000     1.694000  0.7177000     2.043000  0.7663000     -0.3491000     1.050000  
1 1 1 1  2  16 o 14.65000  0.2143000     14.48000  0.3052000     14.83000  0.3009000     -0.3528000     0.4285000 
1 1 1 1  2  17 o 10.26000  0.2448000     9.966000  0.3484000     10.56000  0.3439000     -0.5907000     0.4896000 
1 1 1 1  2  18 o 3.714000  0.5505000     3.942000  0.7264000     3.487000  0.8273000     0.4553000      1.101000  
1 1 1 1  2  19 o 11.63000  0.2710000     11.56000  0.3849000     11.71000  0.3815000     -0.1530000     0.5419000 
1 1 1 1  2  20 o 4.531000  0.5837000     4.581000  0.8343000     4.480000  0.8166000     0.1009000      1.167000  
1 1 1 1  2  21 o 3.801000  0.6307000     4.814000  0.7784000     2.788000  0.9925000     2.026000       1.261000  
1 1 1 1  2  22 o 2.605000  0.6712000     2.549000  0.9515000     2.661000  0.9468000     -0.1113000     1.342000  
1 1 1 1  2  23 o 2.072000  0.5955000     1.771000  0.7867000     2.372000  0.8943000     -0.6009000     1.191000  
1 1 1 1  2  24 o 1.940000  0.5423000     1.663000  0.7297000     2.218000  0.8025000     -0.5547000     1.085000  
1 1 1 1  2  25 o 1.803000  0.5564000     2.259000  0.8965000     1.348000  0.6591000     0.9110000      1.113000  
1 1 1 1  2  26 o 1.502000  0.4806000     1.630000  0.7127000     1.375000  0.6450000     0.2552000      0.9613000 
1 1 1 1  2  27 o 1.499000  0.4703000     1.128000  0.5552000     1.870000  0.7592000     -0.7423000     0.9406000 
1 1 1 1  2  28 o 0.8742000 0.3183000     0.9045000 0.4645000     0.8439000 0.4353000     0.6057000E-01  0.6366000 
1 1 1 1  3  1  o 14.62000  0.1170000     14.73000  0.1665000     14.51000  0.1643000     0.2221000      0.2339000 
1 1 1 1  3  2  o 35.88000  0.2772000     35.96000  0.3929000     35.79000  0.3911000     0.1735000      0.5543000 
1 1 1 1  3  3  f 60.97000  0.4686000     60.47000  0.6570000     61.48000  0.6684000     -1.015000      0.9373000 
1 1 1 1  3  4  o 20.29000  0.1663000     20.40000  0.2362000     20.19000  0.2340000     0.2083000      0.3325000 
1 1 1 1  3  5  o 14.48000  0.2618000     14.67000  0.3755000     14.28000  0.3649000     0.3956000      0.5236000 
1 1 1 1  3  6  o 37.26000  0.2934000     37.04000  0.4126000     37.49000  0.4173000     -0.4509000     0.5869000 
1 1 1 1  3  7  o 35.38000  0.2813000     35.48000  0.3989000     35.29000  0.3966000     0.1959000      0.5625000 
1 1 1 1  3  8  o 14.79000  0.1461000     14.69000  0.2052000     14.89000  0.2080000     -0.2013000     0.2922000 
1 1 1 1  3  9  o 20.53000  0.1989000     20.43000  0.2996000     20.62000  0.2617000     -0.1858000     0.3978000 
1 1 1 1  3  10 o 4.845000  0.2262000     4.539000  0.3382000     5.152000  0.3004000     -0.6125000     0.4524000 
1 1 1 1  3  11 o 1.328000  0.3948000     1.356000  0.5630000     1.299000  0.5538000     0.5636000E-01  0.7897000 
1 1 1 1  3  12 o 4.145000  0.2921000     4.296000  0.3998000     3.995000  0.4261000     0.3008000      0.5843000 
1 1 1 1  3  13 o 2.466000  0.4777000     2.962000  0.6398000     1.970000  0.7096000     0.9925000      0.9554000 
1 1 1 1  3  14 f 7.949000  0.2252000     8.349000  0.3147000     7.548000  0.3221000     0.8007000      0.4503000 
1 1 1 1  3  15 o 8.476000  0.2323000     8.524000  0.3252000     8.427000  0.3318000     0.9739000E-01  0.4646000 
1 1 1 1  3  16 o 7.459000  0.2678000     7.693000  0.3691000     7.225000  0.3882000     0.4677000      0.5356000 
1 1 1 1  3  17 o 14.56000  0.2261000     14.52000  0.3192000     14.60000  0.3204000     -0.7545000E-01 0.4523000 
1 1 1 1  3  18 o 7.645000  0.3050000     7.454000  0.4459000     7.835000  0.4163000     -0.3803000     0.6100000 
1 1 1 1  3  19 o 4.024000  0.5923000     4.100000  0.8337000     3.948000  0.8414000     0.1518000      1.185000  
1 1 1 1  3  20 o 3.893000  0.6416000     4.638000  0.8238000     3.148000  0.9839000     1.490000       1.283000  
1 1 1 1  3  21 o 4.985000  0.5509000     3.924000  0.9157000     6.046000  0.6128000     -2.123000      1.102000  
1 1 1 1  3  22 o 1.830000  0.5763000     1.723000  0.7855000     1.938000  0.8434000     -0.2153000     1.153000  
1 1 1 1  3  23 o 1.773000  0.5593000     1.642000  0.7595000     1.904000  0.8212000     -0.2619000     1.119000  
1 1 1 1  3  24 o 2.044000  0.5720000     2.035000  0.8092000     2.053000  0.8087000     -0.1761000E-01 1.144000  
1 1 1 1  3  25 o 1.524000  0.5101000     1.298000  0.6398000     1.750000  0.7947000     -0.4520000     1.020000  
1 1 1 1  3  26 o 1.382000  0.4580000     1.482000  0.6799000     1.282000  0.6138000     0.2002000      0.9160000 
1 1 1 1  3  27 f 1.797000  0.5124000     2.218000  0.7957000     1.376000  0.6458000     0.8415000      1.025000  
1 1 1 1  3  28 o 1.072000  0.3843000     1.178000  0.5886000     0.9665000 0.4943000     0.2116000      0.7687000 
1 1 1 1  4  0  o 118.4000  1.284000      118.4000  1.284000      118.4000  1.284000      -0.000000      0.000000  
1 1 1 1  4  1  o 18.75000  0.1481000     18.62000  0.2080000     18.88000  0.2109000     -0.2547000     0.2962000 
1 1 1 1  4  2  o 37.00000  0.2856000     37.22000  0.4062000     36.79000  0.4016000     0.4354000      0.5712000 
1 1 1 1  4  3  o 22.22000  0.1824000     21.94000  0.2864000     22.50000  0.2259000     -0.5518000     0.3648000 
1 1 1 1  4  4  o 10.39000  0.1045000     10.52000  0.1487000     10.27000  0.1467000     0.2533000      0.2089000 
1 1 1 1  4  6  o 24.26000  0.1994000     24.31000  0.2825000     24.22000  0.2816000     0.9456000E-01  0.3989000 
1 1 1 1  4  7  o 29.19000  0.2364000     28.91000  0.3314000     29.48000  0.3373000     -0.5716000     0.4729000 
1 1 1 1  4  8  o 12.19000  0.1360000     12.52000  0.1939000     11.85000  0.1909000     0.6783000      0.2721000 
1 1 1 1  4  9  o 6.834000  0.1524000     6.675000  0.2159000     6.993000  0.2152000     -0.3187000     0.3049000 
1 1 1 1  4  10 o 19.35000  0.2103000     19.56000  0.2986000     19.14000  0.2963000     0.4223000      0.4206000 
1 1 1 1  4  11 o 3.449000  0.2979000     3.427000  0.4202000     3.471000  0.4223000     -0.4401000E-01 0.5957000 
1 1 1 1  4  12 o 14.14000  0.1780000     14.09000  0.2510000     14.18000  0.2524000     -0.9160000E-01 0.3560000 
1 1 1 1  4  13 o 3.388000  0.4029000     3.413000  0.5540000     3.362000  0.5851000     0.5026000E-01  0.8058000 
1 1 1 1  4  14 o 6.556000  0.2522000     6.139000  0.3680000     6.974000  0.3451000     -0.8354000     0.5045000 
1 1 1 1  4  15 o 4.239000  0.4071000     4.553000  0.5328000     3.924000  0.6158000     0.6294000      0.8142000 
1 1 1 1  4  16 o 6.388000  0.3121000     6.580000  0.4296000     6.197000  0.4530000     0.3835000      0.6243000 
1 1 1 1  4  17 o 3.728000  0.5445000     3.580000  0.7860000     3.876000  0.7537000     -0.2964000     1.089000  
1 1 1 1  4  18 o 3.599000  0.5902000     3.192000  0.8981000     4.006000  0.7659000     -0.8133000     1.180000  
1 1 1 1  4  19 o 10.75000  0.2826000     10.87000  0.3963000     10.63000  0.4030000     0.2400000      0.5653000 
1 1 1 1  4  20 o 2.836000  0.7237000     2.736000  1.015000      2.936000  1.032000      -0.2002000     1.447000  
1 1 1 1  4  21 f 1.864000  0.6024000     1.681000  0.7985000     2.047000  0.9023000     -0.3657000     1.205000  
1 1 1 1  4  22 o 2.641000  0.6271000     1.849000  0.8328000     3.433000  0.9379000     -1.584000      1.254000  
1 1 1 1  4  23 o 2.070000  0.5919000     2.533000  0.9188000     1.607000  0.7465000     0.9265000      1.184000  
1 1 1 1  4  24 o 1.805000  0.5300000     2.258000  0.8433000     1.352000  0.6421000     0.9053000      1.060000  
1 1 1 1  4  25 o 1.853000  0.5592000     1.306000  0.6408000     2.400000  0.9166000     -1.093000      1.118000  
1 1 1 1  4  26 o 1.510000  0.4851000     1.653000  0.7240000     1.367000  0.6459000     0.2859000      0.9703000 
1 1 1 1  4  27 o 1.122000  0.3914000     1.267000  0.6089000     0.9766000 0.4918000     0.2899000      0.7827000 
1 1 1 1  4  28 o 1.111000  0.3963000     1.037000  0.5269000     1.185000  0.5921000     -0.1487000     0.7926000 
1 1 1 1  5  0  o 35.00000  0.3825000     35.00000  0.3825000     35.00000  0.3825000     0.000000       0.000000  
1 1 1 1  5  1  o 18.80000  0.1493000     18.78000  0.2108000     18.82000  0.2114000     -0.4605000E-01 0.2985000 
1 1 1 1  5  2  o 43.70000  0.3369000     44.37000  0.4835000     43.04000  0.4693000     1.328000       0.6738000 
1 1 1 1  5  3  o 15.18000  0.1272000     15.04000  0.1790000     15.32000  0.1809000     -0.2833000     0.2545000 
1 1 1 1  5  4  o 24.69000  0.1978000     24.67000  0.2794000     24.71000  0.2801000     -0.4183000E-01 0.3957000 
1 1 1 1  5  5  o 15.26000  0.2406000     15.26000  0.3933000     15.27000  0.2773000     -0.1216000E-01 0.4812000 
1 1 1 1  5  6  o 29.61000  0.2378000     29.79000  0.3382000     29.43000  0.3343000     0.3543000      0.4756000 
1 1 1 1  5  7  o 8.124000  0.1231000     8.072000  0.1745000     8.177000  0.1737000     -0.1048000     0.2462000 
1 1 1 1  5  8  o 6.648000  0.1365000     6.644000  0.1938000     6.652000  0.1924000     -0.7321000E-02 0.2731000 
1 1 1 1  5  9  o 15.83000  0.1590000     15.91000  0.2254000     15.76000  0.2245000     0.1550000      0.3181000 
1 1 1 1  5  10 o 9.041000  0.2091000     8.962000  0.2946000     9.120000  0.2969000     -0.1583000     0.4183000 
1 1 1 1  5  11 o 7.316000  0.1781000     7.308000  0.2519000     7.324000  0.2519000     -0.1655000E-01 0.3563000 
1 1 1 1  5  12 o 6.774000  0.2131000     7.019000  0.2963000     6.528000  0.3065000     0.4905000      0.4263000 
1 1 1 1  5  13 o 4.337000  0.3176000     4.162000  0.4623000     4.512000  0.4357000     -0.3497000     0.6353000 
1 1 1 1  5  14 o 4.329000  0.3582000     4.391000  0.5042000     4.268000  0.5089000     0.1233000      0.7164000 
1 1 1 1  5  15 o 7.158000  0.2652000     7.380000  0.3669000     6.936000  0.3831000     0.4446000      0.5304000 
1 1 1 1  5  16 o 6.518000  0.3094000     5.866000  0.4604000     7.170000  0.4136000     -1.303000      0.6189000 
1 1 1 1  5  17 o 4.736000  0.4524000     4.519000  0.6614000     4.954000  0.6175000     -0.4347000     0.9049000 
1 1 1 1  5  18 o 5.198000  0.4406000     4.498000  0.6885000     5.899000  0.5498000     -1.401000      0.8811000 
1 1 1 1  5  19 o 2.101000  0.6152000     1.595000  0.7558000     2.606000  0.9708000     -1.012000      1.230000  
1 1 1 1  5  20 f 2.643000  0.7194000     2.084000  0.9367000     3.202000  1.092000      -1.117000      1.439000  
1 1 1 1  5  21 o 2.160000  0.6489000     2.441000  0.9734000     1.879000  0.8585000     0.5619000      1.298000  
1 1 1 1  5  22 o 3.236000  0.6500000     3.729000  0.8820000     2.743000  0.9550000     0.9854000      1.300000  
1 1 1 1  5  23 o 3.110000  0.6319000     3.325000  0.8788000     2.895000  0.9082000     0.4295000      1.264000  
1 1 1 1  5  24 o 2.130000  0.5420000     2.731000  0.8252000     1.530000  0.7029000     1.202000       1.084000  
1 1 1 1  5  25 o 1.446000  0.4935000     1.448000  0.6999000     1.444000  0.6959000     0.3500000E-02  0.9870000 
1 1 1 1  5  26 o 1.445000  0.4728000     1.596000  0.7161000     1.295000  0.6175000     0.3008000      0.9455000 
1 1 1 1  5  27 o 1.301000  0.4365000     1.301000  0.6155000     1.302000  0.6191000     -0.1424000E-02 0.8730000 
1 1 1 1  6  0  o 25.84000  0.2858000     25.84000  0.2858000     25.84000  0.2858000     -0.000000      0.000000  
1 1 1 1  6  1  o 45.42000  0.3494000     45.26000  0.4924000     45.59000  0.4958000     -0.3263000     0.6988000 
1 1 1 1  6  2  o 38.81000  0.3248000     38.32000  0.4200000     39.30000  0.4957000     -0.9840000     0.6497000 
1 1 1 1  6  3  o 9.120000  0.9134000E-01 8.913000  0.1271000     9.326000  0.1312000     -0.4128000     0.1827000 
1 1 1 1  6  4  o 5.431000  0.8401000E-01 5.381000  0.1188000     5.481000  0.1188000     -0.9972000E-01 0.1680000 
1 1 1 1  6  5  o 14.86000  0.1756000     14.89000  0.2707000     14.83000  0.2236000     0.5991000E-01  0.3511000 
1 1 1 1  6  6  o 15.67000  0.1438000     15.75000  0.2041000     15.58000  0.2025000     0.1700000      0.2875000 
1 1 1 1  6  7  o 21.59000  0.1844000     21.56000  0.2610000     21.61000  0.2607000     -0.4902000E-01 0.3689000 
1 1 1 1  6  8  o 35.03000  0.2805000     35.39000  0.4005000     34.66000  0.3929000     0.7330000      0.5611000 
1 1 1 1  6  9  o 8.924000  0.1428000     8.694000  0.2042000     9.154000  0.1997000     -0.4599000     0.2856000 
1 1 1 1  6  10 o 12.58000  0.2163000     12.43000  0.3046000     12.74000  0.3073000     -0.3189000     0.4327000 
1 1 1 1  6  11 o 14.73000  0.1701000     14.83000  0.2399000     14.63000  0.2412000     0.1972000      0.3402000 
1 1 1 1  6  12 o 3.068000  0.4007000     3.068000  0.5564000     3.068000  0.5769000     0.3681000E-03  0.8015000 
1 1 1 1  6  13 f 4.805000  0.3017000     4.924000  0.4202000     4.685000  0.4329000     0.2388000      0.6033000 
1 1 1 1  6  14 f 8.789000  0.2190000     8.813000  0.3113000     8.766000  0.3082000     0.4714000E-01  0.4380000 
1 1 1 1  6  15 o 10.07000  0.2528000     9.873000  0.3656000     10.27000  0.3491000     -0.3946000     0.5055000 
1 1 1 1  6  16 o 1.755000  0.5344000     1.924000  0.7986000     1.587000  0.7104000     0.3365000      1.069000  
1 1 1 1  6  17 o 13.93000  0.2310000     13.80000  0.3274000     14.07000  0.3259000     -0.2668000     0.4619000 
1 1 1 1  6  18 f 8.824000  0.2888000     9.056000  0.3973000     8.592000  0.4193000     0.4645000      0.5777000 
1 1 1 1  6  19 o 7.100000  0.3668000     7.583000  0.4948000     6.617000  0.5416000     0.9663000      0.7336000 
1 1 1 1  6  20 o 2.151000  0.6753000     2.275000  0.9888000     2.027000  0.9201000     0.2478000      1.351000  
1 1 1 1  6  21 o 5.352000  0.5092000     5.048000  0.7394000     5.656000  0.7004000     -0.6083000     1.018000  
1 1 1 1  6  22 o 4.264000  0.5629000     4.319000  0.7811000     4.209000  0.8106000     0.1102000      1.126000  
1 1 1 1  6  23 o 1.865000  0.5690000     1.757000  0.7787000     1.972000  0.8300000     -0.2150000     1.138000  
1 1 1 1  6  24 o 1.984000  0.5370000     1.437000  0.6728000     2.531000  0.8370000     -1.094000      1.074000  
1 1 1 1  6  25 o 1.877000  0.6315000     2.004000  0.9359000     1.750000  0.8480000     0.2546000      1.263000  
1 1 1 1  6  26 o 1.416000  0.4678000     1.369000  0.6438000     1.464000  0.6790000     -0.9462000E-01 0.9357000 
1 1 1 1  6  27 o 1.374000  0.4571000     1.376000  0.6472000     1.371000  0.6458000     0.5070000E-02  0.9143000 
1 1 1 1  7  0  o 49.27000  0.5358000     49.27000  0.5358000     49.27000  0.5358000     -0.000000      0.000000  
1 1 1 1  7  1  o 11.99000  0.1040000     12.05000  0.1479000     11.93000  0.1462000     0.1151000      0.2080000 
1 1 1 1  7  2  o 20.57000  0.1653000     20.44000  0.2324000     20.70000  0.2352000     -0.2607000     0.3306000 
1 1 1 1  7  3  o 11.87000  0.1228000     12.03000  0.1755000     11.70000  0.1718000     0.3331000      0.2456000 
1 1 1 1  7  4  o 10.69000  0.1434000     10.61000  0.2072000     10.77000  0.1982000     -0.1638000     0.2867000 
1 1 1 1  7  5  o 29.03000  0.2308000     29.39000  0.3302000     28.67000  0.3227000     0.7211000      0.4616000 
1 1 1 1  7  6  o 24.84000  0.2036000     25.03000  0.2896000     24.66000  0.2861000     0.3728000      0.4071000 
1 1 1 1  7  7  o 25.54000  0.2111000     25.25000  0.2957000     25.82000  0.3013000     -0.5626000     0.4221000 
1 1 1 1  7  8  o 7.648000  0.1348000     7.585000  0.1898000     7.711000  0.1915000     -0.1254000     0.2696000 
1 1 1 1  7  9  o 29.14000  0.2420000     29.16000  0.3425000     29.12000  0.3421000     0.4395000E-01  0.4841000 
1 1 1 1  7  10 o 4.753000  0.4352000     5.016000  0.6185000     4.489000  0.6124000     0.5268000      0.8703000 
1 1 1 1  7  11 o 13.19000  0.1663000     13.05000  0.2349000     13.32000  0.2356000     -0.2659000     0.3327000 
1 1 1 1  7  12 o 2.100000  0.4249000     1.339000  0.6007000     2.861000  0.6010000     -1.522000      0.8497000 
1 1 1 1  7  13 o 3.129000  0.4412000     2.628000  0.7169000     3.631000  0.5145000     -1.003000      0.8824000 
1 1 1 1  7  14 o 8.463000  0.2231000     8.218000  0.3186000     8.708000  0.3124000     -0.4899000     0.4462000 
1 1 1 1  7  15 f 10.09000  0.2883000     9.789000  0.3781000     10.40000  0.4353000     -0.6092000     0.5765000 
1 1 1 1  7  16 o 8.317000  0.2647000     8.412000  0.3678000     8.221000  0.3808000     0.1909000      0.5294000 
1 1 1 1  7  17 o 3.156000  0.6135000     3.247000  0.8455000     3.065000  0.8892000     0.1826000      1.227000  
1 1 1 1  7  18 o 2.122000  0.5763000     2.839000  0.9291000     1.404000  0.6822000     1.435000       1.153000  
1 1 1 1  7  19 o 4.331000  0.5948000     4.209000  0.8620000     4.452000  0.8199000     -0.2424000     1.190000  
1 1 1 1  7  20 o 4.403000  0.7588000     4.901000  0.9156000     3.904000  1.210000      0.9961000      1.518000  
1 1 1 1  7  21 o 4.164000  0.6812000     4.161000  0.8962000     4.166000  1.026000      -0.4727000E-02 1.362000  
1 1 1 1  7  22 o 2.129000  0.6224000     2.518000  0.9540000     1.740000  0.7997000     0.7773000      1.245000  
1 1 1 1  7  23 o 1.923000  0.5638000     1.450000  0.6916000     2.396000  0.8905000     -0.9468000     1.128000  
1 1 1 1  7  24 o 1.982000  0.5555000     1.635000  0.7312000     2.329000  0.8365000     -0.6938000     1.111000  
1 1 1 1  7  25 o 1.518000  0.5338000     1.608000  0.7932000     1.428000  0.7147000     0.1795000      1.068000  
1 1 1 1  7  26 o 1.849000  0.5312000     2.017000  0.7758000     1.680000  0.7259000     0.3364000      1.062000  
1 1 1 1  7  27 o 2.094000  0.5669000     2.054000  0.8040000     2.134000  0.7995000     -0.8041000E-01 1.134000  
1 1 1 1  8  0  o 7.206000  0.1136000     7.206000  0.1136000     7.206000  0.1136000     -0.000000      0.000000  
1 1 1 1  8  1  o 29.97000  0.2342000     29.92000  0.3307000     30.01000  0.3316000     -0.9464000E-01 0.4683000 
1 1 1 1  8  2  o 19.33000  0.1698000     19.26000  0.2558000     19.41000  0.2233000     -0.1485000     0.3395000 
1 1 1 1  8  3  o 18.71000  0.1796000     19.10000  0.2588000     18.32000  0.2490000     0.7769000      0.3591000 
1 1 1 1  8  4  o 11.35000  0.2232000     11.35000  0.2232000     ?         ?             ?              ?         
1 1 1 1  8  5  o 16.20000  0.1536000     16.10000  0.1986000     16.31000  0.2345000     -0.2145000     0.3073000 
1 1 1 1  8  6  f 27.32000  0.2211000     27.33000  0.3127000     27.32000  0.3128000     0.5678000E-02  0.4423000 
1 1 1 1  8  7  o 17.48000  0.1567000     17.62000  0.2227000     17.34000  0.2205000     0.2779000      0.3134000 
1 1 1 1  8  8  o 16.24000  0.1563000     16.35000  0.2220000     16.13000  0.2201000     0.2245000      0.3127000 
1 1 1 1  8  9  o 10.29000  0.1445000     10.25000  0.2041000     10.32000  0.2046000     -0.6562000E-01 0.2890000 
1 1 1 1  8  10 o 2.152000  0.6044000     1.959000  0.8345000     2.345000  0.8747000     -0.3861000     1.209000  
1 1 1 1  8  11 o 6.229000  0.2048000     6.066000  0.2952000     6.393000  0.2840000     -0.3262000     0.4096000 
1 1 1 1  8  12 o 11.72000  0.1766000     11.94000  0.2512000     11.51000  0.2483000     0.4353000      0.3532000 
1 1 1 1  8  13 f 10.21000  0.1926000     10.58000  0.2686000     9.841000  0.2760000     0.7376000      0.3851000 
1 1 1 1  8  14 o 11.82000  0.1988000     12.10000  0.2790000     11.54000  0.2832000     0.5553000      0.3975000 
1 1 1 1  8  15 o 6.261000  0.4181000     6.148000  0.5942000     6.374000  0.5884000     -0.2256000     0.8362000 
1 1 1 1  8  16 o 9.968000  0.2397000     9.947000  0.3373000     9.988000  0.3407000     -0.4089000E-01 0.4795000 
1 1 1 1  8  17 o 3.954000  0.5375000     3.889000  0.7725000     4.019000  0.7475000     -0.1300000     1.075000  
1 1 1 1  8  18 o 3.241000  0.5812000     2.225000  0.9090000     4.257000  0.7246000     -2.032000      1.162000  
1 1 1 1  8  19 o 2.666000  0.6727000     2.260000  0.9170000     3.073000  0.9845000     -0.8131000     1.345000  
1 1 1 1  8  20 o 4.330000  0.8343000     4.009000  1.219000      4.652000  1.140000      -0.6433000     1.669000  
1 1 1 1  8  21 o 4.646000  0.5993000     4.513000  0.8671000     4.779000  0.8276000     -0.2653000     1.199000  
1 1 1 1  8  22 o 2.373000  0.6516000     2.014000  0.8710000     2.733000  0.9694000     -0.7190000     1.303000  
1 1 1 1  8  23 o 1.674000  0.5385000     1.756000  0.7824000     1.593000  0.7402000     0.1628000      1.077000  
1 1 1 1  8  24 o 1.440000  0.4743000     1.507000  0.6924000     1.373000  0.6482000     0.1344000      0.9485000 
1 1 1 1  8  25 o 1.675000  0.8239000     1.675000  0.8239000     ?         ?             ?              ?         
1 1 1 1  8  26 o 1.390000  0.4559000     1.357000  0.6385000     1.422000  0.6509000     -0.6524000E-01 0.9118000 
1 1 1 1  8  27 o 1.324000  0.4430000     1.311000  0.6216000     1.338000  0.6314000     -0.2733000E-01 0.8860000 
1 1 1 1  9  0  o 17.68000  0.2066000     17.68000  0.2066000     17.68000  0.2066000     0.000000       0.000000  
1 1 1 1  9  1  o 13.68000  0.1186000     13.81000  0.1690000     13.55000  0.1663000     0.2560000      0.2371000 
1 1 1 1  9  2  f 14.54000  0.1257000     14.61000  0.1785000     14.47000  0.1770000     0.1382000      0.2514000 
1 1 1 1  9  3  o 19.40000  0.1723000     19.28000  0.2588000     19.52000  0.2274000     -0.2370000     0.3445000 
1 1 1 1  9  4  o 4.218000  0.1401000     4.151000  0.1987000     4.284000  0.1974000     -0.1325000     0.2801000 
1 1 1 1  9  5  o 10.26000  0.1080000     10.24000  0.1523000     10.29000  0.1532000     -0.5843000E-01 0.2160000 
1 1 1 1  9  6  o 7.970000  0.1037000     7.894000  0.1463000     8.046000  0.1469000     -0.1514000     0.2074000 
1 1 1 1  9  7  o 25.69000  0.2114000     25.99000  0.3019000     25.39000  0.2960000     0.5969000      0.4228000 
1 1 1 1  9  8  o 13.05000  0.1377000     13.32000  0.1960000     12.79000  0.1936000     0.5252000      0.2755000 
1 1 1 1  9  9  o 8.764000  0.1455000     8.431000  0.2067000     9.097000  0.2048000     -0.6658000     0.2910000 
1 1 1 1  9  10 o 1.960000  0.4809000     2.340000  0.7016000     1.581000  0.6580000     0.7588000      0.9618000 
1 1 1 1  9  11 o 4.640000  0.2592000     4.656000  0.3698000     4.624000  0.3633000     0.3232000E-01  0.5184000 
1 1 1 1  9  12 f 9.059000  0.1907000     9.221000  0.2675000     8.898000  0.2718000     0.3226000      0.3813000 
1 1 1 1  9  13 o 2.739000  0.4815000     2.631000  0.6872000     2.847000  0.6745000     -0.2155000     0.9629000 
1 1 1 1  9  14 o 6.775000  0.2534000     6.564000  0.3716000     6.986000  0.3447000     -0.4219000     0.5069000 
1 1 1 1  9  15 o 14.30000  0.4185000     14.61000  0.5904000     13.98000  0.5934000     0.6357000      0.8370000 
1 1 1 1  9  16 o 2.517000  0.5925000     2.346000  0.8328000     2.687000  0.8429000     -0.3401000     1.185000  
1 1 1 1  9  17 f 9.193000  0.2669000     9.164000  0.3796000     9.222000  0.3752000     -0.5745000E-01 0.5338000 
1 1 1 1  9  18 o 5.922000  0.3912000     6.481000  0.4954000     5.364000  0.6057000     1.117000       0.7825000 
1 1 1 1  9  19 o 2.597000  0.6627000     2.163000  0.8971000     3.031000  0.9757000     -0.8675000     1.325000  
1 1 1 1  9  20 o 2.480000  0.7781000     2.273000  1.050000      2.687000  1.149000      -0.4134000     1.556000  
1 1 1 1  9  21 o 3.392000  0.6866000     3.969000  0.9383000     2.815000  1.003000      1.154000       1.373000  
1 1 1 1  9  22 o 1.948000  0.5865000     1.466000  0.7101000     2.430000  0.9337000     -0.9642000     1.173000  
1 1 1 1  9  23 o 1.613000  0.5219000     1.643000  0.7470000     1.584000  0.7289000     0.5848000E-01  1.044000  
1 1 1 1  9  24 o 1.768000  0.5302000     1.752000  0.7519000     1.785000  0.7476000     -0.3349000E-01 1.060000  
1 1 1 1  9  25 o 1.762000  0.6090000     2.132000  0.9923000     1.393000  0.7065000     0.7384000      1.218000  
1 1 1 1  9  26 o 2.042000  0.5256000     2.575000  0.7963000     1.509000  0.6862000     1.066000       1.051000  
1 1 1 1  9  27 o 1.242000  0.4189000     1.403000  0.6473000     1.080000  0.5319000     0.3224000      0.8378000 
1 1 1 1  10 0  o 28.91000  0.3223000     28.91000  0.3223000     28.91000  0.3223000     -0.000000      0.000000  
1 1 1 1  10 1  o 8.465000  0.9139000E-01 8.536000  0.1297000     8.394000  0.1288000     0.1418000      0.1828000 
1 1 1 1  10 2  o 17.52000  0.1468000     17.42000  0.2065000     17.62000  0.2087000     -0.2050000     0.2936000 
1 1 1 1  10 3  o 7.960000  0.1768000     8.160000  0.2950000     7.759000  0.1949000     0.4009000      0.3536000 
1 1 1 1  10 4  o 16.58000  0.1434000     16.36000  0.2008000     16.79000  0.2048000     -0.4385000     0.2868000 
1 1 1 1  10 5  o 14.84000  0.1344000     15.15000  0.1930000     14.54000  0.1872000     0.6173000      0.2688000 
1 1 1 1  10 6  o 13.94000  0.1785000     13.60000  0.2161000     14.28000  0.2841000     -0.6779000     0.3569000 
1 1 1 1  10 7  o 27.84000  0.2346000     27.86000  0.3712000     27.82000  0.2869000     0.3955000E-01  0.4692000 
1 1 1 1  10 8  o 18.44000  0.1674000     18.52000  0.2371000     18.36000  0.2363000     0.1617000      0.3348000 
1 1 1 1  10 9  o 7.624000  0.1339000     7.585000  0.1893000     7.662000  0.1893000     -0.7672000E-01 0.2677000 
1 1 1 1  10 10 o 5.422000  0.2270000     5.343000  0.3214000     5.500000  0.3205000     -0.1563000     0.4539000 
1 1 1 1  10 11 o 4.439000  0.2752000     4.663000  0.3642000     4.216000  0.4127000     0.4467000      0.5504000 
1 1 1 1  10 12 o 7.331000  0.2143000     7.130000  0.3032000     7.531000  0.3029000     -0.4010000     0.4285000 
1 1 1 1  10 13 o 3.076000  0.4642000     3.687000  0.5724000     2.464000  0.7309000     1.224000       0.9284000 
1 1 1 1  10 14 o 15.63000  0.2005000     15.73000  0.2826000     15.53000  0.2845000     0.1992000      0.4010000 
1 1 1 1  10 16 o 2.801000  0.6146000     3.046000  0.8762000     2.555000  0.8619000     0.4914000      1.229000  
1 1 1 1  10 17 f 8.497000  0.2845000     8.364000  0.4072000     8.630000  0.3975000     -0.2659000     0.5691000 
1 1 1 1  10 18 o 6.061000  0.3876000     5.777000  0.5796000     6.344000  0.5147000     -0.5670000     0.7751000 
1 1 1 1  10 19 o 8.353000  0.3349000     8.214000  0.4777000     8.492000  0.4696000     -0.2781000     0.6699000 
1 1 1 1  10 20 o 2.947000  0.9187000     3.132000  1.296000      2.763000  1.303000      0.3694000      1.837000  
1 1 1 1  10 21 o 3.777000  0.6714000     3.724000  0.9732000     3.829000  0.9253000     -0.1055000     1.343000  
1 1 1 1  10 22 o 3.223000  0.6549000     2.797000  0.9493000     3.649000  0.9025000     -0.8526000     1.310000  
1 1 1 1  10 23 o 1.747000  0.5435000     1.841000  0.7912000     1.653000  0.7454000     0.1883000      1.087000  
1 1 1 1  10 24 o 1.866000  0.5187000     2.390000  0.8207000     1.343000  0.6346000     1.047000       1.037000  
1 1 1 1  10 25 o 1.947000  0.6517000     2.516000  1.110000      1.378000  0.6829000     1.138000       1.303000  
1 1 1 1  10 26 f 1.386000  0.4572000     1.438000  0.6662000     1.333000  0.6264000     0.1050000      0.9144000 
1 1 1 1  10 27 o 1.314000  0.4378000     1.404000  0.6491000     1.224000  0.5876000     0.1799000      0.8755000 
1 1 1 1  11 0  f 2.308000  0.1840000     2.308000  0.1840000     2.308000  0.1840000     0.000000       0.000000  
1 1 1 1  11 1  o 26.77000  0.2129000     26.48000  0.2980000     27.05000  0.3042000     -0.5698000     0.4258000 
1 1 1 1  11 2  o 22.28000  0.2563000     22.45000  0.3650000     22.11000  0.3599000     0.3421000      0.5126000 
1 1 1 1  11 3  o 19.29000  0.2276000     18.79000  0.3150000     19.79000  0.3286000     -0.9925000     0.4552000 
1 1 1 1  11 4  o 33.13000  0.2830000     32.85000  0.3676000     33.41000  0.4305000     -0.5576000     0.5660000 
1 1 1 1  11 5  o 6.325000  0.1022000     6.271000  0.1454000     6.379000  0.1438000     -0.1078000     0.2045000 
1 1 1 1  11 6  o 23.95000  0.1974000     24.19000  0.2814000     23.72000  0.2768000     0.4684000      0.3947000 
1 1 1 1  11 7  o 36.04000  0.2861000     36.48000  0.4087000     35.60000  0.4004000     0.8790000      0.5722000 
1 1 1 1  11 8  o 32.40000  0.2626000     31.87000  0.3661000     32.94000  0.3765000     -1.070000      0.5252000 
1 1 1 1  11 9  o 4.062000  0.1903000     4.010000  0.2733000     4.114000  0.2650000     -0.1036000     0.3807000 
1 1 1 1  11 10 o 5.785000  0.1606000     5.955000  0.2240000     5.615000  0.2303000     0.3407000      0.3212000 
1 1 1 1  11 11 o 5.844000  0.2211000     5.718000  0.3159000     5.970000  0.3093000     -0.2528000     0.4421000 
1 1 1 1  11 12 o 4.331000  0.3124000     4.508000  0.4315000     4.153000  0.4519000     0.3549000      0.6248000 
1 1 1 1  11 13 o 1.753000  0.4929000     1.506000  0.6639000     2.000000  0.7287000     -0.4942000     0.9858000 
1 1 1 1  11 14 o 4.355000  0.3619000     4.045000  0.5373000     4.665000  0.4850000     -0.6200000     0.7238000 
1 1 1 1  11 15 f 6.576000  0.5165000     7.523000  0.7414000     5.630000  0.7192000     1.893000       1.033000  
1 1 1 1  11 16 o 14.48000  0.2311000     14.73000  0.3296000     14.23000  0.3240000     0.5027000      0.4622000 
1 1 1 1  11 17 f 4.472000  0.4790000     4.865000  0.6088000     4.079000  0.7396000     0.7858000      0.9580000 
1 1 1 1  11 18 o 3.630000  0.6104000     4.177000  0.7713000     3.083000  0.9463000     1.094000       1.221000  
1 1 1 1  11 19 o 9.687000  0.3165000     9.952000  0.4438000     9.421000  0.4514000     0.5307000      0.6330000 
1 1 1 1  11 20 o 2.507000  1.154000      2.507000  1.154000      ?         ?             ?              ?         
1 1 1 1  11 21 o 3.049000  0.6763000     3.750000  0.9626000     2.348000  0.9502000     1.402000       1.353000  
1 1 1 1  11 22 o 1.857000  0.5817000     1.569000  0.7423000     2.146000  0.8958000     -0.5770000     1.163000  
1 1 1 1  11 23 o 2.159000  0.5905000     2.023000  0.8232000     2.295000  0.8468000     -0.2720000     1.181000  
1 1 1 1  11 24 o 1.929000  0.5469000     1.751000  0.7461000     2.107000  0.7998000     -0.3562000     1.094000  
1 1 1 1  11 25 o 2.253000  0.6578000     2.671000  1.018000      1.835000  0.8330000     0.8359000      1.316000  
1 1 1 1  11 26 o 1.316000  0.4392000     1.437000  0.6607000     1.196000  0.5789000     0.2411000      0.8785000 
1 1 1 1  11 27 o 1.812000  0.5123000     1.421000  0.6572000     2.203000  0.7861000     -0.7823000     1.025000  
1 1 1 1  12 0  o 8.726000  0.1966000     8.726000  0.1966000     8.726000  0.1966000     0.000000       0.000000  
1 1 1 1  12 1  f 13.86000  0.1766000     14.12000  0.2529000     13.61000  0.2465000     0.5111000      0.3532000 
1 1 1 1  12 2  o 15.28000  0.2362000     15.17000  0.2679000     15.39000  0.3892000     -0.2159000     0.4725000 
1 1 1 1  12 3  f 24.09000  0.2116000     23.91000  0.3185000     24.26000  0.2786000     -0.3459000     0.4232000 
1 1 1 1  12 4  f 11.59000  0.1925000     11.85000  0.3494000     11.32000  0.1617000     0.5282000      0.3850000 
1 1 1 1  12 5  o 29.99000  0.2602000     30.04000  0.3944000     29.95000  0.3395000     0.8652000E-01  0.5204000 
1 1 1 1  12 6  o 20.48000  0.1744000     20.57000  0.2481000     20.39000  0.2454000     0.1799000      0.3489000 
1 1 1 1  12 7  o 37.86000  0.2998000     37.78000  0.4234000     37.95000  0.4245000     -0.1662000     0.5995000 
1 1 1 1  12 8  o 15.76000  0.1779000     16.11000  0.2548000     15.41000  0.2484000     0.7043000      0.3559000 
1 1 1 1  12 9  o 12.61000  0.1952000     12.33000  0.2725000     12.88000  0.2795000     -0.5461000     0.3904000 
1 1 1 1  12 10 o 7.717000  0.1472000     7.909000  0.2075000     7.524000  0.2088000     0.3856000      0.2944000 
1 1 1 1  12 11 o 7.407000  0.1651000     7.158000  0.2354000     7.656000  0.2317000     -0.4982000     0.3303000 
1 1 1 1  12 12 o 7.510000  0.1773000     7.466000  0.2473000     7.553000  0.2540000     -0.8784000E-01 0.3545000 
1 1 1 1  12 13 o 3.020000  0.4812000     2.728000  0.7159000     3.313000  0.6433000     -0.5853000     0.9624000 
1 1 1 1  12 14 o 9.166000  0.2231000     9.221000  0.3170000     9.110000  0.3141000     0.1114000      0.4462000 
1 1 1 1  12 15 o 7.706000  0.3778000     7.708000  0.5361000     7.704000  0.5324000     0.3703000E-02  0.7555000 
1 1 1 1  12 16 o 12.45000  0.2371000     12.41000  0.3355000     12.48000  0.3353000     -0.7327000E-01 0.4743000 
1 1 1 1  12 17 o 4.442000  0.5147000     4.228000  0.7198000     4.656000  0.7358000     -0.4277000     1.029000  
1 1 1 1  12 18 o 4.351000  0.5466000     4.865000  0.6818000     3.837000  0.8544000     1.028000       1.093000  
1 1 1 1  12 19 o 9.862000  0.3112000     9.752000  0.4510000     9.972000  0.4289000     -0.2199000     0.6224000 
1 1 1 1  12 20 o 2.847000  0.8531000     2.892000  1.259000      2.803000  1.152000      0.8851000E-01  1.706000  
1 1 1 1  12 21 o 4.226000  0.6343000     4.028000  0.9451000     4.424000  0.8463000     -0.3965000     1.269000  
1 1 1 1  12 22 o 1.891000  0.5807000     2.188000  0.8921000     1.595000  0.7437000     0.5931000      1.161000  
1 1 1 1  12 23 o 3.551000  0.5356000     3.289000  0.7949000     3.814000  0.7181000     -0.5250000     1.071000  
1 1 1 1  12 24 o 1.825000  0.5351000     2.013000  0.7878000     1.638000  0.7245000     0.3755000      1.070000  
1 1 1 1  12 25 o 1.804000  0.5873000     1.868000  0.8435000     1.741000  0.8175000     0.1265000      1.175000  
1 1 1 1  12 26 o 1.801000  0.5154000     1.452000  0.6601000     2.150000  0.7918000     -0.6980000     1.031000  
1 1 1 1  12 27 o 1.338000  0.4418000     1.048000  0.5215000     1.627000  0.7132000     -0.5793000     0.8835000 
1 1 1 1  13 0  o 15.62000  0.2758000     15.62000  0.2758000     15.62000  0.2758000     -0.000000      0.000000  
1 1 1 1  13 1  o 4.890000  0.1683000     4.662000  0.2028000     5.118000  0.2686000     -0.4564000     0.3366000 
1 1 1 1  13 2  o 10.49000  0.1085000     10.64000  0.1542000     10.34000  0.1527000     0.2929000      0.2170000 
1 1 1 1  13 3  o 6.362000  0.1007000     6.372000  0.1418000     6.351000  0.1431000     0.2067000E-01  0.2014000 
1 1 1 1  13 4  o 5.177000  0.1071000     5.258000  0.1498000     5.095000  0.1530000     0.1631000      0.2141000 
1 1 1 1  13 5  o 20.19000  0.1713000     20.29000  0.2434000     20.09000  0.2410000     0.1990000      0.3425000 
1 1 1 1  13 6  o 13.70000  0.1328000     13.78000  0.1882000     13.62000  0.1873000     0.1545000      0.2656000 
1 1 1 1  13 7  o 5.366000  0.1228000     5.175000  0.1750000     5.556000  0.1724000     -0.3813000     0.2456000 
1 1 1 1  13 8  o 20.65000  0.1807000     20.69000  0.2560000     20.61000  0.2551000     0.7525000E-01  0.3614000 
1 1 1 1  13 10 o 5.128000  0.1748000     5.534000  0.2371000     4.722000  0.2569000     0.8118000      0.3496000 
1 1 1 1  13 11 o 8.576000  0.1628000     8.557000  0.2309000     8.595000  0.2296000     -0.3830000E-01 0.3256000 
1 1 1 1  13 12 o 3.904000  0.2550000     3.907000  0.3567000     3.901000  0.3645000     0.6310000E-02  0.5100000 
1 1 1 1  13 13 o 8.959000  0.1815000     9.186000  0.2557000     8.732000  0.2577000     0.4538000      0.3630000 
1 1 1 1  13 14 o 8.626000  0.2328000     9.105000  0.3187000     8.147000  0.3394000     0.9584000      0.4656000 
1 1 1 1  13 15 o 13.20000  0.2547000     13.17000  0.3610000     13.23000  0.3596000     -0.5595000E-01 0.5095000 
1 1 1 1  13 16 o 3.187000  0.5288000     4.459000  0.6706000     1.916000  0.8178000     2.544000       1.058000  
1 1 1 1  13 17 o 9.082000  0.2747000     8.864000  0.3986000     9.300000  0.3782000     -0.4358000     0.5494000 
1 1 1 1  13 18 o 10.64000  0.2774000     10.36000  0.3969000     10.91000  0.3876000     -0.5496000     0.5548000 
1 1 1 1  13 19 o 6.330000  0.4315000     6.636000  0.5841000     6.024000  0.6354000     0.6122000      0.8631000 
1 1 1 1  13 20 o 4.662000  0.8009000     5.108000  1.122000      4.216000  1.143000      0.8919000      1.602000  
1 1 1 1  13 21 o 2.061000  0.6280000     1.988000  0.8695000     2.134000  0.9063000     -0.1454000     1.256000  
1 1 1 1  13 22 o 2.913000  0.6470000     3.244000  0.9129000     2.583000  0.9172000     0.6612000      1.294000  
1 1 1 1  13 23 o 2.312000  0.5915000     2.125000  0.8200000     2.499000  0.8526000     -0.3736000     1.183000  
1 1 1 1  13 24 o 1.933000  0.5382000     2.264000  0.8083000     1.602000  0.7109000     0.6616000      1.076000  
1 1 1 1  13 25 o 1.432000  0.4797000     1.300000  0.6299000     1.565000  0.7236000     -0.2651000     0.9593000 
1 1 1 1  13 26 o 1.518000  0.4801000     1.742000  0.7364000     1.295000  0.6162000     0.4469000      0.9602000 
1 1 1 1  13 27 o 1.295000  0.4319000     1.445000  0.6559000     1.145000  0.5622000     0.3000000      0.8639000 
1 1 1 1  14 0  o 34.42000  0.3839000     34.42000  0.3839000     34.42000  0.3839000     0.000000       0.000000  
1 1 1 1  14 1  o 3.976000  0.1104000     3.905000  0.1561000     4.046000  0.1561000     -0.1408000     0.2207000 
1 1 1 1  14 2  o 7.742000  0.1008000     7.856000  0.1427000     7.629000  0.1425000     0.2276000      0.2017000 
1 1 1 1  14 3  o 2.795000  0.1487000     2.899000  0.2079000     2.692000  0.2126000     0.2068000      0.2973000 
1 1 1 1  14 4  o 14.11000  0.1320000     14.12000  0.1867000     14.09000  0.1867000     0.3078000E-01  0.2640000 
1 1 1 1  14 5  o 12.32000  0.1247000     12.58000  0.1781000     12.07000  0.1746000     0.5061000      0.2494000 
1 1 1 1  14 6  o 3.988000  0.1351000     3.822000  0.1965000     4.155000  0.1856000     -0.3323000     0.2702000 
1 1 1 1  14 7  o 14.52000  0.1421000     14.46000  0.2001000     14.57000  0.2019000     -0.1094000     0.2843000 
1 1 1 1  14 8  o 11.48000  0.1307000     11.27000  0.1834000     11.69000  0.1861000     -0.4243000     0.2613000 
1 1 1 1  14 9  o 14.24000  0.2089000     14.36000  0.2974000     14.11000  0.2934000     0.2428000      0.4178000 
1 1 1 1  14 10 o 8.918000  0.1526000     8.840000  0.2163000     8.997000  0.2153000     -0.1565000     0.3052000 
1 1 1 1  14 11 f 4.761000  0.2142000     4.797000  0.2988000     4.726000  0.3068000     0.7149000E-01  0.4283000 
1 1 1 1  14 12 o 2.061000  0.4206000     2.236000  0.5753000     1.885000  0.6137000     0.3513000      0.8412000 
1 1 1 1  14 13 o 1.947000  0.4289000     1.444000  0.6029000     2.450000  0.6103000     -1.006000      0.8579000 
1 1 1 1  14 14 o 22.10000  0.2347000     21.85000  0.3504000     22.34000  0.3123000     -0.4897000     0.4694000 
1 1 1 1  14 15 o 5.474000  0.2848000     5.673000  0.3891000     5.274000  0.4161000     0.3988000      0.5697000 
1 1 1 1  14 16 o 8.527000  0.2953000     8.681000  0.4115000     8.373000  0.4237000     0.3073000      0.5906000 
1 1 1 1  14 17 o 6.719000  0.3470000     6.729000  0.4927000     6.708000  0.4886000     0.2087000E-01  0.6939000 
1 1 1 1  14 18 o 7.901000  0.3444000     8.387000  0.4585000     7.415000  0.5141000     0.9724000      0.6888000 
1 1 1 1  14 19 o 3.624000  0.7091000     3.942000  0.9562000     3.305000  1.047000      0.6371000      1.418000  
1 1 1 1  14 20 o 6.464000  0.5041000     6.762000  0.7082000     6.165000  0.7177000     0.5979000      1.008000  
1 1 1 1  14 21 o 4.029000  0.6036000     3.544000  0.9394000     4.514000  0.7582000     -0.9701000     1.207000  
1 1 1 1  14 22 o 2.369000  0.6171000     2.911000  0.9258000     1.826000  0.8163000     1.085000       1.234000  
1 1 1 1  14 23 o 2.475000  0.5833000     2.755000  0.8253000     2.196000  0.8245000     0.5589000      1.167000  
1 1 1 1  14 24 o 1.761000  0.5094000     2.144000  0.7897000     1.378000  0.6436000     0.7662000      1.019000  
1 1 1 1  14 25 o 1.523000  0.4842000     1.487000  0.6761000     1.560000  0.6933000     -0.7329000E-01 0.9684000 
1 1 1 1  14 26 o 1.207000  0.4127000     1.201000  0.5814000     1.212000  0.5859000     -0.1070000E-01 0.8254000 
1 1 1 1  14 27 o 1.296000  0.4341000     1.470000  0.6714000     1.122000  0.5503000     0.3480000      0.8681000 
1 1 1 1  15 0  o 15.43000  0.1955000     15.43000  0.1955000     15.43000  0.1955000     -0.000000      0.000000  
1 1 1 1  15 1  o 8.080000  0.1031000     7.992000  0.1460000     8.167000  0.1456000     -0.1744000     0.2062000 
1 1 1 1  15 2  f 17.93000  0.1545000     18.22000  0.2213000     17.64000  0.2156000     0.5803000      0.3090000 
1 1 1 1  15 3  o 5.784000  0.1083000     5.587000  0.1537000     5.981000  0.1525000     -0.3939000     0.2165000 
1 1 1 1  15 4  o 9.073000  0.1102000     9.182000  0.1556000     8.964000  0.1559000     0.2181000      0.2203000 
1 1 1 1  15 5  o 12.49000  0.1261000     12.66000  0.1798000     12.32000  0.1768000     0.3430000      0.2522000 
1 1 1 1  15 6  o 18.18000  0.1619000     17.92000  0.2263000     18.43000  0.2316000     -0.5136000     0.3237000 
1 1 1 1  15 7  o 9.126000  0.1227000     8.932000  0.1740000     9.320000  0.1730000     -0.3884000     0.2454000 
1 1 1 1  15 8  o 12.77000  0.1776000     12.86000  0.2799000     12.67000  0.2188000     0.1843000      0.3552000 
1 1 1 1  15 9  o 7.085000  0.1341000     6.980000  0.1902000     7.191000  0.1890000     -0.2112000     0.2681000 
1 1 1 1  15 10 o 9.255000  0.1634000     8.915000  0.2401000     9.596000  0.2218000     -0.6808000     0.3269000 
1 1 1 1  15 11 o 2.231000  0.3945000     1.899000  0.6011000     2.563000  0.5112000     -0.6633000     0.7891000 
1 1 1 1  15 12 o 7.008000  0.1860000     7.097000  0.2613000     6.919000  0.2648000     0.1779000      0.3720000 
1 1 1 1  15 13 o 5.585000  0.2353000     5.248000  0.3467000     5.922000  0.3183000     -0.6740000     0.4707000 
1 1 1 1  15 14 o 5.075000  0.3122000     5.176000  0.4375000     4.973000  0.4456000     0.2028000      0.6245000 
1 1 1 1  15 15 o 12.99000  0.2033000     12.99000  0.2890000     13.00000  0.2861000     -0.5569000E-02 0.4067000 
1 1 1 1  15 16 o 17.03000  0.2122000     16.95000  0.3004000     17.10000  0.2997000     -0.1527000     0.4244000 
1 1 1 1  15 17 o 5.913000  0.3936000     5.997000  0.5562000     5.829000  0.5571000     0.1681000      0.7873000 
1 1 1 1  15 18 o 2.307000  0.6542000     2.303000  0.9280000     2.310000  0.9223000     -0.7679000E-02 1.308000  
1 1 1 1  15 19 o 3.778000  0.6655000     3.244000  0.9945000     4.313000  0.8846000     -1.069000      1.331000  
1 1 1 1  15 20 o 3.369000  0.7092000     3.015000  1.013000      3.723000  0.9930000     -0.7081000     1.418000  
1 1 1 1  15 21 o 1.926000  0.5962000     1.738000  0.7966000     2.115000  0.8872000     -0.3766000     1.192000  
1 1 1 1  15 22 o 2.313000  0.6298000     2.526000  0.9217000     2.100000  0.8585000     0.4252000      1.260000  
1 1 1 1  15 23 o 2.422000  0.5618000     1.986000  0.7918000     2.857000  0.7972000     -0.8708000     1.124000  
1 1 1 1  15 24 o 2.176000  0.5723000     2.067000  0.8221000     2.284000  0.7964000     -0.2172000     1.145000  
1 1 1 1  15 25 o 1.694000  0.5128000     1.523000  0.6841000     1.864000  0.7641000     -0.3415000     1.026000  
1 1 1 1  15 26 o 1.488000  0.4727000     1.701000  0.7246000     1.276000  0.6072000     0.4252000      0.9454000 
1 1 1 1  15 27 o 1.974000  0.5187000     1.483000  0.6693000     2.466000  0.7925000     -0.9833000     1.037000  
1 1 1 1  16 0  o 3.779000  0.1741000     3.779000  0.1741000     3.779000  0.1741000     0.000000       0.000000  
1 1 1 1  16 1  o 6.561000  0.1047000     6.568000  0.1482000     6.554000  0.1479000     0.1384000E-01  0.2094000 
1 1 1 1  16 2  o 22.09000  0.1835000     22.34000  0.2622000     21.83000  0.2569000     0.5094000      0.3671000 
1 1 1 1  16 3  o 11.89000  0.1215000     12.10000  0.1729000     11.69000  0.1706000     0.4185000      0.2429000 
1 1 1 1  16 4  o 7.589000  0.1103000     7.748000  0.1555000     7.429000  0.1564000     0.3195000      0.2206000 
1 1 1 1  16 5  o 5.848000  0.1180000     5.813000  0.1663000     5.883000  0.1673000     -0.7005000E-01 0.2359000 
1 1 1 1  16 6  o 3.618000  0.1540000     3.603000  0.2197000     3.632000  0.2158000     -0.2914000E-01 0.3079000 
1 1 1 1  16 7  o 13.38000  0.1516000     13.24000  0.2303000     13.52000  0.1971000     -0.2878000     0.3031000 
1 1 1 1  16 8  o 8.833000  0.2666000     8.833000  0.2666000     ?         ?             ?              ?         
1 1 1 1  16 9  o 9.542000  0.1331000     9.733000  0.1882000     9.351000  0.1884000     0.3815000      0.2663000 
1 1 1 1  16 10 o 8.711000  0.1424000     8.576000  0.2007000     8.845000  0.2021000     -0.2690000     0.2849000 
1 1 1 1  16 11 o 4.676000  0.2233000     4.640000  0.3143000     4.712000  0.3174000     -0.7236000E-01 0.4466000 
1 1 1 1  16 12 f 8.636000  0.1778000     8.748000  0.2497000     8.524000  0.2531000     0.2238000      0.3555000 
1 1 1 1  16 13 o 10.30000  0.1917000     10.62000  0.2514000     9.980000  0.2896000     0.6354000      0.3835000 
1 1 1 1  16 14 o 12.50000  0.3608000     12.50000  0.3608000     ?         ?             ?              ?         
1 1 1 1  16 15 o 14.95000  0.2085000     14.84000  0.2938000     15.06000  0.2958000     -0.2155000     0.4169000 
1 1 1 1  16 16 o 2.213000  0.5494000     2.581000  0.8031000     1.845000  0.7500000     0.7362000      1.099000  
1 1 1 1  16 17 o 8.189000  0.2564000     8.368000  0.3565000     8.010000  0.3686000     0.3577000      0.5128000 
1 1 1 1  16 18 o 3.875000  0.5347000     3.030000  0.8637000     4.719000  0.6306000     -1.689000      1.069000  
1 1 1 1  16 19 o 7.069000  0.4924000     6.351000  0.7788000     7.787000  0.6028000     -1.436000      0.9849000 
1 1 1 1  16 20 o 2.415000  0.6801000     2.212000  0.9352000     2.618000  0.9878000     -0.4055000     1.360000  
1 1 1 1  16 21 o 2.052000  0.6091000     1.899000  0.8384000     2.205000  0.8838000     -0.3055000     1.218000  
1 1 1 1  16 22 o 1.521000  0.5066000     1.551000  0.7287000     1.492000  0.7041000     0.5871000E-01  1.013000  
1 1 1 1  16 23 o 1.393000  0.4608000     1.378000  0.6472000     1.408000  0.6561000     -0.2970000E-01 0.9216000 
1 1 1 1  16 24 o 1.538000  0.5031000     1.139000  0.5657000     1.936000  0.8320000     -0.7971000     1.006000  
1 1 1 1  16 25 o 1.974000  0.5414000     1.802000  0.7422000     2.145000  0.7885000     -0.3426000     1.083000  
1 1 1 1  16 26 o 1.457000  0.4653000     1.627000  0.7025000     1.286000  0.6103000     0.3414000      0.9306000 
1 1 1 1  16 27 o 1.466000  0.4726000     1.581000  0.7039000     1.351000  0.6307000     0.2303000      0.9451000 
1 1 1 1  17 0  o 19.30000  0.2329000     19.30000  0.2329000     19.30000  0.2329000     0.000000       0.000000  
1 1 1 1  17 1  o 8.441000  0.1079000     8.476000  0.1535000     8.405000  0.1515000     0.7142000E-01  0.2157000 
1 1 1 1  17 2  o 12.86000  0.1263000     12.96000  0.1794000     12.76000  0.1777000     0.1925000      0.2525000 
1 1 1 1  17 3  o 2.947000  0.1575000     3.051000  0.2182000     2.844000  0.2273000     0.2067000      0.3151000 
1 1 1 1  17 4  o 8.243000  0.1124000     8.319000  0.1594000     8.166000  0.1583000     0.1528000      0.2247000 
1 1 1 1  17 5  o 20.69000  0.1780000     20.64000  0.2513000     20.74000  0.2522000     -0.1012000     0.3560000 
1 1 1 1  17 6  o 9.400000  0.1220000     9.198000  0.1719000     9.603000  0.1732000     -0.4045000     0.2440000 
1 1 1 1  17 7  o 7.240000  0.1323000     7.452000  0.1954000     7.028000  0.1785000     0.4243000      0.2646000 
1 1 1 1  17 8  o 13.96000  0.2049000     14.19000  0.2926000     13.73000  0.2870000     0.4654000      0.4098000 
1 1 1 1  17 9  o 16.81000  0.1643000     17.02000  0.2347000     16.61000  0.2300000     0.4075000      0.3286000 
1 1 1 1  17 10 o 4.631000  0.1814000     4.324000  0.2702000     4.938000  0.2420000     -0.6138000     0.3628000 
1 1 1 1  17 11 o 4.361000  0.1995000     4.294000  0.2860000     4.428000  0.2781000     -0.1342000     0.3989000 
1 1 1 1  17 12 o 8.069000  0.1834000     7.827000  0.2597000     8.311000  0.2589000     -0.4833000     0.3667000 
1 1 1 1  17 13 o 13.51000  0.1823000     13.26000  0.2565000     13.77000  0.2592000     -0.5101000     0.3647000 
1 1 1 1  17 14 o 4.713000  0.6220000     4.935000  0.9035000     4.491000  0.8551000     0.4442000      1.244000  
1 1 1 1  17 15 o 9.782000  0.2276000     9.884000  0.3199000     9.681000  0.3239000     0.2034000      0.4552000 
1 1 1 1  17 16 o 1.769000  0.5301000     1.721000  0.7429000     1.818000  0.7565000     -0.9656000E-01 1.060000  
1 1 1 1  17 17 o 2.627000  0.5687000     2.829000  0.7983000     2.425000  0.8101000     0.4041000      1.137000  
1 1 1 1  17 18 o 3.404000  0.5926000     3.304000  0.8486000     3.503000  0.8274000     -0.1994000     1.185000  
1 1 1 1  17 19 o 3.015000  0.7163000     3.159000  1.032000      2.871000  0.9936000     0.2874000      1.433000  
1 1 1 1  17 20 o 6.210000  0.3555000     6.510000  0.4876000     5.911000  0.5174000     0.5991000      0.7109000 
1 1 1 1  17 21 o 3.765000  0.5720000     5.019000  0.6502000     2.511000  0.9411000     2.508000       1.144000  
1 1 1 1  17 22 o 2.132000  0.5879000     1.703000  0.7668000     2.562000  0.8913000     -0.8592000     1.176000  
1 1 1 1  17 23 o 1.305000  0.4411000     1.305000  0.6227000     1.305000  0.6250000     0.3433000E-03  0.8822000 
1 1 1 1  17 24 o 1.874000  0.5780000     2.116000  0.8774000     1.631000  0.7525000     0.4850000      1.156000  
1 1 1 1  17 25 o 1.407000  0.4574000     1.567000  0.6912000     1.246000  0.5992000     0.3215000      0.9148000 
1 1 1 1  17 26 o 1.461000  0.4660000     1.359000  0.6328000     1.563000  0.6842000     -0.2032000     0.9320000 
1 1 1 1  17 27 o 1.273000  0.4281000     1.144000  0.5605000     1.401000  0.6473000     -0.2566000     0.8562000 
1 1 1 1  18 0  o 15.39000  0.1996000     15.39000  0.1996000     15.39000  0.1996000     -0.000000      0.000000  
1 1 1 1  18 1  o 13.21000  0.1286000     13.10000  0.1813000     13.31000  0.1823000     -0.2059000     0.2571000 
1 1 1 1  18 2  o 5.382000  0.1160000     5.628000  0.1625000     5.135000  0.1656000     0.4932000      0.2320000 
1 1 1 1  18 3  o 4.061000  0.1341000     4.240000  0.1840000     3.881000  0.1952000     0.3590000      0.2682000 
1 1 1 1  18 4  o 11.17000  0.1234000     11.07000  0.1741000     11.27000  0.1749000     -0.2034000     0.2467000 
1 1 1 1  18 5  o 3.318000  0.1654000     3.326000  0.2329000     3.309000  0.2351000     0.1715000E-01  0.3309000 
1 1 1 1  18 6  o 5.364000  0.1330000     5.381000  0.1881000     5.348000  0.1880000     0.3321000E-01  0.2659000 
1 1 1 1  18 7  o 12.40000  0.1953000     12.76000  0.2763000     12.04000  0.2760000     0.7172000      0.3905000 
1 1 1 1  18 8  o 9.345000  0.1327000     9.147000  0.1868000     9.542000  0.1886000     -0.3948000     0.2654000 
1 1 1 1  18 9  o 7.538000  0.1403000     7.566000  0.1968000     7.511000  0.1999000     0.5521000E-01  0.2806000 
1 1 1 1  18 10 o 1.937000  0.3372000     2.448000  0.4213000     1.426000  0.5266000     1.022000       0.6744000 
1 1 1 1  18 11 o 6.449000  0.1703000     6.739000  0.2470000     6.160000  0.2346000     0.5793000      0.3406000 
1 1 1 1  18 12 o 1.539000  0.4313000     1.473000  0.6051000     1.604000  0.6147000     -0.1310000     0.8625000 
1 1 1 1  18 13 o 20.64000  0.2072000     20.59000  0.2921000     20.70000  0.2940000     -0.1110000     0.4144000 
1 1 1 1  18 14 o 15.52000  0.2570000     15.26000  0.4314000     15.77000  0.2794000     -0.5165000     0.5140000 
1 1 1 1  18 15 o 2.975000  0.5273000     3.703000  0.6698000     2.248000  0.8146000     1.455000       1.055000  
1 1 1 1  18 16 o 2.863000  0.4801000     3.870000  0.6107000     1.855000  0.7410000     2.016000       0.9602000 
1 1 1 1  18 17 o 3.776000  0.4799000     3.695000  0.6860000     3.856000  0.6714000     -0.1609000     0.9599000 
1 1 1 1  18 18 o 3.700000  0.5798000     3.109000  0.8842000     4.291000  0.7502000     -1.182000      1.160000  
1 1 1 1  18 19 o 2.149000  0.9419000     2.149000  0.9419000     ?         ?             ?              ?         
1 1 1 1  18 20 o 2.962000  0.6082000     2.571000  0.8953000     3.352000  0.8234000     -0.7814000     1.216000  
1 1 1 1  18 21 o 3.076000  0.5761000     2.765000  0.8552000     3.386000  0.7721000     -0.6212000     1.152000  
1 1 1 1  18 22 o 1.981000  0.5558000     1.862000  0.7731000     2.100000  0.7987000     -0.2382000     1.112000  
1 1 1 1  18 23 o 1.849000  0.5127000     1.622000  0.7016000     2.076000  0.7478000     -0.4540000     1.025000  
1 1 1 1  18 24 o 1.798000  0.6058000     1.826000  0.8892000     1.769000  0.8230000     0.5720000E-01  1.212000  
1 1 1 1  18 25 o 1.770000  0.5069000     1.427000  0.6549000     2.114000  0.7739000     -0.6873000     1.014000  
1 1 1 1  18 26 o 1.603000  0.4740000     2.017000  0.7548000     1.189000  0.5734000     0.8289000      0.9479000 
1 1 1 1  18 27 o 0.9816000 0.3515000     0.9755000 0.4938000     0.9877000 0.5003000     -0.1220000E-01 0.7030000 
1 1 1 1  19 0  o 4.137000  0.1858000     4.137000  0.1858000     4.137000  0.1858000     0.000000       0.000000  
1 1 1 1  19 1  o 6.165000  0.1142000     6.112000  0.1623000     6.218000  0.1608000     -0.1068000     0.2285000 
1 1 1 1  19 2  o 10.10000  0.1176000     10.11000  0.1664000     10.08000  0.1662000     0.2814000E-01  0.2352000 
1 1 1 1  19 3  o 8.493000  0.1154000     8.668000  0.1624000     8.317000  0.1638000     0.3507000      0.2307000 
1 1 1 1  19 4  o 3.431000  0.1623000     3.331000  0.2352000     3.531000  0.2236000     -0.1994000     0.3245000 
1 1 1 1  19 5  o 6.600000  0.1237000     6.322000  0.1765000     6.878000  0.1734000     -0.5564000     0.2474000 
1 1 1 1  19 6  o 13.82000  0.1512000     13.68000  0.2252000     13.97000  0.2019000     -0.2902000     0.3024000 
1 1 1 1  19 7  o 5.571000  0.2815000     5.571000  0.2815000     ?         ?             ?              ?         
1 1 1 1  19 8  o 3.308000  0.2035000     3.225000  0.2922000     3.391000  0.2833000     -0.1659000     0.4070000 
1 1 1 1  19 9  o 2.386000  0.3115000     2.687000  0.3925000     2.084000  0.4839000     0.6026000      0.6231000 
1 1 1 1  19 10 f 4.314000  0.1920000     4.443000  0.2623000     4.185000  0.2803000     0.2575000      0.3839000 
1 1 1 1  19 11 f 9.836000  0.1525000     9.912000  0.2147000     9.760000  0.2167000     0.1518000      0.3050000 
1 1 1 1  19 12 o 7.347000  0.1691000     7.367000  0.2365000     7.326000  0.2417000     0.4117000E-01  0.3382000 
1 1 1 1  19 13 o 7.074000  0.2372000     7.131000  0.3353000     7.017000  0.3355000     0.1136000      0.4743000 
1 1 1 1  19 14 f 5.582000  0.2885000     6.208000  0.3687000     4.955000  0.4440000     1.253000       0.5771000 
1 1 1 1  19 15 o 5.788000  0.3237000     6.207000  0.4195000     5.368000  0.4930000     0.8393000      0.6473000 
1 1 1 1  19 16 f 10.63000  0.2178000     10.46000  0.3065000     10.79000  0.3097000     -0.3347000     0.4357000 
1 1 1 1  19 17 o 10.62000  0.2414000     10.58000  0.3331000     10.66000  0.3495000     -0.8331000E-01 0.4828000 
1 1 1 1  19 18 o 4.889000  0.4660000     5.154000  0.6250000     4.625000  0.6912000     0.5296000      0.9319000 
1 1 1 1  19 19 o 2.784000  0.9008000     2.202000  1.041000      3.367000  1.470000      -1.165000      1.802000  
1 1 1 1  19 20 o 2.369000  0.6241000     2.238000  0.8747000     2.499000  0.8903000     -0.2602000     1.248000  
1 1 1 1  19 21 o 2.053000  0.5360000     2.627000  0.8257000     1.478000  0.6835000     1.150000       1.072000  
1 1 1 1  19 22 o 3.087000  0.5273000     2.836000  0.7931000     3.339000  0.6950000     -0.5030000     1.055000  
1 1 1 1  19 23 o 1.870000  0.5236000     1.886000  0.7437000     1.853000  0.7373000     0.3325000E-01  1.047000  
1 1 1 1  19 24 o 2.327000  0.7446000     2.212000  1.019000      2.442000  1.086000      -0.2292000     1.489000  
1 1 1 1  19 25 o 1.404000  0.4445000     1.554000  0.6651000     1.254000  0.5898000     0.2994000      0.8889000 
1 1 1 1  19 26 o 1.643000  0.4851000     1.768000  0.7072000     1.519000  0.6642000     0.2486000      0.9702000 
1 1 1 1  20 0  o 24.56000  0.2877000     24.56000  0.2877000     24.56000  0.2877000     -0.000000      0.000000  
1 1 1 1  20 1  o 16.83000  0.1524000     16.85000  0.2158000     16.81000  0.2152000     0.3527000E-01  0.3048000 
1 1 1 1  20 2  o 19.61000  0.1707000     19.49000  0.2403000     19.73000  0.2424000     -0.2384000     0.3413000 
1 1 1 1  20 3  o 9.019000  0.1185000     8.942000  0.1673000     9.096000  0.1679000     -0.1534000     0.2370000 
1 1 1 1  20 4  o 16.01000  0.1505000     16.13000  0.2141000     15.89000  0.2114000     0.2395000      0.3009000 
1 1 1 1  20 5  o 18.15000  0.1643000     18.26000  0.2335000     18.03000  0.2311000     0.2257000      0.3285000 
1 1 1 1  20 6  o 13.67000  0.2019000     14.00000  0.2867000     13.34000  0.2844000     0.6562000      0.4038000 
1 1 1 1  20 7  o 6.967000  0.1362000     6.892000  0.1966000     7.042000  0.1886000     -0.1495000     0.2724000 
1 1 1 1  20 8  o 12.58000  0.1444000     12.83000  0.2059000     12.34000  0.2025000     0.4886000      0.2888000 
1 1 1 1  20 9  o 10.95000  0.1448000     10.84000  0.2035000     11.06000  0.2059000     -0.2130000     0.2895000 
1 1 1 1  20 10 o 10.70000  0.1494000     10.69000  0.2108000     10.70000  0.2117000     -0.8221000E-02 0.2988000 
1 1 1 1  20 11 o 3.305000  0.2681000     3.473000  0.3609000     3.137000  0.3967000     0.3366000      0.5363000 
1 1 1 1  20 12 o 2.941000  0.3188000     2.962000  0.4459000     2.919000  0.4559000     0.4214000E-01  0.6377000 
1 1 1 1  20 13 o 6.359000  0.3999000     6.359000  0.3999000     ?         ?             ?              ?         
1 1 1 1  20 14 o 9.778000  0.2113000     9.877000  0.2982000     9.679000  0.2993000     0.1982000      0.4225000 
1 1 1 1  20 15 o 4.056000  0.4283000     4.174000  0.5629000     3.939000  0.6457000     0.2344000      0.8567000 
1 1 1 1  20 16 o 3.108000  0.5405000     3.069000  0.7709000     3.147000  0.7578000     -0.7809000E-01 1.081000  
1 1 1 1  20 17 o 4.101000  0.5052000     5.465000  0.5197000     2.738000  0.8664000     2.727000       1.010000  
1 1 1 1  20 18 o 6.001000  0.4240000     7.023000  0.5000000     4.978000  0.6849000     2.045000       0.8480000 
1 1 1 1  20 19 f 4.193000  0.8570000     3.972000  1.210000      4.414000  1.214000      -0.4421000     1.714000  
1 1 1 1  20 20 o 3.514000  0.5663000     4.018000  0.7482000     3.011000  0.8502000     1.007000       1.133000  
1 1 1 1  20 21 o 2.547000  0.5854000     2.358000  0.8265000     2.735000  0.8293000     -0.3778000     1.171000  
1 1 1 1  20 22 o 1.983000  0.5433000     2.137000  0.7939000     1.829000  0.7418000     0.3073000      1.087000  
1 1 1 1  20 23 o 1.365000  0.4460000     1.465000  0.6622000     1.264000  0.5978000     0.2012000      0.8920000 
1 1 1 1  20 24 o 1.610000  0.5395000     1.852000  0.8411000     1.369000  0.6760000     0.4833000      1.079000  
1 1 1 1  20 25 o 1.468000  0.4586000     1.669000  0.7026000     1.266000  0.5897000     0.4026000      0.9172000 
1 1 1 1  20 26 o 1.140000  0.3879000     1.180000  0.5632000     1.099000  0.5334000     0.8058000E-01  0.7757000 
1 1 1 1  21 0  o 6.491000  0.1941000     6.491000  0.1941000     6.491000  0.1941000     -0.000000      0.000000  
1 1 1 1  21 1  o 4.419000  0.1383000     4.356000  0.1999000     4.483000  0.1911000     -0.1261000     0.2766000 
1 1 1 1  21 2  o 20.50000  0.1773000     20.64000  0.2522000     20.36000  0.2493000     0.2796000      0.3546000 
1 1 1 1  21 3  o 15.79000  0.1486000     15.93000  0.2116000     15.65000  0.2088000     0.2801000      0.2972000 
1 1 1 1  21 4  o 2.018000  0.2733000     2.272000  0.3390000     1.764000  0.4287000     0.5086000      0.5465000 
1 1 1 1  21 5  o 8.922000  0.1258000     9.221000  0.1791000     8.622000  0.1767000     0.5988000      0.2516000 
1 1 1 1  21 6  o 9.679000  0.1889000     9.547000  0.2590000     9.811000  0.2751000     -0.2637000     0.3778000 
1 1 1 1  21 7  o 11.81000  0.1395000     11.99000  0.1985000     11.63000  0.1962000     0.3553000      0.2791000 
1 1 1 1  21 8  o 3.640000  0.2052000     3.992000  0.2680000     3.289000  0.3109000     0.7025000      0.4105000 
1 1 1 1  21 9  o 7.482000  0.1484000     7.551000  0.2078000     7.414000  0.2119000     0.1370000      0.2968000 
1 1 1 1  21 10 o 4.285000  0.2044000     3.999000  0.3032000     4.571000  0.2743000     -0.5720000     0.4088000 
1 1 1 1  21 11 o 14.35000  0.1638000     14.43000  0.2326000     14.26000  0.2307000     0.1716000      0.3276000 
1 1 1 1  21 12 o 12.04000  0.1630000     12.28000  0.2325000     11.79000  0.2285000     0.4923000      0.3260000 
1 1 1 1  21 13 o 6.325000  0.4088000     6.325000  0.4088000     ?         ?             ?              ?         
1 1 1 1  21 14 o 5.521000  0.3087000     4.856000  0.4738000     6.185000  0.3960000     -1.329000      0.6175000 
1 1 1 1  21 15 o 5.787000  0.3032000     5.665000  0.4338000     5.910000  0.4236000     -0.2452000     0.6063000 
1 1 1 1  21 16 o 14.39000  0.2126000     13.99000  0.3008000     14.80000  0.3005000     -0.8047000     0.4252000 
1 1 1 1  21 17 o 3.367000  0.5777000     2.908000  0.8727000     3.825000  0.7573000     -0.9161000     1.155000  
1 1 1 1  21 18 o 3.501000  0.6167000     3.058000  0.9323000     3.944000  0.8076000     -0.8857000     1.233000  
1 1 1 1  21 19 o 4.001000  0.5438000     4.126000  0.7642000     3.877000  0.7740000     0.2489000      1.088000  
1 1 1 1  21 20 o 3.427000  0.5722000     3.719000  0.7791000     3.134000  0.8381000     0.5843000      1.144000  
1 1 1 1  21 21 o 5.577000  0.3490000     5.439000  0.5110000     5.716000  0.4757000     -0.2766000     0.6981000 
1 1 1 1  21 22 o 1.723000  0.4933000     1.276000  0.6089000     2.169000  0.7763000     -0.8923000     0.9866000 
1 1 1 1  21 23 o 1.616000  0.4833000     1.403000  0.6348000     1.829000  0.7291000     -0.4266000     0.9667000 
1 1 1 1  21 24 o 1.966000  0.5634000     1.861000  0.8410000     2.070000  0.7500000     -0.2092000     1.127000  
1 1 1 1  21 25 o 1.584000  0.4563000     1.138000  0.5475000     2.031000  0.7301000     -0.8922000     0.9126000 
1 1 1 1  21 26 o 1.284000  0.4232000     1.293000  0.6031000     1.275000  0.5938000     0.1878000E-01  0.8463000 
1 1 1 1  22 0  o 3.864000  0.2172000     3.864000  0.2172000     3.864000  0.2172000     -0.000000      0.000000  
1 1 1 1  22 1  o 4.112000  0.1464000     4.020000  0.2083000     4.204000  0.2059000     -0.1839000     0.2929000 
1 1 1 1  22 2  o 16.09000  0.1630000     15.70000  0.2440000     16.48000  0.2161000     -0.7784000     0.3260000 
1 1 1 1  22 3  o 9.298000  0.1228000     9.357000  0.1743000     9.239000  0.1731000     0.1177000      0.2456000 
1 1 1 1  22 4  o 11.29000  0.1304000     11.28000  0.1845000     11.30000  0.1844000     -0.1853000E-01 0.2609000 
1 1 1 1  22 6  o 6.857000  0.1354000     6.798000  0.1940000     6.917000  0.1890000     -0.1183000     0.2708000 
1 1 1 1  22 7  o 6.244000  0.1457000     6.094000  0.2087000     6.395000  0.2033000     -0.3013000     0.2913000 
1 1 1 1  22 8  o 7.678000  0.1430000     7.539000  0.2015000     7.817000  0.2031000     -0.2777000     0.2861000 
1 1 1 1  22 9  o 8.912000  0.1472000     8.731000  0.2087000     9.094000  0.2077000     -0.3628000     0.2944000 
1 1 1 1  22 10 o 2.811000  0.2953000     2.850000  0.4109000     2.772000  0.4242000     0.7874000E-01  0.5906000 
1 1 1 1  22 11 f 5.223000  0.1962000     4.932000  0.2881000     5.515000  0.2664000     -0.5832000     0.3924000 
1 1 1 1  22 12 o 2.804000  0.3469000     2.729000  0.4930000     2.880000  0.4881000     -0.1509000     0.6937000 
1 1 1 1  22 13 o 3.924000  0.3572000     4.065000  0.5698000     3.783000  0.4310000     0.2820000      0.7144000 
1 1 1 1  22 14 o 14.86000  0.2045000     15.21000  0.2869000     14.52000  0.2915000     0.6865000      0.4090000 
1 1 1 1  22 15 o 12.55000  0.2077000     12.51000  0.2944000     12.60000  0.2930000     -0.8630000E-01 0.4154000 
1 1 1 1  22 16 o 15.15000  0.2150000     14.89000  0.3025000     15.41000  0.3055000     -0.5162000     0.4299000 
1 1 1 1  22 17 o 6.216000  0.3480000     6.318000  0.4852000     6.115000  0.4989000     0.2033000      0.6959000 
1 1 1 1  22 18 o 2.528000  0.6553000     3.132000  0.9785000     1.924000  0.8718000     1.208000       1.311000  
1 1 1 1  22 19 o 3.811000  0.5759000     3.856000  0.8134000     3.767000  0.8154000     0.8942000E-01  1.152000  
1 1 1 1  22 20 f 6.833000  0.3204000     6.408000  0.4714000     7.259000  0.4340000     -0.8514000     0.6407000 
1 1 1 1  22 21 o 3.025000  0.5631000     3.209000  0.7834000     2.840000  0.8090000     0.3689000      1.126000  
1 1 1 1  22 22 o 1.923000  0.5381000     1.875000  0.7595000     1.972000  0.7623000     -0.9751000E-01 1.076000  
1 1 1 1  22 23 o 2.458000  0.5102000     1.860000  0.7310000     3.056000  0.7120000     -1.196000      1.020000  
1 1 1 1  22 24 o 1.359000  0.4401000     1.333000  0.6157000     1.385000  0.6291000     -0.5181000E-01 0.8803000 
1 1 1 1  22 25 o 1.777000  0.4962000     1.401000  0.6409000     2.152000  0.7577000     -0.7507000     0.9924000 
1 1 1 1  22 26 o 1.222000  0.4067000     0.9928000 0.4914000     1.450000  0.6482000     -0.4575000     0.8134000 
1 1 1 1  23 0  o 29.12000  0.3358000     29.12000  0.3358000     29.12000  0.3358000     0.000000       0.000000  
1 1 1 1  23 1  o 15.63000  0.1490000     15.53000  0.2104000     15.72000  0.2110000     -0.1878000     0.2979000 
1 1 1 1  23 2  o 9.097000  0.1235000     8.871000  0.1744000     9.322000  0.1750000     -0.4507000     0.2471000 
1 1 1 1  23 3  o 3.999000  0.1604000     4.039000  0.2238000     3.959000  0.2299000     0.7942000E-01  0.3208000 
1 1 1 1  23 4  o 8.281000  0.2572000     8.281000  0.2572000     ?         ?             ?              ?         
1 1 1 1  23 5  o 13.89000  0.2024000     13.69000  0.2848000     14.09000  0.2878000     -0.4082000     0.4049000 
1 1 1 1  23 6  o 9.894000  0.1342000     9.886000  0.1886000     9.901000  0.1911000     -0.1449000E-01 0.2685000 
1 1 1 1  23 7  o 10.23000  0.1393000     10.05000  0.1964000     10.42000  0.1976000     -0.3738000     0.2786000 
1 1 1 1  23 8  o 8.693000  0.1436000     8.840000  0.2024000     8.545000  0.2039000     0.2952000      0.2873000 
1 1 1 1  23 9  o 6.443000  0.1598000     6.307000  0.2284000     6.579000  0.2235000     -0.2725000     0.3196000 
1 1 1 1  23 10 o 2.013000  0.3757000     2.229000  0.5138000     1.797000  0.5483000     0.4321000      0.7515000 
1 1 1 1  23 11 o 9.354000  0.1610000     9.469000  0.2265000     9.239000  0.2290000     0.2301000      0.3220000 
1 1 1 1  23 12 o 3.881000  0.3918000     4.041000  0.5421000     3.721000  0.5659000     0.3201000      0.7837000 
1 1 1 1  23 13 o 7.463000  0.2009000     7.279000  0.2926000     7.647000  0.2753000     -0.3673000     0.4017000 
1 1 1 1  23 14 o 9.716000  0.1948000     9.623000  0.2729000     9.809000  0.2782000     -0.1858000     0.3897000 
1 1 1 1  23 15 o 4.897000  0.3567000     4.121000  0.5751000     5.673000  0.4223000     -1.553000      0.7135000 
1 1 1 1  23 16 o 3.156000  0.5515000     3.391000  0.7465000     2.920000  0.8120000     0.4709000      1.103000  
1 1 1 1  23 17 o 5.751000  0.3785000     5.725000  0.5266000     5.778000  0.5437000     -0.5293000E-01 0.7569000 
1 1 1 1  23 18 o 6.590000  0.6344000     6.590000  0.6344000     ?         ?             ?              ?         
1 1 1 1  23 19 f 1.750000  0.5493000     1.665000  0.7575000     1.835000  0.7956000     -0.1701000     1.099000  
1 1 1 1  23 20 f 3.827000  0.5162000     3.994000  0.7159000     3.661000  0.7437000     0.3336000      1.032000  
1 1 1 1  23 21 o 2.393000  0.5425000     3.059000  0.7878000     1.727000  0.7459000     1.332000       1.085000  
1 1 1 1  23 22 o 1.786000  0.5246000     1.892000  0.7634000     1.680000  0.7197000     0.2124000      1.049000  
1 1 1 1  23 23 o 2.563000  0.5881000     2.161000  0.8024000     2.966000  0.8600000     -0.8056000     1.176000  
1 1 1 1  23 24 o 2.334000  0.5044000     2.900000  0.7069000     1.768000  0.7196000     1.132000       1.009000  
1 1 1 1  23 25 o 2.229000  0.5252000     2.279000  0.7362000     2.179000  0.7491000     0.1000000      1.050000  
1 1 1 1  23 26 o 0.9791000 0.3454000     0.8796000 0.4448000     1.079000  0.5285000     -0.1990000     0.6907000 
1 1 1 1  24 0  o 13.10000  0.1940000     13.10000  0.1940000     13.10000  0.1940000     -0.000000      0.000000  
1 1 1 1  24 1  o 20.15000  0.1776000     20.05000  0.2509000     20.25000  0.2515000     -0.2009000     0.3553000 
1 1 1 1  24 2  o 13.22000  0.1966000     13.22000  0.2783000     13.22000  0.2776000     -0.7772000E-03 0.3931000 
1 1 1 1  24 4  o 7.864000  0.1797000     7.586000  0.2551000     8.143000  0.2531000     -0.5569000     0.3594000 
1 1 1 1  24 5  o 8.439000  0.1317000     8.486000  0.1868000     8.391000  0.1858000     0.9526000E-01  0.2635000 
1 1 1 1  24 6  o 9.105000  0.1357000     9.183000  0.1921000     9.027000  0.1917000     0.1557000      0.2714000 
1 1 1 1  24 7  o 4.898000  0.1708000     4.660000  0.2451000     5.136000  0.2378000     -0.4757000     0.3415000 
1 1 1 1  24 8  o 4.335000  0.1911000     4.223000  0.2709000     4.448000  0.2695000     -0.2246000     0.3821000 
1 1 1 1  24 9  o 2.658000  0.3231000     1.914000  0.5464000     3.402000  0.3450000     -1.488000      0.6462000 
1 1 1 1  24 10 o 5.948000  0.1769000     5.947000  0.2514000     5.949000  0.2488000     -0.1362000E-02 0.3537000 
1 1 1 1  24 11 o 8.426000  0.1660000     8.466000  0.2332000     8.387000  0.2362000     0.7982000E-01  0.3319000 
1 1 1 1  24 12 o 11.69000  0.3491000     11.69000  0.3491000     ?         ?             ?              ?         
1 1 1 1  24 13 o 9.856000  0.2044000     9.797000  0.2635000     9.915000  0.3125000     -0.1177000     0.4087000 
1 1 1 1  24 14 o 2.328000  0.5016000     2.040000  0.7375000     2.616000  0.6801000     -0.5758000     1.003000  
1 1 1 1  24 15 o 13.39000  0.2176000     13.80000  0.3215000     12.99000  0.2933000     0.8049000      0.4352000 
1 1 1 1  24 16 o 2.278000  0.5764000     2.584000  0.8328000     1.973000  0.7972000     0.6115000      1.153000  
1 1 1 1  24 17 o 3.061000  0.6259000     3.140000  0.8748000     2.982000  0.8954000     0.1579000      1.252000  
1 1 1 1  24 18 f 7.364000  0.6152000     7.528000  0.9034000     7.200000  0.8353000     0.3278000      1.230000  
1 1 1 1  24 19 o 3.103000  0.6107000     3.006000  0.8916000     3.199000  0.8347000     -0.1934000     1.221000  
1 1 1 1  24 20 o 1.691000  0.5318000     1.800000  0.7859000     1.583000  0.7168000     0.2172000      1.064000  
1 1 1 1  24 21 o 2.330000  0.5792000     2.244000  0.8191000     2.416000  0.8192000     -0.1727000     1.158000  
1 1 1 1  24 22 o 2.359000  0.5614000     2.398000  0.7963000     2.319000  0.7917000     0.7819000E-01  1.123000  
1 1 1 1  24 23 o 2.461000  0.8639000     2.461000  0.8639000     ?         ?             ?              ?         
1 1 1 1  24 24 o 2.079000  0.5245000     1.903000  0.7254000     2.255000  0.7577000     -0.3519000     1.049000  
1 1 1 1  24 25 o 1.306000  0.4289000     1.209000  0.5758000     1.403000  0.6358000     -0.1946000     0.8578000 
1 1 1 1  24 26 o 1.496000  0.4661000     1.472000  0.6566000     1.520000  0.6617000     -0.4798000E-01 0.9322000 
1 1 1 1  25 2  o 3.329000  0.2834000     3.283000  0.4004000     3.375000  0.4011000     -0.9155000E-01 0.5668000 
1 1 1 1  25 3  o 13.50000  0.1739000     13.26000  0.2810000     13.75000  0.2049000     -0.4925000     0.3478000 
1 1 1 1  25 4  o 9.103000  0.1313000     9.068000  0.1847000     9.138000  0.1866000     -0.7030000E-01 0.2625000 
1 1 1 1  25 5  o 3.098000  0.2239000     2.737000  0.3459000     3.459000  0.2844000     -0.7222000     0.4478000 
1 1 1 1  25 6  o 12.28000  0.1535000     12.32000  0.2035000     12.25000  0.2298000     0.7553000E-01  0.3069000 
1 1 1 1  25 7  o 6.560000  0.1563000     6.322000  0.2225000     6.798000  0.2196000     -0.4759000     0.3126000 
1 1 1 1  25 8  o 3.237000  0.2490000     3.099000  0.3631000     3.376000  0.3408000     -0.2771000     0.4980000 
1 1 1 1  25 9  f 13.60000  0.1577000     13.71000  0.2245000     13.48000  0.2214000     0.2337000      0.3154000 
1 1 1 1  25 10 o 9.168000  0.1580000     9.165000  0.2244000     9.172000  0.2225000     -0.7330000E-02 0.3160000 
1 1 1 1  25 11 o 7.471000  0.1749000     7.648000  0.2459000     7.294000  0.2488000     0.3549000      0.3498000 
1 1 1 1  25 12 o 4.960000  0.2997000     5.181000  0.4867000     4.740000  0.3500000     0.4410000      0.5995000 
1 1 1 1  25 13 o 5.525000  0.2545000     5.236000  0.3791000     5.813000  0.3397000     -0.5769000     0.5090000 
1 1 1 1  25 14 o 12.67000  0.1813000     12.72000  0.2584000     12.63000  0.2545000     0.8625000E-01  0.3627000 
1 1 1 1  25 15 o 4.964000  0.3659000     4.162000  0.6356000     5.765000  0.3627000     -1.603000      0.7318000 
1 1 1 1  25 16 o 5.021000  0.3967000     5.457000  0.5148000     4.586000  0.6037000     0.8708000      0.7934000 
1 1 1 1  25 17 o 2.891000  0.6183000     2.565000  0.8732000     3.217000  0.8756000     -0.6524000     1.237000  
1 1 1 1  25 18 o 2.793000  0.7370000     2.979000  1.166000      2.608000  0.9012000     0.3708000      1.474000  
1 1 1 1  25 19 o 3.149000  0.5396000     2.042000  0.8485000     4.257000  0.6670000     -2.215000      1.079000  
1 1 1 1  25 20 o 1.547000  0.5012000     1.584000  0.7204000     1.510000  0.6972000     0.7394000E-01  1.002000  
1 1 1 1  25 21 o 2.699000  0.5493000     2.102000  0.8021000     3.297000  0.7507000     -1.195000      1.099000  
1 1 1 1  25 22 o 3.011000  0.5237000     2.649000  0.7705000     3.373000  0.7095000     -0.7242000     1.047000  
1 1 1 1  25 23 o 1.567000  0.7823000     1.567000  0.7823000     ?         ?             ?              ?         
1 1 1 1  25 24 f 1.682000  0.4955000     1.700000  0.7009000     1.663000  0.7005000     0.3772000E-01  0.9909000 
1 1 1 1  25 25 o 1.278000  0.4207000     1.374000  0.6242000     1.181000  0.5643000     0.1932000      0.8414000 
1 1 1 1  25 26 o 1.734000  0.5582000     2.176000  0.9135000     1.291000  0.6416000     0.8854000      1.116000  
1 1 1 1  26 0  o 9.145000  0.2579000     9.145000  0.2579000     9.145000  0.2579000     0.000000       0.000000  
1 1 1 1  26 1  o 10.24000  0.1318000     10.20000  0.1863000     10.28000  0.1863000     -0.8024000E-01 0.2635000 
1 1 1 1  26 2  o 23.26000  0.2001000     23.25000  0.2831000     23.26000  0.2828000     -0.8226000E-02 0.4002000 
1 1 1 1  26 3  o 9.017000  0.1316000     8.813000  0.1861000     9.221000  0.1861000     -0.4074000     0.2632000 
1 1 1 1  26 4  o 9.018000  0.1339000     9.151000  0.1894000     8.885000  0.1894000     0.2659000      0.2679000 
1 1 1 1  26 5  o 8.414000  0.1392000     8.464000  0.1956000     8.365000  0.1982000     0.9813000E-01  0.2784000 
1 1 1 1  26 6  o 3.407000  0.2195000     3.321000  0.3131000     3.493000  0.3078000     -0.1725000     0.4391000 
1 1 1 1  26 7  o 8.397000  0.1457000     8.402000  0.2056000     8.391000  0.2064000     0.1132000E-01  0.2913000 
1 1 1 1  26 8  o 6.728000  0.1594000     6.559000  0.2267000     6.896000  0.2241000     -0.3378000     0.3188000 
1 1 1 1  26 9  o 11.30000  0.1547000     11.15000  0.2194000     11.46000  0.2182000     -0.3089000     0.3094000 
1 1 1 1  26 10 f 7.234000  0.1707000     7.520000  0.2370000     6.949000  0.2459000     0.5710000      0.3415000 
1 1 1 1  26 11 o 11.52000  0.2804000     11.19000  0.3369000     11.85000  0.4482000     -0.6550000     0.5607000 
1 1 1 1  26 12 o 4.836000  0.2490000     4.598000  0.3718000     5.074000  0.3313000     -0.4759000     0.4980000 
1 1 1 1  26 13 o 2.064000  0.4931000     2.032000  0.6990000     2.097000  0.6957000     -0.6418000E-01 0.9862000 
1 1 1 1  26 14 o 16.59000  0.1897000     16.76000  0.2696000     16.42000  0.2669000     0.3416000      0.3793000 
1 1 1 1  26 15 o 8.991000  0.2013000     8.574000  0.2873000     9.408000  0.2819000     -0.8348000     0.4025000 
1 1 1 1  26 16 o 4.328000  0.4490000     3.908000  0.6852000     4.748000  0.5804000     -0.8399000     0.8980000 
1 1 1 1  26 17 o 5.019000  0.5118000     4.519000  0.7683000     5.520000  0.6763000     -1.001000      1.024000  
1 1 1 1  26 18 o 2.140000  0.5993000     2.331000  0.8717000     1.948000  0.8228000     0.3830000      1.199000  
1 1 1 1  26 19 o 3.075000  0.5716000     3.812000  0.7482000     2.337000  0.8643000     1.475000       1.143000  
1 1 1 1  26 20 o 1.716000  0.5184000     1.408000  0.6625000     2.024000  0.7976000     -0.6158000     1.037000  
1 1 1 1  26 21 o 2.711000  0.4935000     3.625000  0.6550000     1.797000  0.7383000     1.828000       0.9870000 
1 1 1 1  26 22 o 1.437000  0.4647000     1.285000  0.6121000     1.589000  0.6994000     -0.3038000     0.9294000 
1 1 1 1  26 23 o 1.923000  0.5985000     1.608000  0.7693000     2.238000  0.9171000     -0.6293000     1.197000  
1 1 1 1  26 24 o 1.568000  0.4770000     1.352000  0.6238000     1.785000  0.7218000     -0.4327000     0.9540000 
1 1 1 1  26 25 o 1.313000  0.4326000     1.437000  0.6496000     1.189000  0.5715000     0.2474000      0.8652000 
1 1 1 1  27 0  o 4.607000  0.2208000     4.607000  0.2208000     4.607000  0.2208000     0.000000       0.000000  
1 1 1 1  27 1  o 19.55000  0.1772000     19.76000  0.2525000     19.35000  0.2486000     0.4094000      0.3544000 
1 1 1 1  27 2  f 4.776000  0.1587000     4.541000  0.2273000     5.011000  0.2215000     -0.4692000     0.3174000 
1 1 1 1  27 3  o 13.87000  0.1473000     14.00000  0.2094000     13.75000  0.2073000     0.2523000      0.2946000 
1 1 1 1  27 4  o 4.113000  0.1907000     3.968000  0.2747000     4.258000  0.2646000     -0.2907000     0.3814000 
1 1 1 1  27 5  o 5.340000  0.1643000     5.258000  0.2340000     5.423000  0.2306000     -0.1651000     0.3285000 
1 1 1 1  27 6  o 11.46000  0.1440000     11.48000  0.2028000     11.44000  0.2046000     0.3344000E-01  0.2881000 
1 1 1 1  27 7  o 6.331000  0.1598000     6.241000  0.2263000     6.422000  0.2258000     -0.1805000     0.3196000 
1 1 1 1  27 8  o 22.62000  0.2037000     22.73000  0.2891000     22.52000  0.2869000     0.2117000      0.4073000 
1 1 1 1  27 9  o 15.21000  0.1677000     15.09000  0.2363000     15.32000  0.2380000     -0.2292000     0.3354000 
1 1 1 1  27 10 o 14.34000  0.1675000     14.49000  0.2382000     14.19000  0.2355000     0.2963000      0.3349000 
1 1 1 1  27 11 o 4.237000  0.3768000     4.565000  0.4963000     3.908000  0.5671000     0.6568000      0.7536000 
1 1 1 1  27 12 o 9.695000  0.1803000     9.361000  0.2606000     10.03000  0.2492000     -0.6686000     0.3606000 
1 1 1 1  27 13 o 3.541000  0.3581000     3.488000  0.5252000     3.594000  0.4870000     -0.1064000     0.7163000 
1 1 1 1  27 14 o 4.406000  0.3003000     4.487000  0.4158000     4.324000  0.4334000     0.1632000      0.6006000 
1 1 1 1  27 15 o 6.322000  0.2542000     5.971000  0.3704000     6.673000  0.3483000     -0.7014000     0.5085000 
1 1 1 1  27 16 o 2.186000  0.5781000     1.839000  0.7830000     2.533000  0.8508000     -0.6943000     1.156000  
1 1 1 1  27 17 o 2.740000  0.9552000     2.740000  0.9552000     ?         ?             ?              ?         
1 1 1 1  27 18 o 2.604000  0.5940000     2.011000  0.8338000     3.198000  0.8464000     -1.187000      1.188000  
1 1 1 1  27 19 o 7.003000  0.3067000     7.069000  0.4203000     6.938000  0.4467000     0.1306000      0.6134000 
1 1 1 1  27 20 o 2.439000  0.5414000     1.938000  0.7701000     2.940000  0.7612000     -1.002000      1.083000  
1 1 1 1  27 21 o 2.458000  0.5648000     2.367000  0.8150000     2.549000  0.7820000     -0.1815000     1.130000  
1 1 1 1  27 22 o 1.825000  0.5098000     2.284000  0.7960000     1.365000  0.6370000     0.9189000      1.020000  
1 1 1 1  27 23 o 1.167000  0.4010000     1.282000  0.6098000     1.051000  0.5209000     0.2312000      0.8020000 
1 1 1 1  27 24 o 1.394000  0.4379000     1.001000  0.4991000     1.788000  0.7197000     -0.7874000     0.8758000 
1 1 1 1  27 25 o 1.359000  0.4427000     1.413000  0.6426000     1.305000  0.6091000     0.1084000      0.8854000 
1 1 1 1  28 0  o 13.97000  0.2099000     13.97000  0.2099000     13.97000  0.2099000     0.000000       0.000000  
1 1 1 1  28 1  o 11.85000  0.1399000     12.21000  0.1996000     11.49000  0.1962000     0.7191000      0.2798000 
1 1 1 1  28 2  o 5.917000  0.1526000     5.875000  0.2199000     5.960000  0.2116000     -0.8499000E-01 0.3051000 
1 1 1 1  28 3  o 9.054000  0.1384000     9.003000  0.1964000     9.105000  0.1951000     -0.1022000     0.2769000 
1 1 1 1  28 4  o 4.787000  0.1752000     4.869000  0.2446000     4.705000  0.2510000     0.1640000      0.3505000 
1 1 1 1  28 5  o 19.07000  0.1783000     19.00000  0.2516000     19.15000  0.2527000     -0.1541000     0.3566000 
1 1 1 1  28 6  o 3.739000  0.2169000     3.790000  0.3021000     3.689000  0.3113000     0.1012000      0.4338000 
1 1 1 1  28 7  o 8.398000  0.1493000     8.139000  0.2135000     8.658000  0.2089000     -0.5195000     0.2987000 
1 1 1 1  28 8  o 7.347000  0.1599000     7.308000  0.2272000     7.387000  0.2252000     -0.7890000E-01 0.3199000 
1 1 1 1  28 9  f 3.335000  0.2870000     3.612000  0.3750000     3.057000  0.4347000     0.5545000      0.5741000 
1 1 1 1  28 10 f 17.27000  0.2597000     17.20000  0.3661000     17.33000  0.3686000     -0.1217000     0.5195000 
1 1 1 1  28 11 o 9.025000  0.1734000     8.983000  0.2483000     9.067000  0.2422000     -0.8404000E-01 0.3468000 
1 1 1 1  28 12 o 6.304000  0.2229000     6.321000  0.3191000     6.288000  0.3113000     0.3249000E-01  0.4458000 
1 1 1 1  28 13 o 5.148000  0.2626000     5.244000  0.3575000     5.053000  0.3848000     0.1906000      0.5252000 
1 1 1 1  28 14 o 7.731000  0.2144000     7.622000  0.3014000     7.841000  0.3050000     -0.2194000     0.4288000 
1 1 1 1  28 15 o 3.576000  0.4263000     3.585000  0.6061000     3.567000  0.5996000     0.1732000E-01  0.8526000 
1 1 1 1  28 16 o 2.296000  0.5420000     1.833000  0.7566000     2.759000  0.7762000     -0.9263000     1.084000  
1 1 1 1  28 17 o 3.290000  0.8516000     3.929000  1.304000      2.652000  1.096000      1.278000       1.703000  
1 1 1 1  28 18 o 6.107000  0.3579000     5.730000  0.5399000     6.483000  0.4699000     -0.7528000     0.7157000 
1 1 1 1  28 19 o 3.187000  0.5361000     2.263000  0.8354000     4.111000  0.6721000     -1.848000      1.072000  
1 1 1 1  28 20 o 3.699000  0.4684000     3.112000  0.7562000     4.287000  0.5529000     -1.175000      0.9367000 
1 1 1 1  28 21 o 3.013000  0.5305000     2.864000  0.7759000     3.163000  0.7237000     -0.2993000     1.061000  
1 1 1 1  28 22 o 2.122000  0.5478000     2.608000  0.8074000     1.636000  0.7405000     0.9719000      1.096000  
1 1 1 1  28 23 o 1.315000  0.4343000     1.492000  0.6677000     1.139000  0.5556000     0.3527000      0.8686000 
1 1 1 1  28 24 o 1.167000  0.3974000     1.040000  0.5131000     1.295000  0.6069000     -0.2553000     0.7947000 
1 1 1 1  28 25 o 1.409000  0.4461000     1.641000  0.6888000     1.177000  0.5672000     0.4641000      0.8922000 
1 1 1 1  29 0  o 7.138000  0.2004000     7.138000  0.2004000     7.138000  0.2004000     -0.000000      0.000000  
1 1 1 1  29 1  o 9.356000  0.1388000     9.242000  0.1963000     9.470000  0.1963000     -0.2276000     0.2776000 
1 1 1 1  29 2  o 6.510000  0.1496000     6.471000  0.2109000     6.549000  0.2121000     -0.7763000E-01 0.2991000 
1 1 1 1  29 3  o 6.959000  0.1457000     6.900000  0.2069000     7.018000  0.2053000     -0.1177000     0.2915000 
1 1 1 1  29 4  o 8.059000  0.1430000     8.243000  0.2002000     7.876000  0.2041000     0.3670000      0.2859000 
1 1 1 1  29 5  o 11.81000  0.1611000     12.02000  0.2093000     11.59000  0.2449000     0.4338000      0.3222000 
1 1 1 1  29 6  o 7.958000  0.1515000     7.934000  0.2152000     7.982000  0.2134000     -0.4754000E-01 0.3031000 
1 1 1 1  29 7  o 5.577000  0.1785000     5.636000  0.2528000     5.517000  0.2522000     0.1190000      0.3571000 
1 1 1 1  29 8  o 7.678000  0.1609000     7.541000  0.2295000     7.815000  0.2256000     -0.2742000     0.3218000 
1 1 1 1  29 9  f 16.53000  0.1753000     16.47000  0.2480000     16.59000  0.2479000     -0.1199000     0.3506000 
1 1 1 1  29 10 o 11.45000  0.3102000     11.06000  0.3332000     11.85000  0.5234000     -0.7911000     0.6205000 
1 1 1 1  29 11 o 23.13000  0.2160000     22.87000  0.3041000     23.40000  0.3069000     -0.5291000     0.4320000 
1 1 1 1  29 12 o 6.153000  0.2216000     6.574000  0.3008000     5.731000  0.3255000     0.8427000      0.4432000 
1 1 1 1  29 13 o 9.235000  0.1868000     8.914000  0.2660000     9.556000  0.2622000     -0.6418000     0.3735000 
1 1 1 1  29 14 o 8.137000  0.2066000     8.111000  0.2927000     8.163000  0.2916000     -0.5125000E-01 0.4131000 
1 1 1 1  29 15 o 8.180000  0.2273000     8.390000  0.3150000     7.971000  0.3277000     0.4183000      0.4545000 
1 1 1 1  29 16 o 5.357000  0.3465000     6.172000  0.4210000     4.542000  0.5505000     1.630000       0.6931000 
1 1 1 1  29 17 o 2.478000  0.6517000     3.030000  1.031000      1.926000  0.7980000     1.104000       1.303000  
1 1 1 1  29 18 o 3.629000  0.5434000     4.118000  0.6787000     3.140000  0.8489000     0.9776000      1.087000  
1 1 1 1  29 19 o 4.312000  0.4515000     4.948000  0.5305000     3.675000  0.7308000     1.273000       0.9031000 
1 1 1 1  29 20 o 1.454000  0.4618000     1.751000  0.7301000     1.156000  0.5658000     0.5948000      0.9237000 
1 1 1 1  29 21 o 3.631000  0.4489000     3.769000  0.6245000     3.494000  0.6450000     0.2756000      0.8978000 
1 1 1 1  29 22 o 2.687000  0.9036000     2.687000  0.9036000     ?         ?             ?              ?         
1 1 1 1  29 23 o 1.373000  0.4477000     1.238000  0.5897000     1.508000  0.6739000     -0.2702000     0.8954000 
1 1 1 1  29 24 o 1.055000  0.3679000     1.002000  0.4967000     1.109000  0.5430000     -0.1064000     0.7359000 
1 1 1 1  29 25 o 1.400000  0.4484000     1.238000  0.5877000     1.561000  0.6775000     -0.3232000     0.8969000 
1 1 1 1  30 0  o 4.275000  0.2726000     4.275000  0.2726000     4.275000  0.2726000     -0.000000      0.000000  
1 1 1 1  30 1  o 3.266000  0.2279000     3.307000  0.3211000     3.226000  0.3234000     0.8088000E-01  0.4558000 
1 1 1 1  30 2  o 12.29000  0.1450000     12.39000  0.2060000     12.18000  0.2043000     0.2109000      0.2901000 
1 1 1 1  30 3  o 8.188000  0.1431000     8.133000  0.2018000     8.242000  0.2029000     -0.1095000     0.2862000 
1 1 1 1  30 4  o 17.70000  0.1720000     17.39000  0.2410000     18.00000  0.2455000     -0.6037000     0.3440000 
1 1 1 1  30 5  o 11.38000  0.1469000     11.21000  0.2076000     11.55000  0.2079000     -0.3380000     0.2939000 
1 1 1 1  30 6  o 13.61000  0.1575000     13.43000  0.2215000     13.79000  0.2239000     -0.3659000     0.3150000 
1 1 1 1  30 7  o 9.306000  0.1542000     9.259000  0.2180000     9.354000  0.2180000     -0.9457000E-01 0.3083000 
1 1 1 1  30 8  o 10.10000  0.1567000     9.916000  0.2211000     10.29000  0.2220000     -0.3719000     0.3133000 
1 1 1 1  30 9  o 18.01000  0.2627000     17.60000  0.3678000     18.41000  0.3752000     -0.8168000     0.5254000 
1 1 1 1  30 10 o 1.680000  0.4367000     1.543000  0.6069000     1.817000  0.6281000     -0.2744000     0.8734000 
1 1 1 1  30 11 o 11.21000  0.1743000     11.04000  0.2490000     11.38000  0.2439000     -0.3332000     0.3486000 
1 1 1 1  30 12 o 7.194000  0.2008000     7.141000  0.2851000     7.246000  0.2830000     -0.1056000     0.4017000 
1 1 1 1  30 13 o 11.80000  0.1833000     11.83000  0.2603000     11.77000  0.2582000     0.6150000E-01  0.3666000 
1 1 1 1  30 14 o 5.398000  0.2797000     5.283000  0.4066000     5.513000  0.3842000     -0.2300000     0.5593000 
1 1 1 1  30 15 o 2.442000  0.5376000     2.078000  0.7587000     2.805000  0.7620000     -0.7269000     1.075000  
1 1 1 1  30 16 o 4.987000  0.5128000     5.404000  0.6440000     4.570000  0.7982000     0.8339000      1.026000  
1 1 1 1  30 17 o 4.414000  0.3789000     4.517000  0.5384000     4.311000  0.5332000     0.2059000      0.7577000 
1 1 1 1  30 18 o 4.348000  0.4408000     4.612000  0.5943000     4.084000  0.6512000     0.5276000      0.8817000 
1 1 1 1  30 19 o 2.559000  0.5639000     2.172000  0.8154000     2.946000  0.7790000     -0.7731000     1.128000  
1 1 1 1  30 20 o 1.985000  0.5165000     2.511000  0.7883000     1.458000  0.6676000     1.054000       1.033000  
1 1 1 1  30 21 o 1.580000  0.4891000     1.717000  0.7225000     1.443000  0.6596000     0.2742000      0.9783000 
1 1 1 1  30 22 o 1.666000  0.5692000     1.794000  0.8628000     1.538000  0.7427000     0.2565000      1.138000  
1 1 1 1  30 23 o 1.695000  0.4809000     2.109000  0.7528000     1.281000  0.5987000     0.8288000      0.9618000 
1 1 1 1  30 24 o 1.441000  0.4568000     1.506000  0.6633000     1.375000  0.6282000     0.1316000      0.9136000 
1 1 1 1  30 25 o 1.788000  0.5158000     1.976000  0.7687000     1.599000  0.6879000     0.3773000      1.032000  
1 1 1 1  31 0  o 30.52000  0.3583000     30.52000  0.3583000     30.52000  0.3583000     -0.000000      0.000000  
1 1 1 1  31 1  o 17.14000  0.1682000     17.41000  0.2400000     16.87000  0.2357000     0.5403000      0.3364000 
1 1 1 1  31 2  o 9.538000  0.1442000     9.773000  0.2040000     9.302000  0.2037000     0.4702000      0.2883000 
1 1 1 1  31 3  o 9.483000  0.1454000     9.394000  0.2050000     9.573000  0.2063000     -0.1793000     0.2908000 
1 1 1 1  31 4  o 10.00000  0.1457000     10.07000  0.2064000     9.942000  0.2058000     0.1233000      0.2915000 
1 1 1 1  31 5  o 7.504000  0.1545000     7.416000  0.2204000     7.592000  0.2166000     -0.1769000     0.3090000 
1 1 1 1  31 6  o 16.80000  0.1718000     16.65000  0.2417000     16.96000  0.2443000     -0.3138000     0.3436000 
1 1 1 1  31 7  o 19.93000  0.1898000     19.73000  0.2668000     20.13000  0.2701000     -0.3998000     0.3796000 
1 1 1 1  31 8  o 7.169000  0.1851000     7.205000  0.2782000     7.133000  0.2441000     0.7179000E-01  0.3701000 
1 1 1 1  31 9  o 9.667000  0.2309000     10.00000  0.3268000     9.333000  0.3261000     0.6694000      0.4617000 
1 1 1 1  31 10 o 19.04000  0.1930000     18.77000  0.2717000     19.32000  0.2743000     -0.5459000     0.3861000 
1 1 1 1  31 11 o 9.203000  0.1815000     9.322000  0.2559000     9.084000  0.2574000     0.2382000      0.3629000 
1 1 1 1  31 12 f 7.270000  0.1995000     6.958000  0.2917000     7.583000  0.2723000     -0.6252000     0.3990000 
1 1 1 1  31 13 o 8.383000  0.1988000     8.560000  0.2828000     8.206000  0.2795000     0.3540000      0.3976000 
1 1 1 1  31 14 o 5.364000  0.2864000     5.730000  0.3869000     4.999000  0.4225000     0.7307000      0.5729000 
1 1 1 1  31 15 o 4.787000  0.3415000     4.806000  0.4763000     4.768000  0.4895000     0.3716000E-01  0.6830000 
1 1 1 1  31 16 o 2.383000  0.9314000     2.383000  0.9314000     ?         ?             ?              ?         
1 1 1 1  31 17 o 2.179000  0.5294000     1.720000  0.7273000     2.638000  0.7695000     -0.9180000     1.059000  
1 1 1 1  31 18 o 3.193000  0.5395000     3.952000  0.6701000     2.434000  0.8456000     1.518000       1.079000  
1 1 1 1  31 19 o 3.674000  0.4838000     4.007000  0.6269000     3.342000  0.7370000     0.6650000      0.9675000 
1 1 1 1  31 20 o 2.534000  0.5452000     2.620000  0.7672000     2.449000  0.7747000     0.1711000      1.090000  
1 1 1 1  31 21 o 2.247000  0.5553000     2.315000  0.7794000     2.179000  0.7911000     0.1362000      1.111000  
1 1 1 1  31 22 o 1.407000  0.4678000     1.342000  0.6635000     1.473000  0.6598000     -0.1309000     0.9357000 
1 1 1 1  31 23 o 1.843000  0.5160000     1.911000  0.7288000     1.775000  0.7306000     0.1358000      1.032000  
1 1 1 1  31 24 o 1.259000  0.4194000     1.109000  0.5398000     1.408000  0.6419000     -0.2998000     0.8387000 
1 1 1 1  32 0  o 18.66000  0.2514000     18.66000  0.2514000     18.66000  0.2514000     0.000000       0.000000  
1 1 1 1  32 1  o 9.313000  0.1450000     9.269000  0.2055000     9.358000  0.2046000     -0.8871000E-01 0.2900000 
1 1 1 1  32 2  o 15.28000  0.1608000     15.05000  0.2259000     15.51000  0.2290000     -0.4560000     0.3217000 
1 1 1 1  32 3  o 1.951000  0.3557000     2.432000  0.4668000     1.470000  0.5368000     0.9620000      0.7114000 
1 1 1 1  32 4  o 5.155000  0.1841000     5.372000  0.2534000     4.938000  0.2671000     0.4335000      0.3682000 
1 1 1 1  32 5  o 3.551000  0.2448000     3.569000  0.3458000     3.533000  0.3466000     0.3537000E-01  0.4896000 
1 1 1 1  32 6  o 1.332000  0.3798000     1.534000  0.5695000     1.129000  0.5027000     0.4048000      0.7596000 
1 1 1 1  32 7  o 8.554000  0.1605000     8.710000  0.2257000     8.397000  0.2282000     0.3126000      0.3209000 
1 1 1 1  32 9  f 15.60000  0.1759000     15.94000  0.2509000     15.26000  0.2465000     0.6765000      0.3517000 
1 1 1 1  32 10 o 13.73000  0.1739000     13.37000  0.2448000     14.09000  0.2470000     -0.7167000     0.3477000 
1 1 1 1  32 11 o 5.351000  0.2332000     5.785000  0.3110000     4.918000  0.3476000     0.8669000      0.4665000 
1 1 1 1  32 12 o 7.898000  0.1938000     8.187000  0.2698000     7.609000  0.2784000     0.5779000      0.3877000 
1 1 1 1  32 13 o 3.751000  0.3529000     4.013000  0.4796000     3.488000  0.5178000     0.5245000      0.7057000 
1 1 1 1  32 14 o 5.430000  0.2922000     5.375000  0.4257000     5.485000  0.4003000     -0.1104000     0.5844000 
1 1 1 1  32 15 o 5.786000  0.2932000     6.050000  0.3986000     5.521000  0.4301000     0.5289000      0.5864000 
1 1 1 1  32 16 o 4.732000  0.4568000     4.432000  0.7849000     5.031000  0.4676000     -0.5987000     0.9136000 
1 1 1 1  32 17 o 6.278000  0.2816000     6.405000  0.3944000     6.151000  0.4021000     0.2531000      0.5633000 
1 1 1 1  32 18 o 3.644000  0.4449000     2.773000  0.7246000     4.515000  0.5165000     -1.742000      0.8899000 
1 1 1 1  32 19 f 2.337000  0.5749000     2.523000  0.8254000     2.151000  0.8004000     0.3724000      1.150000  
1 1 1 1  32 20 o 3.003000  0.5306000     3.382000  0.7226000     2.624000  0.7773000     0.7586000      1.061000  
1 1 1 1  32 21 o 2.503000  0.5796000     2.645000  0.8222000     2.360000  0.8171000     0.2850000      1.159000  
1 1 1 1  32 22 o 1.433000  0.4588000     1.565000  0.6833000     1.302000  0.6125000     0.2629000      0.9176000 
1 1 1 1  32 23 o 1.586000  0.4862000     1.559000  0.6835000     1.613000  0.6916000     -0.5403000E-01 0.9723000 
1 1 1 1  32 24 o 2.586000  0.5379000     2.471000  0.7659000     2.701000  0.7554000     -0.2301000     1.076000  
1 1 1 1  33 0  o 13.81000  0.2206000     13.81000  0.2206000     13.81000  0.2206000     -0.000000      0.000000  
1 1 1 1  33 1  o 21.22000  0.1942000     21.26000  0.2750000     21.19000  0.2742000     0.6757000E-01  0.3884000 
1 1 1 1  33 2  o 13.47000  0.1564000     13.45000  0.2221000     13.49000  0.2204000     -0.4551000E-01 0.3129000 
1 1 1 1  33 3  o 6.828000  0.1612000     6.656000  0.2307000     7.000000  0.2251000     -0.3439000     0.3223000 
1 1 1 1  33 4  o 15.40000  0.1650000     15.16000  0.2320000     15.64000  0.2347000     -0.4772000     0.3300000 
1 1 1 1  33 5  o 13.81000  0.1604000     13.81000  0.2264000     13.81000  0.2273000     -0.3519000E-03 0.3208000 
1 1 1 1  33 6  o 14.65000  0.1657000     14.62000  0.2347000     14.67000  0.2340000     -0.5238000E-01 0.3314000 
1 1 1 1  33 7  o 4.868000  0.3168000     5.042000  0.4260000     4.694000  0.4689000     0.3482000      0.6335000 
1 1 1 1  33 8  o 16.27000  0.2170000     16.42000  0.3535000     16.12000  0.2516000     0.2943000      0.4339000 
1 1 1 1  33 9  o 4.170000  0.3088000     3.591000  0.4954000     4.748000  0.3688000     -1.157000      0.6176000 
1 1 1 1  33 10 o 9.532000  0.1765000     9.467000  0.2502000     9.596000  0.2488000     -0.1292000     0.3529000 
1 1 1 1  33 11 o 5.337000  0.2389000     5.266000  0.3489000     5.407000  0.3263000     -0.1409000     0.4777000 
1 1 1 1  33 12 o 4.704000  0.2768000     4.275000  0.4215000     5.134000  0.3589000     -0.8590000     0.5536000 
1 1 1 1  33 13 o 7.677000  0.2364000     7.866000  0.2984000     7.487000  0.3666000     0.3786000      0.4727000 
1 1 1 1  33 14 o 3.698000  0.4146000     3.653000  0.5969000     3.744000  0.5755000     -0.9079000E-01 0.8292000 
1 1 1 1  33 15 o 3.420000  0.6095000     3.811000  0.8024000     3.028000  0.9175000     0.7822000      1.219000  
1 1 1 1  33 16 o 2.906000  0.5341000     2.851000  0.7770000     2.961000  0.7331000     -0.1094000     1.068000  
1 1 1 1  33 17 f 2.486000  0.5441000     2.594000  0.7679000     2.377000  0.7710000     0.2174000      1.088000  
1 1 1 1  33 18 o 2.987000  0.5049000     3.007000  0.7190000     2.967000  0.7091000     0.3975000E-01  1.010000  
1 1 1 1  33 19 o 3.408000  0.4993000     3.223000  0.7271000     3.593000  0.6844000     -0.3702000     0.9985000 
1 1 1 1  33 20 o 2.439000  0.5370000     2.139000  0.7759000     2.739000  0.7426000     -0.6002000     1.074000  
1 1 1 1  33 21 o 1.607000  0.7335000     1.607000  0.7335000     ?         ?             ?              ?         
1 1 1 1  33 22 o 2.940000  0.4946000     3.368000  0.6487000     2.512000  0.7468000     0.8561000      0.9892000 
1 1 1 1  33 23 o 2.009000  0.5275000     1.842000  0.7351000     2.175000  0.7567000     -0.3332000     1.055000  
1 1 1 1  33 24 o 1.154000  0.3941000     1.164000  0.5589000     1.144000  0.5559000     0.1931000E-01  0.7882000 
1 1 1 1  34 0  o 1.464000  0.6813000     1.464000  0.6813000     1.464000  0.6813000     -0.000000      0.000000  
1 1 1 1  34 1  o 24.41000  0.2153000     24.15000  0.3022000     24.67000  0.3067000     -0.5240000     0.4306000 
1 1 1 1  34 2  o 4.586000  0.2030000     4.629000  0.2859000     4.543000  0.2882000     0.8542000E-01  0.4059000 
1 1 1 1  34 3  o 13.44000  0.1582000     13.52000  0.2243000     13.36000  0.2230000     0.1645000      0.3163000 
1 1 1 1  34 4  o 18.46000  0.1809000     18.56000  0.2563000     18.36000  0.2554000     0.2025000      0.3618000 
1 1 1 1  34 5  o 9.482000  0.1575000     9.240000  0.2219000     9.723000  0.2235000     -0.4833000     0.3149000 
1 1 1 1  34 6  o 11.54000  0.2302000     11.68000  0.3222000     11.41000  0.3288000     0.2784000      0.4603000 
1 1 1 1  34 7  o 2.333000  0.4610000     3.020000  0.6391000     1.647000  0.6645000     1.373000       0.9220000 
1 1 1 1  34 8  f 18.80000  0.1891000     18.63000  0.2675000     18.97000  0.2674000     -0.3478000     0.3783000 
1 1 1 1  34 9  f 7.655000  0.1812000     7.671000  0.2564000     7.640000  0.2562000     0.3154000E-01  0.3625000 
1 1 1 1  34 10 f 9.161000  0.1772000     9.259000  0.2488000     9.063000  0.2524000     0.1963000      0.3544000 
1 1 1 1  34 11 o 5.959000  0.2247000     5.938000  0.3214000     5.980000  0.3142000     -0.4173000E-01 0.4495000 
1 1 1 1  34 12 o 9.013000  0.1934000     9.246000  0.2711000     8.780000  0.2759000     0.4665000      0.3868000 
1 1 1 1  34 13 o 7.874000  0.2186000     7.789000  0.3140000     7.960000  0.3042000     -0.1704000     0.4372000 
1 1 1 1  34 14 o 2.236000  0.5659000     2.117000  0.7702000     2.355000  0.8293000     -0.2388000     1.132000  
1 1 1 1  34 15 o 2.864000  0.6571000     3.417000  0.9204000     2.312000  0.9381000     1.105000       1.314000  
1 1 1 1  34 16 o 1.819000  0.5168000     1.574000  0.6942000     2.064000  0.7658000     -0.4901000     1.034000  
1 1 1 1  34 17 o 2.027000  0.5337000     2.045000  0.7575000     2.010000  0.7522000     0.3502000E-01  1.067000  
1 1 1 1  34 18 o 1.296000  0.4301000     1.153000  0.5591000     1.440000  0.6537000     -0.2872000     0.8602000 
1 1 1 1  34 19 o 2.297000  0.5465000     2.593000  0.7681000     2.001000  0.7777000     0.5919000      1.093000  
1 1 1 1  34 20 o 1.949000  0.5141000     1.510000  0.6753000     2.387000  0.7753000     -0.8777000     1.028000  
1 1 1 1  34 21 o 2.218000  0.6904000     2.635000  1.110000      1.801000  0.8219000     0.8341000      1.381000  
1 1 1 1  34 22 o 3.472000  0.4661000     3.040000  0.7310000     3.903000  0.5786000     -0.8629000     0.9323000 
1 1 1 1  34 23 o 1.492000  0.4709000     1.594000  0.6939000     1.390000  0.6370000     0.2043000      0.9419000 
1 1 1 1  34 24 o 1.429000  0.4567000     1.532000  0.6741000     1.325000  0.6164000     0.2068000      0.9134000 
1 1 1 1  35 0  o 22.49000  0.2887000     22.49000  0.2887000     22.49000  0.2887000     -0.000000      0.000000  
1 1 1 1  35 1  o 20.09000  0.1900000     20.08000  0.2688000     20.10000  0.2685000     -0.2027000E-01 0.3800000 
1 1 1 1  35 2  o 6.086000  0.1783000     6.367000  0.2453000     5.805000  0.2588000     0.5625000      0.3565000 
1 1 1 1  35 3  o 10.03000  0.1548000     10.24000  0.2191000     9.823000  0.2187000     0.4121000      0.3096000 
1 1 1 1  35 4  o 16.40000  0.1722000     16.41000  0.2433000     16.39000  0.2438000     0.1924000E-01  0.3445000 
1 1 1 1  35 5  o 7.470000  0.2449000     7.660000  0.3422000     7.280000  0.3505000     0.3796000      0.4899000 
1 1 1 1  35 6  o 1.986000  0.4876000     1.754000  0.6775000     2.218000  0.7014000     -0.4638000     0.9752000 
1 1 1 1  35 7  o 2.460000  0.3916000     2.836000  0.5086000     2.084000  0.5956000     0.7520000      0.7832000 
1 1 1 1  35 8  o 17.77000  0.1856000     17.34000  0.2602000     18.19000  0.2647000     -0.8521000     0.3712000 
1 1 1 1  35 9  o 16.97000  0.1832000     16.85000  0.2593000     17.08000  0.2589000     -0.2273000     0.3665000 
1 1 1 1  35 10 o 2.849000  0.4014000     2.952000  0.5551000     2.746000  0.5800000     0.2055000      0.8029000 
1 1 1 1  35 11 f 5.369000  0.2459000     5.372000  0.3515000     5.366000  0.3438000     0.6628000E-02  0.4917000 
1 1 1 1  35 12 o 5.983000  0.2455000     5.963000  0.3467000     6.003000  0.3476000     -0.3987000E-01 0.4910000 
1 1 1 1  35 13 o 5.273000  0.2979000     5.316000  0.4236000     5.229000  0.4191000     0.8633000E-01  0.5958000 
1 1 1 1  35 14 o 4.815000  0.4732000     5.432000  0.5784000     4.199000  0.7491000     1.233000       0.9464000 
1 1 1 1  35 15 o 11.64000  0.2079000     11.40000  0.2948000     11.87000  0.2931000     -0.4771000     0.4157000 
1 1 1 1  35 16 f 3.277000  0.4813000     3.302000  0.6854000     3.253000  0.6759000     0.4927000E-01  0.9626000 
1 1 1 1  35 17 o 1.914000  0.5215000     1.958000  0.7450000     1.870000  0.7301000     0.8815000E-01  1.043000  
1 1 1 1  35 18 o 1.996000  0.5150000     2.251000  0.7408000     1.742000  0.7156000     0.5093000      1.030000  
1 1 1 1  35 19 o 2.946000  0.4683000     2.140000  0.7448000     3.753000  0.5678000     -1.613000      0.9366000 
1 1 1 1  35 20 o 1.345000  0.4420000     1.248000  0.5953000     1.442000  0.6534000     -0.1940000     0.8840000 
1 1 1 1  35 21 o 1.541000  0.4736000     1.298000  0.6303000     1.785000  0.7070000     -0.4863000     0.9472000 
1 1 1 1  35 22 o 2.110000  0.5131000     1.629000  0.6952000     2.590000  0.7550000     -0.9608000     1.026000  
1 1 1 1  35 23 o 2.583000  0.5288000     2.857000  0.7179000     2.308000  0.7765000     0.5495000      1.058000  
1 1 1 1  36 0  o 37.84000  0.4360000     37.84000  0.4360000     37.84000  0.4360000     -0.000000      0.000000  
1 1 1 1  36 1  o 11.36000  0.1564000     11.39000  0.2222000     11.33000  0.2200000     0.6664000E-01  0.3127000 
1 1 1 1  36 2  o 20.56000  0.1942000     20.57000  0.2749000     20.55000  0.2744000     0.2416000E-01  0.3884000 
1 1 1 1  36 3  o 30.22000  0.3640000     30.19000  0.5143000     30.25000  0.5151000     -0.6233000E-01 0.7279000 
1 1 1 1  36 4  o 4.776000  0.6746000     4.776000  0.6746000     ?         ?             ?              ?         
1 1 1 1  36 5  o 22.42000  0.2925000     22.55000  0.4156000     22.29000  0.4117000     0.2537000      0.5850000 
1 1 1 1  36 6  o 7.111000  0.1825000     6.907000  0.2644000     7.314000  0.2517000     -0.4070000     0.3651000 
1 1 1 1  36 7  o 11.21000  0.1672000     11.46000  0.2374000     10.96000  0.2355000     0.5000000      0.3344000 
1 1 1 1  36 8  o 17.31000  0.1971000     17.40000  0.2962000     17.22000  0.2602000     0.1815000      0.3943000 
1 1 1 1  36 9  o 12.25000  0.1719000     12.32000  0.2429000     12.17000  0.2432000     0.1475000      0.3437000 
1 1 1 1  36 10 o 6.559000  0.2055000     6.330000  0.2937000     6.787000  0.2873000     -0.4577000     0.4109000 
1 1 1 1  36 11 o 6.688000  0.2192000     6.967000  0.3009000     6.409000  0.3189000     0.5572000      0.4384000 
1 1 1 1  36 12 o 2.015000  0.5064000     1.952000  0.7109000     2.078000  0.7214000     -0.1252000     1.013000  
1 1 1 1  36 13 o 9.616000  0.2095000     9.573000  0.2956000     9.659000  0.2969000     -0.8615000E-01 0.4189000 
1 1 1 1  36 14 o 2.270000  1.041000      2.270000  1.041000      ?         ?             ?              ?         
1 1 1 1  36 15 o 4.158000  0.3940000     4.348000  0.5362000     3.968000  0.5775000     0.3799000      0.7881000 
1 1 1 1  36 16 o 5.590000  0.2945000     5.511000  0.4161000     5.668000  0.4168000     -0.1567000     0.5890000 
1 1 1 1  36 17 o 1.578000  0.4806000     1.332000  0.6195000     1.824000  0.7348000     -0.4925000     0.9611000 
1 1 1 1  36 18 o 2.219000  0.5317000     2.142000  0.7583000     2.297000  0.7454000     -0.1555000     1.063000  
1 1 1 1  36 19 o 1.965000  0.4993000     2.294000  0.7283000     1.636000  0.6833000     0.6580000      0.9986000 
1 1 1 1  36 20 o 1.960000  0.5724000     1.677000  0.7512000     2.242000  0.8638000     -0.5649000     1.145000  
1 1 1 1  36 21 o 1.453000  0.4575000     1.480000  0.6548000     1.427000  0.6390000     0.5312000E-01  0.9149000 
1 1 1 1  36 22 o 1.395000  0.4516000     1.486000  0.6672000     1.304000  0.6089000     0.1820000      0.9033000 
1 1 1 1  36 23 o 2.047000  0.5218000     1.814000  0.7162000     2.280000  0.7591000     -0.4666000     1.044000  
1 1 1 1  37 0  o 26.80000  0.4692000     26.80000  0.4692000     26.80000  0.4692000     0.000000       0.000000  
1 1 1 1  37 1  o 14.52000  0.2388000     14.64000  0.3377000     14.40000  0.3378000     0.2385000      0.4777000 
1 1 1 1  37 3  o 19.26000  0.2671000     19.16000  0.3769000     19.37000  0.3786000     -0.2039000     0.5342000 
1 1 1 1  37 4  o 15.72000  0.2136000     16.11000  0.3489000     15.33000  0.2464000     0.7737000      0.4272000 
1 1 1 1  37 5  o 11.43000  0.1641000     11.62000  0.2319000     11.23000  0.2322000     0.3827000      0.3282000 
1 1 1 1  37 6  o 5.675000  0.2117000     5.303000  0.3096000     6.048000  0.2888000     -0.7450000     0.4234000 
1 1 1 1  37 7  o 11.23000  0.1697000     11.01000  0.2423000     11.45000  0.2377000     -0.4324000     0.3394000 
1 1 1 1  37 8  o 16.66000  0.1820000     16.38000  0.2556000     16.94000  0.2593000     -0.5606000     0.3641000 
1 1 1 1  37 9  o 18.06000  0.2024000     17.84000  0.3021000     18.28000  0.2696000     -0.4354000     0.4049000 
1 1 1 1  37 10 o 15.44000  0.1822000     15.58000  0.2587000     15.31000  0.2565000     0.2672000      0.3643000 
1 1 1 1  37 11 o 10.92000  0.1881000     11.07000  0.2645000     10.78000  0.2675000     0.2874000      0.3762000 
1 1 1 1  37 12 o 2.172000  0.5084000     2.512000  0.7189000     1.832000  0.7191000     0.6801000      1.017000  
1 1 1 1  37 13 o 4.914000  0.3987000     5.071000  0.6145000     4.757000  0.5080000     0.3147000      0.7973000 
1 1 1 1  37 14 o 11.57000  0.2484000     11.49000  0.4032000     11.65000  0.2903000     -0.1606000     0.4968000 
1 1 1 1  37 15 f 4.022000  0.3927000     4.352000  0.5099000     3.691000  0.5974000     0.6614000      0.7854000 
1 1 1 1  37 16 o 3.805000  0.4161000     3.753000  0.6228000     3.857000  0.5520000     -0.1045000     0.8322000 
1 1 1 1  37 17 o 2.961000  0.4961000     2.571000  0.7604000     3.351000  0.6374000     -0.7791000     0.9923000 
1 1 1 1  37 18 o 1.654000  0.4876000     1.640000  0.6915000     1.667000  0.6878000     -0.2641000E-01 0.9753000 
1 1 1 1  37 19 o 2.019000  0.5089000     2.117000  0.7285000     1.922000  0.7108000     0.1948000      1.018000  
1 1 1 1  37 20 o 2.152000  0.8050000     2.152000  0.8050000     ?         ?             ?              ?         
1 1 1 1  37 21 o 1.465000  0.4647000     1.367000  0.6279000     1.563000  0.6852000     -0.1962000     0.9294000 
1 1 1 1  37 22 o 1.549000  0.4751000     1.368000  0.6284000     1.730000  0.7128000     -0.3623000     0.9502000 
1 1 1 1  37 23 o 1.426000  0.4533000     1.592000  0.6814000     1.261000  0.5979000     0.3308000      0.9065000 
1 1 1 1  38 0  o 10.21000  0.3141000     10.21000  0.3141000     10.21000  0.3141000     0.000000       0.000000  
1 1 1 1  38 1  f 12.87000  0.2271000     12.91000  0.3205000     12.82000  0.3217000     0.8987000E-01  0.4541000 
1 1 1 1  38 2  o 8.605000  0.1669000     8.922000  0.2346000     8.287000  0.2374000     0.6350000      0.3337000 
1 1 1 1  38 3  o 9.300000  0.1658000     9.200000  0.2356000     9.399000  0.2332000     -0.1991000     0.3315000 
1 1 1 1  38 4  o 21.67000  0.2042000     21.54000  0.2877000     21.81000  0.2899000     -0.2693000     0.4084000 
1 1 1 1  38 5  f 2.645000  0.3812000     2.745000  0.5263000     2.546000  0.5517000     0.1993000      0.7625000 
1 1 1 1  38 6  o 16.36000  0.1800000     16.30000  0.2548000     16.43000  0.2544000     -0.1334000     0.3600000 
1 1 1 1  38 7  o 18.27000  0.1894000     18.11000  0.2678000     18.44000  0.2679000     -0.3276000     0.3788000 
1 1 1 1  38 8  f 11.30000  0.1709000     11.44000  0.2423000     11.16000  0.2411000     0.2767000      0.3418000 
1 1 1 1  38 9  o 18.19000  0.1920000     18.19000  0.2723000     18.19000  0.2708000     0.4038000E-02  0.3840000 
1 1 1 1  38 10 o 2.051000  0.4739000     2.045000  0.6675000     2.057000  0.6729000     -0.1249000E-01 0.9479000 
1 1 1 1  38 11 o 9.385000  0.1974000     9.405000  0.2804000     9.365000  0.2780000     0.3952000E-01  0.3948000 
1 1 1 1  38 12 o 8.142000  0.2190000     8.189000  0.3066000     8.096000  0.3128000     0.9324000E-01  0.4380000 
1 1 1 1  38 14 o 7.766000  0.2375000     8.157000  0.3337000     7.376000  0.3381000     0.7804000      0.4750000 
1 1 1 1  38 15 o 2.182000  0.5343000     2.147000  0.7537000     2.218000  0.7577000     -0.7160000E-01 1.069000  
1 1 1 1  38 16 o 2.226000  0.5381000     1.974000  0.7505000     2.478000  0.7713000     -0.5044000     1.076000  
1 1 1 1  38 17 o 2.482000  0.5205000     2.664000  0.7309000     2.300000  0.7412000     0.3640000      1.041000  
1 1 1 1  38 18 o 2.015000  0.4871000     2.607000  0.7314000     1.423000  0.6435000     1.185000       0.9742000 
1 1 1 1  38 19 o 1.854000  0.4942000     2.110000  0.7299000     1.599000  0.6666000     0.5111000      0.9885000 
1 1 1 1  38 20 o 2.490000  0.5239000     2.201000  0.8090000     2.779000  0.6660000     -0.5777000     1.048000  
1 1 1 1  38 21 o 1.312000  0.4335000     1.303000  0.6089000     1.321000  0.6172000     -0.1786000E-01 0.8670000 
1 1 1 1  38 22 o 1.491000  0.4651000     1.430000  0.6420000     1.551000  0.6732000     -0.1210000     0.9302000 
1 1 1 1  38 23 o 1.240000  0.4144000     1.362000  0.6254000     1.118000  0.5440000     0.2438000      0.8289000 
1 1 1 1  39 0  o 20.20000  0.2761000     20.20000  0.2761000     20.20000  0.2761000     0.000000       0.000000  
1 1 1 1  39 1  o 12.42000  0.1643000     12.40000  0.2336000     12.44000  0.2310000     -0.4080000E-01 0.3285000 
1 1 1 1  39 2  o 15.54000  0.1735000     15.51000  0.2456000     15.58000  0.2452000     -0.7106000E-01 0.3471000 
1 1 1 1  39 3  o 10.45000  0.1645000     10.51000  0.2307000     10.38000  0.2347000     0.1306000      0.3291000 
1 1 1 1  39 4  o 29.50000  0.2541000     29.51000  0.3598000     29.50000  0.3589000     0.1055000E-01  0.5082000 
1 1 1 1  39 5  o 6.772000  0.1906000     7.039000  0.2653000     6.505000  0.2739000     0.5339000      0.3813000 
1 1 1 1  39 6  o 21.74000  0.2064000     21.98000  0.2940000     21.49000  0.2897000     0.4915000      0.4128000 
1 1 1 1  39 7  o 4.747000  0.2452000     4.994000  0.3369000     4.499000  0.3562000     0.4957000      0.4903000 
1 1 1 1  39 8  o 8.134000  0.1847000     8.199000  0.2602000     8.069000  0.2623000     0.1298000      0.3695000 
1 1 1 1  39 9  o 11.23000  0.1779000     11.32000  0.2505000     11.14000  0.2528000     0.1869000      0.3559000 
1 1 1 1  39 10 o 6.797000  0.2190000     6.644000  0.3129000     6.951000  0.3065000     -0.3072000     0.4380000 
1 1 1 1  39 11 o 10.68000  0.1909000     10.42000  0.2713000     10.94000  0.2687000     -0.5242000     0.3819000 
1 1 1 1  39 12 o 3.645000  0.5253000     2.793000  0.8867000     4.496000  0.5634000     -1.702000      1.051000  
1 1 1 1  39 13 o 3.416000  0.5360000     3.127000  0.8882000     3.705000  0.6003000     -0.5787000     1.072000  
1 1 1 1  39 14 o 7.436000  0.2455000     7.441000  0.3441000     7.431000  0.3501000     0.9888000E-02  0.4909000 
1 1 1 1  39 15 o 4.317000  0.3671000     4.147000  0.5430000     4.488000  0.4943000     -0.3407000     0.7343000 
1 1 1 1  39 16 o 1.486000  0.4661000     1.358000  0.6256000     1.615000  0.6910000     -0.2574000     0.9321000 
1 1 1 1  39 17 f 1.638000  0.4835000     1.295000  0.6079000     1.980000  0.7520000     -0.6850000     0.9670000 
1 1 1 1  39 18 o 2.184000  0.4744000     2.855000  0.6824000     1.512000  0.6591000     1.342000       0.9487000 
1 1 1 1  39 19 o 2.017000  0.5891000     1.829000  0.7951000     2.206000  0.8696000     -0.3777000     1.178000  
1 1 1 1  39 20 o 3.621000  0.3913000     2.980000  0.6308000     4.261000  0.4633000     -1.282000      0.7827000 
1 1 1 1  39 21 o 2.091000  0.5290000     1.830000  0.7325000     2.352000  0.7635000     -0.5221000     1.058000  
1 1 1 1  39 22 o 1.174000  0.3976000     1.242000  0.5844000     1.106000  0.5393000     0.1362000      0.7953000 
1 1 1 1  40 0  o 22.85000  0.3002000     22.85000  0.3002000     22.85000  0.3002000     -0.000000      0.000000  
1 1 1 1  40 1  o 19.98000  0.1958000     20.12000  0.2779000     19.85000  0.2760000     0.2674000      0.3917000 
1 1 1 1  40 2  o 1.783000  0.4230000     2.112000  0.6105000     1.454000  0.5855000     0.6575000      0.8459000 
1 1 1 1  40 3  o 9.230000  0.1703000     9.087000  0.2427000     9.373000  0.2391000     -0.2869000     0.3407000 
1 1 1 1  40 4  o 6.967000  0.1872000     6.934000  0.2667000     7.000000  0.2628000     -0.6600000E-01 0.3744000 
1 1 1 1  40 5  o 9.805000  0.1702000     9.807000  0.2404000     9.803000  0.2411000     0.3999000E-02  0.3405000 
1 1 1 1  40 6  o 4.573000  0.2489000     4.853000  0.3319000     4.292000  0.3710000     0.5613000      0.4978000 
1 1 1 1  40 7  o 7.496000  0.1926000     7.791000  0.2666000     7.201000  0.2780000     0.5903000      0.3852000 
1 1 1 1  40 8  f 1.417000  0.4077000     1.819000  0.6523000     1.015000  0.4892000     0.8035000      0.8154000 
1 1 1 1  40 9  o 3.691000  0.3393000     3.642000  0.4909000     3.739000  0.4685000     -0.9713000E-01 0.6786000 
1 1 1 1  40 10 o 7.309000  0.2151000     7.398000  0.3067000     7.220000  0.3016000     0.1780000      0.4301000 
1 1 1 1  40 11 o 5.845000  0.2819000     5.169000  0.3878000     6.522000  0.4093000     -1.353000      0.5639000 
1 1 1 1  40 12 f 2.290000  1.024000      2.290000  1.024000      ?         ?             ?              ?         
1 1 1 1  40 13 o 3.950000  0.3958000     3.886000  0.5626000     4.014000  0.5568000     -0.1280000     0.7915000 
1 1 1 1  40 14 o 1.682000  0.5020000     1.680000  0.7137000     1.685000  0.7061000     -0.5392000E-02 1.004000  
1 1 1 1  40 15 o 5.298000  0.3055000     5.144000  0.4551000     5.452000  0.4076000     -0.3075000     0.6110000 
1 1 1 1  40 16 o 5.423000  0.2892000     5.131000  0.4303000     5.715000  0.3865000     -0.5847000     0.5784000 
1 1 1 1  40 17 f 2.405000  0.5074000     1.826000  0.7277000     2.984000  0.7072000     -1.158000      1.015000  
1 1 1 1  40 18 o 4.111000  0.3545000     4.180000  0.4799000     4.043000  0.5219000     0.1369000      0.7090000 
1 1 1 1  40 19 o 1.099000  0.5460000     1.099000  0.5460000     ?         ?             ?              ?         
1 1 1 1  40 20 o 1.994000  0.4759000     2.391000  0.6842000     1.598000  0.6616000     0.7931000      0.9517000 
1 1 1 1  40 21 o 2.165000  0.4978000     2.278000  0.7071000     2.053000  0.7009000     0.2246000      0.9956000 
1 1 1 1  40 22 o 1.578000  0.4765000     1.354000  0.6225000     1.802000  0.7215000     -0.4483000     0.9529000 
1 1 1 1  41 0  o 6.139000  0.2865000     6.139000  0.2865000     6.139000  0.2865000     -0.000000      0.000000  
1 1 1 1  41 1  o 9.011000  0.1718000     8.825000  0.2451000     9.198000  0.2408000     -0.3732000     0.3436000 
1 1 1 1  41 2  o 8.353000  0.1756000     8.574000  0.2478000     8.131000  0.2488000     0.4424000      0.3511000 
1 1 1 1  41 3  o 13.48000  0.1852000     14.00000  0.2811000     12.95000  0.2412000     1.054000       0.3703000 
1 1 1 1  41 4  o 8.117000  0.1796000     8.018000  0.2532000     8.216000  0.2548000     -0.1975000     0.3593000 
1 1 1 1  41 5  o 6.333000  0.1986000     6.272000  0.2828000     6.394000  0.2789000     -0.1223000     0.3972000 
1 1 1 1  41 6  o 11.76000  0.1707000     11.66000  0.2426000     11.85000  0.2401000     -0.1940000     0.3413000 
1 1 1 1  41 7  o 9.235000  0.1814000     9.198000  0.2551000     9.272000  0.2580000     -0.7406000E-01 0.3628000 
1 1 1 1  41 8  o 11.03000  0.1819000     10.92000  0.2576000     11.13000  0.2568000     -0.2137000     0.3638000 
1 1 1 1  41 9  f 6.238000  0.2321000     5.843000  0.3393000     6.633000  0.3167000     -0.7904000     0.4641000 
1 1 1 1  41 10 o 15.82000  0.1929000     15.87000  0.2721000     15.78000  0.2736000     0.9312000E-01  0.3859000 
1 1 1 1  41 11 o 3.659000  0.5620000     3.935000  0.7523000     3.383000  0.8351000     0.5526000      1.124000  
1 1 1 1  41 12 o 9.153000  0.2355000     9.420000  0.3613000     8.886000  0.3022000     0.5336000      0.4711000 
1 1 1 1  41 13 o 8.031000  0.2354000     7.847000  0.3390000     8.215000  0.3266000     -0.3679000     0.4707000 
1 1 1 1  41 14 o 4.957000  0.3208000     5.080000  0.4515000     4.834000  0.4560000     0.2459000      0.6417000 
1 1 1 1  41 15 o 7.911000  0.2330000     7.864000  0.3348000     7.958000  0.3240000     -0.9376000E-01 0.4659000 
1 1 1 1  41 16 o 1.546000  0.4734000     1.667000  0.6981000     1.424000  0.6396000     0.2423000      0.9468000 
1 1 1 1  41 17 o 3.790000  0.4085000     3.803000  0.5776000     3.778000  0.5778000     0.2467000E-01  0.8169000 
1 1 1 1  41 18 o 2.937000  0.4948000     2.713000  0.7587000     3.162000  0.6353000     -0.4489000     0.9896000 
1 1 1 1  41 19 o 1.859000  0.5111000     1.877000  0.7460000     1.841000  0.6990000     0.3647000E-01  1.022000  
1 1 1 1  41 20 f 1.424000  0.4440000     1.360000  0.6115000     1.488000  0.6440000     -0.1280000     0.8881000 
1 1 1 1  41 21 o 2.305000  0.4847000     1.990000  0.7059000     2.619000  0.6645000     -0.6292000     0.9694000 
1 1 1 1  41 22 o 1.547000  0.4755000     1.492000  0.6583000     1.601000  0.6865000     -0.1092000     0.9511000 
1 1 1 1  42 0  o 6.158000  0.2861000     6.158000  0.2861000     6.158000  0.2861000     -0.000000      0.000000  
1 1 1 1  42 1  o 15.13000  0.1758000     15.32000  0.2494000     14.94000  0.2479000     0.3786000      0.3517000 
1 1 1 1  42 2  o 21.01000  0.2034000     21.33000  0.2902000     20.69000  0.2852000     0.6363000      0.4069000 
1 1 1 1  42 3  o 11.30000  0.1692000     11.46000  0.2408000     11.14000  0.2379000     0.3229000      0.3385000 
1 1 1 1  42 4  o 12.55000  0.1702000     12.49000  0.2415000     12.61000  0.2400000     -0.1271000     0.3405000 
1 1 1 1  42 5  o 11.07000  0.1723000     10.89000  0.2449000     11.26000  0.2425000     -0.3750000     0.3446000 
1 1 1 1  42 6  o 2.550000  0.4285000     2.731000  0.5850000     2.369000  0.6264000     0.3625000      0.8571000 
1 1 1 1  42 7  o 13.06000  0.1806000     12.97000  0.2545000     13.14000  0.2563000     -0.1737000     0.3612000 
1 1 1 1  42 8  f 3.762000  0.3430000     3.550000  0.4979000     3.975000  0.4719000     -0.4256000     0.6860000 
1 1 1 1  42 9  o 14.97000  0.1892000     15.31000  0.2683000     14.64000  0.2669000     0.6737000      0.3785000 
1 1 1 1  42 10 o 10.46000  0.2425000     10.73000  0.3930000     10.19000  0.2842000     0.5409000      0.4850000 
1 1 1 1  42 11 o 3.210000  0.5825000     3.132000  0.8336000     3.288000  0.8139000     -0.1557000     1.165000  
1 1 1 1  42 12 o 5.126000  0.3074000     5.366000  0.4146000     4.885000  0.4539000     0.4815000      0.6147000 
1 1 1 1  42 13 o 3.142000  0.4762000     2.275000  0.7719000     4.010000  0.5578000     -1.735000      0.9524000 
1 1 1 1  42 14 o 2.022000  0.5294000     2.040000  0.7547000     2.003000  0.7427000     0.3663000E-01  1.059000  
1 1 1 1  42 15 o 1.850000  0.5114000     2.001000  0.7409000     1.698000  0.7051000     0.3028000      1.023000  
1 1 1 1  42 16 o 2.132000  0.4777000     1.468000  0.6536000     2.797000  0.6969000     -1.329000      0.9554000 
1 1 1 1  42 17 o 3.568000  0.4199000     3.883000  0.5464000     3.253000  0.6376000     0.6299000      0.8397000 
1 1 1 1  42 18 o 1.726000  0.7703000     1.726000  0.7703000     ?         ?             ?              ?         
1 1 1 1  42 19 o 1.826000  0.4959000     1.734000  0.6888000     1.917000  0.7137000     -0.1823000     0.9919000 
1 1 1 1  42 20 o 1.609000  0.4458000     1.162000  0.5473000     2.057000  0.7039000     -0.8945000     0.8916000 
1 1 1 1  42 21 o 1.750000  0.4718000     1.473000  0.6389000     2.027000  0.6943000     -0.5543000     0.9435000 
1 1 1 1  43 0  o 1.806000  0.7711000     1.806000  0.7711000     1.806000  0.7711000     -0.000000      0.000000  
1 1 1 1  43 1  o 7.404000  0.1867000     7.466000  0.2631000     7.341000  0.2648000     0.1245000      0.3733000 
1 1 1 1  43 2  o 11.72000  0.1713000     11.91000  0.2426000     11.53000  0.2418000     0.3810000      0.3425000 
1 1 1 1  43 3  o 8.494000  0.1807000     8.724000  0.2550000     8.264000  0.2562000     0.4602000      0.3615000 
1 1 1 1  43 4  o 3.670000  0.3119000     3.398000  0.4712000     3.941000  0.4087000     -0.5430000     0.6237000 
1 1 1 1  43 5  o 2.075000  0.4517000     2.447000  0.6372000     1.704000  0.6406000     0.7428000      0.9035000 
1 1 1 1  43 6  o 12.19000  0.1798000     12.55000  0.2527000     11.82000  0.2558000     0.7250000      0.3596000 
1 1 1 1  43 7  o 5.935000  0.2350000     5.844000  0.3370000     6.026000  0.3276000     -0.1817000     0.4700000 
1 1 1 1  43 8  o 5.679000  0.2464000     5.640000  0.3448000     5.717000  0.3521000     -0.7709000E-01 0.4928000 
1 1 1 1  43 9  o 6.979000  0.2259000     7.061000  0.3166000     6.897000  0.3223000     0.1640000      0.4518000 
1 1 1 1  43 11 o 4.829000  0.3105000     4.658000  0.4609000     5.000000  0.4162000     -0.3416000     0.6210000 
1 1 1 1  43 12 o 5.658000  0.2767000     5.595000  0.3977000     5.722000  0.3848000     -0.1274000     0.5534000 
1 1 1 1  43 13 o 2.323000  0.5184000     2.677000  0.7288000     1.970000  0.7375000     0.7070000      1.037000  
1 1 1 1  43 14 o 4.215000  0.3733000     4.236000  0.5310000     4.195000  0.5248000     0.4081000E-01  0.7466000 
1 1 1 1  43 15 o 1.758000  0.5000000     1.944000  0.7358000     1.573000  0.6771000     0.3709000      0.9999000 
1 1 1 1  43 16 o 1.356000  0.4357000     1.143000  0.5562000     1.569000  0.6707000     -0.4263000     0.8713000 
1 1 1 1  43 17 o 1.787000  0.4583000     1.171000  0.5630000     2.402000  0.7234000     -1.230000      0.9167000 
1 1 1 1  43 18 o 3.178000  0.5459000     4.260000  0.6978000     2.096000  0.8398000     2.164000       1.092000  
1 1 1 1  43 19 o 1.940000  0.4980000     1.763000  0.6980000     2.117000  0.7106000     -0.3538000     0.9961000 
1 1 1 1  43 20 o 2.852000  0.4623000     2.693000  0.6704000     3.010000  0.6366000     -0.3167000     0.9245000 
1 1 1 1  43 21 o 1.825000  0.4854000     1.564000  0.6623000     2.085000  0.7096000     -0.5212000     0.9707000 
1 1 1 1  44 0  o 0.8230000 0.5593000     0.8230000 0.5593000     0.8230000 0.5593000     0.000000       0.000000  
1 1 1 1  44 1  o 11.46000  0.1874000     11.57000  0.2428000     11.35000  0.2855000     0.2226000      0.3748000 
1 1 1 1  44 2  o 11.48000  0.1741000     11.30000  0.2469000     11.66000  0.2455000     -0.3559000     0.3481000 
1 1 1 1  44 3  o 4.294000  0.2979000     3.773000  0.4356000     4.815000  0.4065000     -1.042000      0.5958000 
1 1 1 1  44 4  o 6.858000  0.2066000     6.579000  0.3043000     7.137000  0.2797000     -0.5585000     0.4133000 
1 1 1 1  44 5  o 9.847000  0.1843000     9.648000  0.2607000     10.05000  0.2607000     -0.3984000     0.3686000 
1 1 1 1  44 6  o 9.201000  0.1903000     8.966000  0.2707000     9.436000  0.2676000     -0.4698000     0.3806000 
1 1 1 1  44 7  o 10.51000  0.1898000     10.34000  0.2691000     10.68000  0.2677000     -0.3420000     0.3796000 
1 1 1 1  44 8  o 2.178000  0.4831000     2.632000  0.6795000     1.725000  0.6870000     0.9071000      0.9663000 
1 1 1 1  44 9  o 6.139000  0.5564000     6.139000  0.5564000     ?         ?             ?              ?         
1 1 1 1  44 10 o 10.91000  0.2178000     10.86000  0.3351000     10.97000  0.2782000     -0.1088000     0.4355000 
1 1 1 1  44 11 o 1.825000  0.5056000     1.833000  0.7177000     1.817000  0.7124000     0.1632000E-01  1.011000  
1 1 1 1  44 12 o 2.431000  0.5059000     2.824000  0.7023000     2.038000  0.7284000     0.7862000      1.012000  
1 1 1 1  44 13 o 2.768000  0.5046000     2.539000  0.7373000     2.996000  0.6890000     -0.4572000     1.009000  
1 1 1 1  44 14 o 3.723000  0.3994000     3.798000  0.5472000     3.648000  0.5819000     0.1500000      0.7988000 
1 1 1 1  44 15 o 4.315000  0.3543000     4.479000  0.4898000     4.151000  0.5121000     0.3280000      0.7086000 
1 1 1 1  44 16 o 1.785000  0.4621000     1.148000  0.5541000     2.422000  0.7398000     -1.274000      0.9243000 
1 1 1 1  44 17 o 1.563000  0.5131000     1.502000  0.7042000     1.625000  0.7465000     -0.1228000     1.026000  
1 1 1 1  44 18 o 1.563000  0.4671000     1.435000  0.6375000     1.691000  0.6828000     -0.2554000     0.9341000 
1 1 1 1  44 19 o 2.992000  0.4648000     3.190000  0.6297000     2.793000  0.6838000     0.3972000      0.9296000 
1 1 1 1  44 20 o 2.253000  0.4998000     2.223000  0.7062000     2.282000  0.7073000     -0.5951000E-01 0.9995000 
1 1 1 1  44 21 o 1.420000  0.4376000     1.241000  0.5718000     1.598000  0.6625000     -0.3574000     0.8751000 
1 1 1 1  45 0  o 6.909000  0.2897000     6.909000  0.2897000     6.909000  0.2897000     -0.000000      0.000000  
1 1 1 1  45 1  o 5.708000  0.2304000     6.147000  0.3039000     5.269000  0.3465000     0.8780000      0.4609000 
1 1 1 1  45 2  o 15.50000  0.2147000     15.40000  0.3039000     15.60000  0.3032000     -0.1975000     0.4293000 
1 1 1 1  45 3  o 12.25000  0.1790000     12.14000  0.2526000     12.36000  0.2536000     -0.2217000     0.3579000 
1 1 1 1  45 4  o 9.781000  0.1834000     9.695000  0.2604000     9.867000  0.2584000     -0.1726000     0.3668000 
1 1 1 1  45 5  o 8.182000  0.1970000     8.384000  0.2747000     7.980000  0.2824000     0.4040000      0.3940000 
1 1 1 1  45 6  o 3.025000  0.4105000     3.061000  0.5731000     2.988000  0.5878000     0.7296000E-01  0.8210000 
1 1 1 1  45 7  o 8.152000  0.2085000     8.145000  0.2902000     8.159000  0.2996000     -0.1406000E-01 0.4171000 
1 1 1 1  45 8  o 4.145000  0.5243000     3.993000  0.7611000     4.297000  0.7212000     -0.3039000     1.049000  
1 1 1 1  45 9  o 1.935000  0.5648000     2.036000  0.8224000     1.833000  0.7743000     0.2031000      1.130000  
1 1 1 1  45 10 o 6.558000  0.2486000     6.777000  0.3437000     6.338000  0.3593000     0.4391000      0.4972000 
1 1 1 1  45 11 o 5.791000  0.2704000     5.761000  0.3841000     5.820000  0.3807000     -0.5872000E-01 0.5407000 
1 1 1 1  45 12 o 5.896000  0.2617000     6.253000  0.3565000     5.538000  0.3832000     0.7154000      0.5234000 
1 1 1 1  45 13 o 2.104000  0.4622000     1.342000  0.6158000     2.865000  0.6893000     -1.523000      0.9243000 
1 1 1 1  45 14 o 4.522000  0.3430000     4.825000  0.4569000     4.219000  0.5119000     0.6059000      0.6861000 
1 1 1 1  45 15 o 4.875000  0.3227000     4.760000  0.4708000     4.990000  0.4416000     -0.2306000     0.6455000 
1 1 1 1  45 16 o 2.023000  0.4844000     1.434000  0.6425000     2.612000  0.7252000     -1.178000      0.9688000 
1 1 1 1  45 17 o 2.159000  0.6324000     2.404000  0.8715000     1.915000  0.9167000     0.4892000      1.265000  
1 1 1 1  45 18 o 1.516000  0.4622000     1.487000  0.6474000     1.546000  0.6597000     -0.5819000E-01 0.9243000 
1 1 1 1  45 19 o 1.448000  0.4491000     1.503000  0.6467000     1.392000  0.6234000     0.1111000      0.8983000 
1 1 1 1  45 20 o 1.302000  0.4198000     1.235000  0.5724000     1.369000  0.6141000     -0.1340000     0.8395000 
1 1 1 1  46 0  o 14.15000  0.2576000     14.15000  0.2576000     14.15000  0.2576000     0.000000       0.000000  
1 1 1 1  46 1  o 8.424000  0.1904000     8.631000  0.2673000     8.218000  0.2711000     0.4126000      0.3807000 
1 1 1 1  46 2  o 2.222000  0.4260000     1.497000  0.6249000     2.947000  0.5791000     -1.450000      0.8519000 
1 1 1 1  46 3  o 10.55000  0.1828000     10.40000  0.2575000     10.69000  0.2595000     -0.2929000     0.3656000 
1 1 1 1  46 4  o 3.591000  0.3575000     3.377000  0.5322000     3.804000  0.4776000     -0.4266000     0.7151000 
1 1 1 1  46 5  o 10.06000  0.1875000     10.39000  0.2660000     9.736000  0.2644000     0.6556000      0.3750000 
1 1 1 1  46 6  o 14.12000  0.1891000     14.04000  0.2678000     14.20000  0.2671000     -0.1663000     0.3783000 
1 1 1 1  46 7  o 10.90000  0.3466000     10.79000  0.4119000     11.00000  0.5575000     -0.2185000     0.6932000 
1 1 1 1  46 8  o 11.50000  0.2657000     11.79000  0.3790000     11.21000  0.3726000     0.5787000      0.5314000 
1 1 1 1  46 9  o 4.505000  0.3267000     4.125000  0.4916000     4.886000  0.4305000     -0.7613000     0.6535000 
1 1 1 1  46 10 o 2.632000  0.4979000     2.884000  0.6737000     2.380000  0.7334000     0.5038000      0.9959000 
1 1 1 1  46 11 o 2.958000  0.4735000     2.482000  0.7335000     3.434000  0.5991000     -0.9516000     0.9470000 
1 1 1 1  46 12 o 3.513000  0.4210000     3.996000  0.5254000     3.031000  0.6580000     0.9646000      0.8421000 
1 1 1 1  46 13 o 2.133000  0.5037000     2.574000  0.7289000     1.693000  0.6955000     0.8804000      1.007000  
1 1 1 1  46 14 f 1.444000  0.4524000     1.263000  0.5905000     1.626000  0.6856000     -0.3633000     0.9048000 
1 1 1 1  46 15 o 3.297000  0.4641000     3.435000  0.6495000     3.159000  0.6631000     0.2756000      0.9282000 
1 1 1 1  46 16 o 3.708000  0.5858000     4.353000  0.7518000     3.062000  0.8985000     1.290000       1.172000  
1 1 1 1  46 17 o 2.103000  0.5067000     2.396000  0.7275000     1.810000  0.7055000     0.5852000      1.013000  
1 1 1 1  46 18 o 1.550000  0.4650000     1.723000  0.6981000     1.378000  0.6143000     0.3445000      0.9299000 
1 1 1 1  46 19 f 1.885000  0.4426000     2.574000  0.6844000     1.196000  0.5612000     1.379000       0.8851000 
1 1 1 1  46 20 o 1.762000  0.4763000     2.041000  0.7105000     1.483000  0.6344000     0.5582000      0.9525000 
1 1 1 1  47 0  o 11.22000  0.2604000     11.22000  0.2604000     11.22000  0.2604000     0.000000       0.000000  
1 1 1 1  47 1  o 10.96000  0.1832000     10.73000  0.2590000     11.20000  0.2591000     -0.4696000     0.3663000 
1 1 1 1  47 2  o 5.537000  0.2472000     5.604000  0.3425000     5.470000  0.3566000     0.1343000      0.4945000 
1 1 1 1  47 3  o 4.312000  0.2976000     3.911000  0.4537000     4.712000  0.3852000     -0.8013000     0.5951000 
1 1 1 1  47 4  f 16.76000  0.1937000     16.98000  0.2740000     16.55000  0.2738000     0.4266000      0.3874000 
1 1 1 1  47 5  o 2.892000  0.5930000     3.190000  0.8292000     2.594000  0.8479000     0.5965000      1.186000  
1 1 1 1  47 7  o 16.42000  0.2744000     16.61000  0.3896000     16.23000  0.3864000     0.3855000      0.5487000 
1 1 1 1  47 8  f 15.79000  0.1981000     15.77000  0.2797000     15.81000  0.2805000     -0.3755000E-01 0.3961000 
1 1 1 1  47 9  o 5.644000  0.2724000     5.872000  0.3760000     5.417000  0.3943000     0.4553000      0.5449000 
1 1 1 1  47 10 o 11.83000  0.1992000     11.66000  0.2837000     12.01000  0.2798000     -0.3481000     0.3984000 
1 1 1 1  47 11 o 2.544000  0.5059000     2.199000  0.7520000     2.889000  0.6771000     -0.6894000     1.012000  
1 1 1 1  47 12 o 1.076000  0.3712000     1.108000  0.5371000     1.044000  0.5126000     0.6488000E-01  0.7424000 
1 1 1 1  47 13 o 5.452000  0.2875000     5.352000  0.4160000     5.552000  0.3968000     -0.2001000     0.5750000 
1 1 1 1  47 14 o 4.936000  0.3121000     4.664000  0.4666000     5.208000  0.4147000     -0.5436000     0.6243000 
1 1 1 1  47 15 o 2.048000  0.5041000     1.603000  0.6824000     2.493000  0.7423000     -0.8901000     1.008000  
1 1 1 1  47 16 o 1.816000  0.6164000     1.455000  0.6931000     2.178000  1.020000      -0.7230000     1.233000  
1 1 1 1  47 17 o 2.325000  0.4763000     1.677000  0.6840000     2.973000  0.6631000     -1.296000      0.9527000 
1 1 1 1  47 18 o 1.399000  0.4363000     1.551000  0.6508000     1.246000  0.5814000     0.3050000      0.8727000 
1 1 1 1  47 19 o 1.224000  0.4032000     1.346000  0.6065000     1.101000  0.5315000     0.2456000      0.8065000 
1 1 1 1  47 20 o 1.577000  0.4723000     1.734000  0.6952000     1.421000  0.6396000     0.3134000      0.9446000 
1 1 1 1  48 0  o 17.12000  0.2751000     17.12000  0.2751000     17.12000  0.2751000     -0.000000      0.000000  
1 1 1 1  48 1  o 12.67000  0.1848000     12.60000  0.2622000     12.75000  0.2605000     -0.1532000     0.3696000 
1 1 1 1  48 2  o 3.597000  0.3648000     3.640000  0.5138000     3.554000  0.5180000     0.8575000E-01  0.7296000 
1 1 1 1  48 3  o 5.182000  0.4125000     5.530000  0.5598000     4.835000  0.6061000     0.6952000      0.8251000 
1 1 1 1  48 4  o 3.537000  0.5618000     3.596000  0.7689000     3.478000  0.8193000     0.1181000      1.124000  
1 1 1 1  48 5  o 1.964000  0.5550000     1.658000  0.7308000     2.269000  0.8356000     -0.6107000     1.110000  
1 1 1 1  48 6  o 3.893000  0.3982000     4.194000  0.5633000     3.592000  0.5629000     0.6024000      0.7963000 
1 1 1 1  48 7  o 4.673000  0.3245000     5.208000  0.4053000     4.138000  0.5069000     1.070000       0.6490000 
1 1 1 1  48 8  o 3.688000  0.3960000     3.444000  0.5835000     3.932000  0.5354000     -0.4872000     0.7919000 
1 1 1 1  48 9  o 5.744000  0.2774000     5.915000  0.3804000     5.573000  0.4038000     0.3427000      0.5548000 
1 1 1 1  48 10 f 1.461000  0.4550000     1.568000  0.6670000     1.355000  0.6192000     0.2128000      0.9101000 
1 1 1 1  48 11 o 2.726000  0.4617000     3.523000  0.5776000     1.929000  0.7205000     1.593000       0.9235000 
1 1 1 1  48 12 o 6.131000  0.2641000     5.814000  0.3839000     6.448000  0.3626000     -0.6348000     0.5281000 
1 1 1 1  48 13 o 2.499000  0.4776000     3.296000  0.6505000     1.703000  0.6996000     1.593000       0.9553000 
1 1 1 1  48 14 o 1.503000  0.4587000     1.214000  0.5747000     1.793000  0.7151000     -0.5785000     0.9174000 
1 1 1 1  48 15 o 2.045000  0.5982000     2.042000  0.8478000     2.049000  0.8443000     -0.6702000E-02 1.196000  
1 1 1 1  48 16 o 2.818000  0.4749000     2.097000  0.7429000     3.539000  0.5919000     -1.442000      0.9499000 
1 1 1 1  48 17 o 2.671000  0.4900000     2.544000  0.7128000     2.797000  0.6724000     -0.2532000     0.9799000 
1 1 1 1  48 18 o 1.091000  0.3731000     1.026000  0.5029000     1.156000  0.5514000     -0.1293000     0.7463000 
1 1 1 1  48 19 o 1.559000  0.4616000     1.280000  0.5926000     1.837000  0.7080000     -0.5572000     0.9233000 
1 1 1 1  49 0  o 10.12000  0.4057000     10.12000  0.4057000     10.12000  0.4057000     -0.000000      0.000000  
1 1 1 1  49 1  f 7.707000  0.6407000     7.707000  0.6407000     ?         ?             ?              ?         
1 1 1 1  49 3  o 3.204000  0.5706000     3.143000  0.8083000     3.265000  0.8056000     -0.1221000     1.141000  
1 1 1 1  49 4  o 2.217000  0.5732000     2.076000  0.8196000     2.358000  0.8014000     -0.2823000     1.146000  
1 1 1 1  49 5  o 1.888000  0.4938000     1.961000  0.7028000     1.815000  0.6937000     0.1461000      0.9875000 
1 1 1 1  49 6  o 6.527000  0.2371000     6.751000  0.3253000     6.303000  0.3451000     0.4479000      0.4743000 
1 1 1 1  49 7  o 7.739000  0.2229000     7.589000  0.3197000     7.890000  0.3107000     -0.3013000     0.4458000 
1 1 1 1  49 8  o 11.68000  0.2009000     11.44000  0.2858000     11.92000  0.2824000     -0.4792000     0.4018000 
1 1 1 1  49 9  o 5.065000  0.2985000     4.705000  0.4426000     5.425000  0.4008000     -0.7199000     0.5971000 
1 1 1 1  49 10 o 3.300000  0.4367000     3.689000  0.5534000     2.911000  0.6757000     0.7782000      0.8734000 
1 1 1 1  49 11 o 4.463000  0.3375000     4.380000  0.4842000     4.546000  0.4704000     -0.1658000     0.6751000 
1 1 1 1  49 12 o 5.048000  0.3119000     5.537000  0.4064000     4.558000  0.4733000     0.9787000      0.6238000 
1 1 1 1  49 13 o 2.729000  0.4975000     2.725000  0.7050000     2.732000  0.7021000     -0.6681000E-02 0.9950000 
1 1 1 1  49 14 o 1.473000  0.4538000     1.154000  0.5556000     1.792000  0.7177000     -0.6385000     0.9076000 
1 1 1 1  49 15 o 2.052000  0.5778000     2.107000  0.8189000     1.998000  0.8154000     0.1085000      1.156000  
1 1 1 1  49 16 o 1.198000  0.4020000     1.162000  0.5574000     1.234000  0.5794000     -0.7236000E-01 0.8040000 
1 1 1 1  49 17 o 3.440000  0.4303000     2.668000  0.7017000     4.212000  0.4982000     -1.544000      0.8605000 
1 1 1 1  49 18 o 1.646000  0.4624000     2.068000  0.7226000     1.224000  0.5771000     0.8434000      0.9247000 
1 1 1 1  49 19 o 1.460000  0.4519000     1.582000  0.6638000     1.339000  0.6134000     0.2431000      0.9039000 
1 1 1 1  50 0  o 1.280000  0.8187000     1.280000  0.8187000     1.280000  0.8187000     0.000000       0.000000  
1 1 1 1  50 1  o 4.524000  0.3377000     4.829000  0.4812000     4.220000  0.4738000     0.6096000      0.6754000 
1 1 1 1  50 2  o 7.573000  0.2200000     7.668000  0.3086000     7.478000  0.3137000     0.1906000      0.4401000 
1 1 1 1  50 3  o 12.59000  0.1910000     12.81000  0.2703000     12.37000  0.2697000     0.4457000      0.3819000 
1 1 1 1  50 4  o 6.660000  0.2367000     6.754000  0.3274000     6.566000  0.3420000     0.1883000      0.4735000 
1 1 1 1  50 5  o 6.381000  0.2463000     6.324000  0.3447000     6.438000  0.3518000     -0.1140000     0.4925000 
1 1 1 1  50 6  o 8.130000  0.2180000     8.061000  0.3073000     8.198000  0.3094000     -0.1364000     0.4360000 
1 1 1 1  50 7  o 10.87000  0.1985000     10.92000  0.2801000     10.81000  0.2813000     0.1141000      0.3969000 
1 1 1 1  50 8  o 6.199000  0.2588000     5.874000  0.3782000     6.524000  0.3535000     -0.6500000     0.5177000 
1 1 1 1  50 9  o 3.655000  0.4075000     4.040000  0.5150000     3.269000  0.6316000     0.7708000      0.8150000 
1 1 1 1  50 10 o 2.838000  0.4835000     3.105000  0.6384000     2.571000  0.7263000     0.5335000      0.9670000 
1 1 1 1  50 11 o 3.876000  0.3940000     4.054000  0.5278000     3.698000  0.5853000     0.3560000      0.7881000 
1 1 1 1  50 12 o 2.651000  0.5052000     2.315000  0.7476000     2.987000  0.6797000     -0.6718000     1.010000  
1 1 1 1  50 13 o 1.937000  0.4894000     2.365000  0.7286000     1.509000  0.6537000     0.8560000      0.9789000 
1 1 1 1  50 14 o 1.523000  0.5143000     1.518000  0.7099000     1.529000  0.7444000     -0.1042000E-01 1.029000  
1 1 1 1  50 15 o 3.568000  0.4035000     3.091000  0.6321000     4.046000  0.5016000     -0.9550000     0.8070000 
1 1 1 1  50 16 o 1.822000  0.4917000     1.592000  0.6691000     2.052000  0.7206000     -0.4590000     0.9834000 
1 1 1 1  50 17 o 1.265000  0.4158000     1.337000  0.6108000     1.192000  0.5643000     0.1450000      0.8316000 
1 1 1 1  50 18 o 1.351000  0.4244000     1.042000  0.5082000     1.661000  0.6799000     -0.6185000     0.8489000 
1 1 1 1  51 0  o 7.510000  0.3117000     7.510000  0.3117000     7.510000  0.3117000     0.000000       0.000000  
1 1 1 1  51 1  o 5.460000  0.2688000     5.153000  0.3991000     5.767000  0.3601000     -0.6138000     0.5376000 
1 1 1 1  51 2  o 7.725000  0.2198000     7.720000  0.3118000     7.729000  0.3097000     -0.9356000E-02 0.4395000 
1 1 1 1  51 3  o 9.234000  0.2060000     8.993000  0.2970000     9.474000  0.2857000     -0.4813000     0.4121000 
1 1 1 1  51 4  o 11.47000  0.1975000     10.97000  0.2803000     11.98000  0.2784000     -1.004000      0.3950000 
1 1 1 1  51 5  o 4.869000  0.2946000     4.936000  0.4125000     4.802000  0.4207000     0.1338000      0.5892000 
1 1 1 1  51 6  o 3.372000  0.4262000     3.407000  0.6109000     3.337000  0.5945000     0.7061000E-01  0.8524000 
1 1 1 1  51 7  o 2.760000  0.4690000     3.145000  0.6147000     2.376000  0.7085000     0.7686000      0.9380000 
1 1 1 1  51 8  o 2.068000  0.5183000     2.153000  0.7322000     1.984000  0.7338000     0.1682000      1.037000  
1 1 1 1  51 9  o 2.664000  0.4894000     3.272000  0.6552000     2.056000  0.7273000     1.216000       0.9789000 
1 1 1 1  51 10 o 4.922000  0.3124000     5.154000  0.4231000     4.690000  0.4597000     0.4645000      0.6248000 
1 1 1 1  51 11 o 4.721000  0.3351000     5.393000  0.4103000     4.049000  0.5300000     1.345000       0.6702000 
1 1 1 1  51 12 o 1.612000  0.4625000     2.029000  0.7312000     1.195000  0.5666000     0.8342000      0.9250000 
1 1 1 1  51 13 o 1.528000  0.4939000     1.583000  0.7314000     1.473000  0.6638000     0.1098000      0.9877000 
1 1 1 1  51 14 o 1.525000  0.4813000     1.141000  0.5635000     1.909000  0.7805000     -0.7684000     0.9627000 
1 1 1 1  51 15 o 1.397000  0.4376000     1.178000  0.5593000     1.616000  0.6732000     -0.4377000     0.8753000 
1 1 1 1  51 16 f 1.297000  0.4107000     1.655000  0.6755000     0.9393000 0.4672000     0.7162000      0.8214000 
1 1 1 1  51 17 o 1.909000  0.5046000     1.858000  0.7145000     1.960000  0.7128000     -0.1017000     1.009000  
1 1 1 1  51 18 o 2.434000  0.5117000     2.477000  0.7194000     2.391000  0.7278000     0.8646000E-01  1.023000  
1 1 1 1  52 0  o 4.117000  0.4895000     4.117000  0.4895000     4.117000  0.4895000     0.000000       0.000000  
1 1 1 1  52 1  o 4.244000  0.3352000     4.449000  0.4433000     4.039000  0.5028000     0.4096000      0.6703000 
1 1 1 1  52 2  o 6.089000  0.2544000     6.389000  0.3436000     5.789000  0.3752000     0.6004000      0.5088000 
1 1 1 1  52 3  o 3.421000  0.4221000     3.889000  0.5086000     2.952000  0.6738000     0.9372000      0.8442000 
1 1 1 1  52 4  o 5.742000  0.2642000     5.630000  0.3751000     5.854000  0.3723000     -0.2241000     0.5285000 
1 1 1 1  52 5  o 5.507000  0.2753000     5.256000  0.4022000     5.758000  0.3759000     -0.5015000     0.5505000 
1 1 1 1  52 6  o 1.321000  0.4268000     1.146000  0.5502000     1.497000  0.6526000     -0.3508000     0.8535000 
1 1 1 1  52 7  o 1.712000  0.4890000     1.757000  0.6983000     1.667000  0.6848000     0.9024000E-01  0.9781000 
1 1 1 1  52 8  o 2.506000  0.5107000     2.535000  0.7116000     2.477000  0.7328000     0.5832000E-01  1.021000  
1 1 1 1  52 9  o 1.583000  0.4786000     1.530000  0.6649000     1.636000  0.6886000     -0.1057000     0.9572000 
1 1 1 1  52 10 o 1.358000  0.4413000     1.438000  0.6475000     1.279000  0.5997000     0.1585000      0.8825000 
1 1 1 1  52 11 o 2.884000  0.5017000     3.036000  0.6795000     2.733000  0.7385000     0.3032000      1.003000  
1 1 1 1  52 12 o 2.437000  0.5111000     2.786000  0.7135000     2.089000  0.7320000     0.6972000      1.022000  
1 1 1 1  52 13 o 4.023000  0.7755000     4.023000  0.7755000     ?         ?             ?              ?         
1 1 1 1  52 14 o 1.347000  0.4333000     1.291000  0.5995000     1.403000  0.6257000     -0.1113000     0.8666000 
1 1 1 1  52 15 o 2.825000  0.4450000     3.833000  0.5379000     1.816000  0.7091000     2.017000       0.8900000 
1 1 1 1  52 16 o 2.478000  0.4977000     2.208000  0.7128000     2.747000  0.6948000     -0.5392000     0.9954000 
1 1 1 1  52 17 o 2.289000  0.4960000     2.757000  0.6975000     1.821000  0.7055000     0.9353000      0.9921000 
1 1 1 1  53 0  o 1.792000  0.8760000     1.792000  0.8760000     1.792000  0.8760000     0.000000       0.000000  
1 1 1 1  53 1  o 4.698000  0.3093000     4.680000  0.4385000     4.717000  0.4363000     -0.3670000E-01 0.6186000 
1 1 1 1  53 2  o 7.256000  0.2309000     7.349000  0.3245000     7.162000  0.3285000     0.1868000      0.4618000 
1 1 1 1  53 3  o 2.998000  0.4517000     2.701000  0.6799000     3.294000  0.5950000     -0.5924000     0.9035000 
1 1 1 1  53 4  o 6.592000  0.2382000     6.704000  0.3319000     6.479000  0.3418000     0.2248000      0.4764000 
1 1 1 1  53 5  o 3.474000  0.4075000     3.425000  0.5946000     3.523000  0.5574000     -0.9853000E-01 0.8150000 
1 1 1 1  53 6  o 2.440000  0.4654000     1.711000  0.6905000     3.168000  0.6240000     -1.457000      0.9307000 
1 1 1 1  53 7  o 7.004000  0.2371000     6.980000  0.3354000     7.027000  0.3351000     -0.4757000E-01 0.4741000 
1 1 1 1  53 8  o 6.465000  0.2550000     6.497000  0.3543000     6.432000  0.3668000     0.6473000E-01  0.5100000 
1 1 1 1  53 9  o 2.744000  0.5137000     2.637000  0.7341000     2.851000  0.7188000     -0.2137000     1.027000  
1 1 1 1  53 10 o 1.975000  0.5243000     1.972000  0.7361000     1.978000  0.7469000     -0.6161000E-02 1.049000  
1 1 1 1  53 11 o 1.405000  0.4464000     1.482000  0.6532000     1.328000  0.6086000     0.1540000      0.8928000 
1 1 1 1  53 12 o 2.445000  0.6992000     1.988000  0.8511000     2.903000  1.109000      -0.9156000     1.398000  
1 1 1 1  53 13 o 1.462000  0.4515000     1.280000  0.5936000     1.643000  0.6805000     -0.3631000     0.9030000 
1 1 1 1  53 14 o 2.719000  0.5039000     2.475000  0.7324000     2.962000  0.6922000     -0.4865000     1.008000  
1 1 1 1  53 15 o 1.318000  0.4293000     1.241000  0.5834000     1.394000  0.6300000     -0.1529000     0.8587000 
1 1 1 1  53 16 o 3.858000  0.3688000     3.727000  0.5339000     3.989000  0.5089000     -0.2617000     0.7376000 
1 1 1 1  53 17 o 1.584000  0.4726000     1.675000  0.6883000     1.493000  0.6479000     0.1826000      0.9453000 
1 1 1 1  54 0  o 3.711000  0.5511000     3.711000  0.5511000     3.711000  0.5511000     0.000000       0.000000  
1 1 1 1  54 1  o 5.187000  0.2849000     5.259000  0.3975000     5.116000  0.4082000     0.1431000      0.5698000 
1 1 1 1  54 2  o 4.726000  0.3135000     4.426000  0.4733000     5.025000  0.4113000     -0.5997000     0.6270000 
1 1 1 1  54 3  o 6.082000  0.2556000     6.444000  0.3440000     5.720000  0.3780000     0.7232000      0.5111000 
1 1 1 1  54 4  o 8.883000  0.2121000     9.291000  0.2952000     8.475000  0.3045000     0.8157000      0.4241000 
1 1 1 1  54 5  o 1.309000  0.4231000     1.116000  0.5384000     1.502000  0.6528000     -0.3858000     0.8462000 
1 1 1 1  54 6  o 3.514000  0.4184000     2.987000  0.6662000     4.041000  0.5063000     -1.054000      0.8368000 
1 1 1 1  54 7  o 1.775000  0.4983000     1.868000  0.7165000     1.682000  0.6926000     0.1853000      0.9965000 
1 1 1 1  54 8  f 3.141000  0.4722000     3.123000  0.6632000     3.158000  0.6725000     -0.3485000E-01 0.9445000 
1 1 1 1  54 9  o 2.685000  0.5081000     2.446000  0.7503000     2.925000  0.6852000     -0.4786000     1.016000  
1 1 1 1  54 10 o 2.106000  0.5028000     1.691000  0.7056000     2.520000  0.7166000     -0.8285000     1.006000  
1 1 1 1  54 11 o 2.689000  0.6397000     2.644000  0.8984000     2.734000  0.9108000     -0.8907000E-01 1.279000  
1 1 1 1  54 12 o 2.166000  0.5405000     1.448000  0.6794000     2.883000  0.8409000     -1.435000      1.081000  
1 1 1 1  54 13 o 1.370000  0.4373000     1.389000  0.6231000     1.350000  0.6138000     0.3917000E-01  0.8747000 
1 1 1 1  54 14 o 1.663000  0.4789000     1.340000  0.6116000     1.985000  0.7372000     -0.6453000     0.9579000 
1 1 1 1  54 15 o 2.016000  0.5157000     1.930000  0.7255000     2.103000  0.7332000     -0.1729000     1.031000  
1 1 1 1  54 16 o 2.003000  0.5088000     1.811000  0.7079000     2.194000  0.7310000     -0.3833000     1.018000  
1 1 1 1  55 0  f 1.664000  0.8548000     1.664000  0.8548000     1.664000  0.8548000     -0.000000      0.000000  
1 1 1 1  55 1  o 3.040000  0.4467000     3.715000  0.5270000     2.364000  0.7215000     1.351000       0.8935000 
1 1 1 1  55 2  o 2.239000  0.4957000     1.948000  0.7078000     2.530000  0.6941000     -0.5821000     0.9913000 
1 1 1 1  55 3  o 3.096000  0.4370000     2.050000  0.7331000     4.142000  0.4760000     -2.092000      0.8740000 
1 1 1 1  55 4  o 2.322000  0.5091000     2.422000  0.7228000     2.222000  0.7173000     0.1998000      1.018000  
1 1 1 1  55 5  o 6.534000  0.2523000     6.690000  0.3448000     6.378000  0.3684000     0.3126000      0.5046000 
1 1 1 1  55 6  o 8.367000  0.2394000     8.472000  0.3152000     8.262000  0.3604000     0.2099000      0.4788000 
1 1 1 1  55 7  o 1.754000  0.4975000     1.740000  0.7030000     1.768000  0.7040000     -0.2786000E-01 0.9949000 
1 1 1 1  55 8  o 1.531000  0.4664000     1.806000  0.7210000     1.256000  0.5918000     0.5503000      0.9328000 
1 1 1 1  55 9  o 1.908000  0.5070000     1.613000  0.6853000     2.203000  0.7474000     -0.5897000     1.014000  
1 1 1 1  55 10 o 3.609000  0.5814000     4.352000  0.7178000     2.866000  0.9148000     1.485000       1.163000  
1 1 1 1  55 11 o 2.174000  0.6030000     2.383000  0.8722000     1.965000  0.8329000     0.4177000      1.206000  
1 1 1 1  55 12 o 2.779000  0.4880000     2.267000  0.7297000     3.291000  0.6483000     -1.024000      0.9761000 
1 1 1 1  55 13 o 1.775000  0.4983000     1.649000  0.6872000     1.900000  0.7219000     -0.2515000     0.9967000 
1 1 1 1  55 14 o 1.734000  0.4700000     1.252000  0.5869000     2.217000  0.7343000     -0.9650000     0.9401000 
1 1 1 1  55 15 o 1.445000  0.4481000     1.222000  0.5762000     1.669000  0.6865000     -0.4467000     0.8962000 
1 1 1 1  55 16 o 2.020000  0.5137000     1.845000  0.7162000     2.196000  0.7366000     -0.3510000     1.027000  
1 1 1 1  56 0  f 1.106000  0.7095000     1.106000  0.7095000     1.106000  0.7095000     -0.000000      0.000000  
1 1 1 1  56 1  o 1.823000  0.4798000     2.135000  0.7090000     1.511000  0.6467000     0.6242000      0.9596000 
1 1 1 1  56 2  f 1.708000  0.4578000     1.237000  0.5778000     2.180000  0.7102000     -0.9433000     0.9156000 
1 1 1 1  56 3  o 6.110000  0.2648000     6.537000  0.3566000     5.683000  0.3916000     0.8537000      0.5297000 
1 1 1 1  56 4  o 6.131000  0.2660000     6.257000  0.3736000     6.004000  0.3787000     0.2536000      0.5319000 
1 1 1 1  56 5  o 5.356000  0.2990000     5.733000  0.4046000     4.978000  0.4404000     0.7554000      0.5980000 
1 1 1 1  56 6  o 7.860000  0.2330000     7.864000  0.3291000     7.857000  0.3300000     0.6934000E-02  0.4661000 
1 1 1 1  56 7  o 1.808000  0.4941000     2.077000  0.7287000     1.539000  0.6674000     0.5381000      0.9882000 
1 1 1 1  56 8  o 2.903000  0.4990000     2.582000  0.7501000     3.224000  0.6582000     -0.6420000     0.9980000 
1 1 1 1  56 9  o 2.232000  0.6134000     2.258000  0.8711000     2.207000  0.8639000     0.5014000E-01  1.227000  
1 1 1 1  56 10 f 1.997000  0.5818000     2.005000  0.8332000     1.989000  0.8122000     0.1544000E-01  1.164000  
1 1 1 1  56 11 o 1.938000  0.5119000     2.114000  0.7466000     1.762000  0.7005000     0.3520000      1.024000  
1 1 1 1  56 12 o 2.962000  0.4875000     3.197000  0.6631000     2.726000  0.7148000     0.4707000      0.9750000 
1 1 1 1  56 13 o 2.216000  0.5136000     1.996000  0.7328000     2.437000  0.7198000     -0.4415000     1.027000  
1 1 1 1  56 14 o 1.192000  0.3995000     1.273000  0.5923000     1.110000  0.5363000     0.1637000      0.7990000 
1 1 1 1  56 15 o 1.830000  0.5071000     1.792000  0.7031000     1.869000  0.7310000     -0.7684000E-01 1.014000  
1 1 1 1  57 0  o 6.373000  0.3580000     6.373000  0.3580000     6.373000  0.3580000     -0.000000      0.000000  
1 1 1 1  57 1  o 1.850000  0.5040000     1.946000  0.7248000     1.755000  0.7005000     0.1914000      1.008000  
1 1 1 1  57 2  o 4.730000  0.3279000     5.070000  0.4364000     4.390000  0.4896000     0.6809000      0.6559000 
1 1 1 1  57 3  o 6.259000  0.2666000     6.097000  0.3876000     6.421000  0.3661000     -0.3239000     0.5332000 
1 1 1 1  57 4  o 6.222000  0.2649000     6.382000  0.3748000     6.062000  0.3744000     0.3194000      0.5297000 
1 1 1 1  57 5  o 3.006000  0.4725000     2.815000  0.6886000     3.198000  0.6472000     -0.3831000     0.9450000 
1 1 1 1  57 6  o 2.675000  0.4928000     3.230000  0.6588000     2.121000  0.7331000     1.109000       0.9856000 
1 1 1 1  57 7  o 2.135000  0.5109000     2.487000  0.7357000     1.782000  0.7090000     0.7052000      1.022000  
1 1 1 1  57 8  o 2.205000  0.6072000     1.756000  0.7975000     2.653000  0.9157000     -0.8964000     1.214000  
1 1 1 1  57 9  o 1.783000  0.5413000     2.003000  0.8147000     1.562000  0.7128000     0.4411000      1.083000  
1 1 1 1  57 10 o 2.042000  0.5127000     1.817000  0.7173000     2.266000  0.7329000     -0.4496000     1.025000  
1 1 1 1  57 11 o 5.019000  0.3197000     4.791000  0.4594000     5.246000  0.4446000     -0.4551000     0.6393000 
1 1 1 1  57 12 o 1.088000  0.3752000     1.132000  0.5473000     1.044000  0.5135000     0.8847000E-01  0.7504000 
1 1 1 1  57 13 o 1.472000  0.4522000     1.365000  0.6167000     1.578000  0.6616000     -0.2130000     0.9045000 
1 1 1 1  57 14 o 2.022000  0.4849000     1.409000  0.6334000     2.635000  0.7345000     -1.227000      0.9699000 
1 1 1 1  57 15 o 1.466000  0.5130000     1.468000  0.7222000     1.465000  0.7289000     0.3173000E-02  1.026000  
1 1 1 1  58 0  o 1.351000  0.7946000     1.351000  0.7946000     1.351000  0.7946000     0.000000       0.000000  
1 1 1 1  58 1  o 2.689000  0.4964000     2.735000  0.6942000     2.642000  0.7097000     0.9353000E-01  0.9928000 
1 1 1 1  58 2  o 2.984000  0.4813000     2.932000  0.6961000     3.036000  0.6649000     -0.1039000     0.9626000 
1 1 1 1  58 3  f 1.882000  0.5113000     2.131000  0.7570000     1.634000  0.6876000     0.4971000      1.023000  
1 1 1 1  58 4  o 8.027000  0.2302000     8.110000  0.3252000     7.944000  0.3258000     0.1659000      0.4603000 
1 1 1 1  58 5  o 2.965000  0.4725000     3.407000  0.6134000     2.523000  0.7188000     0.8842000      0.9450000 
1 1 1 1  58 6  o 1.738000  0.5327000     1.712000  0.7754000     1.764000  0.7306000     -0.5176000E-01 1.065000  
1 1 1 1  58 7  o 1.729000  0.8187000     1.729000  0.8187000     ?         ?             ?              ?         
1 1 1 1  58 8  o 3.698000  0.5489000     2.711000  0.8930000     4.685000  0.6384000     -1.974000      1.098000  
1 1 1 1  58 9  o 1.278000  0.4198000     1.408000  0.6317000     1.149000  0.5532000     0.2586000      0.8397000 
1 1 1 1  58 10 o 2.368000  0.5157000     2.045000  0.7305000     2.692000  0.7280000     -0.6468000     1.031000  
1 1 1 1  58 11 o 2.063000  0.5229000     2.060000  0.7451000     2.066000  0.7338000     -0.5951000E-02 1.046000  
1 1 1 1  58 12 o 4.165000  0.3702000     3.694000  0.5710000     4.636000  0.4713000     -0.9418000     0.7403000 
1 1 1 1  58 13 o 2.679000  0.4887000     2.163000  0.7331000     3.194000  0.6464000     -1.030000      0.9773000 
1 1 1 1  58 14 o 1.388000  0.4424000     1.282000  0.5950000     1.495000  0.6548000     -0.2126000     0.8847000 
1 1 1 1  59 0  o 1.313000  0.7906000     1.313000  0.7906000     1.313000  0.7906000     0.000000       0.000000  
1 1 1 1  59 1  o 2.897000  0.4737000     3.512000  0.5771000     2.282000  0.7514000     1.230000       0.9474000 
1 1 1 1  59 2  o 3.813000  0.4098000     4.485000  0.4747000     3.141000  0.6683000     1.344000       0.8197000 
1 1 1 1  59 3  o 9.075000  0.2229000     9.059000  0.3183000     9.092000  0.3122000     -0.3312000E-01 0.4459000 
1 1 1 1  59 4  o 2.685000  0.5919000     3.199000  0.8808000     2.171000  0.7907000     1.028000       1.184000  
1 1 1 1  59 5  o 1.622000  0.5232000     1.572000  0.7224000     1.671000  0.7571000     -0.9880000E-01 1.046000  
1 1 1 1  59 6  o 3.282000  0.7239000     3.278000  0.8932000     3.285000  1.139000      -0.6536000E-02 1.448000  
1 1 1 1  59 7  o 3.220000  0.5001000     3.601000  0.6865000     2.839000  0.7274000     0.7615000      1.000000  
1 1 1 1  59 8  o 1.962000  0.5193000     1.795000  0.7188000     2.128000  0.7496000     -0.3329000     1.039000  
1 1 1 1  59 9  o 2.323000  0.5061000     1.811000  0.7176000     2.834000  0.7138000     -1.023000      1.012000  
1 1 1 1  59 10 o 2.123000  0.5195000     2.308000  0.7433000     1.938000  0.7261000     0.3698000      1.039000  
1 1 1 1  59 11 o 2.323000  0.5016000     2.857000  0.7096000     1.789000  0.7091000     1.068000       1.003000  
1 1 1 1  59 12 o 1.413000  0.4448000     1.229000  0.5775000     1.596000  0.6767000     -0.3667000     0.8896000 
1 1 1 1  59 13 o 1.299000  0.4238000     1.207000  0.5723000     1.392000  0.6253000     -0.1853000     0.8477000 
1 1 1 1  60 0  o 2.577000  1.133000      2.577000  1.133000      2.577000  1.133000      0.000000       0.000000  
1 1 1 1  60 1  o 2.947000  0.6370000     3.404000  0.8785000     2.491000  0.9228000     0.9129000      1.274000  
1 1 1 1  60 2  o 4.702000  0.5043000     4.555000  0.7359000     4.850000  0.6897000     -0.2945000     1.009000  
1 1 1 1  60 3  o 7.164000  0.8142000     7.164000  0.8142000     ?         ?             ?              ?         
1 1 1 1  60 4  o 6.838000  0.3857000     6.463000  0.5538000     7.212000  0.5371000     -0.7500000     0.7715000 
1 1 1 1  60 5  o 4.132000  0.5265000     3.848000  0.7955000     4.416000  0.6900000     -0.5674000     1.053000  
1 1 1 1  60 6  o 1.571000  0.4791000     1.631000  0.6950000     1.511000  0.6596000     0.1206000      0.9582000 
1 1 1 1  60 7  o 1.852000  0.4903000     1.452000  0.6386000     2.252000  0.7441000     -0.8000000     0.9806000 
1 1 1 1  60 8  o 2.026000  0.4903000     1.423000  0.6456000     2.630000  0.7379000     -1.207000      0.9805000 
1 1 1 1  60 9  o 2.080000  0.5334000     2.323000  0.7696000     1.837000  0.7386000     0.4855000      1.067000  
1 1 1 1  60 10 o 1.461000  0.4525000     1.712000  0.6990000     1.211000  0.5749000     0.5010000      0.9050000 
1 1 1 1  60 11 o 1.878000  0.5078000     1.739000  0.7039000     2.017000  0.7321000     -0.2781000     1.016000  
1 1 1 1  60 12 o 1.501000  0.4624000     1.633000  0.6849000     1.369000  0.6215000     0.2637000      0.9248000 
1 1 1 1  61 0  o 1.739000  0.9991000     1.739000  0.9991000     1.739000  0.9991000     -0.000000      0.000000  
1 1 1 1  61 1  o 1.998000  0.5646000     1.517000  0.7084000     2.479000  0.8795000     -0.9620000     1.129000  
1 1 1 1  61 2  o 5.154000  0.4357000     4.893000  0.6406000     5.414000  0.5908000     -0.5214000     0.8715000 
1 1 1 1  61 3  o 3.711000  0.4304000     3.469000  0.6433000     3.952000  0.5719000     -0.4827000     0.8608000 
1 1 1 1  61 4  o 2.411000  0.5228000     2.373000  0.7312000     2.450000  0.7474000     -0.7643000E-01 1.046000  
1 1 1 1  61 5  o 3.044000  0.4813000     3.530000  0.5995000     2.558000  0.7531000     0.9727000      0.9626000 
1 1 1 1  61 6  o 5.288000  0.3093000     4.945000  0.4573000     5.630000  0.4167000     -0.6846000     0.6187000 
1 1 1 1  61 7  o 1.813000  0.5075000     1.811000  0.7176000     1.815000  0.7178000     -0.3621000E-02 1.015000  
1 1 1 1  61 8  o 2.030000  0.5012000     1.575000  0.6730000     2.485000  0.7429000     -0.9099000     1.002000  
1 1 1 1  61 9  o 2.017000  0.5127000     2.341000  0.7462000     1.693000  0.7033000     0.6479000      1.025000  
1 1 1 1  61 10 o 1.228000  0.4101000     1.411000  0.6376000     1.046000  0.5161000     0.3650000      0.8203000 
1 1 1 1  61 11 o 1.444000  0.4568000     1.572000  0.6797000     1.316000  0.6106000     0.2560000      0.9137000 
1 1 1 1  61 12 o 1.315000  0.4690000     1.368000  0.6861000     1.261000  0.6396000     0.1069000      0.9380000 
1 1 1 1  62 0  o 1.833000  0.9019000     1.833000  0.9019000     1.833000  0.9019000     -0.000000      0.000000  
1 1 1 1  62 1  o 2.432000  0.5328000     2.236000  0.7494000     2.627000  0.7576000     -0.3917000     1.066000  
1 1 1 1  62 2  o 3.756000  0.4100000     4.203000  0.5154000     3.309000  0.6377000     0.8947000      0.8199000 
1 1 1 1  62 3  o 1.353000  0.4405000     1.272000  0.5996000     1.434000  0.6455000     -0.1630000     0.8810000 
1 1 1 1  62 4  o 3.237000  0.4598000     3.976000  0.5407000     2.497000  0.7438000     1.479000       0.9196000 
1 1 1 1  62 5  o 1.995000  0.5247000     2.022000  0.7399000     1.968000  0.7442000     0.5486000E-01  1.049000  
1 1 1 1  62 6  o 2.102000  0.5282000     1.845000  0.7201000     2.360000  0.7729000     -0.5153000     1.056000  
1 1 1 1  62 7  o 1.211000  0.4067000     1.222000  0.5797000     1.200000  0.5707000     0.2174000E-01  0.8135000 
1 1 1 1  62 8  o 1.216000  0.4085000     1.066000  0.5221000     1.366000  0.6285000     -0.2993000     0.8171000 
1 1 1 1  62 9  f 4.993000  0.3282000     5.054000  0.4571000     4.933000  0.4710000     0.1209000      0.6564000 
1 1 1 1  62 10 o 1.550000  0.4750000     1.484000  0.6546000     1.616000  0.6884000     -0.1319000     0.9500000 
1 1 1 1  62 11 o 1.871000  0.5672000     1.692000  0.7661000     2.050000  0.8367000     -0.3579000     1.134000  
1 1 1 1  63 0  o 1.429000  0.8391000     1.429000  0.8391000     1.429000  0.8391000     -0.000000      0.000000  
1 1 1 1  63 1  o 2.637000  0.5225000     2.509000  0.7494000     2.765000  0.7282000     -0.2555000     1.045000  
1 1 1 1  63 2  o 4.131000  0.3942000     3.920000  0.5823000     4.342000  0.5316000     -0.4225000     0.7885000 
1 1 1 1  63 3  o 1.371000  0.4422000     1.267000  0.5928000     1.474000  0.6563000     -0.2068000     0.8844000 
1 1 1 1  63 4  o 4.865000  0.3317000     4.853000  0.4733000     4.878000  0.4647000     -0.2528000E-01 0.6633000 
1 1 1 1  63 5  o 3.270000  0.4618000     3.747000  0.5763000     2.794000  0.7218000     0.9527000      0.9237000 
1 1 1 1  63 6  o 1.740000  0.4818000     2.137000  0.7410000     1.343000  0.6159000     0.7939000      0.9635000 
1 1 1 1  63 7  o 1.528000  0.4652000     1.744000  0.7075000     1.313000  0.6042000     0.4315000      0.9304000 
1 1 1 1  63 8  o 1.920000  0.5017000     1.450000  0.6491000     2.390000  0.7652000     -0.9403000     1.003000  
1 1 1 1  63 9  o 2.878000  0.5104000     2.688000  0.7383000     3.068000  0.7050000     -0.3807000     1.021000  
1 1 1 1  63 10 o 1.971000  0.6012000     2.182000  0.8928000     1.760000  0.8054000     0.4220000      1.202000  
1 1 1 1  64 0  o 0.8065000 0.5705000     0.8065000 0.5705000     0.8065000 0.5705000     -0.000000      0.000000  
1 1 1 1  64 1  o 1.527000  0.4656000     1.271000  0.5984000     1.783000  0.7135000     -0.5123000     0.9312000 
1 1 1 1  64 2  o 3.170000  0.4713000     3.302000  0.6424000     3.038000  0.6897000     0.2640000      0.9425000 
1 1 1 1  64 3  o 2.240000  0.4964000     1.606000  0.6845000     2.874000  0.7192000     -1.268000      0.9929000 
1 1 1 1  64 4  o 2.652000  0.4488000     3.707000  0.5796000     1.597000  0.6854000     2.109000       0.8976000 
1 1 1 1  64 5  o 2.308000  0.4722000     3.151000  0.6677000     1.466000  0.6678000     1.684000       0.9444000 
1 1 1 1  64 6  o 1.123000  0.3824000     1.217000  0.5728000     1.030000  0.5067000     0.1869000      0.7647000 
1 1 1 1  64 7  o 2.044000  0.4961000     2.502000  0.7225000     1.585000  0.6799000     0.9167000      0.9921000 
1 1 1 1  64 8  o 1.358000  0.4424000     1.372000  0.6298000     1.345000  0.6214000     0.2658000E-01  0.8848000 
1 1 1 1  65 0  o 3.673000  0.6247000     3.673000  0.6247000     3.673000  0.6247000     -0.000000      0.000000  
1 1 1 1  65 1  o 1.416000  0.4521000     1.428000  0.6420000     1.404000  0.6369000     0.2461000E-01  0.9043000 
1 1 1 1  65 2  o 1.261000  0.4174000     0.9321000 0.4681000     1.591000  0.6912000     -0.6588000     0.8348000 
1 1 1 1  65 3  o 3.353000  0.4596000     3.282000  0.6601000     3.424000  0.6396000     -0.1420000     0.9192000 
1 1 1 1  65 4  o 2.697000  0.4866000     3.194000  0.6352000     2.201000  0.7373000     0.9930000      0.9732000 
1 1 1 1  65 5  o 1.771000  0.5051000     1.840000  0.7234000     1.701000  0.7051000     0.1391000      1.010000  
1 1 1 1  65 6  o 2.820000  0.4933000     3.427000  0.6341000     2.214000  0.7559000     1.213000       0.9866000 
1 1 1 1  65 7  o 1.774000  0.5047000     1.711000  0.7101000     1.836000  0.7173000     -0.1248000     1.009000  
1 1 1 1  66 0  o 1.210000  0.7670000     1.210000  0.7670000     1.210000  0.7670000     0.000000       0.000000  
1 1 1 1  66 1  o 1.136000  0.3894000     1.076000  0.5267000     1.196000  0.5737000     -0.1196000     0.7788000 
1 1 1 1  66 2  f 2.501000  0.5197000     2.141000  0.7442000     2.861000  0.7257000     -0.7202000     1.039000  
1 1 1 1  66 3  o 1.659000  0.4919000     1.839000  0.7294000     1.478000  0.6603000     0.3609000      0.9839000 
1 1 1 1  66 4  o 2.300000  0.5353000     2.195000  0.7518000     2.406000  0.7620000     -0.2115000     1.071000  
1 1 1 1  66 5  o 2.002000  0.5379000     1.992000  0.7834000     2.013000  0.7375000     -0.2173000E-01 1.076000  
1 1 1 1  67 0  o 1.587000  0.8754000     1.587000  0.8754000     1.587000  0.8754000     0.000000       0.000000  
1 1 1 1  67 1  o 3.069000  0.4956000     3.329000  0.6536000     2.808000  0.7451000     0.5212000      0.9912000 
1 1 1 1  67 2  o 1.341000  0.4358000     1.175000  0.5644000     1.508000  0.6643000     -0.3331000     0.8717000 
1 1 1 1  67 3  o 2.094000  0.5338000     2.296000  0.7663000     1.892000  0.7432000     0.4041000      1.068000  
1 1 1 2  0  1  o 6.389000  0.8297000E-01 6.389000  0.8297000E-01 6.389000  0.8297000E-01 -0.000000      0.000000  
1 1 1 2  0  2  o 44.52000  0.4840000     44.52000  0.4840000     44.52000  0.4840000     -0.000000      0.000000  
1 1 1 2  0  3  o 15.96000  0.1865000     15.96000  0.1865000     15.96000  0.1865000     -0.000000      0.000000  
1 1 1 2  0  4  o 15.06000  0.1837000     15.06000  0.1837000     15.06000  0.1837000     -0.000000      0.000000  
1 1 1 2  0  5  o 11.47000  0.1866000     11.47000  0.1866000     11.47000  0.1866000     0.000000       0.000000  
1 1 1 2  0  6  o 12.80000  0.1794000     12.80000  0.1794000     12.80000  0.1794000     0.000000       0.000000  
1 1 1 2  0  7  o 4.721000  0.2016000     4.721000  0.2016000     4.721000  0.2016000     0.000000       0.000000  
1 1 1 2  0  8  o 2.970000  0.3169000     2.970000  0.3169000     2.970000  0.3169000     -0.000000      0.000000  
1 1 1 2  0  9  o 36.93000  0.4193000     36.93000  0.4193000     36.93000  0.4193000     0.000000       0.000000  
1 1 1 2  0  10 o 4.000000  0.3191000     4.000000  0.3191000     4.000000  0.3191000     0.000000       0.000000  
1 1 1 2  0  11 o 6.161000  0.2683000     6.161000  0.2683000     6.161000  0.2683000     -0.000000      0.000000  
1 1 1 2  0  12 o 7.200000  0.2846000     7.200000  0.2846000     7.200000  0.2846000     -0.000000      0.000000  
1 1 1 2  0  13 o 1.570000  0.8302000     1.570000  0.8302000     1.570000  0.8302000     0.000000       0.000000  
1 1 1 2  0  14 o 9.077000  0.2983000     9.077000  0.2983000     9.077000  0.2983000     0.000000       0.000000  
1 1 1 2  0  15 o 1.090000  0.7215000     1.090000  0.7215000     1.090000  0.7215000     0.000000       0.000000  
1 1 1 2  0  16 o 2.500000  1.066000      2.500000  1.066000      2.500000  1.066000      -0.000000      0.000000  
1 1 1 2  0  17 f 1.676000  0.9616000     1.676000  0.9616000     1.676000  0.9616000     -0.000000      0.000000  
1 1 1 2  0  18 o 21.36000  0.3411000     21.36000  0.3411000     21.36000  0.3411000     -0.000000      0.000000  
1 1 1 2  0  19 o 4.806000  0.7405000     4.806000  0.7405000     4.806000  0.7405000     -0.000000      0.000000  
1 1 1 2  0  20 o 1.303000  0.8828000     1.303000  0.8828000     1.303000  0.8828000     0.000000       0.000000  
1 1 1 2  0  21 o 2.370000  1.191000      2.370000  1.191000      2.370000  1.191000      0.000000       0.000000  
1 1 1 2  0  22 o 0.9247000 0.6667000     0.9247000 0.6667000     0.9247000 0.6667000     0.000000       0.000000  
1 1 1 2  0  23 o 6.814000  0.4670000     6.814000  0.4670000     6.814000  0.4670000     0.000000       0.000000  
1 1 1 2  0  24 o 1.109000  0.7454000     1.109000  0.7454000     1.109000  0.7454000     -0.000000      0.000000  
1 1 1 2  0  25 o 1.588000  0.9696000     1.588000  0.9696000     1.588000  0.9696000     0.000000       0.000000  
1 1 1 2  0  26 o 0.9423000 0.6558000     0.9423000 0.6558000     0.9423000 0.6558000     -0.000000      0.000000  
1 1 1 2  0  27 o 1.285000  0.8122000     1.285000  0.8122000     1.285000  0.8122000     0.000000       0.000000  
1 1 1 2  0  28 o 0.8661000 0.6257000     0.8661000 0.6257000     0.8661000 0.6257000     0.000000       0.000000  
1 1 1 2  1  1  o 17.26000  0.1353000     17.25000  0.1911000     17.27000  0.1915000     -0.2938000E-01 0.2705000 
1 1 1 2  1  2  o 36.19000  0.2790000     36.06000  0.3931000     36.32000  0.3960000     -0.2678000     0.5580000 
1 1 1 2  1  3  o 32.10000  0.2499000     32.25000  0.3549000     31.96000  0.3518000     0.2915000      0.4997000 
1 1 1 2  1  4  o 27.71000  0.2193000     27.86000  0.3117000     27.56000  0.3085000     0.2988000      0.4386000 
1 1 1 2  1  5  o 13.27000  0.1593000     13.55000  0.2052000     12.99000  0.2436000     0.5522000      0.3186000 
1 1 1 2  1  6  o 6.174000  0.1144000     6.099000  0.1620000     6.249000  0.1616000     -0.1496000     0.2288000 
1 1 1 2  1  7  o 23.99000  0.1998000     23.93000  0.2821000     24.04000  0.2831000     -0.1053000     0.3996000 
1 1 1 2  1  8  o 13.54000  0.1403000     13.58000  0.1985000     13.50000  0.1984000     0.7924000E-01  0.2806000 
1 1 1 2  1  9  o 12.21000  0.1435000     12.19000  0.2031000     12.22000  0.2028000     -0.2282000E-01 0.2870000 
1 1 1 2  1  10 f 4.533000  0.2049000     4.751000  0.2821000     4.315000  0.2973000     0.4367000      0.4099000 
1 1 1 2  1  11 o 8.097000  0.1697000     8.072000  0.2411000     8.123000  0.2390000     -0.5113000E-01 0.3395000 
1 1 1 2  1  12 o 2.204000  0.4524000     2.565000  0.6206000     1.843000  0.6584000     0.7223000      0.9047000 
1 1 1 2  1  13 o 4.245000  0.3210000     4.434000  0.4348000     4.056000  0.4722000     0.3780000      0.6419000 
1 1 1 2  1  14 o 6.818000  0.2457000     6.807000  0.3479000     6.830000  0.3471000     -0.2314000E-01 0.4914000 
1 1 1 2  1  15 o 6.971000  0.2591000     7.139000  0.3625000     6.803000  0.3702000     0.3361000      0.5181000 
1 1 1 2  1  16 o 8.506000  0.2883000     8.952000  0.4043000     8.059000  0.4112000     0.8924000      0.5766000 
1 1 1 2  1  17 o 2.912000  0.6002000     3.012000  0.8370000     2.812000  0.8606000     0.1999000      1.200000  
1 1 1 2  1  18 o 14.94000  0.2323000     15.46000  0.3298000     14.41000  0.3274000     1.045000       0.4647000 
1 1 1 2  1  19 f 2.467000  0.6455000     2.137000  0.8722000     2.798000  0.9517000     -0.6606000     1.291000  
1 1 1 2  1  20 o 2.452000  0.6689000     2.116000  0.9069000     2.788000  0.9834000     -0.6725000     1.338000  
1 1 1 2  1  21 o 5.176000  0.5197000     5.689000  0.6763000     4.663000  0.7893000     1.027000       1.039000  
1 1 1 2  1  22 f 1.824000  0.5676000     1.410000  0.6834000     2.239000  0.9063000     -0.8292000     1.135000  
1 1 1 2  1  23 o 3.610000  0.5720000     3.747000  0.7839000     3.473000  0.8331000     0.2745000      1.144000  
1 1 1 2  1  24 o 2.457000  0.5672000     2.158000  0.8071000     2.757000  0.7972000     -0.5987000     1.134000  
1 1 1 2  1  25 o 1.708000  0.5367000     1.251000  0.6204000     2.165000  0.8759000     -0.9138000     1.073000  
1 1 1 2  1  26 o 1.673000  0.5054000     1.461000  0.6716000     1.886000  0.7555000     -0.4249000     1.011000  
1 1 1 2  1  27 o 1.332000  0.4447000     1.348000  0.6318000     1.316000  0.6261000     0.3194000E-01  0.8895000 
1 1 1 2  1  28 o 1.321000  0.4589000     1.450000  0.6979000     1.193000  0.5962000     0.2572000      0.9179000 
1 1 1 2  2  0  o 10.94000  0.1238000     10.94000  0.1238000     10.94000  0.1238000     0.000000       0.000000  
1 1 1 2  2  1  o 6.168000  0.5810000E-01 6.037000  0.8111000E-01 6.300000  0.8320000E-01 -0.2631000     0.1162000 
1 1 1 2  2  2  o 44.39000  0.3413000     44.74000  0.4866000     44.04000  0.4788000     0.7009000      0.6826000 
1 1 1 2  2  3  o 70.15000  0.5385000     69.83000  0.7580000     70.48000  0.7651000     -0.6466000     1.077000  
1 1 1 2  2  4  o 20.39000  0.1666000     20.43000  0.2359000     20.35000  0.2352000     0.7968000E-01  0.3331000 
1 1 1 2  2  5  o 12.51000  0.2173000     12.27000  0.2407000     12.74000  0.3619000     -0.4732000     0.4346000 
1 1 1 2  2  6  f 3.879000  0.1424000     3.816000  0.2042000     3.942000  0.1983000     -0.1261000     0.2847000 
1 1 1 2  2  7  o 24.93000  0.2064000     24.78000  0.2904000     25.08000  0.2934000     -0.3012000     0.4128000 
1 1 1 2  2  8  o 19.13000  0.1710000     19.17000  0.2420000     19.08000  0.2418000     0.9394000E-01  0.3420000 
1 1 1 2  2  9  f 20.88000  0.1867000     20.76000  0.2630000     21.00000  0.2650000     -0.2350000     0.3734000 
1 1 1 2  2  10 o 5.592000  0.2032000     5.587000  0.2886000     5.598000  0.2861000     -0.1095000E-01 0.4064000 
1 1 1 2  2  11 o 8.311000  0.1706000     8.381000  0.2414000     8.242000  0.2411000     0.1394000      0.3412000 
1 1 1 2  2  12 o 4.826000  0.2578000     4.927000  0.3606000     4.725000  0.3686000     0.2022000      0.5156000 
1 1 1 2  2  13 o 4.436000  0.3185000     3.862000  0.5004000     5.010000  0.3942000     -1.148000      0.6371000 
1 1 1 2  2  14 o 5.059000  0.3002000     5.394000  0.4022000     4.723000  0.4458000     0.6708000      0.6004000 
1 1 1 2  2  15 o 16.26000  0.2062000     15.84000  0.2911000     16.68000  0.2921000     -0.8349000     0.4124000 
1 1 1 2  2  16 o 9.626000  0.2728000     9.442000  0.3900000     9.811000  0.3815000     -0.3690000     0.5455000 
1 1 1 2  2  17 o 4.764000  0.4360000     5.475000  0.5197000     4.053000  0.7003000     1.422000       0.8721000 
1 1 1 2  2  18 o 3.233000  0.5838000     3.954000  0.7557000     2.513000  0.8899000     1.441000       1.168000  
1 1 1 2  2  19 o 7.517000  0.3448000     7.927000  0.4691000     7.106000  0.5055000     0.8207000      0.6896000 
1 1 1 2  2  20 o 5.072000  0.5203000     5.338000  0.7028000     4.807000  0.7675000     0.5311000      1.041000  
1 1 1 2  2  21 o 2.860000  0.6798000     2.315000  0.9313000     3.405000  0.9906000     -1.091000      1.360000  
1 1 1 2  2  22 o 1.886000  0.5841000     1.610000  0.7594000     2.162000  0.8877000     -0.5521000     1.168000  
1 1 1 2  2  23 o 3.471000  0.5514000     2.380000  0.8820000     4.562000  0.6619000     -2.181000      1.103000  
1 1 1 2  2  24 o 3.647000  0.4947000     3.997000  0.6517000     3.297000  0.7445000     0.6999000      0.9895000 
1 1 1 2  2  25 o 1.812000  0.5657000     1.524000  0.7204000     2.100000  0.8725000     -0.5768000     1.131000  
1 1 1 2  2  26 f 1.822000  0.5268000     1.603000  0.6978000     2.040000  0.7893000     -0.4369000     1.054000  
1 1 1 2  2  27 o 2.180000  0.5604000     2.083000  0.7891000     2.277000  0.7960000     -0.1940000     1.121000  
1 1 1 2  2  28 o 1.078000  0.3858000     1.019000  0.5198000     1.137000  0.5703000     -0.1178000     0.7717000 
1 1 1 2  3  0  o 12.68000  0.1441000     12.68000  0.1441000     12.68000  0.1441000     -0.000000      0.000000  
1 1 1 2  3  1  o 3.908000  0.6870000E-01 3.947000  0.9756000E-01 3.870000  0.9674000E-01 0.7723000E-01  0.1374000 
1 1 1 2  3  2  f 10.43000  0.1127000     10.69000  0.1480000     10.16000  0.1700000     0.5339000      0.2254000 
1 1 1 2  3  3  o 3.186000  0.9462000E-01 3.331000  0.1313000     3.040000  0.1363000     0.2912000      0.1892000 
1 1 1 2  3  4  o 44.18000  0.3426000     44.63000  0.4892000     43.73000  0.4798000     0.9010000      0.6852000 
1 1 1 2  3  5  o 23.98000  0.3902000     24.39000  0.5619000     23.56000  0.5417000     0.8263000      0.7805000 
1 1 1 2  3  6  f 29.93000  0.2398000     30.03000  0.3401000     29.82000  0.3380000     0.2063000      0.4795000 
1 1 1 2  3  7  o 25.86000  0.2132000     26.07000  0.3038000     25.64000  0.2992000     0.4366000      0.4264000 
1 1 1 2  3  8  o 22.06000  0.1896000     22.17000  0.2688000     21.96000  0.2674000     0.2103000      0.3792000 
1 1 1 2  3  9  o 6.424000  0.1525000     6.262000  0.2185000     6.587000  0.2129000     -0.3254000     0.3050000 
1 1 1 2  3  10 o 13.98000  0.1794000     13.97000  0.2537000     14.00000  0.2536000     -0.3540000E-01 0.3587000 
1 1 1 2  3  11 o 5.775000  0.2009000     5.493000  0.2903000     6.056000  0.2778000     -0.5630000     0.4018000 
1 1 1 2  3  12 o 7.127000  0.2004000     7.298000  0.2800000     6.955000  0.2866000     0.3432000      0.4007000 
1 1 1 2  3  13 o 7.251000  0.2163000     6.999000  0.3132000     7.504000  0.2984000     -0.5051000     0.4326000 
1 1 1 2  3  14 o 7.493000  0.2338000     7.086000  0.3431000     7.899000  0.3178000     -0.8132000     0.4677000 
1 1 1 2  3  15 o 12.54000  0.2076000     12.52000  0.2932000     12.56000  0.2940000     -0.4445000E-01 0.4152000 
1 1 1 2  3  16 o 8.063000  0.2593000     8.043000  0.3655000     8.084000  0.3679000     -0.4082000E-01 0.5186000 
1 1 1 2  3  17 o 9.204000  0.2604000     9.002000  0.3716000     9.406000  0.3649000     -0.4042000     0.5208000 
1 1 1 2  3  18 o 4.158000  0.5150000     3.714000  0.8065000     4.602000  0.6405000     -0.8881000     1.030000  
1 1 1 2  3  19 o 9.716000  0.2899000     9.566000  0.4181000     9.866000  0.4018000     -0.2994000     0.5799000 
1 1 1 2  3  20 o 3.292000  0.7125000     2.890000  1.064000      3.694000  0.9475000     -0.8043000     1.425000  
1 1 1 2  3  21 f 3.674000  0.6598000     4.204000  0.8661000     3.143000  0.9956000     1.061000       1.320000  
1 1 1 2  3  22 o 1.940000  0.5935000     1.933000  0.8351000     1.946000  0.8435000     -0.1332000E-01 1.187000  
1 1 1 2  3  23 o 1.978000  0.5928000     1.866000  0.8092000     2.090000  0.8666000     -0.2231000     1.186000  
1 1 1 2  3  24 o 2.052000  0.5660000     1.817000  0.7721000     2.287000  0.8277000     -0.4704000     1.132000  
1 1 1 2  3  25 o 2.105000  0.6111000     1.800000  0.7999000     2.411000  0.9239000     -0.6107000     1.222000  
1 1 1 2  3  26 o 1.351000  0.4491000     1.134000  0.5596000     1.569000  0.7025000     -0.4359000     0.8981000 
1 1 1 2  3  27 o 1.944000  0.5370000     2.173000  0.7770000     1.715000  0.7415000     0.4583000      1.074000  
1 1 1 2  3  28 o 1.096000  0.3937000     1.171000  0.5903000     1.021000  0.5211000     0.1505000      0.7874000 
1 1 1 2  4  0  o 25.81000  0.2831000     25.81000  0.2831000     25.81000  0.2831000     0.000000       0.000000  
1 1 1 2  4  1  o 58.02000  0.4446000     58.39000  0.6326000     57.65000  0.6249000     0.7369000      0.8892000 
1 1 1 2  4  2  o 28.86000  0.2243000     29.07000  0.3193000     28.65000  0.3150000     0.4157000      0.4485000 
1 1 1 2  4  3  o 15.19000  0.1317000     15.52000  0.2111000     14.87000  0.1575000     0.6559000      0.2634000 
1 1 1 2  4  4  o 32.45000  0.2548000     32.64000  0.3623000     32.25000  0.3585000     0.3887000      0.5097000 
1 1 1 2  4  5  o 13.16000  0.1807000     13.35000  0.2625000     12.97000  0.2483000     0.3722000      0.3613000 
1 1 1 2  4  6  o 29.65000  0.2381000     29.73000  0.3373000     29.57000  0.3362000     0.1583000      0.4763000 
1 1 1 2  4  7  o 23.26000  0.1954000     23.65000  0.2800000     22.88000  0.2727000     0.7683000      0.3909000 
1 1 1 2  4  8  o 28.20000  0.2315000     27.94000  0.3248000     28.46000  0.3300000     -0.5176000     0.4631000 
1 1 1 2  4  9  f 16.00000  0.1600000     15.90000  0.2256000     16.11000  0.2271000     -0.2142000     0.3201000 
1 1 1 2  4  10 o 11.22000  0.1718000     11.35000  0.2440000     11.08000  0.2419000     0.2722000      0.3436000 
1 1 1 2  4  11 o 5.714000  0.2083000     5.980000  0.2830000     5.449000  0.3058000     0.5308000      0.4167000 
1 1 1 2  4  12 o 12.19000  0.1769000     12.32000  0.2515000     12.05000  0.2488000     0.2631000      0.3538000 
1 1 1 2  4  13 o 2.834000  0.4608000     3.117000  0.6069000     2.551000  0.6935000     0.5655000      0.9216000 
1 1 1 2  4  14 o 1.656000  0.4890000     1.439000  0.6473000     1.873000  0.7332000     -0.4340000     0.9780000 
1 1 1 2  4  15 o 4.006000  0.4265000     4.072000  0.5978000     3.940000  0.6085000     0.1312000      0.8531000 
1 1 1 2  4  16 o 6.363000  0.3104000     6.015000  0.4607000     6.710000  0.4161000     -0.6957000     0.6208000 
1 1 1 2  4  17 o 7.124000  0.3082000     6.913000  0.4391000     7.334000  0.4326000     -0.4212000     0.6164000 
1 1 1 2  4  18 f 5.695000  0.3895000     5.645000  0.5460000     5.746000  0.5558000     -0.1007000     0.7791000 
1 1 1 2  4  19 o 6.043000  0.4108000     6.138000  0.5713000     5.948000  0.5904000     0.1904000      0.8215000 
1 1 1 2  4  20 o 3.751000  0.7603000     4.147000  1.042000      3.355000  1.108000      0.7926000      1.521000  
1 1 1 2  4  21 o 2.152000  0.6410000     1.679000  0.7983000     2.625000  1.003000      -0.9466000     1.282000  
1 1 1 2  4  22 o 2.189000  0.6146000     2.720000  0.9554000     1.658000  0.7735000     1.062000       1.229000  
1 1 1 2  4  23 o 1.912000  0.5810000     2.106000  0.8643000     1.718000  0.7769000     0.3882000      1.162000  
1 1 1 2  4  24 o 2.777000  0.5671000     2.316000  0.8404000     3.238000  0.7616000     -0.9221000     1.134000  
1 1 1 2  4  25 o 1.949000  0.6179000     1.923000  0.8436000     1.975000  0.9030000     -0.5281000E-01 1.236000  
1 1 1 2  4  26 o 1.358000  0.4509000     1.398000  0.6494000     1.318000  0.6258000     0.7941000E-01  0.9019000 
1 1 1 2  4  27 o 1.371000  0.4531000     1.626000  0.7197000     1.115000  0.5506000     0.5111000      0.9062000 
1 1 1 2  5  0  o 84.97000  0.9205000     84.97000  0.9205000     84.97000  0.9205000     -0.000000      0.000000  
1 1 1 2  5  1  o 33.65000  0.2599000     33.49000  0.3661000     33.80000  0.3690000     -0.3066000     0.5198000 
1 1 1 2  5  2  o 54.27000  0.4168000     54.02000  0.5867000     54.52000  0.5922000     -0.4952000     0.8336000 
1 1 1 2  5  3  o 21.68000  0.1733000     21.41000  0.2420000     21.95000  0.2481000     -0.5471000     0.3466000 
1 1 1 2  5  4  o 12.02000  0.1115000     12.14000  0.1584000     11.90000  0.1570000     0.2441000      0.2230000 
1 1 1 2  5  5  o 17.87000  0.3090000     17.64000  0.4351000     18.11000  0.4389000     -0.4629000     0.6180000 
1 1 1 2  5  6  f 21.07000  0.1779000     21.13000  0.2523000     21.01000  0.2509000     0.1178000      0.3558000 
1 1 1 2  5  7  o 23.70000  0.1986000     23.84000  0.2822000     23.56000  0.2795000     0.2759000      0.3972000 
1 1 1 2  5  8  o 35.06000  0.2807000     35.15000  0.3978000     34.97000  0.3960000     0.1784000      0.5613000 
1 1 1 2  5  9  o 13.20000  0.1489000     13.39000  0.2111000     13.00000  0.2101000     0.3942000      0.2979000 
1 1 1 2  5  10 o 12.78000  0.1965000     12.54000  0.2486000     13.02000  0.3043000     -0.4817000     0.3929000 
1 1 1 2  5  11 o 9.191000  0.1688000     9.055000  0.2405000     9.328000  0.2370000     -0.2730000     0.3377000 
1 1 1 2  5  12 o 6.402000  0.2199000     6.261000  0.3171000     6.542000  0.3046000     -0.2809000     0.4397000 
1 1 1 2  5  13 o 2.657000  0.4929000     2.445000  0.7292000     2.868000  0.6633000     -0.4230000     0.9858000 
1 1 1 2  5  14 o 4.658000  0.3399000     4.514000  0.4969000     4.803000  0.4638000     -0.2890000     0.6797000 
1 1 1 2  5  15 o 7.992000  0.2834000     8.130000  0.3972000     7.853000  0.4043000     0.2771000      0.5667000 
1 1 1 2  5  16 o 3.874000  0.4904000     3.779000  0.6843000     3.969000  0.7027000     -0.1898000     0.9808000 
1 1 1 2  5  17 o 10.12000  0.2560000     10.21000  0.3577000     10.04000  0.3663000     0.1695000      0.5120000 
1 1 1 2  5  18 f 6.524000  0.3522000     5.992000  0.5266000     7.056000  0.4679000     -1.064000      0.7044000 
1 1 1 2  5  19 o 3.360000  0.5965000     4.479000  0.7577000     2.242000  0.9215000     2.237000       1.193000  
1 1 1 2  5  20 o 2.766000  0.7460000     2.966000  1.076000      2.565000  1.033000      0.4007000      1.492000  
1 1 1 2  5  21 o 4.365000  0.6288000     4.908000  0.7886000     3.822000  0.9795000     1.086000       1.258000  
1 1 1 2  5  22 o 2.579000  0.6021000     1.709000  0.7858000     3.450000  0.9125000     -1.741000      1.204000  
1 1 1 2  5  23 o 1.893000  0.5594000     1.470000  0.7021000     2.316000  0.8712000     -0.8466000     1.119000  
1 1 1 2  5  24 o 2.095000  0.5678000     2.428000  0.8438000     1.762000  0.7601000     0.6656000      1.136000  
1 1 1 2  5  25 o 1.994000  0.6469000     2.383000  1.030000      1.605000  0.7828000     0.7786000      1.294000  
1 1 1 2  5  26 o 1.780000  0.5202000     2.145000  0.8053000     1.414000  0.6588000     0.7308000      1.040000  
1 1 1 2  5  27 o 1.125000  0.3922000     0.9601000 0.4854000     1.290000  0.6161000     -0.3302000     0.7844000 
1 1 1 2  6  0  o 5.457000  0.9477000E-01 5.457000  0.9477000E-01 5.457000  0.9477000E-01 0.000000       0.000000  
1 1 1 2  6  1  o 21.55000  0.1701000     21.35000  0.2385000     21.75000  0.2426000     -0.4030000     0.3402000 
1 1 1 2  6  2  o 11.73000  0.1026000     11.58000  0.1437000     11.88000  0.1466000     -0.2998000     0.2053000 
1 1 1 2  6  3  o 26.84000  0.2117000     27.24000  0.3031000     26.44000  0.2956000     0.7954000      0.4233000 
1 1 1 2  6  4  f 22.66000  0.1826000     22.69000  0.2585000     22.64000  0.2580000     0.4812000E-01  0.3653000 
1 1 1 2  6  5  o 20.53000  0.2100000     20.52000  0.3435000     20.55000  0.2416000     -0.2679000E-01 0.4199000 
1 1 1 2  6  6  o 26.41000  0.2152000     26.29000  0.3033000     26.52000  0.3055000     -0.2359000     0.4305000 
1 1 1 2  6  7  f 7.587000  0.1260000     7.864000  0.1776000     7.311000  0.1790000     0.5537000      0.2521000 
1 1 1 2  6  8  o 16.95000  0.1595000     16.92000  0.2252000     16.98000  0.2260000     -0.5769000E-01 0.3190000 
1 1 1 2  6  9  o 23.58000  0.2046000     23.47000  0.2885000     23.69000  0.2902000     -0.2160000     0.4092000 
1 1 1 2  6  10 o 10.65000  0.3003000     10.83000  0.4279000     10.47000  0.4216000     0.3627000      0.6007000 
1 1 1 2  6  11 o 13.32000  0.1669000     13.70000  0.2383000     12.93000  0.2337000     0.7634000      0.3338000 
1 1 1 2  6  12 o 6.049000  0.2265000     5.980000  0.3212000     6.118000  0.3196000     -0.1388000     0.4531000 
1 1 1 2  6  13 o 10.65000  0.1909000     10.77000  0.2725000     10.54000  0.2673000     0.2300000      0.3817000 
1 1 1 2  6  14 o 12.28000  0.1988000     12.29000  0.2839000     12.27000  0.2782000     0.2147000E-01  0.3975000 
1 1 1 2  6  15 o 2.863000  0.5901000     2.447000  0.8551000     3.279000  0.8134000     -0.8323000     1.180000  
1 1 1 2  6  16 o 9.562000  0.2474000     9.051000  0.3580000     10.07000  0.3416000     -1.023000      0.4949000 
1 1 1 2  6  17 o 2.588000  0.6211000     2.792000  0.8844000     2.385000  0.8723000     0.4069000      1.242000  
1 1 1 2  6  18 o 1.338000  0.4624000     1.360000  0.6629000     1.316000  0.6448000     0.4363000E-01  0.9248000 
1 1 1 2  6  19 o 3.672000  0.6456000     4.217000  0.8522000     3.126000  0.9701000     1.092000       1.291000  
1 1 1 2  6  20 o 3.442000  0.7306000     2.771000  1.042000      4.112000  1.024000      -1.341000      1.461000  
1 1 1 2  6  21 o 4.441000  0.6630000     3.396000  1.010000      5.486000  0.8586000     -2.090000      1.326000  
1 1 1 2  6  22 f 2.834000  0.6538000     3.254000  0.9182000     2.413000  0.9310000     0.8412000      1.308000  
1 1 1 2  6  23 o 1.607000  0.5204000     1.374000  0.6654000     1.840000  0.8005000     -0.4666000     1.041000  
1 1 1 2  6  24 o 1.744000  0.5331000     1.906000  0.7910000     1.583000  0.7151000     0.3226000      1.066000  
1 1 1 2  6  25 o 1.874000  0.6062000     1.509000  0.7394000     2.239000  0.9608000     -0.7298000     1.212000  
1 1 1 2  6  26 o 1.731000  0.5186000     1.688000  0.7274000     1.775000  0.7393000     -0.8701000E-01 1.037000  
1 1 1 2  6  27 o 1.711000  0.5169000     1.835000  0.7514000     1.587000  0.7100000     0.2481000      1.034000  
1 1 1 2  7  0  o 40.29000  0.4405000     40.29000  0.4405000     40.29000  0.4405000     -0.000000      0.000000  
1 1 1 2  7  1  o 31.50000  0.2450000     31.69000  0.3483000     31.31000  0.3446000     0.3714000      0.4900000 
1 1 1 2  7  2  o 6.708000  0.7843000E-01 6.590000  0.1104000     6.826000  0.1115000     -0.2362000     0.1569000 
1 1 1 2  7  3  o 14.75000  0.1264000     14.77000  0.1790000     14.73000  0.1784000     0.4059000E-01  0.2528000 
1 1 1 2  7  4  o 6.466000  0.1059000     6.305000  0.1714000     6.627000  0.1246000     -0.3226000     0.2119000 
1 1 1 2  7  5  f 10.21000  0.1160000     10.34000  0.1788000     10.08000  0.1479000     0.2579000      0.2320000 
1 1 1 2  7  6  o 24.95000  0.2043000     25.08000  0.2903000     24.82000  0.2875000     0.2573000      0.4086000 
1 1 1 2  7  7  o 19.14000  0.1689000     18.91000  0.2370000     19.37000  0.2406000     -0.4564000     0.3378000 
1 1 1 2  7  8  o 20.80000  0.1830000     20.76000  0.2586000     20.84000  0.2590000     -0.7758000E-01 0.3659000 
1 1 1 2  7  9  o 26.97000  0.2272000     27.09000  0.3225000     26.84000  0.3203000     0.2446000      0.4545000 
1 1 1 2  7  10 o 4.765000  0.4224000     4.825000  0.6117000     4.704000  0.5825000     0.1201000      0.8447000 
1 1 1 2  7  11 f 13.97000  0.1694000     14.25000  0.2407000     13.70000  0.2385000     0.5542000      0.3388000 
1 1 1 2  7  12 o 6.573000  0.2155000     6.678000  0.3024000     6.468000  0.3070000     0.2101000      0.4309000 
1 1 1 2  7  13 o 7.725000  0.2151000     7.705000  0.3048000     7.745000  0.3035000     -0.3969000E-01 0.4302000 
1 1 1 2  7  14 o 8.199000  0.2295000     8.051000  0.3227000     8.347000  0.3266000     -0.2957000     0.4591000 
1 1 1 2  7  15 o 3.120000  0.5764000     2.629000  0.8595000     3.612000  0.7684000     -0.9827000     1.153000  
1 1 1 2  7  16 o 5.267000  0.3730000     4.683000  0.5811000     5.851000  0.4678000     -1.168000      0.7459000 
1 1 1 2  7  17 o 5.200000  0.4012000     5.448000  0.5523000     4.953000  0.5822000     0.4945000      0.8025000 
1 1 1 2  7  18 o 9.609000  0.2749000     9.455000  0.3894000     9.762000  0.3881000     -0.3070000     0.5498000 
1 1 1 2  7  19 o 4.606000  0.5625000     4.148000  0.8703000     5.064000  0.7129000     -0.9157000     1.125000  
1 1 1 2  7  20 o 4.277000  0.7216000     4.034000  1.053000      4.520000  0.9865000     -0.4868000     1.443000  
1 1 1 2  7  21 o 1.969000  0.6193000     1.752000  0.8179000     2.187000  0.9302000     -0.4343000     1.239000  
1 1 1 2  7  22 o 2.655000  0.6635000     2.911000  0.9574000     2.400000  0.9189000     0.5111000      1.327000  
1 1 1 2  7  23 o 3.495000  0.5778000     3.275000  0.8443000     3.714000  0.7889000     -0.4388000     1.156000  
1 1 1 2  7  24 o 1.742000  0.5316000     1.743000  0.7580000     1.740000  0.7456000     0.3250000E-02  1.063000  
1 1 1 2  7  25 f 1.451000  0.5086000     1.316000  0.6555000     1.586000  0.7778000     -0.2694000     1.017000  
1 1 1 2  7  26 o 1.534000  0.4876000     1.445000  0.6630000     1.622000  0.7152000     -0.1777000     0.9752000 
1 1 1 2  7  27 o 1.636000  0.5075000     1.376000  0.6488000     1.895000  0.7805000     -0.5188000     1.015000  
1 1 1 2  8  0  o 7.964000  0.1179000     7.964000  0.1179000     7.964000  0.1179000     -0.000000      0.000000  
1 1 1 2  8  1  o 18.85000  0.1526000     18.61000  0.2134000     19.09000  0.2182000     -0.4834000     0.3052000 
1 1 1 2  8  2  o 16.14000  0.1350000     16.22000  0.1916000     16.07000  0.1901000     0.1500000      0.2699000 
1 1 1 2  8  3  o 8.954000  0.9350000E-01 9.174000  0.1337000     8.734000  0.1307000     0.4397000      0.1870000 
1 1 1 2  8  4  f 21.52000  0.3513000     21.52000  0.3513000     ?         ?             ?              ?         
1 1 1 2  8  5  o 19.51000  0.1756000     19.46000  0.2643000     19.55000  0.2314000     -0.8825000E-01 0.3513000 
1 1 1 2  8  6  o 14.86000  0.1382000     14.91000  0.1953000     14.82000  0.1956000     0.9651000E-01  0.2764000 
1 1 1 2  8  7  o 23.38000  0.1953000     23.72000  0.2793000     23.04000  0.2731000     0.6784000      0.3906000 
1 1 1 2  8  8  o 31.00000  0.2525000     31.23000  0.3594000     30.78000  0.3549000     0.4492000      0.5051000 
1 1 1 2  8  9  o 2.043000  0.3771000     2.349000  0.4992000     1.737000  0.5654000     0.6115000      0.7542000 
1 1 1 2  8  10 o 10.36000  0.3211000     10.48000  0.4605000     10.24000  0.4475000     0.2372000      0.6422000 
1 1 1 2  8  11 o 4.439000  0.2577000     4.267000  0.3753000     4.611000  0.3532000     -0.3435000     0.5154000 
1 1 1 2  8  12 o 2.490000  0.4578000     2.895000  0.5966000     2.086000  0.6947000     0.8091000      0.9157000 
1 1 1 2  8  13 o 7.753000  0.2149000     7.657000  0.3063000     7.849000  0.3014000     -0.1920000     0.4297000 
1 1 1 2  8  14 o 13.89000  0.1974000     13.78000  0.2780000     14.00000  0.2802000     -0.2205000     0.3947000 
1 1 1 2  8  15 o 9.708000  0.3212000     9.809000  0.4552000     9.608000  0.4533000     0.2008000      0.6424000 
1 1 1 2  8  16 o 4.697000  0.4263000     5.456000  0.4848000     3.939000  0.7013000     1.518000       0.8525000 
1 1 1 2  8  17 o 2.562000  0.6091000     3.051000  0.8841000     2.073000  0.8379000     0.9783000      1.218000  
1 1 1 2  8  18 o 9.291000  0.2856000     8.861000  0.4213000     9.722000  0.3859000     -0.8612000     0.5713000 
1 1 1 2  8  19 o 4.257000  0.5861000     2.954000  0.9892000     5.561000  0.6289000     -2.608000      1.172000  
1 1 1 2  8  20 o 4.260000  0.8507000     4.161000  1.196000      4.359000  1.210000      -0.1981000     1.701000  
1 1 1 2  8  21 o 3.294000  0.7072000     3.158000  1.014000      3.430000  0.9863000     -0.2723000     1.414000  
1 1 1 2  8  22 o 3.882000  0.6082000     4.384000  0.7816000     3.380000  0.9321000     1.004000       1.216000  
1 1 1 2  8  23 o 2.103000  0.5902000     2.390000  0.8775000     1.817000  0.7895000     0.5723000      1.180000  
1 1 1 2  8  24 o 1.857000  0.5431000     2.155000  0.8250000     1.559000  0.7066000     0.5953000      1.086000  
1 1 1 2  8  25 o 1.487000  0.5086000     1.508000  0.7294000     1.466000  0.7090000     0.4205000E-01  1.017000  
1 1 1 2  8  26 o 1.750000  0.5180000     1.995000  0.7815000     1.505000  0.6800000     0.4907000      1.036000  
1 1 1 2  8  27 o 1.441000  0.4630000     1.706000  0.7283000     1.176000  0.5719000     0.5293000      0.9260000 
1 1 1 2  9  0  o 4.173000  0.1180000     4.173000  0.1180000     4.173000  0.1180000     -0.000000      0.000000  
1 1 1 2  9  1  o 19.36000  0.1573000     19.34000  0.2223000     19.38000  0.2227000     -0.4865000E-01 0.3147000 
1 1 1 2  9  2  o 25.51000  0.2028000     25.59000  0.2878000     25.43000  0.2857000     0.1578000      0.4055000 
1 1 1 2  9  3  o 8.781000  0.1040000     8.976000  0.1597000     8.587000  0.1331000     0.3890000      0.2079000 
1 1 1 2  9  4  o 19.10000  0.2257000     18.56000  0.3117000     19.65000  0.3265000     -1.088000      0.4514000 
1 1 1 2  9  5  o 19.66000  0.1650000     19.39000  0.2308000     19.93000  0.2358000     -0.5454000     0.3300000 
1 1 1 2  9  6  o 26.02000  0.2283000     25.66000  0.2957000     26.38000  0.3480000     -0.7186000     0.4566000 
1 1 1 2  9  7  o 21.51000  0.1831000     21.12000  0.2550000     21.90000  0.2628000     -0.7834000     0.3661000 
1 1 1 2  9  8  o 19.29000  0.1722000     19.05000  0.2412000     19.54000  0.2459000     -0.4958000     0.3445000 
1 1 1 2  9  9  f 18.77000  0.1764000     19.06000  0.2519000     18.48000  0.2472000     0.5793000      0.3529000 
1 1 1 2  9  10 o 10.24000  0.2723000     10.55000  0.4456000     9.935000  0.3132000     0.6118000      0.5446000 
1 1 1 2  9  11 o 8.302000  0.1852000     8.271000  0.2629000     8.333000  0.2610000     -0.6225000E-01 0.3705000 
1 1 1 2  9  12 o 6.588000  0.2204000     6.447000  0.3204000     6.729000  0.3026000     -0.2814000     0.4407000 
1 1 1 2  9  13 o 6.918000  0.2331000     6.675000  0.3365000     7.161000  0.3227000     -0.4861000     0.4662000 
1 1 1 2  9  14 o 10.80000  0.2053000     11.09000  0.2863000     10.51000  0.2945000     0.5753000      0.4107000 
1 1 1 2  9  15 o 3.228000  0.7936000     3.593000  1.097000      2.864000  1.147000      0.7291000      1.587000  
1 1 1 2  9  16 o 2.031000  0.5754000     1.895000  0.7924000     2.167000  0.8344000     -0.2719000     1.151000  
1 1 1 2  9  17 o 7.885000  0.2919000     7.774000  0.4158000     7.995000  0.4098000     -0.2210000     0.5838000 
1 1 1 2  9  18 o 8.649000  0.2868000     8.651000  0.4053000     8.646000  0.4058000     0.5630000E-02  0.5736000 
1 1 1 2  9  19 o 10.22000  0.2837000     10.28000  0.3978000     10.17000  0.4046000     0.1168000      0.5674000 
1 1 1 2  9  20 o 8.158000  0.7822000     8.641000  0.9948000     7.675000  1.207000      0.9664000      1.564000  
1 1 1 2  9  21 o 2.260000  0.6476000     1.745000  0.8161000     2.774000  1.006000      -1.029000      1.295000  
1 1 1 2  9  22 f 3.047000  0.6617000     2.628000  0.9527000     3.467000  0.9185000     -0.8387000     1.323000  
1 1 1 2  9  23 o 1.927000  0.5717000     1.962000  0.8187000     1.892000  0.7981000     0.7000000E-01  1.143000  
1 1 1 2  9  24 o 1.639000  0.5077000     1.929000  0.7880000     1.350000  0.6403000     0.5790000      1.015000  
1 1 1 2  9  25 o 1.756000  0.6057000     1.818000  0.8803000     1.694000  0.8323000     0.1242000      1.211000  
1 1 1 2  9  26 o 1.607000  0.4897000     1.193000  0.5797000     2.020000  0.7894000     -0.8264000     0.9794000 
1 1 1 2  9  27 o 1.415000  0.4634000     1.496000  0.6821000     1.334000  0.6274000     0.1626000      0.9268000 
1 1 1 2  10 0  o 17.33000  0.2045000     17.33000  0.2045000     17.33000  0.2045000     0.000000       0.000000  
1 1 1 2  10 1  o 7.177000  0.8675000E-01 7.244000  0.1234000     7.110000  0.1219000     0.1340000      0.1735000 
1 1 1 2  10 2  o 7.725000  0.9078000E-01 7.522000  0.1275000     7.927000  0.1293000     -0.4044000     0.1816000 
1 1 1 2  10 4  o 15.53000  0.1366000     15.77000  0.1957000     15.28000  0.1906000     0.4939000      0.2732000 
1 1 1 2  10 5  o 19.00000  0.1759000     18.41000  0.2226000     19.58000  0.2724000     -1.167000      0.3518000 
1 1 1 2  10 6  o 33.23000  0.2845000     33.44000  0.3755000     33.02000  0.4274000     0.4183000      0.5689000 
1 1 1 2  10 7  o 23.22000  0.2008000     23.00000  0.3162000     23.44000  0.2477000     -0.4426000     0.4016000 
1 1 1 2  10 8  o 23.19000  0.1981000     23.38000  0.2815000     23.01000  0.2789000     0.3741000      0.3963000 
1 1 1 2  10 9  o 11.96000  0.1391000     11.90000  0.1958000     12.02000  0.1977000     -0.1179000     0.2782000 
1 1 1 2  10 10 o 13.47000  0.1844000     13.87000  0.2601000     13.08000  0.2613000     0.7898000      0.3687000 
1 1 1 2  10 11 o 12.86000  0.1705000     12.90000  0.2415000     12.81000  0.2409000     0.8297000E-01  0.3411000 
1 1 1 2  10 12 o 4.389000  0.3089000     4.062000  0.4644000     4.715000  0.4074000     -0.6530000     0.6177000 
1 1 1 2  10 13 o 4.218000  0.3494000     4.387000  0.4771000     4.049000  0.5107000     0.3378000      0.6989000 
1 1 1 2  10 14 o 13.14000  0.1992000     13.41000  0.2810000     12.87000  0.2825000     0.5439000      0.3985000 
1 1 1 2  10 15 f 21.28000  0.3304000     21.60000  0.4709000     20.97000  0.4636000     0.6320000      0.6608000 
1 1 1 2  10 16 o 6.607000  0.3190000     6.837000  0.4410000     6.377000  0.4612000     0.4606000      0.6381000 
1 1 1 2  10 17 o 9.851000  0.2624000     9.918000  0.3700000     9.784000  0.3723000     0.1338000      0.5249000 
1 1 1 2  10 18 o 6.467000  0.3646000     6.167000  0.5401000     6.768000  0.4900000     -0.6014000     0.7292000 
1 1 1 2  10 19 o 7.317000  0.3713000     7.330000  0.5233000     7.304000  0.5270000     0.2554000E-01  0.7427000 
1 1 1 2  10 20 o 2.866000  0.8939000     3.139000  1.297000      2.593000  1.230000      0.5458000      1.788000  
1 1 1 2  10 21 o 4.343000  0.6128000     5.185000  0.7195000     3.500000  0.9922000     1.685000       1.226000  
1 1 1 2  10 22 o 4.261000  0.5602000     4.239000  0.7857000     4.283000  0.7988000     -0.4375000E-01 1.120000  
1 1 1 2  10 23 o 2.785000  0.6006000     3.215000  0.8345000     2.355000  0.8641000     0.8600000      1.201000  
1 1 1 2  10 24 o 1.501000  0.4867000     1.545000  0.7036000     1.457000  0.6727000     0.8822000E-01  0.9734000 
1 1 1 2  10 25 o 1.835000  0.6310000     2.312000  1.056000      1.359000  0.6907000     0.9529000      1.262000  
1 1 1 2  10 26 o 1.530000  0.4870000     1.545000  0.6949000     1.516000  0.6826000     0.2901000E-01  0.9741000 
1 1 1 2  10 27 o 1.566000  0.4887000     1.746000  0.7334000     1.387000  0.6460000     0.3590000      0.9774000 
1 1 1 2  11 0  o 14.65000  0.1815000     14.65000  0.1815000     14.65000  0.1815000     0.000000       0.000000  
1 1 1 2  11 1  o 3.573000  0.1017000     3.693000  0.1416000     3.453000  0.1461000     0.2393000      0.2035000 
1 1 1 2  11 2  o 11.23000  0.1539000     11.45000  0.2202000     11.01000  0.2151000     0.4403000      0.3078000 
1 1 1 2  11 3  o 8.906000  0.1413000     8.847000  0.1998000     8.964000  0.1998000     -0.1175000     0.2826000 
1 1 1 2  11 4  o 19.45000  0.1635000     19.43000  0.2309000     19.48000  0.2316000     -0.5708000E-01 0.3271000 
1 1 1 2  11 5  o 19.14000  0.2011000     18.99000  0.2298000     19.29000  0.3300000     -0.2990000     0.4022000 
1 1 1 2  11 6  o 22.32000  0.1861000     22.46000  0.2646000     22.18000  0.2618000     0.2746000      0.3723000 
1 1 1 2  11 7  o 38.24000  0.3022000     38.60000  0.4314000     37.88000  0.4233000     0.7188000      0.6044000 
1 1 1 2  11 8  o 11.92000  0.1661000     12.22000  0.2348000     11.62000  0.2350000     0.6049000      0.3322000 
1 1 1 2  11 9  o 11.71000  0.1584000     11.59000  0.2219000     11.82000  0.2261000     -0.2385000     0.3168000 
1 1 1 2  11 10 o 11.28000  0.1467000     10.94000  0.2076000     11.63000  0.2075000     -0.6944000     0.2935000 
1 1 1 2  11 11 o 10.21000  0.1746000     9.984000  0.2006000     10.44000  0.2860000     -0.4528000     0.3493000 
1 1 1 2  11 12 o 4.309000  0.3204000     4.480000  0.4401000     4.138000  0.4658000     0.3429000      0.6408000 
1 1 1 2  11 13 o 2.109000  0.5217000     2.046000  0.7443000     2.172000  0.7313000     -0.1261000     1.043000  
1 1 1 2  11 14 o 9.588000  0.2149000     9.822000  0.2997000     9.354000  0.3081000     0.4681000      0.4299000 
1 1 1 2  11 15 o 9.118000  0.4761000     8.879000  0.6579000     9.356000  0.6883000     -0.4769000     0.9521000 
1 1 1 2  11 16 o 7.668000  0.2947000     8.126000  0.4018000     7.210000  0.4313000     0.9160000      0.5894000 
1 1 1 2  11 17 o 6.103000  0.3512000     5.542000  0.5343000     6.664000  0.4559000     -1.121000      0.7024000 
1 1 1 2  11 18 o 2.097000  0.5960000     1.736000  0.7867000     2.458000  0.8955000     -0.7216000     1.192000  
1 1 1 2  11 19 o 5.862000  0.4435000     6.171000  0.5901000     5.553000  0.6621000     0.6182000      0.8869000 
1 1 1 2  11 20 o 3.320000  0.9062000     2.933000  1.271000      3.706000  1.292000      -0.7735000     1.812000  
1 1 1 2  11 21 o 2.265000  0.6614000     2.239000  0.9344000     2.291000  0.9362000     -0.5220000E-01 1.323000  
1 1 1 2  11 22 o 2.408000  0.6567000     2.634000  0.9333000     2.182000  0.9241000     0.4516000      1.313000  
1 1 1 2  11 23 o 1.631000  0.5192000     1.475000  0.6940000     1.786000  0.7725000     -0.3103000     1.038000  
1 1 1 2  11 24 o 1.675000  0.5124000     1.668000  0.7221000     1.681000  0.7271000     -0.1256000E-01 1.025000  
1 1 1 2  11 25 o 1.921000  0.6070000     1.997000  0.8727000     1.844000  0.8440000     0.1529000      1.214000  
1 1 1 2  11 26 o 1.362000  0.4509000     1.370000  0.6382000     1.355000  0.6372000     0.1447000E-01  0.9018000 
1 1 1 2  11 27 o 1.803000  0.5258000     1.925000  0.7716000     1.682000  0.7146000     0.2426000      1.052000  
1 1 1 2  12 0  o 18.86000  0.3155000     18.86000  0.3155000     18.86000  0.3155000     0.000000       0.000000  
1 1 1 2  12 1  o 13.15000  0.1704000     13.11000  0.2403000     13.18000  0.2416000     -0.7818000E-01 0.3407000 
1 1 1 2  12 2  o 4.883000  0.1964000     4.883000  0.1964000     ?         ?             ?              ?         
1 1 1 2  12 3  o 13.46000  0.1339000     13.45000  0.1761000     13.46000  0.2018000     -0.1126000E-01 0.2678000 
1 1 1 2  12 4  o 7.311000  0.1012000     7.355000  0.1429000     7.266000  0.1434000     0.8816000E-01  0.2025000 
1 1 1 2  12 5  o 22.90000  0.1896000     22.65000  0.2656000     23.15000  0.2708000     -0.5002000     0.3793000 
1 1 1 2  12 6  o 9.363000  0.1337000     9.307000  0.1881000     9.419000  0.1900000     -0.1123000     0.2673000 
1 1 1 2  12 7  o 13.52000  0.1744000     13.19000  0.1885000     13.85000  0.2933000     -0.6571000     0.3487000 
1 1 1 2  12 8  o 13.50000  0.1478000     13.66000  0.2217000     13.35000  0.1957000     0.3137000      0.2957000 
1 1 1 2  12 9  o 13.21000  0.2778000     13.21000  0.2778000     ?         ?             ?              ?         
1 1 1 2  12 10 o 1.310000  0.3465000     1.574000  0.5229000     1.046000  0.4549000     0.5276000      0.6931000 
1 1 1 2  12 11 o 6.066000  0.1821000     5.798000  0.2623000     6.334000  0.2528000     -0.5357000     0.3643000 
1 1 1 2  12 12 o 7.089000  0.1896000     7.309000  0.2579000     6.868000  0.2779000     0.4408000      0.3792000 
1 1 1 2  12 13 o 2.148000  0.5235000     2.003000  0.7412000     2.293000  0.7395000     -0.2903000     1.047000  
1 1 1 2  12 14 o 3.026000  0.5188000     2.543000  0.7897000     3.508000  0.6731000     -0.9646000     1.038000  
1 1 1 2  12 15 o 14.35000  0.3058000     14.02000  0.4357000     14.68000  0.4292000     -0.6625000     0.6116000 
1 1 1 2  12 16 o 2.915000  0.5852000     2.283000  0.8510000     3.547000  0.8034000     -1.264000      1.170000  
1 1 1 2  12 17 o 4.380000  0.5054000     3.692000  0.8164000     5.068000  0.5960000     -1.376000      1.011000  
1 1 1 2  12 18 o 8.460000  0.3102000     8.527000  0.4330000     8.394000  0.4444000     0.1333000      0.6205000 
1 1 1 2  12 19 o 5.096000  0.5231000     4.643000  0.8099000     5.549000  0.6623000     -0.9061000     1.046000  
1 1 1 2  12 20 o 3.375000  0.9788000     3.237000  1.338000      3.513000  1.429000      -0.2758000     1.958000  
1 1 1 2  12 21 o 2.383000  0.6535000     2.968000  1.012000      1.799000  0.8266000     1.169000       1.307000  
1 1 1 2  12 22 o 3.929000  0.5835000     3.442000  0.9046000     4.415000  0.7374000     -0.9730000     1.167000  
1 1 1 2  12 23 f 2.483000  0.5966000     2.432000  0.8278000     2.533000  0.8594000     -0.1009000     1.193000  
1 1 1 2  12 24 o 1.893000  0.5416000     2.024000  0.7852000     1.761000  0.7463000     0.2637000      1.083000  
1 1 1 2  12 25 o 1.713000  0.5417000     1.644000  0.7422000     1.781000  0.7892000     -0.1372000     1.083000  
1 1 1 2  12 26 o 1.608000  0.4938000     1.818000  0.7472000     1.397000  0.6459000     0.4214000      0.9876000 
1 1 1 2  12 27 o 1.396000  0.4563000     1.551000  0.6904000     1.242000  0.5968000     0.3090000      0.9127000 
1 1 1 2  13 0  o 13.26000  0.2462000     13.26000  0.2462000     13.26000  0.2462000     0.000000       0.000000  
1 1 1 2  13 1  o 24.85000  0.2838000     24.92000  0.4026000     24.77000  0.4002000     0.1518000      0.5677000 
1 1 1 2  13 2  o 3.753000  0.1141000     3.734000  0.1619000     3.773000  0.1609000     -0.3904000E-01 0.2282000 
1 1 1 2  13 3  o 7.784000  0.1078000     8.074000  0.1453000     7.493000  0.1593000     0.5811000      0.2156000 
1 1 1 2  13 4  o 10.60000  0.1129000     10.64000  0.1600000     10.55000  0.1594000     0.8583000E-01  0.2259000 
1 1 1 2  13 5  o 14.94000  0.1380000     14.80000  0.1942000     15.08000  0.1960000     -0.2850000     0.2759000 
1 1 1 2  13 6  o 11.28000  0.1284000     11.21000  0.1708000     11.35000  0.1917000     -0.1428000     0.2567000 
1 1 1 2  13 7  o 19.16000  0.1691000     18.75000  0.2348000     19.57000  0.2434000     -0.8209000     0.3382000 
1 1 1 2  13 8  o 17.01000  0.1584000     17.17000  0.2260000     16.86000  0.2220000     0.3108000      0.3168000 
1 1 1 2  13 9  o 14.10000  0.3248000     13.68000  0.4592000     14.51000  0.4595000     -0.8274000     0.6497000 
1 1 1 2  13 10 o 7.440000  0.1539000     7.744000  0.2143000     7.136000  0.2211000     0.6075000      0.3079000 
1 1 1 2  13 11 o 2.993000  0.3068000     3.209000  0.4027000     2.777000  0.4629000     0.4317000      0.6136000 
1 1 1 2  13 12 o 1.375000  0.3919000     1.109000  0.5072000     1.641000  0.5976000     -0.5321000     0.7838000 
1 1 1 2  13 13 o 1.373000  0.4132000     1.227000  0.5518000     1.520000  0.6152000     -0.2932000     0.8263000 
1 1 1 2  13 14 o 22.65000  0.2271000     22.32000  0.3188000     22.98000  0.3234000     -0.6596000     0.4542000 
1 1 1 2  13 15 o 2.681000  0.6187000     3.147000  0.8957000     2.214000  0.8536000     0.9323000      1.237000  
1 1 1 2  13 16 o 13.06000  0.2316000     12.98000  0.3301000     13.14000  0.3251000     -0.1513000     0.4633000 
1 1 1 2  13 17 o 10.88000  0.2531000     11.00000  0.3580000     10.75000  0.3579000     0.2508000      0.5062000 
1 1 1 2  13 18 o 4.966000  0.5105000     4.193000  0.8291000     5.739000  0.5957000     -1.546000      1.021000  
1 1 1 2  13 19 o 5.008000  0.5222000     4.789000  0.7751000     5.227000  0.7000000     -0.4376000     1.044000  
1 1 1 2  13 20 o 5.953000  0.6564000     6.253000  0.8858000     5.653000  0.9689000     0.6004000      1.313000  
1 1 1 2  13 21 o 2.312000  0.6579000     2.290000  0.9221000     2.334000  0.9386000     -0.4457000E-01 1.316000  
1 1 1 2  13 22 o 2.188000  0.6114000     1.839000  0.8065000     2.537000  0.9191000     -0.6981000     1.223000  
1 1 1 2  13 23 o 1.997000  0.5514000     2.361000  0.8246000     1.634000  0.7322000     0.7267000      1.103000  
1 1 1 2  13 24 o 1.418000  0.4647000     1.383000  0.6499000     1.453000  0.6645000     -0.6919000E-01 0.9295000 
1 1 1 2  13 25 o 1.839000  0.5638000     1.639000  0.7461000     2.039000  0.8453000     -0.4010000     1.128000  
1 1 1 2  13 26 f 1.727000  0.5083000     1.434000  0.6576000     2.020000  0.7753000     -0.5860000     1.017000  
1 1 1 2  13 27 o 1.430000  0.4639000     1.233000  0.5928000     1.628000  0.7136000     -0.3953000     0.9278000 
1 1 1 2  14 0  o 6.677000  0.1413000     6.677000  0.1413000     6.677000  0.1413000     -0.000000      0.000000  
1 1 1 2  14 1  o 13.77000  0.1270000     13.71000  0.1792000     13.83000  0.1802000     -0.1203000     0.2541000 
1 1 1 2  14 2  o 7.413000  0.1005000     7.427000  0.1418000     7.399000  0.1424000     0.2809000E-01  0.2010000 
1 1 1 2  14 3  o 5.792000  0.1046000     5.812000  0.1474000     5.772000  0.1486000     0.4017000E-01  0.2093000 
1 1 1 2  14 4  o 20.81000  0.1752000     21.11000  0.2509000     20.50000  0.2446000     0.6063000      0.3504000 
1 1 1 2  14 5  o 15.79000  0.1547000     15.88000  0.2341000     15.69000  0.2022000     0.1994000      0.3094000 
1 1 1 2  14 6  f 30.61000  0.2466000     30.45000  0.3469000     30.76000  0.3504000     -0.3048000     0.4931000 
1 1 1 2  14 7  o 11.74000  0.1289000     11.53000  0.1798000     11.94000  0.1848000     -0.4034000     0.2578000 
1 1 1 2  14 8  o 11.71000  0.1401000     11.98000  0.1888000     11.45000  0.2071000     0.5302000      0.2802000 
1 1 1 2  14 9  o 1.720000  0.3563000     1.574000  0.5450000     1.866000  0.4591000     -0.2919000     0.7126000 
1 1 1 2  14 10 o 5.146000  0.1821000     5.161000  0.2571000     5.132000  0.2580000     0.2867000E-01  0.3642000 
1 1 1 2  14 11 o 4.515000  0.2246000     4.476000  0.3203000     4.553000  0.3148000     -0.7615000E-01 0.4491000 
1 1 1 2  14 12 o 3.293000  0.3042000     3.395000  0.4148000     3.191000  0.4452000     0.2038000      0.6085000 
1 1 1 2  14 13 o 4.467000  0.2635000     4.231000  0.3851000     4.703000  0.3599000     -0.4719000     0.5271000 
1 1 1 2  14 14 o 3.013000  0.4361000     2.211000  0.7093000     3.815000  0.5075000     -1.603000      0.8722000 
1 1 1 2  14 15 o 7.598000  0.2247000     8.035000  0.2943000     7.160000  0.3397000     0.8754000      0.4495000 
1 1 1 2  14 16 o 9.055000  0.2721000     9.042000  0.3815000     9.068000  0.3882000     -0.2634000E-01 0.5443000 
1 1 1 2  14 17 o 2.263000  0.6185000     2.465000  0.8995000     2.061000  0.8493000     0.4040000      1.237000  
1 1 1 2  14 18 o 5.502000  0.4457000     5.274000  0.6590000     5.731000  0.6002000     -0.4573000     0.8914000 
1 1 1 2  14 19 o 2.416000  0.6729000     2.103000  0.9111000     2.730000  0.9904000     -0.6269000     1.346000  
1 1 1 2  14 20 o 2.357000  0.7067000     2.212000  0.9829000     2.503000  1.016000      -0.2910000     1.413000  
1 1 1 2  14 21 o 3.402000  0.6636000     3.511000  0.9052000     3.294000  0.9707000     0.2179000      1.327000  
1 1 1 2  14 22 o 2.441000  0.6129000     2.046000  0.8497000     2.836000  0.8834000     -0.7902000     1.226000  
1 1 1 2  14 23 o 1.866000  0.5166000     1.361000  0.6461000     2.372000  0.8062000     -1.011000      1.033000  
1 1 1 2  14 24 o 1.563000  0.4937000     1.551000  0.7000000     1.575000  0.6965000     -0.2399000E-01 0.9875000 
1 1 1 2  14 25 o 2.515000  0.5853000     2.549000  0.7751000     2.481000  0.8773000     0.6813000E-01  1.171000  
1 1 1 2  14 26 o 1.399000  0.4588000     1.469000  0.6691000     1.329000  0.6279000     0.1396000      0.9176000 
1 1 1 2  14 27 o 1.114000  0.3877000     1.113000  0.5476000     1.114000  0.5490000     -0.1281000E-02 0.7755000 
1 1 1 2  15 0  o 2.240000  0.2507000     2.240000  0.2507000     2.240000  0.2507000     0.000000       0.000000  
1 1 1 2  15 1  o 4.343000  0.1130000     4.419000  0.1580000     4.268000  0.1615000     0.1508000      0.2260000 
1 1 1 2  15 2  o 8.256000  0.1046000     8.345000  0.1486000     8.167000  0.1473000     0.1785000      0.2093000 
1 1 1 2  15 3  o 4.674000  0.1159000     4.658000  0.1640000     4.689000  0.1637000     -0.3094000E-01 0.2317000 
1 1 1 2  15 4  o 4.000000  0.1279000     3.968000  0.1826000     4.032000  0.1793000     -0.6385000E-01 0.2559000 
1 1 1 2  15 5  o 17.65000  0.1677000     17.37000  0.2502000     17.94000  0.2233000     -0.5659000     0.3353000 
1 1 1 2  15 6  o 16.92000  0.1544000     16.83000  0.2175000     17.00000  0.2191000     -0.1708000     0.3088000 
1 1 1 2  15 7  o 18.06000  0.1638000     18.15000  0.2316000     17.97000  0.2318000     0.1819000      0.3277000 
1 1 1 2  15 8  o 10.38000  0.1592000     10.22000  0.2580000     10.54000  0.1867000     -0.3204000     0.3185000 
1 1 1 2  15 9  o 8.705000  0.1316000     8.670000  0.1856000     8.741000  0.1867000     -0.7084000E-01 0.2632000 
1 1 1 2  15 10 f 4.009000  0.2288000     3.861000  0.3297000     4.158000  0.3175000     -0.2965000     0.4577000 
1 1 1 2  15 11 o 3.854000  0.2665000     4.184000  0.3482000     3.524000  0.4035000     0.6595000      0.5329000 
1 1 1 2  15 12 o 1.419000  0.4073000     1.660000  0.6152000     1.179000  0.5338000     0.4813000      0.8146000 
1 1 1 2  15 13 o 5.524000  0.2321000     5.862000  0.3265000     5.186000  0.3298000     0.6756000      0.4641000 
1 1 1 2  15 14 o 5.357000  0.3020000     5.418000  0.4079000     5.295000  0.4454000     0.1233000      0.6039000 
1 1 1 2  15 15 o 7.364000  0.2439000     7.032000  0.3465000     7.696000  0.3432000     -0.6644000     0.4877000 
1 1 1 2  15 16 f 6.527000  0.2793000     6.040000  0.4254000     7.014000  0.3621000     -0.9740000     0.5587000 
1 1 1 2  15 17 o 4.949000  0.4053000     4.636000  0.5130000     5.261000  0.6275000     -0.6257000     0.8106000 
1 1 1 2  15 18 o 3.344000  0.6666000     3.487000  0.9270000     3.202000  0.9582000     0.2856000      1.333000  
1 1 1 2  15 19 o 3.000000  0.7116000     2.807000  1.006000      3.192000  1.007000      -0.3850000     1.423000  
1 1 1 2  15 20 o 3.421000  0.7141000     2.830000  1.015000      4.013000  1.005000      -1.182000      1.428000  
1 1 1 2  15 21 o 1.580000  0.5257000     1.709000  0.7840000     1.451000  0.7005000     0.2585000      1.051000  
1 1 1 2  15 22 o 1.971000  0.5808000     2.309000  0.8874000     1.632000  0.7495000     0.6763000      1.162000  
1 1 1 2  15 23 f 1.623000  0.5006000     1.358000  0.6397000     1.887000  0.7702000     -0.5288000     1.001000  
1 1 1 2  15 24 o 1.455000  0.4732000     1.333000  0.6380000     1.577000  0.6989000     -0.2437000     0.9463000 
1 1 1 2  15 25 o 1.398000  0.4523000     1.112000  0.5479000     1.685000  0.7199000     -0.5731000     0.9047000 
1 1 1 2  15 26 o 1.403000  0.4565000     1.265000  0.6003000     1.541000  0.6879000     -0.2763000     0.9130000 
1 1 1 2  15 27 o 1.374000  0.4456000     1.706000  0.7257000     1.041000  0.5173000     0.6644000      0.8912000 
1 1 1 2  16 0  o 7.222000  0.1479000     7.222000  0.1479000     7.222000  0.1479000     -0.000000      0.000000  
1 1 1 2  16 1  o 23.85000  0.1955000     23.78000  0.2758000     23.92000  0.2772000     -0.1386000     0.3910000 
1 1 1 2  16 2  o 8.533000  0.1074000     8.441000  0.1515000     8.624000  0.1524000     -0.1824000     0.2149000 
1 1 1 2  16 3  o 9.870000  0.1127000     9.878000  0.1596000     9.863000  0.1593000     0.1569000E-01  0.2255000 
1 1 1 2  16 4  o 12.60000  0.1263000     12.41000  0.1777000     12.78000  0.1794000     -0.3723000     0.2526000 
1 1 1 2  16 5  o 8.548000  0.1152000     8.617000  0.1631000     8.478000  0.1626000     0.1387000      0.2303000 
1 1 1 2  16 6  o 2.962000  0.1794000     2.744000  0.2683000     3.179000  0.2381000     -0.4346000     0.3587000 
1 1 1 2  16 7  o 10.19000  0.1259000     10.03000  0.1772000     10.35000  0.1788000     -0.3175000     0.2518000 
1 1 1 2  16 8  o 13.72000  0.2882000     13.72000  0.2882000     ?         ?             ?              ?         
1 1 1 2  16 9  o 18.48000  0.1729000     18.20000  0.2430000     18.76000  0.2460000     -0.5602000     0.3458000 
1 1 1 2  16 10 o 12.24000  0.1486000     12.31000  0.2110000     12.18000  0.2093000     0.1328000      0.2972000 
1 1 1 2  16 11 o 5.553000  0.2030000     5.513000  0.2852000     5.593000  0.2891000     -0.8068000E-01 0.4061000 
1 1 1 2  16 12 o 10.70000  0.1739000     10.88000  0.2439000     10.52000  0.2480000     0.3577000      0.3478000 
1 1 1 2  16 13 o 9.945000  0.1857000     9.854000  0.2645000     10.04000  0.2607000     -0.1815000     0.3714000 
1 1 1 2  16 14 o 9.256000  0.3547000     9.256000  0.3547000     ?         ?             ?              ?         
1 1 1 2  16 15 o 16.52000  0.2317000     16.34000  0.3585000     16.71000  0.2935000     -0.3780000     0.4633000 
1 1 1 2  16 16 o 3.473000  0.4735000     3.382000  0.6836000     3.565000  0.6554000     -0.1830000     0.9470000 
1 1 1 2  16 17 o 9.202000  0.2354000     9.230000  0.3298000     9.174000  0.3360000     0.5560000E-01  0.4708000 
1 1 1 2  16 18 o 3.002000  0.6139000     3.271000  0.8615000     2.733000  0.8749000     0.5384000      1.228000  
1 1 1 2  16 19 o 3.244000  0.7419000     2.481000  1.048000      4.006000  1.050000      -1.525000      1.484000  
1 1 1 2  16 20 o 6.051000  0.4518000     5.510000  0.6794000     6.592000  0.5956000     -1.083000      0.9035000 
1 1 1 2  16 21 o 2.832000  0.5950000     3.683000  0.8330000     1.982000  0.8500000     1.701000       1.190000  
1 1 1 2  16 22 o 2.584000  0.6249000     2.291000  0.8765000     2.877000  0.8909000     -0.5860000     1.250000  
1 1 1 2  16 23 o 1.877000  0.5278000     1.472000  0.6750000     2.282000  0.8116000     -0.8097000     1.056000  
1 1 1 2  16 24 o 1.882000  0.5570000     1.804000  0.7669000     1.961000  0.8080000     -0.1567000     1.114000  
1 1 1 2  16 25 o 1.591000  0.5022000     1.676000  0.7335000     1.506000  0.6861000     0.1695000      1.004000  
1 1 1 2  16 26 o 1.282000  0.4310000     1.270000  0.6049000     1.295000  0.6140000     -0.2448000E-01 0.8619000 
1 1 1 2  16 27 o 1.229000  0.4190000     1.287000  0.6125000     1.171000  0.5719000     0.1160000      0.8380000 
1 1 1 2  17 0  f 10.05000  0.1596000     10.05000  0.1596000     10.05000  0.1596000     0.000000       0.000000  
1 1 1 2  17 1  f 9.255000  0.1098000     9.321000  0.1554000     9.188000  0.1551000     0.1338000      0.2195000 
1 1 1 2  17 2  o 13.17000  0.1280000     13.11000  0.1811000     13.23000  0.1810000     -0.1248000     0.2561000 
1 1 1 2  17 3  o 9.399000  0.1125000     9.379000  0.1588000     9.420000  0.1594000     -0.4175000E-01 0.2250000 
1 1 1 2  17 4  f 7.183000  0.1127000     7.205000  0.1602000     7.161000  0.1584000     0.4359000E-01  0.2253000 
1 1 1 2  17 5  o 9.164000  0.1190000     9.192000  0.1688000     9.137000  0.1679000     0.5551000E-01  0.2381000 
1 1 1 2  17 6  o 4.182000  0.1487000     4.045000  0.2144000     4.319000  0.2061000     -0.2740000     0.2974000 
1 1 1 2  17 7  o 13.55000  0.1410000     13.46000  0.1985000     13.64000  0.2001000     -0.1718000     0.2819000 
1 1 1 2  17 8  o 18.20000  0.2862000     17.95000  0.3360000     18.46000  0.4633000     -0.5068000     0.5724000 
1 1 1 2  17 9  o 9.355000  0.1360000     9.331000  0.1924000     9.378000  0.1921000     -0.4694000E-01 0.2719000 
1 1 1 2  17 10 o 1.556000  0.3734000     1.629000  0.5271000     1.482000  0.5290000     0.1469000      0.7468000 
1 1 1 2  17 11 o 6.783000  0.1801000     6.878000  0.2875000     6.687000  0.2170000     0.1909000      0.3602000 
1 1 1 2  17 12 o 3.908000  0.2959000     3.606000  0.4513000     4.211000  0.3827000     -0.6050000     0.5917000 
1 1 1 2  17 13 o 16.46000  0.2275000     16.10000  0.2688000     16.81000  0.3671000     -0.7069000     0.4550000 
1 1 1 2  17 14 o 8.662000  0.5103000     8.044000  0.6987000     9.280000  0.7438000     -1.236000      1.021000  
1 1 1 2  17 15 o 8.473000  0.2393000     8.786000  0.3228000     8.161000  0.3535000     0.6250000      0.4787000 
1 1 1 2  17 16 o 1.677000  0.5096000     1.554000  0.6923000     1.801000  0.7481000     -0.2463000     1.019000  
1 1 1 2  17 17 o 6.765000  0.2892000     7.152000  0.4013000     6.377000  0.4167000     0.7746000      0.5784000 
1 1 1 2  17 18 o 5.470000  0.3943000     5.331000  0.5779000     5.608000  0.5365000     -0.2770000     0.7886000 
1 1 1 2  17 19 o 8.883000  0.3447000     8.593000  0.4644000     9.174000  0.5095000     -0.5815000     0.6894000 
1 1 1 2  17 20 o 3.396000  0.5622000     2.884000  0.8569000     3.908000  0.7279000     -1.024000      1.124000  
1 1 1 2  17 21 o 1.713000  0.5451000     1.645000  0.7103000     1.782000  0.8270000     -0.1361000     1.090000  
1 1 1 2  17 22 o 1.717000  0.5348000     2.117000  0.8553000     1.317000  0.6423000     0.7998000      1.070000  
1 1 1 2  17 23 o 1.659000  0.5083000     1.428000  0.6638000     1.889000  0.7699000     -0.4607000     1.017000  
1 1 1 2  17 24 o 1.744000  0.5539000     1.861000  0.8095000     1.627000  0.7562000     0.2347000      1.108000  
1 1 1 2  17 25 f 1.646000  0.5025000     1.740000  0.7305000     1.552000  0.6903000     0.1885000      1.005000  
1 1 1 2  17 26 o 1.807000  0.5107000     1.410000  0.6476000     2.204000  0.7898000     -0.7945000     1.021000  
1 1 1 2  17 27 o 1.159000  0.4115000     1.261000  0.6304000     1.058000  0.5291000     0.2032000      0.8230000 
1 1 1 2  18 0  o 4.813000  0.1666000     4.813000  0.1666000     4.813000  0.1666000     0.000000       0.000000  
1 1 1 2  18 1  o 14.38000  0.1351000     14.19000  0.1897000     14.57000  0.1925000     -0.3809000     0.2703000 
1 1 1 2  18 2  o 11.35000  0.1204000     11.24000  0.1693000     11.47000  0.1713000     -0.2347000     0.2408000 
1 1 1 2  18 3  o 11.24000  0.1208000     11.34000  0.1717000     11.14000  0.1699000     0.1954000      0.2416000 
1 1 1 2  18 4  o 11.11000  0.1233000     11.17000  0.1741000     11.04000  0.1746000     0.1298000      0.2466000 
1 1 1 2  18 5  o 4.059000  0.1484000     4.005000  0.2105000     4.114000  0.2093000     -0.1090000     0.2968000 
1 1 1 2  18 6  o 10.95000  0.1282000     10.93000  0.1824000     10.96000  0.1802000     -0.3182000E-01 0.2564000 
1 1 1 2  18 7  o 1.293000  0.3643000     1.545000  0.5534000     1.041000  0.4738000     0.5042000      0.7286000 
1 1 1 2  18 8  o 2.625000  0.2348000     2.648000  0.3337000     2.602000  0.3306000     0.4555000E-01  0.4697000 
1 1 1 2  18 9  o 9.801000  0.1397000     9.870000  0.1970000     9.732000  0.1982000     0.1384000      0.2795000 
1 1 1 2  18 10 o 14.01000  0.1652000     13.75000  0.2190000     14.28000  0.2474000     -0.5302000     0.3305000 
1 1 1 2  18 11 o 11.30000  0.1531000     11.27000  0.2154000     11.34000  0.2175000     -0.6405000E-01 0.3061000 
1 1 1 2  18 12 o 5.662000  0.2182000     5.835000  0.3072000     5.490000  0.3100000     0.3454000      0.4364000 
1 1 1 2  18 13 f 9.402000  0.1883000     9.415000  0.2650000     9.388000  0.2677000     0.2768000E-01  0.3767000 
1 1 1 2  18 14 o 6.120000  0.3753000     5.879000  0.6567000     6.360000  0.3638000     -0.4805000     0.7507000 
1 1 1 2  18 15 f 14.20000  0.2101000     14.26000  0.2939000     14.13000  0.3003000     0.1310000      0.4202000 
1 1 1 2  18 16 o 12.15000  0.2108000     12.28000  0.3001000     12.01000  0.2962000     0.2636000      0.4217000 
1 1 1 2  18 17 o 7.647000  0.2779000     7.721000  0.3879000     7.573000  0.3980000     0.1486000      0.5558000 
1 1 1 2  18 18 o 9.496000  0.2626000     9.792000  0.3662000     9.200000  0.3764000     0.5921000      0.5252000 
1 1 1 2  18 19 o 2.673000  1.005000      2.673000  1.005000      ?         ?             ?              ?         
1 1 1 2  18 20 o 3.674000  0.5441000     3.855000  0.7217000     3.492000  0.8145000     0.3628000      1.088000  
1 1 1 2  18 21 o 1.558000  0.4958000     1.693000  0.7372000     1.423000  0.6633000     0.2692000      0.9917000 
1 1 1 2  18 22 o 2.299000  0.5695000     2.532000  0.8119000     2.066000  0.7988000     0.4657000      1.139000  
1 1 1 2  18 23 o 1.740000  0.5073000     1.733000  0.7228000     1.748000  0.7120000     -0.1521000E-01 1.015000  
1 1 1 2  18 24 o 1.276000  0.4533000     1.398000  0.6931000     1.154000  0.5844000     0.2439000      0.9066000 
1 1 1 2  18 25 f 2.191000  0.5533000     2.289000  0.7875000     2.093000  0.7775000     0.1961000      1.107000  
1 1 1 2  18 26 o 1.555000  0.4756000     1.879000  0.7473000     1.231000  0.5885000     0.6481000      0.9512000 
1 1 1 2  18 27 o 1.327000  0.4679000     1.383000  0.6845000     1.271000  0.6382000     0.1112000      0.9359000 
1 1 1 2  19 0  o 22.74000  0.2680000     22.74000  0.2680000     22.74000  0.2680000     0.000000       0.000000  
1 1 1 2  19 1  o 7.134000  0.1116000     7.370000  0.1576000     6.899000  0.1580000     0.4708000      0.2231000 
1 1 1 2  19 2  o 10.12000  0.1178000     10.04000  0.1665000     10.20000  0.1666000     -0.1580000     0.2356000 
1 1 1 2  19 3  o 9.434000  0.1170000     9.481000  0.1655000     9.386000  0.1654000     0.9462000E-01  0.2340000 
1 1 1 2  19 4  o 3.400000  0.1620000     3.593000  0.2204000     3.208000  0.2374000     0.3849000      0.3239000 
1 1 1 2  19 5  o 11.11000  0.1274000     11.20000  0.1805000     11.03000  0.1799000     0.1754000      0.2549000 
1 1 1 2  19 6  o 14.97000  0.1471000     15.09000  0.2089000     14.85000  0.2073000     0.2459000      0.2942000 
1 1 1 2  19 7  o 13.18000  0.2838000     13.18000  0.2838000     ?         ?             ?              ?         
1 1 1 2  19 8  o 17.63000  0.1682000     17.89000  0.2394000     17.37000  0.2362000     0.5256000      0.3363000 
1 1 1 2  19 9  o 8.410000  0.1436000     8.280000  0.2023000     8.541000  0.2038000     -0.2608000     0.2872000 
1 1 1 2  19 10 o 7.139000  0.1545000     7.261000  0.2186000     7.017000  0.2183000     0.2437000      0.3089000 
1 1 1 2  19 11 o 12.27000  0.1560000     12.32000  0.2207000     12.22000  0.2204000     0.9794000E-01  0.3119000 
1 1 1 2  19 12 o 10.05000  0.1819000     10.03000  0.2301000     10.07000  0.2819000     -0.3717000E-01 0.3639000 
1 1 1 2  19 13 o 12.78000  0.2051000     12.71000  0.2909000     12.85000  0.2891000     -0.1347000     0.4101000 
1 1 1 2  19 14 o 12.30000  0.1998000     12.30000  0.2790000     12.30000  0.2862000     -0.2988000E-02 0.3997000 
1 1 1 2  19 15 o 5.746000  0.3180000     5.566000  0.4509000     5.926000  0.4486000     -0.3607000     0.6360000 
1 1 1 2  19 16 o 5.720000  0.3136000     5.394000  0.4600000     6.046000  0.4265000     -0.6521000     0.6273000 
1 1 1 2  19 17 o 6.070000  0.3370000     6.399000  0.4454000     5.741000  0.5059000     0.6579000      0.6740000 
1 1 1 2  19 18 o 2.579000  0.6102000     3.219000  0.8955000     1.940000  0.8291000     1.279000       1.220000  
1 1 1 2  19 19 o 3.261000  0.9617000     2.389000  1.120000      4.133000  1.564000      -1.744000      1.923000  
1 1 1 2  19 20 o 2.551000  0.6115000     2.443000  0.8646000     2.660000  0.8650000     -0.2176000     1.223000  
1 1 1 2  19 21 o 2.389000  0.5884000     2.177000  0.8308000     2.602000  0.8333000     -0.4256000     1.177000  
1 1 1 2  19 22 o 2.312000  0.5554000     2.737000  0.7981000     1.887000  0.7727000     0.8497000      1.111000  
1 1 1 2  19 23 o 1.189000  0.4050000     1.095000  0.5371000     1.283000  0.6064000     -0.1881000     0.8101000 
1 1 1 2  19 25 o 1.812000  0.5110000     1.872000  0.7315000     1.753000  0.7137000     0.1191000      1.022000  
1 1 1 2  19 26 o 1.340000  0.4343000     1.256000  0.5880000     1.423000  0.6392000     -0.1676000     0.8685000 
1 1 1 2  20 0  o 21.43000  0.2572000     21.43000  0.2572000     21.43000  0.2572000     0.000000       0.000000  
1 1 1 2  20 1  o 36.19000  0.2872000     36.38000  0.4079000     36.01000  0.4043000     0.3717000      0.5743000 
1 1 1 2  20 2  o 10.06000  0.1202000     10.02000  0.1699000     10.10000  0.1702000     -0.8257000E-01 0.2405000 
1 1 1 2  20 3  o 10.58000  0.1224000     10.36000  0.1717000     10.80000  0.1744000     -0.4359000     0.2447000 
1 1 1 2  20 4  o 4.954000  0.1353000     5.000000  0.1914000     4.907000  0.1912000     0.9332000E-01  0.2706000 
1 1 1 2  20 5  o 1.974000  0.2761000     1.755000  0.4292000     2.193000  0.3473000     -0.4384000     0.5521000 
1 1 1 2  20 6  f 10.74000  0.1856000     11.10000  0.2620000     10.38000  0.2631000     0.7245000      0.3713000 
1 1 1 2  20 7  o 3.804000  0.2136000     4.011000  0.3393000     3.597000  0.2596000     0.4142000      0.4272000 
1 1 1 2  20 8  o 7.436000  0.1396000     7.475000  0.1973000     7.396000  0.1976000     0.7876000E-01  0.2792000 
1 1 1 2  20 9  o 5.987000  0.1600000     5.894000  0.2257000     6.079000  0.2267000     -0.1843000     0.3199000 
1 1 1 2  20 10 f 8.203000  0.1501000     8.019000  0.2121000     8.387000  0.2125000     -0.3684000     0.3002000 
1 1 1 2  20 11 o 1.665000  0.3839000     1.421000  0.5497000     1.910000  0.5361000     -0.4896000     0.7678000 
1 1 1 2  20 12 o 5.699000  0.1942000     5.756000  0.2742000     5.643000  0.2751000     0.1126000      0.3884000 
1 1 1 2  20 13 o 5.097000  0.4544000     5.097000  0.4544000     ?         ?             ?              ?         
1 1 1 2  20 14 o 11.33000  0.2029000     11.19000  0.2808000     11.47000  0.2930000     -0.2800000     0.4059000 
1 1 1 2  20 15 f 2.509000  0.5640000     2.516000  0.8031000     2.502000  0.7921000     0.1440000E-01  1.128000  
1 1 1 2  20 16 o 3.289000  0.5055000     2.968000  0.7677000     3.609000  0.6577000     -0.6408000     1.011000  
1 1 1 2  20 17 o 2.941000  0.5939000     2.812000  0.8564000     3.070000  0.8231000     -0.2585000     1.188000  
1 1 1 2  20 18 o 6.691000  0.3617000     7.525000  0.4660000     5.857000  0.5534000     1.668000       0.7234000 
1 1 1 2  20 19 o 6.867000  0.5245000     6.111000  0.9510000     7.623000  0.4427000     -1.512000      1.049000  
1 1 1 2  20 20 o 2.188000  0.5790000     2.682000  0.8754000     1.694000  0.7580000     0.9885000      1.158000  
1 1 1 2  20 21 o 2.611000  0.5964000     2.292000  0.8225000     2.930000  0.8639000     -0.6389000     1.193000  
1 1 1 2  20 22 o 2.525000  0.5565000     2.485000  0.7991000     2.565000  0.7745000     -0.8048000E-01 1.113000  
1 1 1 2  20 23 o 3.524000  0.4655000     3.990000  0.5886000     3.058000  0.7214000     0.9317000      0.9311000 
1 1 1 2  20 24 o 1.937000  0.6029000     1.882000  0.9119000     1.993000  0.7887000     -0.1113000     1.206000  
1 1 1 2  20 25 o 1.483000  0.4561000     1.707000  0.6981000     1.258000  0.5871000     0.4494000      0.9121000 
1 1 1 2  20 26 o 1.229000  0.4070000     1.540000  0.6706000     0.9182000 0.4614000     0.6222000      0.8140000 
1 1 1 2  21 0  o 1.431000  0.5028000     1.431000  0.5028000     1.431000  0.5028000     0.000000       0.000000  
1 1 1 2  21 1  o 14.09000  0.1381000     13.99000  0.1942000     14.18000  0.1963000     -0.1881000     0.2761000 
1 1 1 2  21 2  o 18.38000  0.1636000     18.37000  0.2313000     18.40000  0.2314000     -0.3064000E-01 0.3272000 
1 1 1 2  21 3  o 5.140000  0.1314000     5.330000  0.1822000     4.949000  0.1894000     0.3807000      0.2628000 
1 1 1 2  21 4  o 7.897000  0.1218000     8.022000  0.1729000     7.772000  0.1715000     0.2502000      0.2435000 
1 1 1 2  21 5  o 5.457000  0.1680000     5.239000  0.2761000     5.675000  0.1914000     -0.4359000     0.3359000 
1 1 1 2  21 6  o 3.878000  0.3394000     3.369000  0.3901000     4.387000  0.5554000     -1.019000      0.6787000 
1 1 1 2  21 7  o 6.610000  0.1388000     6.643000  0.1939000     6.577000  0.1986000     0.6605000E-01  0.2776000 
1 1 1 2  21 8  o 7.093000  0.1448000     7.096000  0.2026000     7.090000  0.2070000     0.5968000E-02  0.2897000 
1 1 1 2  21 9  o 9.036000  0.1429000     9.012000  0.2031000     9.061000  0.2011000     -0.4934000E-01 0.2858000 
1 1 1 2  21 10 o 3.222000  0.2801000     3.800000  0.3326000     2.645000  0.4507000     1.155000       0.5602000 
1 1 1 2  21 11 o 12.85000  0.1603000     12.73000  0.2258000     12.96000  0.2276000     -0.2355000     0.3207000 
1 1 1 2  21 12 o 11.48000  0.1631000     11.50000  0.2308000     11.47000  0.2306000     0.3015000E-01  0.3262000 
1 1 1 2  21 13 o 12.80000  0.3434000     12.80000  0.3434000     ?         ?             ?              ?         
1 1 1 2  21 14 o 2.828000  0.5181000     3.048000  0.6829000     2.607000  0.7792000     0.4406000      1.036000  
1 1 1 2  21 15 f 4.694000  0.3519000     4.656000  0.4957000     4.733000  0.4994000     -0.7737000E-01 0.7037000 
1 1 1 2  21 16 o 11.90000  0.2166000     11.81000  0.3048000     12.00000  0.3077000     -0.1902000     0.4331000 
1 1 1 2  21 17 o 7.200000  0.3093000     7.100000  0.4307000     7.299000  0.4441000     -0.1989000     0.6187000 
1 1 1 2  21 18 o 5.739000  0.4014000     5.375000  0.6064000     6.102000  0.5262000     -0.7269000     0.8029000 
1 1 1 2  21 19 o 6.142000  0.3893000     5.563000  0.6063000     6.720000  0.4884000     -1.157000      0.7786000 
1 1 1 2  21 20 o 2.368000  0.5568000     3.072000  0.8265000     1.664000  0.7464000     1.408000       1.114000  
1 1 1 2  21 21 o 3.616000  0.5072000     3.532000  0.7411000     3.700000  0.6926000     -0.1675000     1.014000  
1 1 1 2  21 22 o 3.396000  0.4767000     4.212000  0.5430000     2.581000  0.7837000     1.632000       0.9535000 
1 1 1 2  21 23 o 1.558000  0.4687000     1.876000  0.7290000     1.241000  0.5894000     0.6349000      0.9374000 
1 1 1 2  21 24 o 1.338000  0.4630000     1.648000  0.7733000     1.029000  0.5095000     0.6182000      0.9260000 
1 1 1 2  21 25 o 1.311000  0.4276000     1.569000  0.6803000     1.054000  0.5182000     0.5157000      0.8552000 
1 1 1 2  21 26 o 1.625000  0.4843000     1.702000  0.7027000     1.548000  0.6665000     0.1535000      0.9685000 
1 1 1 2  22 0  o 2.427000  0.3056000     2.427000  0.3056000     2.427000  0.3056000     0.000000       0.000000  
1 1 1 2  22 1  o 5.140000  0.1318000     5.341000  0.1839000     4.939000  0.1889000     0.4022000      0.2636000 
1 1 1 2  22 2  o 13.84000  0.1387000     13.78000  0.1958000     13.90000  0.1965000     -0.1205000     0.2774000 
1 1 1 2  22 3  o 5.076000  0.1354000     4.770000  0.1953000     5.383000  0.1877000     -0.6127000     0.2709000 
1 1 1 2  22 4  o 13.82000  0.1406000     13.77000  0.1983000     13.87000  0.1994000     -0.1062000     0.2812000 
1 1 1 2  22 5  o 16.97000  0.4432000     16.97000  0.4432000     ?         ?             ?              ?         
1 1 1 2  22 6  f 3.213000  0.2022000     3.173000  0.2853000     3.253000  0.2865000     -0.7992000E-01 0.4044000 
1 1 1 2  22 7  o 14.89000  0.1779000     14.99000  0.2554000     14.78000  0.2479000     0.2068000      0.3559000 
1 1 1 2  22 8  o 5.396000  0.1612000     5.286000  0.2287000     5.506000  0.2273000     -0.2203000     0.3225000 
1 1 1 2  22 9  f 7.812000  0.1664000     8.236000  0.2545000     7.387000  0.2145000     0.8483000      0.3329000 
1 1 1 2  22 10 o 8.305000  0.1564000     8.806000  0.2213000     7.804000  0.2212000     1.002000       0.3129000 
1 1 1 2  22 11 o 9.672000  0.1584000     9.644000  0.2253000     9.700000  0.2226000     -0.5653000E-01 0.3167000 
1 1 1 2  22 12 o 16.68000  0.1808000     16.32000  0.2539000     17.03000  0.2575000     -0.7085000     0.3616000 
1 1 1 2  22 13 o 6.098000  0.2663000     6.113000  0.4322000     6.083000  0.3113000     0.3017000E-01  0.5326000 
1 1 1 2  22 14 o 4.682000  0.3425000     4.755000  0.4602000     4.608000  0.5073000     0.1466000      0.6850000 
1 1 1 2  22 15 o 7.263000  0.2511000     7.125000  0.3635000     7.402000  0.3466000     -0.2773000     0.5023000 
1 1 1 2  22 16 o 8.124000  0.2563000     8.254000  0.3525000     7.994000  0.3721000     0.2601000      0.5126000 
1 1 1 2  22 17 o 3.418000  0.5839000     2.936000  0.8730000     3.900000  0.7757000     -0.9641000     1.168000  
1 1 1 2  22 18 o 2.423000  0.6206000     3.225000  0.9686000     1.620000  0.7760000     1.605000       1.241000  
1 1 1 2  22 19 o 4.152000  0.5203000     4.075000  0.7547000     4.229000  0.7163000     -0.1535000     1.041000  
1 1 1 2  22 20 o 3.131000  0.5676000     2.748000  0.8492000     3.515000  0.7535000     -0.7674000     1.135000  
1 1 1 2  22 21 o 2.238000  0.5389000     1.650000  0.7248000     2.826000  0.7976000     -1.176000      1.078000  
1 1 1 2  22 22 o 1.729000  0.5137000     1.955000  0.7725000     1.503000  0.6774000     0.4520000      1.027000  
1 1 1 2  22 23 o 2.115000  0.5505000     2.104000  0.7864000     2.127000  0.7706000     -0.2288000E-01 1.101000  
1 1 1 2  22 24 o 1.672000  0.4702000     1.269000  0.5924000     2.074000  0.7304000     -0.8051000     0.9405000 
1 1 1 2  22 25 o 1.625000  0.4595000     1.161000  0.5569000     2.088000  0.7309000     -0.9266000     0.9189000 
1 1 1 2  22 26 o 1.532000  0.4656000     1.207000  0.5769000     1.858000  0.7310000     -0.6508000     0.9312000 
1 1 1 2  23 0  o 6.717000  0.1744000     6.717000  0.1744000     6.717000  0.1744000     -0.000000      0.000000  
1 1 1 2  23 1  o 10.18000  0.1250000     10.06000  0.1761000     10.31000  0.1773000     -0.2529000     0.2500000 
1 1 1 2  23 2  o 3.610000  0.1669000     3.846000  0.2232000     3.375000  0.2482000     0.4706000      0.3338000 
1 1 1 2  23 3  o 3.136000  0.1909000     3.251000  0.2623000     3.020000  0.2773000     0.2304000      0.3817000 
1 1 1 2  23 4  o 4.286000  0.3195000     4.286000  0.3195000     ?         ?             ?              ?         
1 1 1 2  23 5  o 10.78000  0.1616000     10.76000  0.2621000     10.80000  0.1890000     -0.3493000E-01 0.3231000 
1 1 1 2  23 6  o 4.571000  0.1622000     4.352000  0.2383000     4.790000  0.2202000     -0.4377000     0.3245000 
1 1 1 2  23 7  o 4.388000  0.1802000     4.405000  0.2543000     4.370000  0.2555000     0.3531000E-01  0.3605000 
1 1 1 2  23 8  o 1.558000  0.3766000     1.550000  0.5329000     1.566000  0.5321000     -0.1652000E-01 0.7531000 
1 1 1 2  23 9  o 2.063000  0.3567000     2.421000  0.4672000     1.705000  0.5391000     0.7165000      0.7134000 
1 1 1 2  23 10 o 13.56000  0.1592000     13.51000  0.2241000     13.62000  0.2263000     -0.1124000     0.3185000 
1 1 1 2  23 11 o 7.361000  0.1707000     7.291000  0.2413000     7.431000  0.2416000     -0.1397000     0.3414000 
1 1 1 2  23 12 o 7.908000  0.2550000     8.080000  0.3534000     7.736000  0.3678000     0.3433000      0.5101000 
1 1 1 2  23 13 o 3.514000  0.3530000     2.903000  0.5660000     4.124000  0.4219000     -1.221000      0.7059000 
1 1 1 2  23 14 o 8.597000  0.2013000     8.440000  0.2886000     8.753000  0.2805000     -0.3130000     0.4025000 
1 1 1 2  23 15 o 4.890000  0.3367000     5.083000  0.4557000     4.696000  0.4957000     0.3869000      0.6733000 
1 1 1 2  23 16 o 2.831000  0.5318000     1.963000  0.7902000     3.699000  0.7118000     -1.736000      1.064000  
1 1 1 2  23 17 o 5.357000  0.4232000     6.261000  0.4878000     4.452000  0.6916000     1.809000       0.8463000 
1 1 1 2  23 18 o 7.197000  0.5711000     7.197000  0.5711000     ?         ?             ?              ?         
1 1 1 2  23 19 o 3.802000  0.5612000     3.443000  0.8437000     4.162000  0.7403000     -0.7195000     1.122000  
1 1 1 2  23 20 o 5.623000  0.3587000     5.378000  0.5305000     5.868000  0.4828000     -0.4903000     0.7173000 
1 1 1 2  23 21 o 1.637000  0.5076000     1.824000  0.7646000     1.450000  0.6679000     0.3738000      1.015000  
1 1 1 2  23 22 o 1.434000  0.4647000     1.562000  0.6929000     1.305000  0.6195000     0.2562000      0.9294000 
1 1 1 2  23 23 f 2.197000  0.5414000     2.712000  0.7765000     1.681000  0.7546000     1.032000       1.083000  
1 1 1 2  23 24 o 2.065000  0.5261000     2.274000  0.7540000     1.855000  0.7339000     0.4191000      1.052000  
1 1 1 2  23 25 o 1.681000  0.4932000     1.571000  0.6738000     1.791000  0.7203000     -0.2202000     0.9864000 
1 1 1 2  23 26 o 1.116000  0.3826000     1.041000  0.5132000     1.190000  0.5677000     -0.1487000     0.7653000 
1 1 1 2  24 0  o 14.21000  0.2012000     14.21000  0.2012000     14.21000  0.2012000     -0.000000      0.000000  
1 1 1 2  24 1  o 23.95000  0.2026000     23.88000  0.2860000     24.02000  0.2871000     -0.1410000     0.4052000 
1 1 1 2  24 2  o 13.75000  0.1993000     13.75000  0.2821000     13.75000  0.2816000     0.1966000E-02  0.3986000 
1 1 1 2  24 3  o 4.151000  0.4676000     4.151000  0.4676000     ?         ?             ?              ?         
1 1 1 2  24 4  o 2.750000  0.3178000     3.185000  0.3946000     2.315000  0.4982000     0.8692000      0.6355000 
1 1 1 2  24 5  o 6.316000  0.1394000     6.268000  0.1997000     6.363000  0.1946000     -0.9440000E-01 0.2788000 
1 1 1 2  24 6  o 7.811000  0.1374000     7.844000  0.1937000     7.778000  0.1949000     0.6591000E-01  0.2748000 
1 1 1 2  24 7  f 7.184000  0.1476000     7.160000  0.2082000     7.208000  0.2091000     -0.4840000E-01 0.2951000 
1 1 1 2  24 8  o 5.860000  0.1638000     5.795000  0.2302000     5.925000  0.2331000     -0.1304000     0.3276000 
1 1 1 2  24 9  o 9.779000  0.1488000     9.802000  0.2099000     9.755000  0.2111000     0.4666000E-01  0.2976000 
1 1 1 2  24 10 o 8.058000  0.1620000     8.266000  0.2298000     7.851000  0.2285000     0.4147000      0.3241000 
1 1 1 2  24 11 o 11.10000  0.1618000     10.73000  0.2290000     11.47000  0.2286000     -0.7358000     0.3235000 
1 1 1 2  24 12 o 7.055000  0.3860000     7.055000  0.3860000     ?         ?             ?              ?         
1 1 1 2  24 13 o 3.855000  0.3287000     4.143000  0.4413000     3.567000  0.4873000     0.5754000      0.6574000 
1 1 1 2  24 14 o 6.468000  0.2265000     6.483000  0.3205000     6.453000  0.3203000     0.3057000E-01  0.4531000 
1 1 1 2  24 15 o 7.946000  0.2408000     7.990000  0.3413000     7.902000  0.3399000     0.8811000E-01  0.4816000 
1 1 1 2  24 16 o 5.690000  0.3348000     5.458000  0.4844000     5.923000  0.4622000     -0.4653000     0.6695000 
1 1 1 2  24 17 o 7.070000  0.3153000     7.038000  0.4411000     7.102000  0.4507000     -0.6412000E-01 0.6306000 
1 1 1 2  24 18 o 3.807000  0.9977000     4.372000  1.331000      3.243000  1.487000      1.128000       1.995000  
1 1 1 2  24 19 o 2.507000  0.6178000     2.465000  0.8729000     2.548000  0.8744000     -0.8291000E-01 1.236000  
1 1 1 2  24 20 o 3.959000  0.4878000     3.363000  0.7732000     4.555000  0.5949000     -1.192000      0.9756000 
1 1 1 2  24 21 o 1.425000  0.4704000     1.432000  0.6681000     1.417000  0.6623000     0.1470000E-01  0.9408000 
1 1 1 2  24 22 o 2.101000  0.5525000     2.155000  0.7790000     2.047000  0.7837000     0.1082000      1.105000  
1 1 1 2  24 23 o 5.835000  0.5631000     5.835000  0.5631000     ?         ?             ?              ?         
1 1 1 2  24 24 o 2.796000  0.4651000     1.820000  0.7250000     3.773000  0.5827000     -1.953000      0.9301000 
1 1 1 2  24 25 o 1.447000  0.4555000     1.340000  0.6151000     1.554000  0.6720000     -0.2142000     0.9110000 
1 1 1 2  24 26 o 1.247000  0.4142000     1.199000  0.5708000     1.295000  0.6003000     -0.9589000E-01 0.8283000 
1 1 1 2  25 2  o 11.50000  0.2339000     11.46000  0.2664000     11.54000  0.3845000     -0.7991000E-01 0.4678000 
1 1 1 2  25 3  o 10.73000  0.1618000     10.74000  0.2631000     10.72000  0.1882000     0.1829000E-01  0.3235000 
1 1 1 2  25 4  o 6.753000  0.1350000     6.642000  0.1925000     6.864000  0.1893000     -0.2220000     0.2700000 
1 1 1 2  25 5  o 5.019000  0.1594000     4.891000  0.2280000     5.146000  0.2229000     -0.2552000     0.3189000 
1 1 1 2  25 6  o 11.91000  0.1428000     12.06000  0.2025000     11.76000  0.2015000     0.3060000      0.2857000 
1 1 1 2  25 7  o 3.673000  0.2187000     3.948000  0.2932000     3.397000  0.3247000     0.5518000      0.4375000 
1 1 1 2  25 8  o 3.193000  0.2609000     3.694000  0.3046000     2.691000  0.4237000     1.003000       0.5219000 
1 1 1 2  25 9  o 7.457000  0.1588000     7.216000  0.2254000     7.698000  0.2237000     -0.4813000     0.3176000 
1 1 1 2  25 10 o 6.861000  0.1724000     7.155000  0.2397000     6.568000  0.2479000     0.5868000      0.3449000 
1 1 1 2  25 11 o 5.155000  0.2647000     5.045000  0.4433000     5.265000  0.2893000     -0.2193000     0.5293000 
1 1 1 2  25 12 o 6.384000  0.2547000     6.771000  0.4153000     5.998000  0.2951000     0.7726000      0.5095000 
1 1 1 2  25 13 o 2.586000  0.4671000     2.486000  0.6772000     2.686000  0.6435000     -0.2000000     0.9342000 
1 1 1 2  25 14 o 10.57000  0.1835000     10.77000  0.2583000     10.37000  0.2607000     0.4006000      0.3670000 
1 1 1 2  25 15 o 5.239000  0.3008000     5.384000  0.4714000     5.094000  0.3736000     0.2906000      0.6015000 
1 1 1 2  25 16 o 5.172000  0.3874000     5.919000  0.4515000     4.425000  0.6295000     1.495000       0.7747000 
1 1 1 2  25 17 o 8.763000  0.2744000     8.123000  0.3996000     9.403000  0.3762000     -1.280000      0.5488000 
1 1 1 2  25 18 o 2.543000  0.7088000     2.653000  1.099000      2.434000  0.8957000     0.2187000      1.418000  
1 1 1 2  25 19 o 3.655000  0.5631000     3.670000  0.8036000     3.641000  0.7889000     0.2892000E-01  1.126000  
1 1 1 2  25 20 o 3.907000  0.4922000     3.505000  0.7699000     4.310000  0.6134000     -0.8054000     0.9844000 
1 1 1 2  25 21 o 2.891000  0.5049000     3.767000  0.6258000     2.015000  0.7926000     1.752000       1.010000  
1 1 1 2  25 22 o 2.643000  0.5545000     2.548000  0.7973000     2.737000  0.7710000     -0.1881000     1.109000  
1 1 1 2  25 23 o 1.612000  0.5677000     1.720000  0.8525000     1.505000  0.7501000     0.2154000      1.135000  
1 1 1 2  25 24 o 1.739000  0.4910000     1.320000  0.6153000     2.157000  0.7654000     -0.8365000     0.9821000 
1 1 1 2  25 25 o 1.500000  0.4589000     1.799000  0.7170000     1.201000  0.5730000     0.5983000      0.9179000 
1 1 1 2  25 26 o 1.005000  0.3666000     0.9577000 0.4926000     1.053000  0.5431000     -0.9540000E-01 0.7332000 
1 1 1 2  26 0  o 6.551000  0.2265000     6.551000  0.2265000     6.551000  0.2265000     -0.000000      0.000000  
1 1 1 2  26 1  o 2.272000  0.2820000     1.596000  0.4812000     2.948000  0.2943000     -1.352000      0.5641000 
1 1 1 2  26 2  o 1.494000  0.3384000     1.649000  0.4752000     1.340000  0.4819000     0.3095000      0.6768000 
1 1 1 2  26 3  o 15.51000  0.1539000     15.22000  0.2159000     15.80000  0.2194000     -0.5822000     0.3078000 
1 1 1 2  26 4  o 14.45000  0.1493000     14.50000  0.2117000     14.39000  0.2107000     0.1096000      0.2987000 
1 1 1 2  26 5  o 13.61000  0.1487000     13.70000  0.2106000     13.53000  0.2101000     0.1647000      0.2974000 
1 1 1 2  26 6  o 8.827000  0.1409000     8.950000  0.2002000     8.704000  0.1984000     0.2464000      0.2819000 
1 1 1 2  26 7  o 7.565000  0.1499000     7.271000  0.2138000     7.859000  0.2102000     -0.5886000     0.2998000 
1 1 1 2  26 8  o 14.06000  0.1572000     14.18000  0.2221000     13.94000  0.2226000     0.2347000      0.3144000 
1 1 1 2  26 9  o 21.90000  0.2016000     21.92000  0.2852000     21.87000  0.2850000     0.5381000E-01  0.4032000 
1 1 1 2  26 10 o 15.43000  0.1986000     15.44000  0.3161000     15.42000  0.2405000     0.1802000E-01  0.3972000 
1 1 1 2  26 11 o 23.42000  0.4355000     23.42000  0.4355000     ?         ?             ?              ?         
1 1 1 2  26 12 o 4.815000  0.2484000     4.924000  0.3593000     4.707000  0.3431000     0.2169000      0.4968000 
1 1 1 2  26 13 o 1.395000  0.4340000     1.493000  0.6380000     1.296000  0.5885000     0.1965000      0.8680000 
1 1 1 2  26 14 o 2.477000  0.4654000     2.826000  0.6298000     2.127000  0.6855000     0.6997000      0.9309000 
1 1 1 2  26 15 o 1.928000  0.4979000     1.703000  0.6912000     2.153000  0.7168000     -0.4500000     0.9958000 
1 1 1 2  26 16 o 6.578000  0.3091000     6.554000  0.4286000     6.601000  0.4454000     -0.4717000E-01 0.6181000 
1 1 1 2  26 17 o 3.012000  0.5384000     4.367000  0.7616000     1.656000  0.7611000     2.712000       1.077000  
1 1 1 2  26 18 o 3.051000  0.5846000     3.770000  0.7801000     2.332000  0.8708000     1.438000       1.169000  
1 1 1 2  26 19 o 4.924000  0.3970000     4.816000  0.5803000     5.033000  0.5420000     -0.2169000     0.7941000 
1 1 1 2  26 20 o 2.011000  0.5519000     2.273000  0.8137000     1.748000  0.7458000     0.5244000      1.104000  
1 1 1 2  26 21 o 2.769000  0.5496000     3.045000  0.7518000     2.492000  0.8018000     0.5527000      1.099000  
1 1 1 2  26 22 o 2.566000  0.5477000     2.707000  0.7643000     2.426000  0.7848000     0.2809000      1.095000  
1 1 1 2  26 23 o 2.457000  0.6386000     2.049000  0.9790000     2.865000  0.8203000     -0.8166000     1.277000  
1 1 1 2  26 24 o 1.706000  0.5014000     1.837000  0.7320000     1.575000  0.6855000     0.2615000      1.003000  
1 1 1 2  26 25 o 1.724000  0.4966000     1.412000  0.6407000     2.035000  0.7588000     -0.6233000     0.9931000 
1 1 1 2  27 0  o 6.751000  0.1932000     6.751000  0.1932000     6.751000  0.1932000     -0.000000      0.000000  
1 1 1 2  27 1  o 12.20000  0.1391000     12.16000  0.1964000     12.24000  0.1970000     -0.8537000E-01 0.2781000 
1 1 1 2  27 2  o 9.622000  0.1328000     9.651000  0.1879000     9.594000  0.1875000     0.5664000E-01  0.2655000 
1 1 1 2  27 3  o 5.633000  0.1496000     5.510000  0.2151000     5.756000  0.2078000     -0.2456000     0.2991000 
1 1 1 2  27 4  o 7.668000  0.1400000     7.824000  0.1970000     7.512000  0.1991000     0.3122000      0.2801000 
1 1 1 2  27 5  o 11.36000  0.1431000     11.50000  0.2030000     11.21000  0.2017000     0.2853000      0.2862000 
1 1 1 2  27 6  o 9.054000  0.1420000     9.256000  0.2010000     8.852000  0.2005000     0.4032000      0.2839000 
1 1 1 2  27 7  o 1.197000  0.3386000     1.509000  0.5303000     0.8853000 0.4212000     0.6238000      0.6772000 
1 1 1 2  27 8  o 7.778000  0.1568000     7.735000  0.2196000     7.822000  0.2239000     -0.8737000E-01 0.3136000 
1 1 1 2  27 9  o 10.73000  0.1566000     10.57000  0.2208000     10.89000  0.2222000     -0.3122000     0.3132000 
1 1 1 2  27 10 o 9.515000  0.1627000     9.472000  0.2322000     9.557000  0.2280000     -0.8556000E-01 0.3255000 
1 1 1 2  27 11 o 9.878000  0.3179000     9.692000  0.3371000     10.06000  0.5390000     -0.3729000     0.6357000 
1 1 1 2  27 12 o 10.82000  0.1765000     10.93000  0.2523000     10.70000  0.2469000     0.2322000      0.3530000 
1 1 1 2  27 13 o 10.68000  0.1823000     10.46000  0.2620000     10.90000  0.2536000     -0.4317000     0.3646000 
1 1 1 2  27 14 o 8.815000  0.1960000     8.961000  0.2772000     8.668000  0.2772000     0.2923000      0.3920000 
1 1 1 2  27 15 o 6.235000  0.2572000     6.197000  0.3666000     6.273000  0.3609000     -0.7675000E-01 0.5144000 
1 1 1 2  27 16 o 7.267000  0.2992000     6.974000  0.4325000     7.561000  0.4137000     -0.5870000     0.5985000 
1 1 1 2  27 17 o 2.801000  0.9484000     2.801000  0.9484000     ?         ?             ?              ?         
1 1 1 2  27 18 o 4.829000  0.4366000     4.628000  0.6422000     5.031000  0.5915000     -0.4032000     0.8731000 
1 1 1 2  27 19 f 2.713000  0.5549000     2.043000  0.8119000     3.382000  0.7565000     -1.339000      1.110000  
1 1 1 2  27 20 o 3.455000  0.4951000     2.912000  0.7796000     3.998000  0.6106000     -1.086000      0.9903000 
1 1 1 2  27 21 o 4.160000  0.4075000     4.396000  0.5511000     3.924000  0.6005000     0.4724000      0.8150000 
1 1 1 2  27 22 o 2.057000  0.5190000     1.537000  0.6887000     2.577000  0.7765000     -1.040000      1.038000  
1 1 1 2  27 23 o 1.721000  0.5326000     1.989000  0.8338000     1.453000  0.6629000     0.5360000      1.065000  
1 1 1 2  27 24 o 1.480000  0.4666000     1.478000  0.6591000     1.482000  0.6606000     -0.3431000E-02 0.9332000 
1 1 1 2  27 25 o 1.452000  0.4545000     1.723000  0.7098000     1.181000  0.5677000     0.5422000      0.9090000 
1 1 1 2  28 0  o 9.929000  0.1906000     9.929000  0.1906000     9.929000  0.1906000     0.000000       0.000000  
1 1 1 2  28 1  o 2.119000  0.3036000     1.823000  0.4744000     2.415000  0.3790000     -0.5921000     0.6072000 
1 1 1 2  28 2  o 11.95000  0.1414000     11.87000  0.2000000     12.04000  0.2000000     -0.1669000     0.2829000 
1 1 1 2  28 3  o 2.496000  0.2916000     2.051000  0.4762000     2.942000  0.3366000     -0.8911000     0.5832000 
1 1 1 2  28 4  o 1.566000  0.3366000     2.062000  0.4856000     1.071000  0.4661000     0.9911000      0.6731000 
1 1 1 2  28 5  o 3.352000  0.2354000     2.994000  0.3641000     3.711000  0.2985000     -0.7178000     0.4708000 
1 1 1 2  28 6  o 6.236000  0.1595000     6.236000  0.2253000     6.235000  0.2258000     0.1272000E-02  0.3190000 
1 1 1 2  28 7  o 11.66000  0.1592000     11.29000  0.2351000     12.04000  0.2146000     -0.7444000     0.3183000 
1 1 1 2  28 8  o 7.586000  0.1593000     7.573000  0.2252000     7.598000  0.2253000     -0.2455000E-01 0.3185000 
1 1 1 2  28 9  o 5.920000  0.1879000     5.891000  0.2670000     5.949000  0.2646000     -0.5771000E-01 0.3759000 
1 1 1 2  28 10 o 1.807000  0.4982000     1.882000  0.7139000     1.732000  0.6952000     0.1503000      0.9965000 
1 1 1 2  28 11 o 1.390000  0.4110000     1.239000  0.5567000     1.542000  0.6047000     -0.3022000     0.8219000 
1 1 1 2  28 12 o 3.514000  0.3591000     3.885000  0.4624000     3.143000  0.5495000     0.7422000      0.7181000 
1 1 1 2  28 13 o 2.088000  0.4799000     2.185000  0.6658000     1.990000  0.6913000     0.1944000      0.9598000 
1 1 1 2  28 14 o 4.775000  0.2875000     5.032000  0.3800000     4.519000  0.4316000     0.5123000      0.5751000 
1 1 1 2  28 15 o 11.13000  0.1996000     11.40000  0.2790000     10.86000  0.2855000     0.5440000      0.3991000 
1 1 1 2  28 16 o 1.948000  0.5082000     2.548000  0.7943000     1.347000  0.6341000     1.201000       1.016000  
1 1 1 2  28 17 o 2.392000  0.7577000     2.116000  1.004000      2.667000  1.135000      -0.5510000     1.515000  
1 1 1 2  28 18 o 3.254000  0.5565000     4.175000  0.6868000     2.333000  0.8759000     1.841000       1.113000  
1 1 1 2  28 19 o 2.179000  0.5619000     1.789000  0.7622000     2.569000  0.8258000     -0.7794000     1.124000  
1 1 1 2  28 20 o 5.111000  0.3412000     4.807000  0.5065000     5.414000  0.4574000     -0.6071000     0.6825000 
1 1 1 2  28 21 o 2.582000  0.5320000     3.090000  0.7330000     2.074000  0.7712000     1.016000       1.064000  
1 1 1 2  28 22 o 2.631000  0.5572000     2.083000  0.7903000     3.180000  0.7856000     -1.097000      1.114000  
1 1 1 2  28 23 o 1.558000  0.4691000     1.952000  0.7501000     1.164000  0.5636000     0.7877000      0.9382000 
1 1 1 2  28 24 o 1.946000  0.5105000     1.656000  0.6986000     2.237000  0.7446000     -0.5807000     1.021000  
1 1 1 2  28 25 o 1.118000  0.3853000     1.041000  0.5142000     1.194000  0.5741000     -0.1536000     0.7707000 
1 1 1 2  29 0  o 5.078000  0.2273000     5.078000  0.2273000     5.078000  0.2273000     -0.000000      0.000000  
1 1 1 2  29 1  o 4.006000  0.1910000     3.959000  0.2724000     4.053000  0.2679000     -0.9451000E-01 0.3820000 
1 1 1 2  29 2  o 1.087000  0.3290000     0.9352000 0.4310000     1.239000  0.4972000     -0.3043000     0.6580000 
1 1 1 2  29 3  o 4.171000  0.1895000     4.078000  0.2727000     4.263000  0.2631000     -0.1846000     0.3789000 
1 1 1 2  29 4  o 1.594000  0.3676000     1.408000  0.5218000     1.779000  0.5179000     -0.3705000     0.7352000 
1 1 1 2  29 5  o 9.958000  0.1442000     9.846000  0.2035000     10.07000  0.2044000     -0.2240000     0.2884000 
1 1 1 2  29 6  o 22.35000  0.2004000     22.18000  0.2817000     22.52000  0.2853000     -0.3396000     0.4009000 
1 1 1 2  29 7  o 18.02000  0.1776000     17.93000  0.2497000     18.12000  0.2527000     -0.1887000     0.3552000 
1 1 1 2  29 8  o 17.85000  0.1795000     17.64000  0.2513000     18.07000  0.2563000     -0.4255000     0.3590000 
1 1 1 2  29 9  o 9.118000  0.1620000     9.476000  0.2289000     8.761000  0.2292000     0.7147000      0.3239000 
1 1 1 2  29 10 o 7.920000  0.3438000     7.920000  0.3438000     ?         ?             ?              ?         
1 1 1 2  29 11 o 7.561000  0.1887000     7.474000  0.2698000     7.648000  0.2639000     -0.1742000     0.3774000 
1 1 1 2  29 12 o 5.859000  0.2281000     5.608000  0.3400000     6.110000  0.3041000     -0.5020000     0.4562000 
1 1 1 2  29 13 o 3.175000  0.3872000     3.026000  0.5778000     3.325000  0.5156000     -0.2997000     0.7744000 
1 1 1 2  29 14 o 3.139000  0.4266000     3.794000  0.5031000     2.483000  0.6890000     1.311000       0.8532000 
1 1 1 2  29 15 o 4.445000  0.3599000     4.179000  0.5407000     4.711000  0.4751000     -0.5320000     0.7197000 
1 1 1 2  29 16 o 8.208000  0.2563000     8.236000  0.3905000     8.181000  0.3320000     0.5440000E-01  0.5126000 
1 1 1 2  29 17 o 5.968000  0.5311000     5.542000  0.9450000     6.394000  0.4851000     -0.8529000     1.062000  
1 1 1 2  29 18 o 2.378000  0.5788000     1.853000  0.7917000     2.903000  0.8446000     -1.050000      1.158000  
1 1 1 2  29 19 o 4.260000  0.4655000     5.439000  0.4955000     3.081000  0.7883000     2.358000       0.9311000 
1 1 1 2  29 20 o 1.895000  0.5207000     1.499000  0.6771000     2.291000  0.7913000     -0.7919000     1.041000  
1 1 1 2  29 21 o 1.906000  0.5293000     2.137000  0.7802000     1.674000  0.7155000     0.4636000      1.059000  
1 1 1 2  29 22 o 1.599000  0.7333000     1.599000  0.7333000     ?         ?             ?              ?         
1 1 1 2  29 23 o 2.413000  0.5375000     2.655000  0.7568000     2.170000  0.7634000     0.4848000      1.075000  
1 1 1 2  29 24 o 1.342000  0.4367000     1.150000  0.5575000     1.535000  0.6723000     -0.3855000     0.8733000 
1 1 1 2  29 25 f 1.701000  0.4899000     1.365000  0.6263000     2.038000  0.7535000     -0.6734000     0.9798000 
1 1 1 2  30 0  o 11.53000  0.2016000     11.53000  0.2016000     11.53000  0.2016000     0.000000       0.000000  
1 1 1 2  30 1  o 10.82000  0.1413000     11.10000  0.2000000     10.54000  0.1997000     0.5666000      0.2826000 
1 1 1 2  30 2  o 13.09000  0.1480000     13.21000  0.2101000     12.97000  0.2086000     0.2418000      0.2961000 
1 1 1 2  30 3  o 5.978000  0.1583000     5.869000  0.2270000     6.087000  0.2208000     -0.2185000     0.3167000 
1 1 1 2  30 4  o 8.226000  0.1454000     8.497000  0.2038000     7.956000  0.2074000     0.5408000      0.2908000 
1 1 1 2  30 5  o 18.91000  0.1794000     18.58000  0.2509000     19.24000  0.2566000     -0.6590000     0.3588000 
1 1 1 2  30 6  o 4.751000  0.1968000     4.703000  0.2781000     4.799000  0.2784000     -0.9609000E-01 0.3935000 
1 1 1 2  30 7  o 8.674000  0.1546000     8.597000  0.2165000     8.751000  0.2206000     -0.1541000     0.3091000 
1 1 1 2  30 8  o 9.304000  0.1579000     9.092000  0.2233000     9.516000  0.2235000     -0.4244000     0.3159000 
1 1 1 2  30 9  o 2.061000  0.4932000     1.603000  0.6723000     2.519000  0.7217000     -0.9166000     0.9863000 
1 1 1 2  30 10 o 9.926000  0.1718000     10.25000  0.2455000     9.599000  0.2404000     0.6543000      0.3437000 
1 1 1 2  30 11 o 2.802000  0.4061000     3.098000  0.5383000     2.507000  0.6082000     0.5913000      0.8122000 
1 1 1 2  30 12 o 11.62000  0.1785000     11.41000  0.2540000     11.84000  0.2510000     -0.4247000     0.3571000 
1 1 1 2  30 13 o 4.307000  0.3135000     4.986000  0.3736000     3.629000  0.5035000     1.357000       0.6270000 
1 1 1 2  30 14 o 8.261000  0.2085000     8.014000  0.2991000     8.509000  0.2904000     -0.4951000     0.4169000 
1 1 1 2  30 15 o 6.011000  0.2839000     5.487000  0.4338000     6.536000  0.3663000     -1.049000      0.5678000 
1 1 1 2  30 16 o 3.526000  0.6384000     3.465000  0.8733000     3.587000  0.9313000     -0.1224000     1.277000  
1 1 1 2  30 17 o 5.740000  0.3783000     5.733000  0.5297000     5.746000  0.5403000     -0.1270000E-01 0.7566000 
1 1 1 2  30 18 o 5.388000  0.3555000     5.358000  0.4992000     5.418000  0.5061000     -0.6049000E-01 0.7109000 
1 1 1 2  30 19 o 2.397000  0.5854000     2.424000  0.8332000     2.371000  0.8224000     0.5291000E-01  1.171000  
1 1 1 2  30 20 o 2.075000  0.5468000     1.778000  0.7362000     2.372000  0.8088000     -0.5934000     1.094000  
1 1 1 2  30 21 f 2.004000  0.5059000     1.389000  0.6462000     2.620000  0.7785000     -1.231000      1.012000  
1 1 1 2  30 22 o 2.179000  0.7042000     2.505000  1.099000      1.852000  0.8810000     0.6524000      1.408000  
1 1 1 2  30 23 o 1.613000  0.4693000     2.015000  0.7403000     1.210000  0.5771000     0.8057000      0.9387000 
1 1 1 2  30 24 f 1.148000  0.3922000     1.174000  0.5639000     1.122000  0.5453000     0.5224000E-01  0.7845000 
1 1 1 2  30 25 o 1.304000  0.4365000     1.171000  0.5709000     1.437000  0.6604000     -0.2660000     0.8730000 
1 1 1 2  31 0  o 10.67000  0.2037000     10.67000  0.2037000     10.67000  0.2037000     0.000000       0.000000  
1 1 1 2  31 1  o 2.597000  0.3070000     2.061000  0.5044000     3.133000  0.3501000     -1.072000      0.6140000 
1 1 1 2  31 2  f 3.896000  0.2071000     3.585000  0.3120000     4.206000  0.2725000     -0.6204000     0.4143000 
1 1 1 2  31 3  o 12.21000  0.1473000     12.27000  0.2090000     12.15000  0.2076000     0.1207000      0.2946000 
1 1 1 2  31 4  o 14.25000  0.1568000     14.16000  0.2216000     14.33000  0.2218000     -0.1726000     0.3135000 
1 1 1 2  31 5  o 18.06000  0.1762000     18.08000  0.2495000     18.03000  0.2489000     0.5502000E-01  0.3524000 
1 1 1 2  31 6  o 11.02000  0.1525000     11.09000  0.2159000     10.95000  0.2156000     0.1369000      0.3051000 
1 1 1 2  31 7  o 17.96000  0.1795000     17.70000  0.2513000     18.21000  0.2564000     -0.5112000     0.3591000 
1 1 1 2  31 8  o 10.19000  0.1967000     10.42000  0.3235000     9.952000  0.2237000     0.4718000      0.3933000 
1 1 1 2  31 9  o 10.77000  0.2304000     10.74000  0.3214000     10.81000  0.3300000     -0.7277000E-01 0.4607000 
1 1 1 2  31 10 o 3.284000  0.3294000     2.960000  0.5075000     3.609000  0.4200000     -0.6489000     0.6587000 
1 1 1 2  31 11 o 7.852000  0.1911000     7.623000  0.2737000     8.080000  0.2668000     -0.4568000     0.3822000 
1 1 1 2  31 12 o 13.37000  0.1778000     13.45000  0.2535000     13.30000  0.2494000     0.1507000      0.3556000 
1 1 1 2  31 13 o 14.32000  0.1850000     14.35000  0.2622000     14.29000  0.2611000     0.6239000E-01  0.3700000 
1 1 1 2  31 14 o 7.903000  0.2224000     7.816000  0.3117000     7.990000  0.3172000     -0.1740000     0.4447000 
1 1 1 2  31 15 o 6.274000  0.2771000     6.611000  0.3786000     5.937000  0.4049000     0.6741000      0.5543000 
1 1 1 2  31 16 o 2.371000  0.9253000     2.371000  0.9253000     ?         ?             ?              ?         
1 1 1 2  31 17 o 3.659000  0.4450000     4.087000  0.5639000     3.231000  0.6885000     0.8563000      0.8899000 
1 1 1 2  31 18 o 1.719000  0.5218000     2.001000  0.7962000     1.438000  0.6746000     0.5625000      1.044000  
1 1 1 2  31 19 o 1.692000  0.5193000     1.742000  0.7455000     1.642000  0.7232000     0.1003000      1.039000  
1 1 1 2  31 20 o 3.834000  0.4479000     3.290000  0.6777000     4.378000  0.5859000     -1.088000      0.8958000 
1 1 1 2  31 21 o 2.843000  0.5072000     2.181000  0.7826000     3.504000  0.6454000     -1.323000      1.014000  
1 1 1 2  31 22 o 2.280000  0.5867000     1.992000  0.8831000     2.567000  0.7727000     -0.5754000     1.173000  
1 1 1 2  31 23 o 1.955000  0.5261000     1.944000  0.7404000     1.967000  0.7475000     -0.2286000E-01 1.052000  
1 1 1 2  31 24 f 1.707000  0.4978000     1.702000  0.6974000     1.712000  0.7104000     -0.1008000E-01 0.9955000 
1 1 1 2  32 0  o 13.38000  0.2148000     13.38000  0.2148000     13.38000  0.2148000     0.000000       0.000000  
1 1 1 2  32 1  o 15.90000  0.1627000     16.18000  0.2321000     15.62000  0.2282000     0.5623000      0.3255000 
1 1 1 2  32 2  o 22.04000  0.1979000     22.43000  0.2834000     21.64000  0.2763000     0.7808000      0.3958000 
1 1 1 2  32 3  o 5.948000  0.1678000     5.838000  0.2389000     6.058000  0.2358000     -0.2206000     0.3357000 
1 1 1 2  32 4  o 16.54000  0.1685000     16.58000  0.2385000     16.50000  0.2381000     0.7353000E-01  0.3371000 
1 1 1 2  32 5  o 1.979000  0.3867000     2.102000  0.5323000     1.856000  0.5611000     0.2460000      0.7734000 
1 1 1 2  32 6  o 19.53000  0.1869000     19.63000  0.2650000     19.43000  0.2636000     0.1997000      0.3738000 
1 1 1 2  32 7  o 6.766000  0.1749000     6.643000  0.2478000     6.890000  0.2470000     -0.2470000     0.3498000 
1 1 1 2  32 8  o 8.160000  0.4451000     8.160000  0.4451000     ?         ?             ?              ?         
1 1 1 2  32 9  o 8.559000  0.1747000     8.538000  0.2482000     8.579000  0.2459000     -0.4074000E-01 0.3494000 
1 1 1 2  32 10 f 12.86000  0.1735000     12.87000  0.2464000     12.84000  0.2444000     0.2562000E-01  0.3471000 
1 1 1 2  32 11 o 7.047000  0.1997000     6.977000  0.2845000     7.117000  0.2803000     -0.1398000     0.3994000 
1 1 1 2  32 12 o 8.757000  0.1896000     8.655000  0.2705000     8.859000  0.2658000     -0.2046000     0.3792000 
1 1 1 2  32 13 o 2.267000  0.4895000     2.540000  0.6743000     1.993000  0.7098000     0.5477000      0.9790000 
1 1 1 2  32 14 o 6.886000  0.2478000     7.149000  0.3376000     6.623000  0.3628000     0.5261000      0.4956000 
1 1 1 2  32 15 o 2.463000  0.5886000     2.481000  0.8918000     2.444000  0.7684000     0.3681000E-01  1.177000  
1 1 1 2  32 16 o 2.462000  0.6017000     2.648000  0.9254000     2.276000  0.7693000     0.3711000      1.203000  
1 1 1 2  32 17 o 9.482000  0.2209000     9.468000  0.3153000     9.497000  0.3095000     -0.2828000E-01 0.4418000 
1 1 1 2  32 18 o 1.674000  0.4960000     1.818000  0.7265000     1.529000  0.6755000     0.2893000      0.9920000 
1 1 1 2  32 19 o 3.312000  0.5102000     3.079000  0.7587000     3.545000  0.6824000     -0.4658000     1.020000  
1 1 1 2  32 20 o 3.481000  0.4605000     3.542000  0.6300000     3.421000  0.6720000     0.1209000      0.9211000 
1 1 1 2  32 21 o 1.695000  0.5222000     1.686000  0.7276000     1.704000  0.7493000     -0.1756000E-01 1.044000  
1 1 1 2  32 22 o 1.505000  0.4630000     1.132000  0.5511000     1.878000  0.7443000     -0.7458000     0.9261000 
1 1 1 2  32 23 o 1.824000  0.5106000     2.079000  0.7610000     1.569000  0.6810000     0.5103000      1.021000  
1 1 1 2  32 24 o 1.760000  0.4673000     1.193000  0.5733000     2.328000  0.7381000     -1.136000      0.9346000 
1 1 1 2  33 0  o 20.13000  0.2643000     20.13000  0.2643000     20.13000  0.2643000     0.000000       0.000000  
1 1 1 2  33 1  o 10.97000  0.1481000     10.86000  0.2098000     11.07000  0.2089000     -0.2104000     0.2961000 
1 1 1 2  33 2  o 5.225000  0.1849000     5.232000  0.2637000     5.217000  0.2592000     0.1478000E-01  0.3698000 
1 1 1 2  33 3  o 4.652000  0.1983000     4.685000  0.2743000     4.618000  0.2865000     0.6698000E-01  0.3967000 
1 1 1 2  33 4  o 16.75000  0.1707000     16.60000  0.2405000     16.90000  0.2423000     -0.2960000     0.3414000 
1 1 1 2  33 5  o 10.39000  0.1526000     10.47000  0.2159000     10.31000  0.2158000     0.1632000      0.3052000 
1 1 1 2  33 6  o 16.72000  0.1743000     16.47000  0.2446000     16.98000  0.2485000     -0.5162000     0.3487000 
1 1 1 2  33 7  o 11.89000  0.2358000     11.66000  0.3249000     12.11000  0.3417000     -0.4479000     0.4715000 
1 1 1 2  33 8  o 10.23000  0.1984000     10.66000  0.3186000     9.793000  0.2367000     0.8663000      0.3969000 
1 1 1 2  33 9  o 12.55000  0.1685000     12.45000  0.2374000     12.65000  0.2392000     -0.1985000     0.3370000 
1 1 1 2  33 10 o 19.00000  0.1954000     19.14000  0.2792000     18.85000  0.2734000     0.2859000      0.3908000 
1 1 1 2  33 11 o 17.92000  0.1919000     17.82000  0.2721000     18.01000  0.2708000     -0.1877000     0.3839000 
1 1 1 2  33 12 o 11.85000  0.1814000     11.77000  0.2584000     11.93000  0.2545000     -0.1581000     0.3627000 
1 1 1 2  33 13 o 4.531000  0.3136000     4.641000  0.4288000     4.421000  0.4578000     0.2194000      0.6273000 
1 1 1 2  33 14 o 1.988000  0.5250000     1.935000  0.7440000     2.040000  0.7410000     -0.1053000     1.050000  
1 1 1 2  33 15 o 2.004000  0.8325000     2.004000  0.8325000     ?         ?             ?              ?         
1 1 1 2  33 16 o 9.723000  0.2166000     9.364000  0.3149000     10.08000  0.2975000     -0.7192000     0.4332000 
1 1 1 2  33 17 o 2.749000  0.5120000     3.199000  0.6776000     2.299000  0.7678000     0.8995000      1.024000  
1 1 1 2  33 18 o 2.780000  0.5363000     2.863000  0.7321000     2.697000  0.7841000     0.1655000      1.073000  
1 1 1 2  33 19 o 2.605000  0.5524000     2.395000  0.7953000     2.815000  0.7668000     -0.4200000     1.105000  
1 1 1 2  33 20 o 1.992000  0.5249000     1.616000  0.7050000     2.369000  0.7777000     -0.7530000     1.050000  
1 1 1 2  33 21 o 1.726000  0.7667000     1.726000  0.7667000     ?         ?             ?              ?         
1 1 1 2  33 22 o 1.712000  0.4888000     1.297000  0.6063000     2.127000  0.7668000     -0.8303000     0.9776000 
1 1 1 2  33 23 o 1.641000  0.4904000     1.558000  0.6712000     1.723000  0.7153000     -0.1649000     0.9808000 
1 1 1 2  33 24 o 1.311000  0.4315000     1.358000  0.6232000     1.263000  0.5969000     0.9518000E-01  0.8630000 
1 1 1 2  34 0  o 1.839000  0.6566000     1.839000  0.6566000     1.839000  0.6566000     -0.000000      0.000000  
1 1 1 2  34 1  o 21.74000  0.1981000     21.87000  0.2813000     21.62000  0.2790000     0.2554000      0.3962000 
1 1 1 2  34 2  o 21.45000  0.1967000     21.45000  0.2780000     21.45000  0.2784000     0.1436000E-02  0.3934000 
1 1 1 2  34 3  o 12.02000  0.1547000     12.00000  0.2180000     12.05000  0.2196000     -0.4776000E-01 0.3094000 
1 1 1 2  34 4  o 14.86000  0.1634000     15.12000  0.2323000     14.60000  0.2298000     0.5246000      0.3267000 
1 1 1 2  34 5  o 15.23000  0.1669000     15.25000  0.2360000     15.21000  0.2360000     0.4050000E-01  0.3338000 
1 1 1 2  34 6  o 16.99000  0.3034000     17.60000  0.3643000     16.38000  0.4854000     1.224000       0.6069000 
1 1 1 2  34 7  o 2.737000  0.4278000     3.754000  0.5197000     1.720000  0.6796000     2.033000       0.8555000 
1 1 1 2  34 8  o 12.70000  0.1669000     12.64000  0.2345000     12.77000  0.2376000     -0.1282000     0.3339000 
1 1 1 2  34 9  o 13.89000  0.1835000     14.05000  0.2458000     13.73000  0.2726000     0.3189000      0.3670000 
1 1 1 2  34 10 o 8.073000  0.1854000     8.134000  0.2629000     8.012000  0.2614000     0.1221000      0.3707000 
1 1 1 2  34 11 o 13.55000  0.1776000     13.51000  0.2525000     13.58000  0.2499000     -0.7011000E-01 0.3553000 
1 1 1 2  34 12 o 9.860000  0.1918000     9.884000  0.2764000     9.836000  0.2659000     0.4770000E-01  0.3835000 
1 1 1 2  34 13 o 1.994000  0.4894000     2.465000  0.7245000     1.522000  0.6582000     0.9432000      0.9788000 
1 1 1 2  34 14 o 6.380000  0.2643000     6.813000  0.3550000     5.947000  0.3917000     0.8663000      0.5286000 
1 1 1 2  34 15 o 5.937000  0.6108000     6.631000  0.5417000     5.243000  1.095000      1.388000       1.222000  
1 1 1 2  34 16 o 6.395000  0.2740000     5.983000  0.4070000     6.807000  0.3670000     -0.8240000     0.5481000 
1 1 1 2  34 17 o 8.163000  0.2277000     8.088000  0.3189000     8.238000  0.3252000     -0.1504000     0.4554000 
1 1 1 2  34 18 o 2.415000  0.5196000     1.998000  0.7411000     2.832000  0.7285000     -0.8334000     1.039000  
1 1 1 2  34 19 o 1.527000  0.4832000     1.467000  0.6685000     1.587000  0.6977000     -0.1208000     0.9663000 
1 1 1 2  34 20 o 1.955000  0.5299000     2.066000  0.7606000     1.845000  0.7381000     0.2212000      1.060000  
1 1 1 2  34 21 o 1.353000  0.4856000     1.576000  0.7859000     1.130000  0.5705000     0.4466000      0.9711000 
1 1 1 2  34 22 o 2.356000  0.5429000     2.564000  0.7852000     2.148000  0.7499000     0.4163000      1.086000  
1 1 1 2  34 23 o 1.547000  0.4618000     1.077000  0.5304000     2.017000  0.7562000     -0.9402000     0.9236000 
1 1 1 2  34 24 o 1.054000  0.3674000     0.9683000 0.4840000     1.139000  0.5529000     -0.1707000     0.7349000 
1 1 1 2  35 0  o 3.677000  0.3434000     3.677000  0.3434000     3.677000  0.3434000     0.000000       0.000000  
1 1 1 2  35 1  o 4.907000  0.1944000     4.594000  0.2815000     5.220000  0.2682000     -0.6263000     0.3889000 
1 1 1 2  35 2  o 16.40000  0.1703000     16.35000  0.2408000     16.45000  0.2409000     -0.1031000     0.3406000 
1 1 1 2  35 3  o 17.92000  0.1789000     17.43000  0.2492000     18.41000  0.2567000     -0.9839000     0.3578000 
1 1 1 2  35 4  o 13.55000  0.1611000     13.43000  0.2281000     13.67000  0.2276000     -0.2352000     0.3222000 
1 1 1 2  35 5  o 6.287000  0.2643000     5.839000  0.3846000     6.735000  0.3625000     -0.8959000     0.5285000 
1 1 1 2  35 6  o 11.22000  0.2248000     11.00000  0.3188000     11.44000  0.3170000     -0.4396000     0.4496000 
1 1 1 2  35 7  o 9.094000  0.1691000     9.272000  0.2369000     8.916000  0.2414000     0.3564000      0.3382000 
1 1 1 2  35 8  o 3.152000  0.3407000     3.627000  0.4053000     2.676000  0.5477000     0.9513000      0.6813000 
1 1 1 2  35 9  o 8.835000  0.1754000     8.592000  0.2504000     9.077000  0.2458000     -0.4845000     0.3509000 
1 1 1 2  35 10 o 5.459000  0.2300000     5.706000  0.3128000     5.213000  0.3373000     0.4937000      0.4600000 
1 1 1 2  35 11 o 12.46000  0.1798000     12.58000  0.2560000     12.34000  0.2525000     0.2433000      0.3596000 
1 1 1 2  35 12 o 7.097000  0.2247000     7.372000  0.3172000     6.822000  0.3182000     0.5499000      0.4493000 
1 1 1 2  35 13 o 7.573000  0.2286000     7.463000  0.3238000     7.683000  0.3229000     -0.2203000     0.4573000 
1 1 1 2  35 14 o 2.593000  0.5916000     2.854000  0.8765000     2.332000  0.7949000     0.5223000      1.183000  
1 1 1 2  35 15 o 1.952000  0.5396000     1.728000  0.7700000     2.177000  0.7563000     -0.4493000     1.079000  
1 1 1 2  35 16 o 4.670000  0.3519000     4.301000  0.5261000     5.038000  0.4674000     -0.7374000     0.7038000 
1 1 1 2  35 17 o 4.254000  0.3595000     4.375000  0.4923000     4.132000  0.5240000     0.2436000      0.7190000 
1 1 1 2  35 18 o 4.161000  0.3724000     4.434000  0.4957000     3.887000  0.5559000     0.5476000      0.7448000 
1 1 1 2  35 19 o 2.803000  0.5080000     2.767000  0.7232000     2.839000  0.7136000     -0.7199000E-01 1.016000  
1 1 1 2  35 20 o 1.217000  0.4125000     1.236000  0.5909000     1.197000  0.5758000     0.3897000E-01  0.8251000 
1 1 1 2  35 21 o 2.759000  0.5248000     1.978000  0.8479000     3.541000  0.6185000     -1.563000      1.050000  
1 1 1 2  35 22 o 1.671000  0.4936000     1.863000  0.7323000     1.480000  0.6620000     0.3824000      0.9872000 
1 1 1 2  35 23 o 1.972000  0.5245000     1.953000  0.7462000     1.990000  0.7372000     -0.3733000E-01 1.049000  
1 1 1 2  36 0  o 7.272000  0.2363000     7.272000  0.2363000     7.272000  0.2363000     0.000000       0.000000  
1 1 1 2  36 1  o 11.92000  0.1566000     12.01000  0.2223000     11.82000  0.2205000     0.1939000      0.3132000 
1 1 1 2  36 2  o 25.14000  0.2219000     25.13000  0.3137000     25.15000  0.3141000     -0.1289000E-01 0.4439000 
1 1 1 2  36 3  o 13.55000  0.2318000     13.29000  0.3256000     13.80000  0.3301000     -0.5111000     0.4637000 
1 1 1 2  36 4  o 21.66000  0.5723000     21.66000  0.5723000     ?         ?             ?              ?         
1 1 1 2  36 5  o 5.375000  0.2772000     5.437000  0.3917000     5.314000  0.3922000     0.1231000      0.5543000 
1 1 1 2  36 6  o 11.37000  0.1659000     11.75000  0.2333000     10.99000  0.2359000     0.7691000      0.3318000 
1 1 1 2  36 7  o 16.08000  0.1782000     16.25000  0.2514000     15.91000  0.2525000     0.3462000      0.3563000 
1 1 1 2  36 8  o 4.276000  0.2586000     3.960000  0.3864000     4.593000  0.3437000     -0.6334000     0.5171000 
1 1 1 2  36 9  o 5.563000  0.2236000     5.886000  0.3029000     5.240000  0.3289000     0.6458000      0.4472000 
1 1 1 2  36 10 o 6.695000  0.2021000     6.847000  0.2836000     6.544000  0.2881000     0.3030000      0.4043000 
1 1 1 2  36 11 f 5.087000  0.2652000     5.122000  0.3744000     5.051000  0.3756000     0.7091000E-01  0.5303000 
1 1 1 2  36 12 o 7.801000  0.2161000     7.400000  0.3146000     8.203000  0.2963000     -0.8030000     0.4322000 
1 1 1 2  36 13 o 3.183000  0.4582000     2.961000  0.6873000     3.404000  0.6060000     -0.4435000     0.9163000 
1 1 1 2  36 14 o 2.220000  0.9015000     2.220000  0.9015000     ?         ?             ?              ?         
1 1 1 2  36 15 o 2.634000  0.5588000     2.849000  0.7453000     2.419000  0.8328000     0.4294000      1.118000  
1 1 1 2  36 16 o 2.945000  0.5044000     3.032000  0.6969000     2.859000  0.7294000     0.1735000      1.009000  
1 1 1 2  36 17 o 4.861000  0.3284000     4.981000  0.4523000     4.741000  0.4763000     0.2407000      0.6569000 
1 1 1 2  36 18 o 2.560000  0.4880000     3.240000  0.6365000     1.879000  0.7399000     1.361000       0.9760000 
1 1 1 2  36 19 o 4.031000  0.3868000     3.334000  0.6277000     4.727000  0.4522000     -1.392000      0.7736000 
1 1 1 2  36 20 o 1.663000  0.5180000     1.723000  0.7310000     1.602000  0.7342000     0.1217000      1.036000  
1 1 1 2  36 21 o 1.533000  0.4735000     1.555000  0.6772000     1.511000  0.6619000     0.4475000E-01  0.9469000 
1 1 1 2  36 22 o 1.412000  0.4529000     1.345000  0.6236000     1.479000  0.6569000     -0.1342000     0.9058000 
1 1 1 2  36 23 o 1.394000  0.4363000     1.805000  0.7217000     0.9832000 0.4904000     0.8221000      0.8725000 
1 1 1 2  37 0  o 12.83000  0.3253000     12.83000  0.3253000     12.83000  0.3253000     -0.000000      0.000000  
1 1 1 2  37 1  o 6.790000  0.2532000     6.515000  0.3629000     7.064000  0.3531000     -0.5493000     0.5063000 
1 1 1 2  37 3  o 22.07000  0.2908000     21.92000  0.4081000     22.23000  0.4145000     -0.3123000     0.5817000 
1 1 1 2  37 4  o 12.68000  0.2005000     12.82000  0.3275000     12.54000  0.2315000     0.2725000      0.4011000 
1 1 1 2  37 5  o 32.72000  0.2752000     32.37000  0.3859000     33.06000  0.3924000     -0.6914000     0.5503000 
1 1 1 2  37 6  o 44.02000  0.3567000     43.12000  0.4953000     44.92000  0.5134000     -1.801000      0.7134000 
1 1 1 2  37 7  o 10.32000  0.1691000     10.04000  0.2402000     10.60000  0.2382000     -0.5585000     0.3383000 
1 1 1 2  37 8  o 6.614000  0.1985000     6.732000  0.2745000     6.495000  0.2869000     0.2370000      0.3971000 
1 1 1 2  37 9  o 14.21000  0.1756000     14.41000  0.2493000     14.02000  0.2473000     0.3907000      0.3512000 
1 1 1 2  37 10 o 14.76000  0.1802000     14.98000  0.2554000     14.55000  0.2544000     0.4269000      0.3605000 
1 1 1 2  37 11 o 12.89000  0.1867000     12.46000  0.2644000     13.31000  0.2637000     -0.8520000     0.3734000 
1 1 1 2  37 12 o 12.50000  0.1917000     12.18000  0.2725000     12.82000  0.2697000     -0.6387000     0.3834000 
1 1 1 2  37 13 o 4.465000  0.4181000     5.104000  0.6258000     3.825000  0.5545000     1.279000       0.8361000 
1 1 1 2  37 14 o 3.710000  0.5351000     3.357000  0.9199000     4.062000  0.5471000     -0.7052000     1.070000  
1 1 1 2  37 15 o 2.468000  0.5353000     2.266000  0.7654000     2.669000  0.7486000     -0.4039000     1.071000  
1 1 1 2  37 16 f 3.161000  0.4738000     3.412000  0.6259000     2.910000  0.7115000     0.5027000      0.9476000 
1 1 1 2  37 17 o 3.612000  0.4245000     3.932000  0.5539000     3.292000  0.6435000     0.6405000      0.8490000 
1 1 1 2  37 18 o 1.947000  0.5138000     1.750000  0.7062000     2.145000  0.7464000     -0.3945000     1.028000  
1 1 1 2  37 19 o 3.332000  0.4215000     3.553000  0.5744000     3.111000  0.6169000     0.4424000      0.8429000 
1 1 1 2  37 20 o 1.608000  0.7213000     1.608000  0.7213000     ?         ?             ?              ?         
1 1 1 2  37 21 o 1.911000  0.5186000     2.010000  0.7454000     1.812000  0.7211000     0.1986000      1.037000  
1 1 1 2  37 22 o 1.064000  0.3692000     0.9606000 0.4796000     1.168000  0.5613000     -0.2072000     0.7383000 
1 1 1 2  37 23 o 1.811000  0.5168000     1.801000  0.7279000     1.821000  0.7339000     -0.1993000E-01 1.034000  
1 1 1 2  38 0  o 20.65000  0.3914000     20.65000  0.3914000     20.65000  0.3914000     0.000000       0.000000  
1 1 1 2  38 1  o 6.273000  0.2540000     6.480000  0.3595000     6.066000  0.3590000     0.4145000      0.5081000 
1 1 1 2  38 2  o 14.91000  0.1848000     15.03000  0.2808000     14.79000  0.2402000     0.2376000      0.3696000 
1 1 1 2  38 3  o 18.31000  0.1855000     18.08000  0.2613000     18.54000  0.2633000     -0.4587000     0.3710000 
1 1 1 2  38 4  o 14.15000  0.1693000     14.14000  0.2395000     14.16000  0.2393000     -0.2264000E-01 0.3385000 
1 1 1 2  38 5  o 22.32000  0.2263000     22.40000  0.2965000     22.24000  0.3420000     0.1514000      0.4526000 
1 1 1 2  38 6  o 12.65000  0.1692000     12.92000  0.2388000     12.38000  0.2397000     0.5443000      0.3384000 
1 1 1 2  38 7  o 14.25000  0.1744000     14.69000  0.2489000     13.80000  0.2442000     0.8890000      0.3487000 
1 1 1 2  38 8  o 7.222000  0.1921000     7.696000  0.2616000     6.747000  0.2814000     0.9487000      0.3842000 
1 1 1 2  38 9  o 12.29000  0.1749000     12.50000  0.2469000     12.08000  0.2477000     0.4208000      0.3497000 
1 1 1 2  38 10 o 5.897000  0.2304000     6.073000  0.3190000     5.722000  0.3324000     0.3511000      0.4607000 
1 1 1 2  38 11 o 4.067000  0.3332000     4.367000  0.4339000     3.767000  0.5058000     0.5998000      0.6664000 
1 1 1 2  38 12 o 2.664000  0.4398000     1.633000  0.6851000     3.695000  0.5518000     -2.061000      0.8797000 
1 1 1 2  38 13 o 1.839000  0.8372000     1.839000  0.8372000     ?         ?             ?              ?         
1 1 1 2  38 14 o 4.650000  0.3422000     4.307000  0.5161000     4.992000  0.4495000     -0.6850000     0.6844000 
1 1 1 2  38 15 o 5.796000  0.2896000     5.664000  0.4243000     5.929000  0.3942000     -0.2650000     0.5792000 
1 1 1 2  38 16 o 2.113000  0.5071000     2.533000  0.7284000     1.692000  0.7058000     0.8413000      1.014000  
1 1 1 2  38 17 o 4.357000  0.3553000     4.282000  0.4936000     4.431000  0.5113000     -0.1493000     0.7107000 
1 1 1 2  38 18 o 3.357000  0.4510000     2.885000  0.7037000     3.830000  0.5644000     -0.9445000     0.9021000 
1 1 1 2  38 19 o 1.655000  0.4729000     1.339000  0.6105000     1.970000  0.7224000     -0.6308000     0.9459000 
1 1 1 2  38 20 o 1.646000  0.4998000     1.886000  0.7820000     1.406000  0.6228000     0.4801000      0.9997000 
1 1 1 2  38 21 o 1.871000  0.5209000     1.850000  0.7279000     1.893000  0.7453000     -0.4254000E-01 1.042000  
1 1 1 2  38 22 o 1.251000  0.4153000     1.311000  0.6045000     1.192000  0.5695000     0.1189000      0.8305000 
1 1 1 2  38 23 o 1.269000  0.4244000     1.297000  0.6082000     1.242000  0.5922000     0.5469000E-01  0.8489000 
1 1 1 2  39 0  o 19.12000  0.2681000     19.12000  0.2681000     19.12000  0.2681000     -0.000000      0.000000  
1 1 1 2  39 1  o 13.43000  0.1667000     13.54000  0.2350000     13.32000  0.2364000     0.2269000      0.3334000 
1 1 1 2  39 2  o 6.643000  0.1839000     6.555000  0.2630000     6.730000  0.2571000     -0.1756000     0.3678000 
1 1 1 2  39 3  o 21.10000  0.2013000     21.10000  0.2852000     21.10000  0.2842000     -0.1129000E-02 0.4026000 
1 1 1 2  39 4  o 9.104000  0.1689000     8.848000  0.2396000     9.359000  0.2380000     -0.5109000     0.3377000 
1 1 1 2  39 5  o 8.070000  0.1747000     7.880000  0.2500000     8.261000  0.2440000     -0.3815000     0.3494000 
1 1 1 2  39 6  o 8.262000  0.1797000     8.441000  0.2496000     8.082000  0.2586000     0.3584000      0.3594000 
1 1 1 2  39 7  o 6.911000  0.1964000     6.850000  0.2805000     6.971000  0.2751000     -0.1212000     0.3929000 
1 1 1 2  39 8  f 12.13000  0.1745000     12.02000  0.2464000     12.24000  0.2473000     -0.2179000     0.3491000 
1 1 1 2  39 9  o 11.17000  0.1797000     11.53000  0.2528000     10.81000  0.2554000     0.7211000      0.3593000 
1 1 1 2  39 10 o 10.05000  0.1887000     10.13000  0.2644000     9.975000  0.2692000     0.1582000      0.3773000 
1 1 1 2  39 11 o 5.956000  0.2497000     6.078000  0.3499000     5.835000  0.3565000     0.2424000      0.4995000 
1 1 1 2  39 12 o 3.812000  0.5085000     3.283000  0.8591000     4.342000  0.5444000     -1.059000      1.017000  
1 1 1 2  39 13 o 1.723000  0.5114000     1.443000  0.6926000     2.003000  0.7527000     -0.5600000     1.023000  
1 1 1 2  39 14 o 5.830000  0.2890000     6.225000  0.3893000     5.435000  0.4273000     0.7896000      0.5780000 
1 1 1 2  39 15 o 1.235000  0.4126000     1.368000  0.6244000     1.102000  0.5396000     0.2658000      0.8253000 
1 1 1 2  39 16 o 1.852000  0.5176000     1.832000  0.7322000     1.872000  0.7316000     -0.3963000E-01 1.035000  
1 1 1 2  39 17 o 2.289000  0.4981000     2.839000  0.6943000     1.738000  0.7144000     1.101000       0.9962000 
1 1 1 2  39 18 o 3.012000  0.4794000     3.261000  0.6320000     2.762000  0.7209000     0.4990000      0.9587000 
1 1 1 2  39 19 o 1.991000  0.5926000     2.112000  0.8566000     1.869000  0.8190000     0.2421000      1.185000  
1 1 1 2  39 20 o 2.743000  0.4661000     2.962000  0.6320000     2.523000  0.6853000     0.4397000      0.9323000 
1 1 1 2  39 21 o 2.390000  0.5293000     2.272000  0.7490000     2.507000  0.7480000     -0.2357000     1.059000  
1 1 1 2  39 22 o 1.439000  0.4501000     1.619000  0.6763000     1.259000  0.5942000     0.3597000      0.9002000 
1 1 1 2  40 0  o 8.307000  0.2456000     8.307000  0.2456000     8.307000  0.2456000     -0.000000      0.000000  
1 1 1 2  40 1  o 8.740000  0.1697000     8.491000  0.2425000     8.989000  0.2376000     -0.4988000     0.3395000 
1 1 1 2  40 2  o 18.47000  0.1881000     18.03000  0.2632000     18.91000  0.2689000     -0.8747000     0.3763000 
1 1 1 2  40 3  o 21.20000  0.2028000     21.26000  0.2874000     21.15000  0.2862000     0.1092000      0.4056000 
1 1 1 2  40 4  o 22.71000  0.2116000     22.53000  0.2983000     22.90000  0.3003000     -0.3672000     0.4232000 
1 1 1 2  40 5  o 7.728000  0.1807000     7.892000  0.2554000     7.563000  0.2558000     0.3291000      0.3614000 
1 1 1 2  40 6  o 13.29000  0.1720000     13.24000  0.2421000     13.34000  0.2444000     -0.9622000E-01 0.3440000 
1 1 1 2  40 7  o 16.51000  0.1974000     17.04000  0.2612000     15.98000  0.2962000     1.062000       0.3949000 
1 1 1 2  40 8  o 5.550000  0.2368000     5.228000  0.3461000     5.872000  0.3232000     -0.6440000     0.4736000 
1 1 1 2  40 9  o 14.09000  0.1834000     14.33000  0.2590000     13.85000  0.2597000     0.4743000      0.3668000 
1 1 1 2  40 10 o 9.085000  0.1965000     9.290000  0.2769000     8.879000  0.2789000     0.4118000      0.3930000 
1 1 1 2  40 11 o 10.51000  0.1958000     10.26000  0.2796000     10.75000  0.2741000     -0.4876000     0.3916000 
1 1 1 2  40 12 o 4.239000  0.7332000     4.239000  0.7332000     ?         ?             ?              ?         
1 1 1 2  40 13 f 5.252000  0.3103000     4.827000  0.4651000     5.677000  0.4109000     -0.8503000     0.6206000 
1 1 1 2  40 14 o 6.946000  0.2541000     6.586000  0.3739000     7.305000  0.3444000     -0.7189000     0.5083000 
1 1 1 2  40 15 o 5.884000  0.2785000     5.636000  0.4037000     6.132000  0.3839000     -0.4962000     0.5571000 
1 1 1 2  40 16 o 1.939000  0.5228000     2.026000  0.7486000     1.852000  0.7300000     0.1740000      1.046000  
1 1 1 2  40 17 o 2.033000  0.4484000     2.931000  0.7062000     1.134000  0.5529000     1.797000       0.8968000 
1 1 1 2  40 18 o 1.635000  0.4825000     1.814000  0.7154000     1.456000  0.6475000     0.3578000      0.9649000 
1 1 1 2  40 19 o 1.595000  0.7172000     1.595000  0.7172000     ?         ?             ?              ?         
1 1 1 2  40 20 o 1.646000  0.4463000     2.148000  0.7090000     1.144000  0.5423000     1.004000       0.8926000 
1 1 1 2  40 21 o 2.128000  0.4472000     1.341000  0.6028000     2.915000  0.6607000     -1.574000      0.8944000 
1 1 1 2  40 22 o 1.282000  0.4224000     1.407000  0.6347000     1.157000  0.5574000     0.2506000      0.8447000 
1 1 1 2  41 0  o 5.721000  0.2852000     5.721000  0.2852000     5.721000  0.2852000     0.000000       0.000000  
1 1 1 2  41 1  o 8.239000  0.1757000     8.384000  0.2499000     8.094000  0.2471000     0.2898000      0.3515000 
1 1 1 2  41 2  o 12.20000  0.1690000     12.26000  0.2394000     12.13000  0.2387000     0.1275000      0.3381000 
1 1 1 2  41 3  o 9.857000  0.1695000     10.10000  0.2389000     9.618000  0.2406000     0.4773000      0.3390000 
1 1 1 2  41 4  o 3.734000  0.3136000     3.671000  0.4190000     3.797000  0.4668000     -0.1251000     0.6272000 
1 1 1 2  41 5  o 13.12000  0.1711000     13.21000  0.2425000     13.02000  0.2413000     0.1884000      0.3421000 
1 1 1 2  41 6  o 3.285000  0.3394000     3.400000  0.4619000     3.169000  0.4973000     0.2309000      0.6788000 
1 1 1 2  41 7  o 2.511000  0.4371000     2.141000  0.6645000     2.881000  0.5680000     -0.7398000     0.8742000 
1 1 1 2  41 8  o 11.71000  0.1823000     11.47000  0.2561000     11.96000  0.2595000     -0.4871000     0.3646000 
1 1 1 2  41 9  o 9.616000  0.1907000     9.857000  0.2658000     9.376000  0.2735000     0.4812000      0.3814000 
1 1 1 2  41 10 o 11.78000  0.1905000     11.73000  0.2681000     11.82000  0.2706000     -0.8549000E-01 0.3810000 
1 1 1 2  41 11 o 4.999000  0.4373000     5.107000  0.5972000     4.891000  0.6391000     0.2157000      0.8747000 
1 1 1 2  41 12 o 5.215000  0.3392000     5.221000  0.5385000     5.208000  0.4126000     0.1271000E-01  0.6784000 
1 1 1 2  41 13 o 3.412000  0.4597000     3.659000  0.6106000     3.164000  0.6872000     0.4956000      0.9193000 
1 1 1 2  41 14 o 3.752000  0.4192000     3.803000  0.5699000     3.700000  0.6150000     0.1031000      0.8384000 
1 1 1 2  41 15 o 1.923000  0.4825000     2.491000  0.7393000     1.355000  0.6202000     1.136000       0.9650000 
1 1 1 2  41 16 f 2.313000  0.4981000     2.913000  0.7017000     1.713000  0.7072000     1.199000       0.9963000 
1 1 1 2  41 17 o 1.452000  0.4579000     1.334000  0.6115000     1.570000  0.6817000     -0.2358000     0.9158000 
1 1 1 2  41 18 o 2.001000  0.5337000     1.756000  0.7769000     2.246000  0.7320000     -0.4902000     1.067000  
1 1 1 2  41 19 o 2.096000  0.5481000     2.755000  0.8941000     1.437000  0.6343000     1.319000       1.096000  
1 1 1 2  41 20 o 1.687000  0.4774000     1.548000  0.6524000     1.826000  0.6973000     -0.2775000     0.9549000 
1 1 1 2  41 21 o 2.025000  0.4853000     1.796000  0.6838000     2.254000  0.6889000     -0.4571000     0.9707000 
1 1 1 2  41 22 o 1.366000  0.4427000     1.393000  0.6322000     1.339000  0.6199000     0.5373000E-01  0.8854000 
1 1 1 2  42 0  f 5.391000  0.3123000     5.391000  0.3123000     5.391000  0.3123000     -0.000000      0.000000  
1 1 1 2  42 1  o 8.096000  0.1787000     8.082000  0.2526000     8.111000  0.2528000     -0.2974000E-01 0.3573000 
1 1 1 2  42 2  o 9.521000  0.1735000     9.492000  0.2482000     9.550000  0.2426000     -0.5805000E-01 0.3470000 
1 1 1 2  42 3  o 14.77000  0.1750000     14.80000  0.2474000     14.75000  0.2475000     0.5572000E-01  0.3500000 
1 1 1 2  42 4  f 9.278000  0.1890000     9.654000  0.2848000     8.902000  0.2484000     0.7525000      0.3779000 
1 1 1 2  42 5  o 7.917000  0.1865000     8.104000  0.2600000     7.730000  0.2674000     0.3736000      0.3729000 
1 1 1 2  42 6  o 6.608000  0.2026000     6.790000  0.2869000     6.426000  0.2861000     0.3642000      0.4052000 
1 1 1 2  42 7  o 1.248000  0.4015000     1.418000  0.6143000     1.078000  0.5171000     0.3402000      0.8029000 
1 1 1 2  42 8  o 12.45000  0.1840000     12.20000  0.2610000     12.71000  0.2595000     -0.5119000     0.3681000 
1 1 1 2  42 9  o 12.66000  0.1877000     12.61000  0.2645000     12.71000  0.2665000     -0.1069000     0.3755000 
1 1 1 2  42 10 o 11.36000  0.2409000     11.53000  0.3984000     11.18000  0.2710000     0.3513000      0.4818000 
1 1 1 2  42 11 o 9.670000  0.3792000     9.436000  0.6440000     9.903000  0.4007000     -0.4673000     0.7584000 
1 1 1 2  42 12 o 6.938000  0.2451000     7.026000  0.3488000     6.850000  0.3444000     0.1753000      0.4902000 
1 1 1 2  42 13 o 4.131000  0.3765000     4.113000  0.5274000     4.148000  0.5374000     -0.3511000E-01 0.7530000 
1 1 1 2  42 14 o 1.546000  0.4744000     1.724000  0.7094000     1.368000  0.6302000     0.3556000      0.9489000 
1 1 1 2  42 15 o 6.325000  0.2622000     6.338000  0.3734000     6.311000  0.3681000     0.2671000E-01  0.5244000 
1 1 1 2  42 16 o 2.113000  0.5234000     2.316000  0.7481000     1.911000  0.7321000     0.4046000      1.047000  
1 1 1 2  42 17 o 1.208000  0.4064000     1.226000  0.5805000     1.189000  0.5689000     0.3722000E-01  0.8128000 
1 1 1 2  42 18 o 2.534000  0.8804000     2.534000  0.8804000     ?         ?             ?              ?         
1 1 1 2  42 19 o 1.779000  0.4718000     1.299000  0.5990000     2.259000  0.7291000     -0.9604000     0.9436000 
1 1 1 2  42 20 o 1.995000  0.4956000     1.792000  0.6896000     2.197000  0.7120000     -0.4050000     0.9912000 
1 1 1 2  42 21 o 1.130000  0.3804000     1.253000  0.5787000     1.007000  0.4938000     0.2462000      0.7608000 
1 1 1 2  43 0  o 9.541000  0.2458000     9.541000  0.2458000     9.541000  0.2458000     0.000000       0.000000  
1 1 1 2  43 1  o 13.14000  0.1714000     12.90000  0.2411000     13.39000  0.2437000     -0.4865000     0.3428000 
1 1 1 2  43 2  o 21.02000  0.2035000     20.68000  0.2852000     21.37000  0.2903000     -0.6972000     0.4070000 
1 1 1 2  43 3  o 7.441000  0.1896000     7.635000  0.2621000     7.248000  0.2741000     0.3872000      0.3792000 
1 1 1 2  43 4  o 7.597000  0.1901000     7.385000  0.2746000     7.809000  0.2629000     -0.4234000     0.3802000 
1 1 1 2  43 5  o 7.504000  0.1965000     7.605000  0.2756000     7.403000  0.2802000     0.2018000      0.3930000 
1 1 1 2  43 6  f 9.274000  0.1860000     9.127000  0.2645000     9.421000  0.2614000     -0.2940000     0.3719000 
1 1 1 2  43 7  o 21.78000  0.2145000     21.81000  0.3031000     21.75000  0.3035000     0.5605000E-01  0.4290000 
1 1 1 2  43 8  f 9.318000  0.1962000     9.181000  0.2782000     9.454000  0.2767000     -0.2731000     0.3924000 
1 1 1 2  43 9  o 4.305000  0.3342000     3.911000  0.5088000     4.699000  0.4334000     -0.7879000     0.6684000 
1 1 1 2  43 10 o 4.906000  1.004000      4.906000  1.004000      ?         ?             ?              ?         
1 1 1 2  43 11 o 6.201000  0.2544000     6.216000  0.3657000     6.186000  0.3538000     0.2969000E-01  0.5088000 
1 1 1 2  43 12 o 8.949000  0.2165000     8.630000  0.3113000     9.267000  0.3009000     -0.6368000     0.4329000 
1 1 1 2  43 13 o 4.158000  0.3680000     4.009000  0.5332000     4.307000  0.5073000     -0.2979000     0.7360000 
1 1 1 2  43 14 o 2.801000  0.5027000     3.010000  0.6835000     2.592000  0.7374000     0.4175000      1.005000  
1 1 1 2  43 15 o 3.794000  0.3970000     3.795000  0.5632000     3.793000  0.5597000     0.2671000E-02  0.7940000 
1 1 1 2  43 16 o 3.211000  0.4560000     3.806000  0.5542000     2.615000  0.7242000     1.191000       0.9119000 
1 1 1 2  43 17 o 2.200000  0.5164000     2.065000  0.7392000     2.335000  0.7213000     -0.2708000     1.033000  
1 1 1 2  43 18 o 2.317000  0.6092000     2.656000  0.9061000     1.977000  0.8146000     0.6789000      1.218000  
1 1 1 2  43 19 o 1.342000  0.4272000     1.368000  0.6109000     1.315000  0.5972000     0.5290000E-01  0.8543000 
1 1 1 2  43 20 o 1.618000  0.4738000     1.544000  0.6505000     1.692000  0.6889000     -0.1484000     0.9475000 
1 1 1 2  43 21 o 1.400000  0.4336000     1.274000  0.5847000     1.526000  0.6405000     -0.2524000     0.8672000 
1 1 1 2  44 0  o 1.201000  0.6963000     1.201000  0.6963000     1.201000  0.6963000     -0.000000      0.000000  
1 1 1 2  44 1  o 12.51000  0.1733000     12.31000  0.2449000     12.72000  0.2452000     -0.4099000     0.3465000 
1 1 1 2  44 2  o 5.403000  0.2305000     5.296000  0.3305000     5.509000  0.3213000     -0.2134000     0.4609000 
1 1 1 2  44 3  o 12.76000  0.1763000     12.49000  0.2496000     13.03000  0.2491000     -0.5411000     0.3526000 
1 1 1 2  44 4  f 4.916000  0.2572000     4.744000  0.3720000     5.089000  0.3554000     -0.3452000     0.5145000 
1 1 1 2  44 5  o 12.07000  0.1804000     11.98000  0.2557000     12.16000  0.2544000     -0.1800000     0.3608000 
1 1 1 2  44 6  o 5.198000  0.2587000     4.906000  0.3836000     5.491000  0.3472000     -0.5851000     0.5174000 
1 1 1 2  44 7  o 5.401000  0.2622000     5.035000  0.3853000     5.767000  0.3556000     -0.7321000     0.5243000 
1 1 1 2  44 8  o 8.053000  0.2124000     8.343000  0.2925000     7.763000  0.3081000     0.5796000      0.4249000 
1 1 1 2  44 9  o 3.786000  0.7822000     3.786000  0.7822000     ?         ?             ?              ?         
1 1 1 2  44 10 o 10.35000  0.2437000     10.54000  0.3970000     10.16000  0.2828000     0.3857000      0.4874000 
1 1 1 2  44 11 o 9.414000  0.2126000     9.719000  0.2958000     9.109000  0.3053000     0.6094000      0.4251000 
1 1 1 2  44 12 o 5.638000  0.2827000     5.709000  0.4008000     5.568000  0.3988000     0.1413000      0.5654000 
1 1 1 2  44 13 o 1.886000  0.5094000     2.074000  0.7376000     1.698000  0.7027000     0.3766000      1.019000  
1 1 1 2  44 14 o 1.726000  0.4962000     1.477000  0.6574000     1.976000  0.7435000     -0.4995000     0.9924000 
1 1 1 2  44 15 o 1.628000  0.4900000     1.439000  0.6469000     1.817000  0.7362000     -0.3782000     0.9800000 
1 1 1 2  44 16 o 2.186000  0.5225000     1.891000  0.7328000     2.481000  0.7450000     -0.5902000     1.045000  
1 1 1 2  44 17 o 2.451000  0.6348000     2.557000  0.9038000     2.345000  0.8917000     0.2114000      1.270000  
1 1 1 2  44 18 o 2.652000  0.4876000     2.827000  0.6776000     2.477000  0.7014000     0.3503000      0.9753000 
1 1 1 2  44 19 f 1.757000  0.4726000     2.096000  0.7106000     1.418000  0.6233000     0.6780000      0.9453000 
1 1 1 2  44 20 o 1.662000  0.4689000     1.444000  0.6307000     1.880000  0.6940000     -0.4364000     0.9378000 
1 1 1 2  44 21 o 1.498000  0.4426000     1.830000  0.6928000     1.166000  0.5508000     0.6647000      0.8851000 
1 1 1 2  45 0  o 3.468000  0.5142000     3.468000  0.5142000     3.468000  0.5142000     0.000000       0.000000  
1 1 1 2  45 1  o 7.237000  0.1977000     7.271000  0.2770000     7.202000  0.2822000     0.6946000E-01  0.3955000 
1 1 1 2  45 2  o 5.925000  0.2232000     5.816000  0.3198000     6.035000  0.3113000     -0.2191000     0.4463000 
1 1 1 2  45 3  o 11.08000  0.1792000     11.30000  0.2521000     10.87000  0.2547000     0.4288000      0.3583000 
1 1 1 2  45 4  o 7.579000  0.2018000     7.599000  0.2854000     7.560000  0.2855000     0.3898000E-01  0.4037000 
1 1 1 2  45 5  o 6.769000  0.2148000     6.621000  0.3024000     6.916000  0.3050000     -0.2959000     0.4295000 
1 1 1 2  45 6  o 6.595000  0.2236000     6.485000  0.3173000     6.705000  0.3153000     -0.2206000     0.4473000 
1 1 1 2  45 7  o 8.827000  0.2002000     8.942000  0.2808000     8.711000  0.2853000     0.2309000      0.4003000 
1 1 1 2  45 8  o 5.840000  0.5470000     4.804000  0.6680000     6.876000  0.8664000     -2.072000      1.094000  
1 1 1 2  45 9  o 11.22000  0.2377000     11.30000  0.3778000     11.13000  0.2885000     0.1778000      0.4754000 
1 1 1 2  45 10 o 8.590000  0.2129000     8.618000  0.3029000     8.563000  0.2992000     0.5554000E-01  0.4258000 
1 1 1 2  45 11 o 10.52000  0.2036000     10.37000  0.2893000     10.68000  0.2866000     -0.3058000     0.4072000 
1 1 1 2  45 12 o 4.440000  0.3359000     4.677000  0.4524000     4.203000  0.4968000     0.4745000      0.6719000 
1 1 1 2  45 13 o 4.455000  0.3408000     4.380000  0.4849000     4.531000  0.4789000     -0.1515000     0.6815000 
1 1 1 2  45 14 f 1.849000  0.4958000     1.550000  0.6706000     2.148000  0.7305000     -0.5973000     0.9916000 
1 1 1 2  45 15 o 2.608000  0.5036000     2.091000  0.7555000     3.125000  0.6662000     -1.035000      1.007000  
1 1 1 2  45 16 o 2.888000  0.4946000     3.018000  0.6801000     2.759000  0.7184000     0.2593000      0.9892000 
1 1 1 2  45 17 o 2.270000  0.8566000     2.270000  0.8566000     ?         ?             ?              ?         
1 1 1 2  45 18 o 2.206000  0.5051000     2.373000  0.7071000     2.039000  0.7214000     0.3339000      1.010000  
1 1 1 2  45 19 o 1.548000  0.4570000     1.782000  0.6915000     1.314000  0.5976000     0.4676000      0.9139000 
1 1 1 2  45 20 o 1.257000  0.4095000     1.247000  0.5758000     1.268000  0.5823000     -0.2084000E-01 0.8189000 
1 1 1 2  46 0  o 11.28000  0.2558000     11.28000  0.2558000     11.28000  0.2558000     0.000000       0.000000  
1 1 1 2  46 1  o 1.915000  0.4545000     1.551000  0.6313000     2.279000  0.6541000     -0.7278000     0.9091000 
1 1 1 2  46 2  o 6.058000  0.2277000     5.730000  0.3358000     6.385000  0.3075000     -0.6551000     0.4553000 
1 1 1 2  46 3  o 10.57000  0.1835000     10.79000  0.2580000     10.36000  0.2610000     0.4330000      0.3670000 
1 1 1 2  46 4  o 15.35000  0.1879000     15.31000  0.2658000     15.40000  0.2656000     -0.8671000E-01 0.3757000 
1 1 1 2  46 5  o 9.795000  0.1899000     9.671000  0.2698000     9.918000  0.2675000     -0.2468000     0.3799000 
1 1 1 2  46 6  f 12.61000  0.1869000     12.84000  0.2647000     12.39000  0.2640000     0.4538000      0.3739000 
1 1 1 2  46 7  o 7.129000  0.4695000     7.129000  0.4695000     ?         ?             ?              ?         
1 1 1 2  46 8  o 18.14000  0.2825000     17.96000  0.3992000     18.31000  0.3998000     -0.3469000     0.5650000 
1 1 1 2  46 9  o 7.703000  0.2263000     7.726000  0.3176000     7.680000  0.3224000     0.4559000E-01  0.4525000 
1 1 1 2  46 10 o 5.614000  0.2763000     5.655000  0.3876000     5.573000  0.3940000     0.8225000E-01  0.5527000 
1 1 1 2  46 11 o 5.113000  0.2972000     5.413000  0.3997000     4.814000  0.4400000     0.5993000      0.5944000 
1 1 1 2  46 12 f 5.656000  0.2768000     5.353000  0.4008000     5.958000  0.3817000     -0.6049000     0.5535000 
1 1 1 2  46 13 o 1.598000  0.4816000     1.541000  0.6674000     1.656000  0.6946000     -0.1149000     0.9633000 
1 1 1 2  46 14 o 1.960000  0.5049000     1.622000  0.6893000     2.298000  0.7379000     -0.6768000     1.010000  
1 1 1 2  46 15 o 1.661000  0.4876000     1.521000  0.6604000     1.802000  0.7177000     -0.2804000     0.9753000 
1 1 1 2  46 16 o 1.988000  0.5813000     2.392000  0.9027000     1.585000  0.7328000     0.8069000      1.163000  
1 1 1 2  46 17 o 1.352000  0.4366000     1.179000  0.5733000     1.524000  0.6588000     -0.3454000     0.8733000 
1 1 1 2  46 18 o 1.244000  0.4054000     1.497000  0.6460000     0.9906000 0.4900000     0.5069000      0.8108000 
1 1 1 2  46 19 o 1.443000  0.4249000     0.9569000 0.4728000     1.928000  0.7061000     -0.9714000     0.8498000 
1 1 1 2  46 20 o 1.246000  0.4108000     1.300000  0.5949000     1.192000  0.5667000     0.1074000      0.8216000 
1 1 1 2  47 0  f 12.74000  0.2577000     12.74000  0.2577000     12.74000  0.2577000     -0.000000      0.000000  
1 1 1 2  47 1  o 5.651000  0.2446000     5.175000  0.3708000     6.126000  0.3191000     -0.9504000     0.4892000 
1 1 1 2  47 2  o 11.14000  0.1835000     11.29000  0.2585000     10.98000  0.2604000     0.3012000      0.3669000 
1 1 1 2  47 3  o 11.62000  0.1849000     11.50000  0.2620000     11.73000  0.2610000     -0.2270000     0.3699000 
1 1 1 2  47 4  o 6.801000  0.2215000     6.613000  0.3192000     6.989000  0.3073000     -0.3762000     0.4431000 
1 1 1 2  47 5  o 6.937000  0.3082000     6.478000  0.4894000     7.395000  0.3746000     -0.9167000     0.6163000 
1 1 1 2  47 6  o 6.469000  0.7050000     6.469000  0.7050000     ?         ?             ?              ?         
1 1 1 2  47 7  o 5.932000  0.3527000     5.582000  0.5146000     6.281000  0.4825000     -0.6990000     0.7054000 
1 1 1 2  47 8  o 3.285000  0.4410000     3.348000  0.6173000     3.223000  0.6300000     0.1249000      0.8820000 
1 1 1 2  47 9  o 4.008000  0.3924000     3.156000  0.6503000     4.859000  0.4395000     -1.703000      0.7849000 
1 1 1 2  47 10 f 6.992000  0.2417000     6.928000  0.3519000     7.056000  0.3315000     -0.1277000     0.4835000 
1 1 1 2  47 11 o 1.715000  0.4786000     1.387000  0.6270000     2.043000  0.7232000     -0.6559000     0.9572000 
1 1 1 2  47 12 o 1.893000  0.5059000     2.016000  0.7288000     1.771000  0.7019000     0.2449000      1.012000  
1 1 1 2  47 13 o 3.179000  0.4590000     3.635000  0.5762000     2.722000  0.7146000     0.9123000      0.9180000 
1 1 1 2  47 14 o 3.240000  0.4616000     2.336000  0.7529000     4.143000  0.5343000     -1.806000      0.9232000 
1 1 1 2  47 15 o 2.053000  0.5170000     2.253000  0.7394000     1.853000  0.7228000     0.3999000      1.034000  
1 1 1 2  47 16 o 3.590000  0.7777000     3.590000  0.7777000     ?         ?             ?              ?         
1 1 1 2  47 17 o 1.451000  0.4494000     1.643000  0.6794000     1.259000  0.5884000     0.3845000      0.8988000 
1 1 1 2  47 18 o 1.029000  0.3565000     1.137000  0.5449000     0.9213000 0.4599000     0.2158000      0.7130000 
1 1 1 2  47 19 o 1.228000  0.4058000     1.195000  0.5635000     1.262000  0.5840000     -0.6710000E-01 0.8116000 
1 1 1 2  47 20 o 1.562000  0.4935000     1.410000  0.6556000     1.715000  0.7377000     -0.3048000     0.9869000 
1 1 1 2  48 0  o 2.280000  0.8174000     2.280000  0.8174000     2.280000  0.8174000     0.000000       0.000000  
1 1 1 2  48 1  o 2.126000  0.4949000     2.038000  0.7021000     2.213000  0.6977000     -0.1752000     0.9898000 
1 1 1 2  48 2  f 1.856000  0.4636000     1.489000  0.6323000     2.223000  0.6781000     -0.7349000     0.9272000 
1 1 1 2  48 3  o 2.598000  0.6052000     2.729000  0.8528000     2.467000  0.8588000     0.2612000      1.210000  
1 1 1 2  48 4  o 7.078000  0.3309000     7.035000  0.4682000     7.120000  0.4676000     -0.8481000E-01 0.6618000 
1 1 1 2  48 5  o 9.105000  0.3522000     8.556000  0.4039000     9.653000  0.5770000     -1.098000      0.7043000 
1 1 1 2  48 6  o 6.668000  0.2541000     7.297000  0.3669000     6.038000  0.3517000     1.259000       0.5082000 
1 1 1 2  48 7  o 1.858000  0.5064000     1.821000  0.7154000     1.895000  0.7168000     -0.7388000E-01 1.013000  
1 1 1 2  48 8  o 7.203000  0.2384000     7.232000  0.3308000     7.174000  0.3433000     0.5799000E-01  0.4767000 
1 1 1 2  48 9  o 3.743000  0.3932000     3.516000  0.5865000     3.970000  0.5237000     -0.4544000     0.7863000 
1 1 1 2  48 10 o 4.142000  0.3634000     4.341000  0.4879000     3.942000  0.5388000     0.3990000      0.7268000 
1 1 1 2  48 11 o 2.946000  0.4813000     3.306000  0.6256000     2.586000  0.7315000     0.7202000      0.9626000 
1 1 1 2  48 12 o 4.904000  0.3126000     4.830000  0.4510000     4.978000  0.4330000     -0.1477000     0.6253000 
1 1 1 2  48 13 o 4.751000  0.3233000     4.638000  0.4663000     4.864000  0.4479000     -0.2253000     0.6465000 
1 1 1 2  48 14 o 2.714000  0.4900000     2.276000  0.7385000     3.151000  0.6442000     -0.8750000     0.9799000 
1 1 1 2  48 15 o 2.155000  0.5844000     2.665000  0.8989000     1.644000  0.7470000     1.021000       1.169000  
1 1 1 2  48 16 o 1.863000  0.4989000     1.456000  0.6654000     2.271000  0.7436000     -0.8147000     0.9979000 
1 1 1 2  48 17 o 1.133000  0.3834000     1.028000  0.5049000     1.237000  0.5771000     -0.2085000     0.7668000 
1 1 1 2  48 18 o 1.806000  0.4950000     1.962000  0.7160000     1.649000  0.6835000     0.3138000      0.9899000 
1 1 1 2  48 19 o 1.841000  0.4555000     2.418000  0.7001000     1.265000  0.5829000     1.153000       0.9110000 
1 1 1 2  49 0  o 7.590000  0.4920000     7.590000  0.4920000     7.590000  0.4920000     0.000000       0.000000  
1 1 1 2  49 1  o 12.08000  0.4126000     11.89000  0.5657000     12.27000  0.6006000     -0.3880000     0.8251000 
1 1 1 2  49 3  o 9.904000  0.2769000     10.10000  0.3855000     9.705000  0.3977000     0.3974000      0.5538000 
1 1 1 2  49 4  o 7.967000  0.2906000     7.801000  0.4124000     8.133000  0.4096000     -0.3319000     0.5812000 
1 1 1 2  49 5  o 7.844000  0.2162000     7.735000  0.3078000     7.953000  0.3037000     -0.2181000     0.4324000 
1 1 1 2  49 6  o 7.050000  0.2308000     6.839000  0.3357000     7.262000  0.3167000     -0.4235000     0.4615000 
1 1 1 2  49 7  o 10.76000  0.2003000     10.91000  0.2811000     10.61000  0.2855000     0.3017000      0.4006000 
1 1 1 2  49 8  o 5.961000  0.2689000     5.888000  0.3817000     6.035000  0.3790000     -0.1477000     0.5379000 
1 1 1 2  49 9  o 2.344000  0.5091000     1.917000  0.7239000     2.771000  0.7161000     -0.8541000     1.018000  
1 1 1 2  49 10 o 1.317000  0.4302000     1.308000  0.6050000     1.327000  0.6119000     -0.1925000E-01 0.8605000 
1 1 1 2  49 11 o 6.367000  0.2577000     6.522000  0.3655000     6.212000  0.3633000     0.3102000      0.5153000 
1 1 1 2  49 12 o 4.652000  0.3262000     4.519000  0.4703000     4.786000  0.4523000     -0.2676000     0.6524000 
1 1 1 2  49 13 o 1.238000  0.4094000     1.438000  0.6396000     1.039000  0.5114000     0.3994000      0.8189000 
1 1 1 2  49 14 o 1.305000  0.4260000     1.216000  0.5760000     1.394000  0.6278000     -0.1779000     0.8520000 
1 1 1 2  49 15 o 2.432000  0.6966000     1.697000  0.7374000     3.167000  1.182000      -1.470000      1.393000  
1 1 1 2  49 16 o 1.599000  0.4751000     1.470000  0.6471000     1.727000  0.6959000     -0.2564000     0.9503000 
1 1 1 2  49 17 o 1.238000  0.4081000     1.075000  0.5226000     1.402000  0.6270000     -0.3275000     0.8162000 
1 1 1 2  49 18 o 1.255000  0.4121000     1.090000  0.5270000     1.420000  0.6337000     -0.3295000     0.8242000 
1 1 1 2  49 19 o 1.904000  0.5023000     1.737000  0.6954000     2.071000  0.7250000     -0.3349000     1.005000  
1 1 1 2  50 0  o 2.092000  0.9886000     2.092000  0.9886000     2.092000  0.9886000     0.000000       0.000000  
1 1 1 2  50 1  o 6.215000  0.2801000     6.274000  0.3947000     6.156000  0.3974000     0.1185000      0.5601000 
1 1 1 2  50 2  o 6.526000  0.2416000     6.586000  0.3401000     6.466000  0.3432000     0.1205000      0.4832000 
1 1 1 2  50 3  o 7.329000  0.2249000     7.040000  0.3268000     7.618000  0.3092000     -0.5782000     0.4499000 
1 1 1 2  50 4  f 6.933000  0.2309000     7.032000  0.3205000     6.834000  0.3326000     0.1980000      0.4619000 
1 1 1 2  50 5  o 6.632000  0.2397000     6.823000  0.3361000     6.441000  0.3418000     0.3819000      0.4794000 
1 1 1 2  50 6  o 9.043000  0.2108000     9.115000  0.2947000     8.970000  0.3015000     0.1455000      0.4216000 
1 1 1 2  50 7  f 4.090000  0.3638000     3.850000  0.5377000     4.330000  0.4901000     -0.4801000     0.7276000 
1 1 1 2  50 8  o 5.625000  0.2785000     6.006000  0.3731000     5.244000  0.4137000     0.7619000      0.5571000 
1 1 1 2  50 9  o 2.328000  0.5111000     1.882000  0.7276000     2.774000  0.7181000     -0.8917000     1.022000  
1 1 1 2  50 10 o 3.013000  0.4765000     2.990000  0.6794000     3.036000  0.6682000     -0.4568000E-01 0.9530000 
1 1 1 2  50 11 o 2.339000  0.5018000     2.817000  0.6939000     1.861000  0.7252000     0.9568000      1.004000  
1 1 1 2  50 12 o 4.578000  0.3374000     4.765000  0.4613000     4.391000  0.4924000     0.3730000      0.6747000 
1 1 1 2  50 13 o 2.581000  0.5055000     2.827000  0.6860000     2.335000  0.7427000     0.4920000      1.011000  
1 1 1 2  50 14 o 3.308000  0.9018000     3.308000  0.9018000     ?         ?             ?              ?         
1 1 1 2  50 15 o 2.469000  0.4817000     1.943000  0.7151000     2.995000  0.6457000     -1.053000      0.9635000 
1 1 1 2  50 16 o 1.346000  0.4325000     1.274000  0.5909000     1.417000  0.6317000     -0.1434000     0.8650000 
1 1 1 2  50 17 o 1.321000  0.4263000     1.331000  0.6077000     1.311000  0.5980000     0.1989000E-01  0.8525000 
1 1 1 2  50 18 o 1.418000  0.4404000     1.132000  0.5430000     1.704000  0.6935000     -0.5715000     0.8808000 
1 1 1 2  51 0  o 1.935000  0.8671000     1.935000  0.8671000     1.935000  0.8671000     -0.000000      0.000000  
1 1 1 2  51 1  o 1.943000  0.4947000     2.080000  0.7117000     1.807000  0.6873000     0.2725000      0.9894000 
1 1 1 2  51 2  o 5.047000  0.2891000     4.923000  0.4192000     5.171000  0.3982000     -0.2484000     0.5782000 
1 1 1 2  51 3  o 9.735000  0.2006000     9.764000  0.2858000     9.707000  0.2816000     0.5694000E-01  0.4012000 
1 1 1 2  51 4  o 6.843000  0.2404000     6.358000  0.3613000     7.327000  0.3172000     -0.9688000     0.4807000 
1 1 1 2  51 5  o 5.878000  0.2643000     6.105000  0.3622000     5.651000  0.3852000     0.4542000      0.5287000 
1 1 1 2  51 6  o 1.636000  0.4738000     1.407000  0.6316000     1.864000  0.7063000     -0.4572000     0.9475000 
1 1 1 2  51 7  o 3.196000  0.4438000     3.420000  0.5775000     2.971000  0.6740000     0.4493000      0.8876000 
1 1 1 2  51 8  o 2.764000  0.5016000     3.007000  0.6875000     2.520000  0.7305000     0.4870000      1.003000  
1 1 1 2  51 9  o 4.804000  0.3186000     5.203000  0.4201000     4.406000  0.4791000     0.7970000      0.6372000 
1 1 1 2  51 10 o 1.404000  0.4422000     1.651000  0.6891000     1.156000  0.5544000     0.4941000      0.8844000 
1 1 1 2  51 11 o 2.306000  0.4964000     2.914000  0.6976000     1.699000  0.7065000     1.215000       0.9929000 
1 1 1 2  51 12 o 1.798000  0.4885000     1.477000  0.6516000     2.120000  0.7279000     -0.6427000     0.9769000 
1 1 1 2  51 13 o 1.991000  0.5361000     1.600000  0.7341000     2.382000  0.7814000     -0.7819000     1.072000  
1 1 1 2  51 14 o 1.587000  0.5013000     1.468000  0.6792000     1.705000  0.7375000     -0.2370000     1.003000  
1 1 1 2  51 15 o 1.358000  0.4323000     1.202000  0.5659000     1.515000  0.6536000     -0.3130000     0.8646000 
1 1 1 2  51 16 o 1.839000  0.4828000     2.302000  0.7394000     1.376000  0.6211000     0.9262000      0.9656000 
1 1 1 2  51 17 o 1.345000  0.4265000     1.573000  0.6605000     1.118000  0.5397000     0.4541000      0.8530000 
1 1 1 2  51 18 o 1.615000  0.4580000     1.168000  0.5546000     2.062000  0.7290000     -0.8944000     0.9159000 
1 1 1 2  52 0  o 3.144000  0.6986000     3.144000  0.6986000     3.144000  0.6986000     -0.000000      0.000000  
1 1 1 2  52 1  o 1.696000  0.4515000     1.131000  0.5405000     2.261000  0.7234000     -1.130000      0.9030000 
1 1 1 2  52 2  o 4.062000  0.3482000     4.289000  0.4569000     3.834000  0.5256000     0.4544000      0.6964000 
1 1 1 2  52 3  o 6.011000  0.2617000     5.654000  0.3913000     6.368000  0.3478000     -0.7141000     0.5235000 
1 1 1 2  52 4  o 6.179000  0.2553000     6.233000  0.3584000     6.126000  0.3638000     0.1073000      0.5106000 
1 1 1 2  52 5  o 1.620000  0.4687000     1.889000  0.7107000     1.351000  0.6112000     0.5382000      0.9373000 
1 1 1 2  52 6  o 6.468000  0.2477000     6.711000  0.3403000     6.225000  0.3600000     0.4862000      0.4953000 
1 1 1 2  52 7  o 3.418000  0.4252000     2.801000  0.6895000     4.035000  0.4978000     -1.233000      0.8505000 
1 1 1 2  52 8  f 4.087000  0.3623000     3.553000  0.5763000     4.621000  0.4390000     -1.068000      0.7245000 
1 1 1 2  52 9  o 2.688000  0.5110000     2.541000  0.7331000     2.835000  0.7120000     -0.2936000     1.022000  
1 1 1 2  52 10 o 2.259000  0.4714000     3.069000  0.6842000     1.450000  0.6486000     1.619000       0.9428000 
1 1 1 2  52 11 o 1.612000  0.4782000     1.465000  0.6493000     1.759000  0.7021000     -0.2942000     0.9563000 
1 1 1 2  52 12 o 1.815000  0.4919000     1.482000  0.6579000     2.147000  0.7314000     -0.6645000     0.9838000 
1 1 1 2  52 13 o 3.469000  0.8241000     3.469000  0.8241000     ?         ?             ?              ?         
1 1 1 2  52 14 o 1.511000  0.4644000     1.343000  0.6144000     1.678000  0.6967000     -0.3355000     0.9289000 
1 1 1 2  52 15 o 3.345000  0.4403000     3.013000  0.6800000     3.677000  0.5595000     -0.6645000     0.8806000 
1 1 1 2  52 16 o 1.515000  0.4486000     1.192000  0.5613000     1.838000  0.7000000     -0.6459000     0.8972000 
1 1 1 2  52 17 o 3.081000  0.4559000     2.728000  0.6962000     3.433000  0.5887000     -0.7049000     0.9118000 
1 1 1 2  53 0  o 3.233000  0.6567000     3.233000  0.6567000     3.233000  0.6567000     -0.000000      0.000000  
1 1 1 2  53 1  o 5.474000  0.2755000     5.577000  0.3913000     5.371000  0.3880000     0.2066000      0.5511000 
1 1 1 2  53 2  o 3.366000  0.4334000     4.181000  0.4944000     2.551000  0.7118000     1.630000       0.8667000 
1 1 1 2  53 3  o 1.284000  0.4196000     1.139000  0.5479000     1.429000  0.6355000     -0.2903000     0.8391000 
1 1 1 2  53 4  o 5.567000  0.2702000     5.556000  0.3892000     5.578000  0.3748000     -0.2227000E-01 0.5403000 
1 1 1 2  53 5  o 6.743000  0.2415000     6.607000  0.3471000     6.880000  0.3359000     -0.2733000     0.4830000 
1 1 1 2  53 6  o 3.721000  0.3819000     3.659000  0.5405000     3.784000  0.5398000     -0.1256000     0.7639000 
1 1 1 2  53 7  o 5.913000  0.2608000     6.026000  0.3631000     5.801000  0.3744000     0.2252000      0.5216000 
1 1 1 2  53 8  o 4.929000  0.3139000     5.306000  0.4135000     4.552000  0.4724000     0.7540000      0.6278000 
1 1 1 2  53 9  o 5.658000  0.2866000     5.863000  0.4038000     5.454000  0.4069000     0.4096000      0.5733000 
1 1 1 2  53 10 o 1.716000  0.4896000     1.989000  0.7373000     1.442000  0.6443000     0.5471000      0.9792000 
1 1 1 2  53 11 o 2.418000  0.5156000     2.236000  0.7479000     2.601000  0.7098000     -0.3653000     1.031000  
1 1 1 2  53 12 o 3.784000  0.8914000     3.784000  0.8914000     ?         ?             ?              ?         
1 1 1 2  53 13 o 1.255000  0.4147000     1.217000  0.5771000     1.292000  0.5957000     -0.7542000E-01 0.8294000 
1 1 1 2  53 14 o 1.849000  0.4808000     2.353000  0.7387000     1.344000  0.6157000     1.009000       0.9617000 
1 1 1 2  53 15 o 1.490000  0.4616000     1.507000  0.6576000     1.472000  0.6481000     0.3536000E-01  0.9233000 
1 1 1 2  53 16 o 1.587000  0.4617000     1.247000  0.5841000     1.926000  0.7151000     -0.6789000     0.9233000 
1 1 1 2  53 17 o 1.545000  0.4562000     1.832000  0.6983000     1.259000  0.5873000     0.5722000      0.9124000 
1 1 1 2  54 0  o 2.040000  0.8938000     2.040000  0.8938000     2.040000  0.8938000     -0.000000      0.000000  
1 1 1 2  54 1  o 3.591000  0.3896000     3.553000  0.5605000     3.629000  0.5413000     -0.7565000E-01 0.7791000 
1 1 1 2  54 2  o 3.413000  0.4135000     3.191000  0.6203000     3.634000  0.5470000     -0.4430000     0.8270000 
1 1 1 2  54 3  o 2.095000  0.4949000     1.676000  0.6896000     2.515000  0.7101000     -0.8394000     0.9898000 
1 1 1 2  54 4  o 2.898000  0.4694000     3.244000  0.6109000     2.552000  0.7129000     0.6916000      0.9388000 
1 1 1 2  54 5  o 3.317000  0.4184000     3.286000  0.5949000     3.349000  0.5884000     -0.6276000E-01 0.8367000 
1 1 1 2  54 6  o 1.541000  0.4614000     1.387000  0.6179000     1.695000  0.6854000     -0.3079000     0.9228000 
1 1 1 2  54 7  o 2.867000  0.4793000     3.371000  0.6123000     2.363000  0.7375000     1.009000       0.9585000 
1 1 1 2  54 8  o 3.446000  0.4392000     3.383000  0.6437000     3.509000  0.5978000     -0.1261000     0.8784000 
1 1 1 2  54 9  o 6.005000  0.2771000     6.134000  0.3881000     5.877000  0.3955000     0.2569000      0.5541000 
1 1 1 2  54 10 o 1.944000  0.4939000     1.581000  0.6696000     2.307000  0.7262000     -0.7261000     0.9878000 
1 1 1 2  54 11 o 1.657000  0.5332000     1.487000  0.7109000     1.828000  0.7949000     -0.3411000     1.066000  
1 1 1 2  54 12 o 1.983000  0.5528000     1.765000  0.7703000     2.200000  0.7930000     -0.4357000     1.106000  
1 1 1 2  54 13 o 1.475000  0.4510000     1.731000  0.6920000     1.219000  0.5785000     0.5117000      0.9020000 
1 1 1 2  54 14 o 1.416000  0.4369000     1.069000  0.5221000     1.762000  0.7006000     -0.6936000     0.8737000 
1 1 1 2  54 15 o 1.825000  0.4837000     2.243000  0.7342000     1.406000  0.6299000     0.8366000      0.9674000 
1 1 1 2  54 16 o 1.668000  0.4565000     2.142000  0.7173000     1.194000  0.5649000     0.9472000      0.9130000 
1 1 1 2  55 0  f 1.110000  0.7095000     1.110000  0.7095000     1.110000  0.7095000     -0.000000      0.000000  
1 1 1 2  55 1  o 1.870000  0.4979000     1.743000  0.6909000     1.996000  0.7171000     -0.2534000     0.9958000 
1 1 1 2  55 2  o 4.583000  0.3194000     4.701000  0.4363000     4.465000  0.4667000     0.2367000      0.6388000 
1 1 1 2  55 3  o 2.343000  0.5126000     2.501000  0.7249000     2.185000  0.7249000     0.3164000      1.025000  
1 1 1 2  55 4  o 1.939000  0.5010000     2.217000  0.7362000     1.661000  0.6797000     0.5553000      1.002000  
1 1 1 2  55 5  o 1.239000  0.4116000     1.171000  0.5601000     1.306000  0.6034000     -0.1344000     0.8233000 
1 1 1 2  55 6  o 1.760000  0.4799000     1.410000  0.6327000     2.111000  0.7217000     -0.7016000     0.9598000 
1 1 1 2  55 7  o 1.565000  0.4713000     1.559000  0.6619000     1.571000  0.6711000     -0.1241000E-01 0.9426000 
1 1 1 2  55 8  o 2.351000  0.5187000     2.157000  0.7452000     2.544000  0.7217000     -0.3870000     1.037000  
1 1 1 2  55 9  f 1.903000  0.5102000     2.132000  0.7550000     1.674000  0.6866000     0.4578000      1.020000  
1 1 1 2  55 10 o 1.719000  0.5492000     1.841000  0.8125000     1.597000  0.7392000     0.2448000      1.098000  
1 1 1 2  55 11 o 2.181000  0.5796000     1.812000  0.7774000     2.549000  0.8599000     -0.7374000     1.159000  
1 1 1 2  55 12 o 3.340000  0.4418000     3.327000  0.6311000     3.353000  0.6184000     -0.2534000E-01 0.8836000 
1 1 1 2  55 13 o 2.700000  0.5036000     2.541000  0.7337000     2.859000  0.6901000     -0.3183000     1.007000  
1 1 1 2  55 14 o 1.520000  0.4532000     1.164000  0.5541000     1.876000  0.7173000     -0.7127000     0.9064000 
1 1 1 2  55 15 o 1.354000  0.4338000     1.488000  0.6493000     1.219000  0.5755000     0.2693000      0.8677000 
1 1 1 2  55 16 o 2.151000  0.4962000     2.692000  0.7255000     1.611000  0.6772000     1.081000       0.9924000 
1 1 1 2  56 0  o 1.260000  0.7652000     1.260000  0.7652000     1.260000  0.7652000     -0.000000      0.000000  
1 1 1 2  56 1  o 6.490000  0.2454000     6.498000  0.3445000     6.483000  0.3495000     0.1479000E-01  0.4908000 
1 1 1 2  56 2  o 8.204000  0.2226000     8.115000  0.3199000     8.292000  0.3097000     -0.1774000     0.4453000 
1 1 1 2  56 3  o 2.107000  0.5122000     1.975000  0.7182000     2.239000  0.7304000     -0.2648000     1.024000  
1 1 1 2  56 4  f 2.305000  0.5276000     2.174000  0.7419000     2.435000  0.7502000     -0.2609000     1.055000  
1 1 1 2  56 5  f 2.484000  0.4952000     3.009000  0.6770000     1.959000  0.7228000     1.050000       0.9904000 
1 1 1 2  56 6  o 3.849000  0.3907000     3.231000  0.6263000     4.466000  0.4673000     -1.235000      0.7814000 
1 1 1 2  56 7  o 3.996000  0.3743000     4.427000  0.4644000     3.564000  0.5870000     0.8632000      0.7485000 
1 1 1 2  56 8  o 4.847000  0.3255000     5.126000  0.4313000     4.569000  0.4875000     0.5571000      0.6509000 
1 1 1 2  56 9  o 1.472000  0.4935000     1.416000  0.6821000     1.529000  0.7134000     -0.1130000     0.9870000 
1 1 1 2  56 10 o 2.045000  0.5330000     2.827000  0.8677000     1.263000  0.6192000     1.563000       1.066000  
1 1 1 2  56 11 o 1.450000  0.4532000     1.266000  0.5933000     1.635000  0.6852000     -0.3694000     0.9064000 
1 1 1 2  56 12 o 2.261000  0.5199000     2.252000  0.7395000     2.269000  0.7309000     -0.1608000E-01 1.040000  
1 1 1 2  56 13 o 1.914000  0.4994000     2.233000  0.7372000     1.595000  0.6740000     0.6382000      0.9989000 
1 1 1 2  56 14 o 1.643000  0.4767000     1.762000  0.6932000     1.525000  0.6545000     0.2370000      0.9534000 
1 1 1 2  56 15 f 1.295000  0.4196000     1.457000  0.6405000     1.132000  0.5424000     0.3249000      0.8393000 
1 1 1 2  57 0  o 1.102000  0.7083000     1.102000  0.7083000     1.102000  0.7083000     -0.000000      0.000000  
1 1 1 2  57 1  o 2.020000  0.5067000     1.747000  0.7111000     2.294000  0.7220000     -0.5472000     1.013000  
1 1 1 2  57 2  o 1.388000  0.4416000     1.532000  0.6647000     1.245000  0.5815000     0.2870000      0.8831000 
1 1 1 2  57 3  o 2.957000  0.4896000     2.586000  0.7466000     3.329000  0.6335000     -0.7426000     0.9791000 
1 1 1 2  57 4  o 8.161000  0.2311000     8.002000  0.3286000     8.321000  0.3249000     -0.3184000     0.4621000 
1 1 1 2  57 5  o 6.971000  0.2487000     7.285000  0.3362000     6.657000  0.3667000     0.6283000      0.4974000 
1 1 1 2  57 6  o 3.273000  0.4500000     3.137000  0.6530000     3.409000  0.6195000     -0.2723000     0.9001000 
1 1 1 2  57 7  o 3.739000  0.4051000     3.704000  0.5823000     3.774000  0.5635000     -0.7007000E-01 0.8103000 
1 1 1 2  57 8  o 3.236000  0.6446000     3.582000  0.8997000     2.890000  0.9233000     0.6926000      1.289000  
1 1 1 2  57 9  o 1.495000  0.4882000     1.634000  0.7337000     1.357000  0.6441000     0.2763000      0.9763000 
1 1 1 2  57 10 o 1.610000  0.4826000     1.551000  0.6695000     1.668000  0.6952000     -0.1166000     0.9651000 
1 1 1 2  57 11 o 1.781000  0.5010000     1.567000  0.6725000     1.996000  0.7427000     -0.4284000     1.002000  
1 1 1 2  57 12 o 1.712000  0.4836000     1.417000  0.6370000     2.008000  0.7279000     -0.5913000     0.9673000 
1 1 1 2  57 13 o 1.346000  0.4328000     1.371000  0.6197000     1.321000  0.6043000     0.4976000E-01  0.8656000 
1 1 1 2  57 14 o 1.777000  0.4963000     1.754000  0.6983000     1.800000  0.7054000     -0.4638000E-01 0.9926000 
1 1 1 2  58 0  o 7.640000  0.3260000     7.640000  0.3260000     7.640000  0.3260000     0.000000       0.000000  
1 1 1 2  58 1  o 7.639000  0.2334000     8.004000  0.3252000     7.273000  0.3349000     0.7316000      0.4668000 
1 1 1 2  58 2  o 5.083000  0.3059000     5.445000  0.4145000     4.721000  0.4501000     0.7235000      0.6119000 
1 1 1 2  58 3  o 4.864000  0.3170000     4.711000  0.4551000     5.017000  0.4413000     -0.3057000     0.6339000 
1 1 1 2  58 4  o 6.389000  0.2573000     6.783000  0.3474000     5.995000  0.3797000     0.7887000      0.5146000 
1 1 1 2  58 5  o 1.811000  0.5025000     1.781000  0.7091000     1.840000  0.7122000     -0.5912000E-01 1.005000  
1 1 1 2  58 6  o 2.565000  0.6016000     2.596000  0.9058000     2.533000  0.7920000     0.6244000E-01  1.203000  
1 1 1 2  58 7  o 2.895000  0.9456000     2.895000  0.9456000     ?         ?             ?              ?         
1 1 1 2  58 8  o 2.801000  0.6217000     3.236000  0.8709000     2.365000  0.8874000     0.8706000      1.243000  
1 1 1 2  58 9  o 2.763000  0.5035000     2.705000  0.7095000     2.820000  0.7146000     -0.1153000     1.007000  
1 1 1 2  58 10 o 2.408000  0.5181000     2.756000  0.7256000     2.060000  0.7398000     0.6955000      1.036000  
1 1 1 2  58 11 o 3.316000  0.4505000     3.637000  0.5853000     2.995000  0.6849000     0.6420000      0.9010000 
1 1 1 2  58 12 o 3.380000  0.4451000     3.227000  0.6452000     3.532000  0.6133000     -0.3043000     0.8902000 
1 1 1 2  58 13 o 1.812000  0.4999000     1.793000  0.7009000     1.831000  0.7131000     -0.3823000E-01 0.9998000 
1 1 1 2  58 14 o 1.428000  0.4497000     1.391000  0.6247000     1.465000  0.6471000     -0.7396000E-01 0.8994000 
1 1 1 2  59 0  o 7.127000  0.3511000     7.127000  0.3511000     7.127000  0.3511000     -0.000000      0.000000  
1 1 1 2  59 1  o 1.597000  0.4782000     1.686000  0.6940000     1.507000  0.6581000     0.1789000      0.9564000 
1 1 1 2  59 2  o 2.028000  0.5092000     1.726000  0.7055000     2.330000  0.7345000     -0.6045000     1.018000  
1 1 1 2  59 3  o 3.033000  0.4695000     3.283000  0.6167000     2.784000  0.7080000     0.4983000      0.9389000 
1 1 1 2  59 4  f 1.750000  0.5170000     1.417000  0.6742000     2.082000  0.7839000     -0.6647000     1.034000  
1 1 1 2  59 5  o 4.849000  0.4757000     4.618000  0.6914000     5.081000  0.6534000     -0.4631000     0.9513000 
1 1 1 2  59 6  o 3.854000  0.6865000     3.440000  0.8527000     4.269000  1.076000      -0.8284000     1.373000  
1 1 1 2  59 7  o 1.463000  0.4778000     1.550000  0.7163000     1.377000  0.6326000     0.1735000      0.9557000 
1 1 1 2  59 8  o 1.351000  0.4358000     1.486000  0.6526000     1.216000  0.5776000     0.2700000      0.8715000 
1 1 1 2  59 9  o 2.773000  0.5194000     2.623000  0.7573000     2.924000  0.7109000     -0.3017000     1.039000  
1 1 1 2  59 10 o 2.166000  0.5259000     2.262000  0.7449000     2.070000  0.7427000     0.1923000      1.052000  
1 1 1 2  59 11 o 1.721000  0.4746000     2.113000  0.7276000     1.329000  0.6097000     0.7837000      0.9493000 
1 1 1 2  59 12 o 1.249000  0.4121000     1.078000  0.5252000     1.420000  0.6353000     -0.3420000     0.8243000 
1 1 1 2  59 13 o 1.829000  0.4730000     2.346000  0.7274000     1.313000  0.6048000     1.033000       0.9460000 
1 1 1 2  60 0  o 3.615000  0.9629000     3.615000  0.9629000     3.615000  0.9629000     -0.000000      0.000000  
1 1 1 2  60 1  o 1.533000  0.5093000     1.427000  0.6852000     1.640000  0.7538000     -0.2128000     1.019000  
1 1 1 2  60 2  o 2.932000  0.6478000     3.308000  0.9070000     2.556000  0.9253000     0.7521000      1.296000  
1 1 1 2  60 3  o 2.732000  1.063000      2.732000  1.063000      ?         ?             ?              ?         
1 1 1 2  60 4  o 3.974000  0.6595000     3.867000  0.7924000     4.080000  1.054000      -0.2124000     1.319000  
1 1 1 2  60 5  f 2.159000  0.5676000     1.522000  0.7101000     2.795000  0.8857000     -1.273000      1.135000  
1 1 1 2  60 6  o 1.406000  0.4430000     1.646000  0.6870000     1.167000  0.5596000     0.4791000      0.8860000 
1 1 1 2  60 7  o 2.900000  0.4864000     3.406000  0.6236000     2.394000  0.7467000     1.013000       0.9729000 
1 1 1 2  60 8  o 4.023000  0.4002000     3.711000  0.6140000     4.336000  0.5136000     -0.6252000     0.8005000 
1 1 1 2  60 9  o 1.785000  0.4897000     1.374000  0.6276000     2.196000  0.7519000     -0.8221000     0.9794000 
1 1 1 2  60 10 o 1.524000  0.4530000     1.079000  0.5293000     1.968000  0.7352000     -0.8893000     0.9059000 
1 1 1 2  60 11 o 1.541000  0.4702000     1.491000  0.6538000     1.590000  0.6758000     -0.9864000E-01 0.9403000 
1 1 1 2  60 12 o 1.253000  0.4160000     1.330000  0.6128000     1.176000  0.5627000     0.1535000      0.8320000 
1 1 1 2  61 0  o 3.465000  1.005000      3.465000  1.005000      3.465000  1.005000      -0.000000      0.000000  
1 1 1 2  61 1  o 2.105000  0.5966000     2.125000  0.8517000     2.084000  0.8356000     0.4130000E-01  1.193000  
1 1 1 2  61 2  o 4.231000  0.5214000     3.916000  0.7962000     4.547000  0.6734000     -0.6315000     1.043000  
1 1 1 2  61 3  o 4.976000  0.3728000     4.200000  0.6166000     5.752000  0.4192000     -1.552000      0.7456000 
1 1 1 2  61 4  o 2.393000  0.4836000     3.114000  0.6602000     1.672000  0.7067000     1.442000       0.9671000 
1 1 1 2  61 5  o 1.492000  0.4566000     1.772000  0.7119000     1.211000  0.5718000     0.5609000      0.9131000 
1 1 1 2  61 6  o 2.486000  0.5105000     1.933000  0.7372000     3.039000  0.7064000     -1.106000      1.021000  
1 1 1 2  61 7  f 1.468000  0.4622000     1.418000  0.6406000     1.518000  0.6665000     -0.9962000E-01 0.9244000 
1 1 1 2  61 8  o 2.205000  0.5049000     1.751000  0.7132000     2.659000  0.7148000     -0.9088000     1.010000  
1 1 1 2  61 9  o 1.851000  0.5116000     1.609000  0.6907000     2.093000  0.7549000     -0.4837000     1.023000  
1 1 1 2  61 10 o 1.480000  0.4630000     1.428000  0.6389000     1.531000  0.6702000     -0.1032000     0.9259000 
1 1 1 2  61 11 o 1.299000  0.4245000     1.155000  0.5521000     1.443000  0.6449000     -0.2881000     0.8490000 
1 1 1 2  62 0  o 2.721000  0.8552000     2.721000  0.8552000     2.721000  0.8552000     0.000000       0.000000  
1 1 1 2  62 1  f 1.875000  0.4731000     2.454000  0.7303000     1.296000  0.6017000     1.158000       0.9463000 
1 1 1 2  62 2  o 4.980000  0.3195000     4.861000  0.4647000     5.099000  0.4388000     -0.2383000     0.6391000 
1 1 1 2  62 3  o 4.222000  0.3758000     4.362000  0.5123000     4.083000  0.5501000     0.2787000      0.7517000 
1 1 1 2  62 4  o 5.003000  0.3230000     4.787000  0.4822000     5.218000  0.4298000     -0.4310000     0.6460000 
1 1 1 2  62 5  o 1.209000  0.4060000     1.080000  0.5281000     1.339000  0.6169000     -0.2584000     0.8121000 
1 1 1 2  62 6  o 1.977000  0.5204000     1.854000  0.7236000     2.099000  0.7480000     -0.2447000     1.041000  
1 1 1 2  62 7  o 1.225000  0.4106000     1.252000  0.5892000     1.199000  0.5720000     0.5366000E-01  0.8211000 
1 1 1 2  62 8  o 2.094000  0.4961000     2.715000  0.7405000     1.474000  0.6605000     1.241000       0.9922000 
1 1 1 2  62 9  o 2.498000  0.5222000     2.816000  0.7244000     2.181000  0.7525000     0.6351000      1.044000  
1 1 1 2  62 10 o 1.211000  0.4078000     1.126000  0.5464000     1.297000  0.6055000     -0.1713000     0.8156000 
1 1 1 2  63 0  o 7.608000  0.3489000     7.608000  0.3489000     7.608000  0.3489000     -0.000000      0.000000  
1 1 1 2  63 1  o 2.939000  0.4951000     3.101000  0.6796000     2.777000  0.7201000     0.3243000      0.9901000 
1 1 1 2  63 2  o 1.219000  0.4092000     1.194000  0.5709000     1.244000  0.5863000     -0.5048000E-01 0.8183000 
1 1 1 2  63 3  o 4.547000  0.3563000     5.038000  0.4640000     4.057000  0.5408000     0.9812000      0.7126000 
1 1 1 2  63 4  o 4.430000  0.3579000     4.249000  0.5297000     4.612000  0.4813000     -0.3635000     0.7157000 
1 1 1 2  63 5  o 1.849000  0.5089000     2.005000  0.7441000     1.693000  0.6943000     0.3116000      1.018000  
1 1 1 2  63 6  o 1.885000  0.5135000     1.753000  0.7080000     2.017000  0.7439000     -0.2642000     1.027000  
1 1 1 2  63 7  o 1.563000  0.4448000     2.146000  0.7443000     0.9796000 0.4873000     1.166000       0.8896000 
1 1 1 2  63 8  o 3.454000  0.4542000     3.550000  0.6224000     3.358000  0.6618000     0.1921000      0.9085000 
1 1 1 2  63 9  f 2.804000  0.5257000     2.971000  0.7233000     2.638000  0.7631000     0.3325000      1.051000  
1 1 1 2  64 0  o 7.629000  0.3597000     7.629000  0.3597000     7.629000  0.3597000     0.000000       0.000000  
1 1 1 2  64 1  o 7.388000  0.2589000     7.355000  0.3697000     7.420000  0.3625000     -0.6486000E-01 0.5178000 
1 1 1 2  64 2  o 2.011000  0.5041000     1.516000  0.6668000     2.506000  0.7562000     -0.9900000     1.008000  
1 1 1 2  64 3  o 2.215000  0.5306000     2.271000  0.7509000     2.159000  0.7500000     0.1117000      1.061000  
1 1 1 2  64 4  o 1.484000  0.4566000     1.759000  0.7104000     1.208000  0.5738000     0.5509000      0.9131000 
1 1 1 2  64 5  o 1.897000  0.4727000     2.521000  0.7370000     1.274000  0.5921000     1.247000       0.9454000 
1 1 1 2  64 6  o 1.606000  0.4795000     1.691000  0.6968000     1.520000  0.6588000     0.1709000      0.9590000 
1 1 1 2  64 7  f 1.521000  0.4705000     1.328000  0.6131000     1.713000  0.7139000     -0.3845000     0.9410000 
1 1 1 2  64 8  o 2.798000  0.5333000     2.781000  0.7603000     2.816000  0.7480000     -0.3451000E-01 1.067000  
1 1 1 2  65 0  o 0.8538000 0.5983000     0.8538000 0.5983000     0.8538000 0.5983000     0.000000       0.000000  
1 1 1 2  65 1  o 3.999000  0.4005000     4.523000  0.4961000     3.476000  0.6287000     1.047000       0.8009000 
1 1 1 2  65 2  o 2.518000  0.5251000     2.450000  0.7508000     2.586000  0.7342000     -0.1353000     1.050000  
1 1 1 2  65 3  o 3.366000  0.4639000     2.966000  0.7127000     3.767000  0.5939000     -0.8017000     0.9277000 
1 1 1 2  65 4  f 1.423000  0.4514000     1.404000  0.6307000     1.441000  0.6461000     -0.3713000E-01 0.9028000 
1 1 1 2  65 5  o 1.485000  0.4629000     1.584000  0.6808000     1.385000  0.6274000     0.1992000      0.9258000 
1 1 1 2  65 6  o 2.788000  0.4767000     2.048000  0.7421000     3.528000  0.5985000     -1.480000      0.9534000 
1 1 1 2  65 7  o 1.647000  0.4843000     1.901000  0.7350000     1.392000  0.6307000     0.5084000      0.9686000 
1 1 1 2  66 0  o 3.051000  0.7590000     3.051000  0.7590000     3.051000  0.7590000     0.000000       0.000000  
1 1 1 2  66 1  o 3.584000  0.4408000     3.420000  0.6493000     3.748000  0.5964000     -0.3278000     0.8816000 
1 1 1 2  66 2  o 3.851000  0.4203000     3.497000  0.6368000     4.206000  0.5487000     -0.7093000     0.8406000 
1 1 1 2  66 3  o 1.510000  0.4712000     1.594000  0.6905000     1.426000  0.6413000     0.1682000      0.9423000 
1 1 1 2  66 4  o 1.360000  0.4402000     1.417000  0.6395000     1.303000  0.6052000     0.1145000      0.8805000 
1 1 1 2  66 5  o 2.183000  0.5262000     2.070000  0.7486000     2.296000  0.7398000     -0.2253000     1.052000  
1 1 1 2  67 0  o 1.255000  0.7777000     1.255000  0.7777000     1.255000  0.7777000     -0.000000      0.000000  
1 1 1 2  67 1  o 3.260000  0.4727000     3.471000  0.6270000     3.049000  0.7076000     0.4219000      0.9454000 
1 1 1 2  67 2  o 2.082000  0.5263000     2.459000  0.7791000     1.704000  0.7077000     0.7552000      1.053000  
1 1 1 2  67 3  o 1.186000  0.4117000     1.197000  0.5875000     1.175000  0.5768000     0.2168000E-01  0.8233000 
1 1 1 3  0  1  o 44.31000  0.5544000     44.31000  0.5544000     44.31000  0.5544000     -0.000000      0.000000  
1 1 1 3  0  2  o 13.67000  0.1590000     13.67000  0.1590000     13.67000  0.1590000     -0.000000      0.000000  
1 1 1 3  0  3  o 37.05000  0.4058000     37.05000  0.4058000     37.05000  0.4058000     -0.000000      0.000000  
1 1 1 3  0  4  o 7.657000  0.1302000     7.657000  0.1302000     7.657000  0.1302000     0.000000       0.000000  
1 1 1 3  0  5  o 8.135000  0.1682000     8.135000  0.1682000     8.135000  0.1682000     0.000000       0.000000  
1 1 1 3  0  6  o 26.36000  0.3025000     26.36000  0.3025000     26.36000  0.3025000     -0.000000      0.000000  
1 1 1 3  0  7  o 0.9679000 0.5370000     0.9679000 0.5370000     0.9679000 0.5370000     0.000000       0.000000  
1 1 1 3  0  8  o 13.96000  0.2009000     13.96000  0.2009000     13.96000  0.2009000     -0.000000      0.000000  
1 1 1 3  0  9  o 7.866000  0.2035000     7.866000  0.2035000     7.866000  0.2035000     -0.000000      0.000000  
1 1 1 3  0  10 o 2.041000  0.7214000     2.041000  0.7214000     2.041000  0.7214000     -0.000000      0.000000  
1 1 1 3  0  11 o 10.52000  0.2600000     10.52000  0.2600000     10.52000  0.2600000     0.000000       0.000000  
1 1 1 3  0  12 o 15.53000  0.2520000     15.53000  0.2520000     15.53000  0.2520000     0.000000       0.000000  
1 1 1 3  0  13 o 5.821000  0.3570000     5.821000  0.3570000     5.821000  0.3570000     0.000000       0.000000  
1 1 1 3  0  14 o 5.030000  0.4484000     5.030000  0.4484000     5.030000  0.4484000     0.000000       0.000000  
1 1 1 3  0  15 o 9.267000  0.3158000     9.267000  0.3158000     9.267000  0.3158000     -0.000000      0.000000  
1 1 1 3  0  16 f 11.48000  0.3625000     11.48000  0.3625000     11.48000  0.3625000     0.000000       0.000000  
1 1 1 3  0  17 o 1.143000  0.7718000     1.143000  0.7718000     1.143000  0.7718000     -0.000000      0.000000  
1 1 1 3  0  18 o 4.982000  0.6161000     4.982000  0.6161000     4.982000  0.6161000     -0.000000      0.000000  
1 1 1 3  0  19 o 7.727000  0.4714000     7.727000  0.4714000     7.727000  0.4714000     0.000000       0.000000  
1 1 1 3  0  20 o 3.353000  1.263000      3.353000  1.263000      3.353000  1.263000      0.000000       0.000000  
1 1 1 3  0  21 o 1.156000  0.8143000     1.156000  0.8143000     1.156000  0.8143000     -0.000000      0.000000  
1 1 1 3  0  22 o 1.287000  0.8617000     1.287000  0.8617000     1.287000  0.8617000     -0.000000      0.000000  
1 1 1 3  0  23 o 3.107000  1.013000      3.107000  1.013000      3.107000  1.013000      0.000000       0.000000  
1 1 1 3  0  24 o 1.312000  0.8315000     1.312000  0.8315000     1.312000  0.8315000     -0.000000      0.000000  
1 1 1 3  0  25 o 0.9501000 0.6845000     0.9501000 0.6845000     0.9501000 0.6845000     -0.000000      0.000000  
1 1 1 3  0  26 o 0.9946000 0.6953000     0.9946000 0.6953000     0.9946000 0.6953000     -0.000000      0.000000  
1 1 1 3  0  27 o 1.087000  0.7484000     1.087000  0.7484000     1.087000  0.7484000     0.000000       0.000000  
1 1 1 3  1  0  o 52.92000  0.8104000     52.92000  0.8104000     52.92000  0.8104000     -0.000000      0.000000  
1 1 1 3  1  1  o 35.44000  0.2944000     35.15000  0.3817000     35.74000  0.4485000     -0.5833000     0.5889000 
1 1 1 3  1  2  o 20.16000  0.1592000     20.12000  0.2246000     20.20000  0.2256000     -0.8738000E-01 0.3184000 
1 1 1 3  1  3  o 32.77000  0.2548000     32.96000  0.3624000     32.58000  0.3583000     0.3793000      0.5096000 
1 1 1 3  1  4  o 32.36000  0.2537000     32.37000  0.3590000     32.35000  0.3586000     0.2486000E-01  0.5074000 
1 1 1 3  1  5  o 9.100000  0.1471000     8.990000  0.2068000     9.210000  0.2093000     -0.2202000     0.2943000 
1 1 1 3  1  6  f 42.03000  0.3288000     41.90000  0.4637000     42.15000  0.4664000     -0.2463000     0.6577000 
1 1 1 3  1  7  o 25.93000  0.2134000     25.81000  0.3005000     26.05000  0.3030000     -0.2457000     0.4267000 
1 1 1 3  1  8  o 13.48000  0.1400000     13.68000  0.1993000     13.28000  0.1966000     0.3950000      0.2799000 
1 1 1 3  1  9  o 17.72000  0.1685000     17.86000  0.2395000     17.59000  0.2370000     0.2690000      0.3370000 
1 1 1 3  1  10 o 5.027000  0.2189000     4.898000  0.3143000     5.157000  0.3049000     -0.2590000     0.4379000 
1 1 1 3  1  11 o 2.546000  0.3914000     2.751000  0.5272000     2.341000  0.5787000     0.4096000      0.7828000 
1 1 1 3  1  12 o 9.218000  0.1813000     9.352000  0.2563000     9.085000  0.2563000     0.2667000      0.3625000 
1 1 1 3  1  13 o 11.37000  0.1850000     11.32000  0.2616000     11.42000  0.2617000     -0.9839000E-01 0.3700000 
1 1 1 3  1  14 o 4.900000  0.3120000     4.763000  0.4513000     5.037000  0.4310000     -0.2746000     0.6241000 
1 1 1 3  1  15 o 17.96000  0.2101000     18.01000  0.2965000     17.91000  0.2978000     0.1091000      0.4203000 
1 1 1 3  1  16 o 2.641000  0.6290000     2.793000  0.8924000     2.489000  0.8866000     0.3042000      1.258000  
1 1 1 3  1  17 o 15.57000  0.2238000     15.53000  0.3164000     15.60000  0.3167000     -0.6263000E-01 0.4477000 
1 1 1 3  1  18 o 3.744000  0.5604000     3.590000  0.8195000     3.898000  0.7646000     -0.3077000     1.121000  
1 1 1 3  1  19 f 7.894000  0.3296000     8.124000  0.4530000     7.664000  0.4789000     0.4598000      0.6592000 
1 1 1 3  1  20 o 3.453000  0.7495000     3.217000  1.075000      3.689000  1.044000      -0.4722000     1.499000  
1 1 1 3  1  21 o 2.832000  0.7083000     2.295000  0.9456000     3.368000  1.055000      -1.073000      1.417000  
1 1 1 3  1  22 o 2.075000  0.6172000     2.335000  0.9203000     1.815000  0.8226000     0.5199000      1.234000  
1 1 1 3  1  23 o 2.255000  0.6136000     2.386000  0.8791000     2.125000  0.8563000     0.2608000      1.227000  
1 1 1 3  1  24 o 4.359000  0.4175000     4.141000  0.6230000     4.577000  0.5560000     -0.4363000     0.8350000 
1 1 1 3  1  25 o 3.041000  0.6876000     2.852000  0.9701000     3.231000  0.9747000     -0.3786000     1.375000  
1 1 1 3  1  26 o 1.628000  0.5027000     2.173000  0.8447000     1.084000  0.5453000     1.089000       1.005000  
1 1 1 3  1  27 o 1.274000  0.4387000     1.245000  0.6090000     1.303000  0.6317000     -0.5780000E-01 0.8775000 
1 1 1 3  2  0  o 42.51000  0.4612000     42.51000  0.4612000     42.51000  0.4612000     0.000000       0.000000  
1 1 1 3  2  1  o 17.08000  0.1342000     17.22000  0.1914000     16.94000  0.1883000     0.2830000      0.2685000 
1 1 1 3  2  2  o 12.95000  0.1081000     13.01000  0.1535000     12.89000  0.1523000     0.1256000      0.2162000 
1 1 1 3  2  3  f 35.50000  0.2755000     35.32000  0.3876000     35.68000  0.3915000     -0.3611000     0.5509000 
1 1 1 3  2  4  o 40.15000  0.3120000     40.10000  0.4407000     40.21000  0.4419000     -0.1148000     0.6241000 
1 1 1 3  2  5  o 18.86000  0.2738000     19.20000  0.3248000     18.51000  0.4408000     0.6875000      0.5475000 
1 1 1 3  2  6  o 14.53000  0.1361000     14.64000  0.1933000     14.43000  0.1916000     0.2049000      0.2722000 
1 1 1 3  2  7  o 15.77000  0.1477000     15.61000  0.2080000     15.93000  0.2097000     -0.3174000     0.2954000 
1 1 1 3  2  8  o 25.32000  0.2113000     25.08000  0.2967000     25.55000  0.3010000     -0.4641000     0.4226000 
1 1 1 3  2  9  o 13.74000  0.1497000     13.88000  0.2127000     13.60000  0.2106000     0.2770000      0.2993000 
1 1 1 3  2  10 o 7.098000  0.1835000     7.212000  0.2597000     6.984000  0.2592000     0.2286000      0.3670000 
1 1 1 3  2  11 o 10.08000  0.1630000     10.19000  0.2301000     9.964000  0.2309000     0.2230000      0.3260000 
1 1 1 3  2  12 o 11.74000  0.1738000     11.90000  0.2466000     11.58000  0.2449000     0.3220000      0.3475000 
1 1 1 3  2  13 o 3.323000  0.3918000     3.465000  0.5260000     3.181000  0.5809000     0.2839000      0.7836000 
1 1 1 3  2  14 o 9.475000  0.2078000     9.590000  0.2910000     9.360000  0.2967000     0.2295000      0.4156000 
1 1 1 3  2  15 o 5.755000  0.3048000     5.480000  0.4441000     6.030000  0.4177000     -0.5497000     0.6097000 
1 1 1 3  2  16 o 12.20000  0.2505000     12.01000  0.3547000     12.39000  0.3539000     -0.3822000     0.5011000 
1 1 1 3  2  17 o 3.111000  0.5941000     3.258000  0.8144000     2.964000  0.8651000     0.2945000      1.188000  
1 1 1 3  2  18 o 14.11000  0.2354000     14.37000  0.3317000     13.85000  0.3341000     0.5225000      0.4708000 
1 1 1 3  2  19 o 5.984000  0.4136000     6.193000  0.5720000     5.775000  0.5977000     0.4188000      0.8273000 
1 1 1 3  2  20 o 3.256000  0.7249000     2.593000  1.031000      3.918000  1.019000      -1.325000      1.450000  
1 1 1 3  2  21 o 2.603000  0.6375000     1.775000  0.8217000     3.430000  0.9748000     -1.655000      1.275000  
1 1 1 3  2  22 o 1.658000  0.5427000     1.488000  0.7139000     1.827000  0.8175000     -0.3396000     1.085000  
1 1 1 3  2  23 o 2.744000  0.6265000     3.033000  0.8772000     2.456000  0.8948000     0.5767000      1.253000  
1 1 1 3  2  24 o 1.530000  0.4902000     1.440000  0.6683000     1.620000  0.7172000     -0.1800000     0.9803000 
1 1 1 3  2  25 o 1.568000  0.5257000     1.233000  0.6181000     1.903000  0.8504000     -0.6692000     1.051000  
1 1 1 3  2  26 o 2.113000  0.5879000     1.823000  0.7906000     2.403000  0.8705000     -0.5800000     1.176000  
1 1 1 3  2  27 o 1.785000  0.5510000     1.830000  0.7925000     1.740000  0.7658000     0.8985000E-01  1.102000  
1 1 1 3  3  0  o 20.04000  0.2207000     20.04000  0.2207000     20.04000  0.2207000     0.000000       0.000000  
1 1 1 3  3  1  o 51.84000  0.3973000     52.09000  0.5647000     51.60000  0.5592000     0.4891000      0.7947000 
1 1 1 3  3  2  o 25.02000  0.1952000     25.03000  0.2763000     25.02000  0.2757000     0.9918000E-02  0.3904000 
1 1 1 3  3  3  o 27.32000  0.2149000     27.05000  0.3013000     27.58000  0.3064000     -0.5268000     0.4297000 
1 1 1 3  3  4  o 18.73000  0.1555000     18.46000  0.2174000     19.00000  0.2224000     -0.5324000     0.3110000 
1 1 1 3  3  5  f 18.04000  0.3068000     18.16000  0.4384000     17.92000  0.4293000     0.2452000      0.6135000 
1 1 1 3  3  6  o 21.38000  0.1796000     21.27000  0.2530000     21.49000  0.2549000     -0.2183000     0.3591000 
1 1 1 3  3  7  o 36.21000  0.2875000     36.02000  0.4047000     36.39000  0.4085000     -0.3748000     0.5750000 
1 1 1 3  3  8  o 27.74000  0.2284000     27.62000  0.3216000     27.87000  0.3245000     -0.2525000     0.4569000 
1 1 1 3  3  9  o 13.04000  0.1476000     13.01000  0.2088000     13.07000  0.2087000     -0.5356000E-01 0.2952000 
1 1 1 3  3  10 o 7.902000  0.1759000     7.729000  0.2512000     8.076000  0.2465000     -0.3465000     0.3519000 
1 1 1 3  3  11 o 9.653000  0.1643000     9.617000  0.2316000     9.688000  0.2331000     -0.7086000E-01 0.3286000 
1 1 1 3  3  12 o 10.04000  0.1762000     10.13000  0.2487000     9.949000  0.2496000     0.1773000      0.3524000 
1 1 1 3  3  13 o 8.016000  0.2098000     8.386000  0.2868000     7.645000  0.3062000     0.7410000      0.4195000 
1 1 1 3  3  14 o 11.87000  0.1964000     11.89000  0.2790000     11.84000  0.2766000     0.4884000E-01  0.3929000 
1 1 1 3  3  15 o 14.62000  0.2226000     14.96000  0.3329000     14.28000  0.2955000     0.6796000      0.4451000 
1 1 1 3  3  16 o 8.667000  0.2907000     8.776000  0.4057000     8.557000  0.4165000     0.2190000      0.5815000 
1 1 1 3  3  17 o 6.422000  0.3398000     6.350000  0.4758000     6.493000  0.4853000     -0.1431000     0.6796000 
1 1 1 3  3  18 o 9.408000  0.2726000     9.535000  0.3858000     9.280000  0.3853000     0.2545000      0.5453000 
1 1 1 3  3  19 o 5.358000  0.4590000     5.468000  0.6262000     5.249000  0.6714000     0.2194000      0.9181000 
1 1 1 3  3  20 o 4.387000  0.6885000     4.359000  0.9806000     4.416000  0.9668000     -0.5689000E-01 1.377000  
1 1 1 3  3  21 o 3.057000  0.6535000     2.208000  0.9319000     3.906000  0.9165000     -1.697000      1.307000  
1 1 1 3  3  22 o 1.526000  0.5148000     1.333000  0.6544000     1.719000  0.7949000     -0.3863000     1.030000  
1 1 1 3  3  23 o 3.725000  0.5718000     4.570000  0.6823000     2.880000  0.9179000     1.690000       1.144000  
1 1 1 3  3  24 o 4.146000  0.4384000     4.130000  0.6223000     4.163000  0.6176000     -0.3323000E-01 0.8767000 
1 1 1 3  3  25 f 2.175000  0.6760000     1.775000  0.8223000     2.575000  1.073000      -0.8000000     1.352000  
1 1 1 3  3  26 o 1.864000  0.5405000     1.265000  0.6203000     2.462000  0.8854000     -1.196000      1.081000  
1 1 1 3  3  27 o 1.315000  0.4494000     1.361000  0.6522000     1.269000  0.6185000     0.9215000E-01  0.8988000 
1 1 1 3  4  0  o 38.93000  0.4232000     38.93000  0.4232000     38.93000  0.4232000     -0.000000      0.000000  
1 1 1 3  4  1  o 25.65000  0.1992000     25.54000  0.2806000     25.76000  0.2829000     -0.2192000     0.3985000 
1 1 1 3  4  2  o 31.02000  0.2406000     30.87000  0.3386000     31.16000  0.3419000     -0.2888000     0.4812000 
1 1 1 3  4  3  o 14.99000  0.1527000     14.82000  0.2479000     15.16000  0.1784000     -0.3391000     0.3054000 
1 1 1 3  4  4  o 30.12000  0.2376000     29.94000  0.3341000     30.31000  0.3380000     -0.3779000     0.4752000 
1 1 1 3  4  5  o 5.381000  0.1592000     5.447000  0.2317000     5.314000  0.2185000     0.1329000      0.3185000 
1 1 1 3  4  6  o 39.73000  0.3122000     39.50000  0.4390000     39.97000  0.4439000     -0.4691000     0.6243000 
1 1 1 3  4  7  o 23.81000  0.1989000     23.94000  0.2826000     23.69000  0.2800000     0.2592000      0.3978000 
1 1 1 3  4  8  o 17.78000  0.1636000     18.08000  0.2337000     17.49000  0.2290000     0.5924000      0.3272000 
1 1 1 3  4  9  o 10.90000  0.1428000     10.90000  0.2007000     10.89000  0.2031000     0.1326000E-01  0.2856000 
1 1 1 3  4  10 o 14.08000  0.1811000     14.05000  0.2566000     14.12000  0.2556000     -0.6929000E-01 0.3621000 
1 1 1 3  4  11 o 9.055000  0.1687000     9.077000  0.2393000     9.032000  0.2379000     0.4509000E-01  0.3374000 
1 1 1 3  4  12 o 10.40000  0.1789000     10.45000  0.2524000     10.35000  0.2537000     0.9787000E-01  0.3579000 
1 1 1 3  4  13 o 7.498000  0.2175000     7.326000  0.3077000     7.670000  0.3074000     -0.3439000     0.4349000 
1 1 1 3  4  14 o 20.59000  0.2148000     20.69000  0.3049000     20.50000  0.3028000     0.1894000      0.4297000 
1 1 1 3  4  15 o 12.28000  0.2394000     12.01000  0.3359000     12.56000  0.3412000     -0.5562000     0.4788000 
1 1 1 3  4  16 o 5.724000  0.3760000     6.305000  0.4383000     5.144000  0.6109000     1.161000       0.7519000 
1 1 1 3  4  17 o 14.78000  0.2289000     14.64000  0.3225000     14.92000  0.3249000     -0.2863000     0.4578000 
1 1 1 3  4  18 o 10.70000  0.2601000     10.42000  0.3737000     10.98000  0.3620000     -0.5569000     0.5203000 
1 1 1 3  4  19 o 2.845000  0.6195000     1.957000  0.8565000     3.734000  0.8953000     -1.777000      1.239000  
1 1 1 3  4  20 o 2.579000  0.6869000     1.888000  0.8769000     3.271000  1.057000      -1.383000      1.374000  
1 1 1 3  4  21 o 2.487000  0.6833000     2.750000  0.9974000     2.224000  0.9343000     0.5264000      1.367000  
1 1 1 3  4  22 o 2.503000  0.6585000     2.310000  0.9140000     2.695000  0.9481000     -0.3850000     1.317000  
1 1 1 3  4  23 o 1.780000  0.5617000     1.690000  0.7708000     1.871000  0.8174000     -0.1810000     1.123000  
1 1 1 3  4  24 o 1.780000  0.5317000     1.552000  0.7056000     2.008000  0.7956000     -0.4559000     1.063000  
1 1 1 3  4  25 o 2.129000  0.6723000     1.689000  0.8170000     2.569000  1.068000      -0.8795000     1.345000  
1 1 1 3  4  26 o 1.837000  0.5535000     2.246000  0.8730000     1.428000  0.6806000     0.8181000      1.107000  
1 1 1 3  4  27 o 1.399000  0.4736000     1.284000  0.6257000     1.514000  0.7112000     -0.2293000     0.9472000 
1 1 1 3  5  0  o 28.65000  0.3143000     28.65000  0.3143000     28.65000  0.3143000     0.000000       0.000000  
1 1 1 3  5  1  o 37.97000  0.2926000     38.11000  0.4155000     37.83000  0.4122000     0.2852000      0.5853000 
1 1 1 3  5  2  f 13.93000  0.1162000     13.66000  0.1618000     14.20000  0.1668000     -0.5378000     0.2324000 
1 1 1 3  5  3  o 30.39000  0.2376000     30.33000  0.3350000     30.45000  0.3369000     -0.1248000     0.4751000 
1 1 1 3  5  4  o 21.72000  0.1761000     21.55000  0.2472000     21.88000  0.2510000     -0.3225000     0.3523000 
1 1 1 3  5  5  o 7.972000  0.2136000     7.908000  0.3042000     8.035000  0.3000000     -0.1262000     0.4273000 
1 1 1 3  5  6  o 25.48000  0.2086000     25.59000  0.2962000     25.37000  0.2939000     0.2223000      0.4173000 
1 1 1 3  5  7  o 8.224000  0.1245000     8.021000  0.1766000     8.427000  0.1756000     -0.4062000     0.2490000 
1 1 1 3  5  8  o 12.12000  0.1365000     12.11000  0.1933000     12.14000  0.1927000     -0.3386000E-01 0.2729000 
1 1 1 3  5  9  o 7.153000  0.1535000     6.826000  0.2222000     7.481000  0.2119000     -0.6552000     0.3071000 
1 1 1 3  5  10 o 2.908000  0.3567000     3.094000  0.4618000     2.722000  0.5439000     0.3719000      0.7135000 
1 1 1 3  5  11 o 19.91000  0.1923000     19.65000  0.2696000     20.18000  0.2742000     -0.5244000     0.3845000 
1 1 1 3  5  12 o 4.402000  0.2809000     4.221000  0.4123000     4.583000  0.3817000     -0.3614000     0.5618000 
1 1 1 3  5  13 o 2.183000  0.4703000     2.820000  0.6686000     1.547000  0.6615000     1.274000       0.9405000 
1 1 1 3  5  14 o 4.623000  0.3593000     4.041000  0.5632000     5.205000  0.4464000     -1.164000      0.7187000 
1 1 1 3  5  15 o 7.363000  0.2997000     7.593000  0.4129000     7.133000  0.4345000     0.4595000      0.5994000 
1 1 1 3  5  16 o 6.295000  0.3194000     6.503000  0.4393000     6.087000  0.4638000     0.4157000      0.6388000 
1 1 1 3  5  17 o 5.027000  0.4184000     4.936000  0.5984000     5.119000  0.5849000     -0.1831000     0.8368000 
1 1 1 3  5  18 f 2.753000  0.6316000     3.215000  0.8951000     2.290000  0.8913000     0.9256000      1.263000  
1 1 1 3  5  19 o 2.477000  0.6644000     2.489000  0.9315000     2.465000  0.9476000     0.2385000E-01  1.329000  
1 1 1 3  5  20 o 1.959000  0.6331000     2.027000  0.9168000     1.891000  0.8733000     0.1364000      1.266000  
1 1 1 3  5  21 o 3.166000  0.7145000     3.310000  1.005000      3.022000  1.016000      0.2874000      1.429000  
1 1 1 3  5  22 o 2.813000  0.6188000     3.636000  0.8878000     1.990000  0.8624000     1.647000       1.238000  
1 1 1 3  5  23 o 2.316000  0.6162000     2.081000  0.8496000     2.550000  0.8928000     -0.4691000     1.232000  
1 1 1 3  5  24 o 1.682000  0.5235000     1.822000  0.7743000     1.543000  0.7049000     0.2791000      1.047000  
1 1 1 3  5  25 o 1.769000  0.5984000     1.707000  0.8289000     1.831000  0.8634000     -0.1244000     1.197000  
1 1 1 3  5  26 o 2.054000  0.5828000     2.202000  0.8469000     1.906000  0.8010000     0.2955000      1.166000  
1 1 1 3  5  27 o 1.683000  0.5243000     2.047000  0.8324000     1.319000  0.6377000     0.7274000      1.049000  
1 1 1 3  6  0  o 43.18000  0.4704000     43.18000  0.4704000     43.18000  0.4704000     0.000000       0.000000  
1 1 1 3  6  1  o 24.91000  0.1950000     25.05000  0.2773000     24.76000  0.2743000     0.2904000      0.3900000 
1 1 1 3  6  2  o 28.20000  0.2208000     28.52000  0.3152000     27.88000  0.3091000     0.6427000      0.4415000 
1 1 1 3  6  3  o 26.96000  0.2127000     27.20000  0.3030000     26.73000  0.2985000     0.4745000      0.4254000 
1 1 1 3  6  4  o 12.64000  0.1145000     12.41000  0.1602000     12.87000  0.1637000     -0.4643000     0.2290000 
1 1 1 3  6  5  o 22.11000  0.2242000     22.27000  0.3684000     21.95000  0.2557000     0.3195000      0.4485000 
1 1 1 3  6  6  o 39.13000  0.3080000     38.52000  0.4289000     39.75000  0.4422000     -1.226000      0.6160000 
1 1 1 3  6  7  o 19.09000  0.1683000     18.88000  0.2363000     19.30000  0.2396000     -0.4174000     0.3365000 
1 1 1 3  6  8  o 19.48000  0.1745000     19.50000  0.2468000     19.46000  0.2466000     0.4244000E-01  0.3489000 
1 1 1 3  6  9  o 6.578000  0.1546000     6.511000  0.2200000     6.646000  0.2172000     -0.1341000     0.3092000 
1 1 1 3  6  10 o 9.360000  0.3048000     9.208000  0.4308000     9.513000  0.4313000     -0.3046000     0.6096000 
1 1 1 3  6  11 o 4.978000  0.2329000     4.756000  0.3422000     5.201000  0.3160000     -0.4444000     0.4658000 
1 1 1 3  6  12 o 2.441000  0.4699000     2.449000  0.6529000     2.433000  0.6758000     0.1613000E-01  0.9397000 
1 1 1 3  6  13 o 12.19000  0.1873000     12.28000  0.2648000     12.09000  0.2651000     0.1977000      0.3747000 
1 1 1 3  6  14 o 9.944000  0.2117000     9.831000  0.3010000     10.06000  0.2977000     -0.2266000     0.4234000 
1 1 1 3  6  15 o 12.63000  0.2400000     12.86000  0.3354000     12.40000  0.3435000     0.4559000      0.4801000 
1 1 1 3  6  16 o 7.726000  0.2809000     7.334000  0.4019000     8.118000  0.3927000     -0.7844000     0.5619000 
1 1 1 3  6  17 o 4.254000  0.4988000     3.979000  0.7399000     4.530000  0.6691000     -0.5506000     0.9976000 
1 1 1 3  6  18 o 6.010000  0.3993000     6.437000  0.5193000     5.583000  0.6067000     0.8540000      0.7986000 
1 1 1 3  6  19 f 5.816000  0.4350000     5.645000  0.6497000     5.986000  0.5785000     -0.3409000     0.8699000 
1 1 1 3  6  20 o 8.921000  0.3860000     8.256000  0.5809000     9.586000  0.5086000     -1.330000      0.7721000 
1 1 1 3  6  21 o 2.814000  0.7370000     2.390000  0.9666000     3.238000  1.113000      -0.8475000     1.474000  
1 1 1 3  6  22 o 4.795000  0.5067000     4.654000  0.7437000     4.935000  0.6885000     -0.2809000     1.013000  
1 1 1 3  6  23 o 1.447000  0.4896000     1.449000  0.6891000     1.445000  0.6956000     0.3666000E-02  0.9791000 
1 1 1 3  6  24 o 2.016000  0.5309000     1.523000  0.6968000     2.508000  0.8011000     -0.9845000     1.062000  
1 1 1 3  6  25 o 1.756000  0.5779000     1.869000  0.8563000     1.643000  0.7762000     0.2260000      1.156000  
1 1 1 3  6  26 o 1.432000  0.4828000     1.229000  0.6054000     1.635000  0.7521000     -0.4052000     0.9655000 
1 1 1 3  6  27 o 1.415000  0.4743000     1.773000  0.7837000     1.057000  0.5343000     0.7153000      0.9485000 
1 1 1 3  7  0  o 59.39000  0.6447000     59.39000  0.6447000     59.39000  0.6447000     0.000000       0.000000  
1 1 1 3  7  1  o 22.68000  0.1795000     22.50000  0.2519000     22.85000  0.2557000     -0.3500000     0.3589000 
1 1 1 3  7  2  o 20.61000  0.1655000     20.68000  0.2348000     20.54000  0.2334000     0.1435000      0.3311000 
1 1 1 3  7  3  o 3.963000  0.8577000E-01 4.037000  0.1216000     3.889000  0.1210000     0.1481000      0.1715000 
1 1 1 3  7  4  o 8.497000  0.1148000     8.348000  0.1863000     8.646000  0.1341000     -0.2982000     0.2296000 
1 1 1 3  7  5  o 13.64000  0.1309000     13.61000  0.2084000     13.67000  0.1583000     -0.6545000E-01 0.2617000 
1 1 1 3  7  6  o 21.89000  0.1832000     22.00000  0.2595000     21.77000  0.2587000     0.2337000      0.3664000 
1 1 1 3  7  7  o 26.76000  0.2200000     26.55000  0.3088000     26.97000  0.3134000     -0.4201000     0.4400000 
1 1 1 3  7  8  o 18.98000  0.1719000     19.15000  0.2449000     18.81000  0.2414000     0.3370000      0.3439000 
1 1 1 3  7  9  o 7.534000  0.1500000     7.575000  0.2084000     7.493000  0.2158000     0.8165000E-01  0.3000000 
1 1 1 3  7  10 o 2.092000  0.4944000     2.400000  0.7059000     1.785000  0.6924000     0.6145000      0.9888000 
1 1 1 3  7  11 o 3.535000  0.3086000     3.786000  0.4017000     3.284000  0.4687000     0.5018000      0.6172000 
1 1 1 3  7  12 o 2.174000  0.4218000     1.373000  0.6080000     2.976000  0.5848000     -1.603000      0.8436000 
1 1 1 3  7  13 o 12.01000  0.1873000     12.03000  0.2644000     11.99000  0.2653000     0.3966000E-01  0.3746000 
1 1 1 3  7  14 o 5.682000  0.2917000     5.906000  0.4014000     5.458000  0.4235000     0.4481000      0.5835000 
1 1 1 3  7  15 o 11.91000  0.2454000     11.48000  0.3480000     12.34000  0.3460000     -0.8578000     0.4907000 
1 1 1 3  7  16 o 15.37000  0.2194000     15.42000  0.3101000     15.31000  0.3106000     0.1152000      0.4389000 
1 1 1 3  7  17 o 9.861000  0.2621000     10.02000  0.3670000     9.700000  0.3744000     0.3226000      0.5243000 
1 1 1 3  7  18 o 9.921000  0.2721000     10.13000  0.3793000     9.715000  0.3901000     0.4122000      0.5441000 
1 1 1 3  7  19 o 6.657000  0.4111000     6.974000  0.5464000     6.340000  0.6143000     0.6340000      0.8221000 
1 1 1 3  7  20 o 2.169000  0.6748000     2.129000  0.9449000     2.209000  0.9637000     -0.7953000E-01 1.350000  
1 1 1 3  7  21 o 2.256000  0.6642000     2.344000  0.9622000     2.169000  0.9159000     0.1750000      1.328000  
1 1 1 3  7  22 o 2.773000  0.6629000     2.347000  0.9156000     3.198000  0.9589000     -0.8515000     1.326000  
1 1 1 3  7  23 o 1.515000  0.4985000     1.746000  0.7722000     1.284000  0.6307000     0.4624000      0.9970000 
1 1 1 3  7  24 o 1.692000  0.5108000     2.071000  0.8069000     1.312000  0.6266000     0.7588000      1.022000  
1 1 1 3  7  25 o 1.930000  0.6069000     2.113000  0.9171000     1.746000  0.7953000     0.3667000      1.214000  
1 1 1 3  7  26 o 1.974000  0.5297000     2.730000  0.8685000     1.218000  0.6067000     1.511000       1.059000  
1 1 1 3  7  27 o 1.394000  0.4714000     1.428000  0.6769000     1.360000  0.6562000     0.6787000E-01  0.9428000 
1 1 1 3  8  0  o 26.68000  0.2966000     26.68000  0.2966000     26.68000  0.2966000     -0.000000      0.000000  
1 1 1 3  8  1  o 5.735000  0.7705000E-01 5.781000  0.1091000     5.688000  0.1089000     0.9249000E-01  0.1541000 
1 1 1 3  8  2  o 13.39000  0.1167000     13.24000  0.1636000     13.55000  0.1663000     -0.3117000     0.2333000 
1 1 1 3  8  3  o 42.80000  0.3324000     42.96000  0.4720000     42.65000  0.4681000     0.3166000      0.6648000 
1 1 1 3  8  4  o 10.54000  0.2098000     10.54000  0.2098000     ?         ?             ?              ?         
1 1 1 3  8  5  o 11.86000  0.1153000     11.91000  0.1638000     11.81000  0.1624000     0.1024000      0.2307000 
1 1 1 3  8  6  o 11.24000  0.1191000     11.28000  0.1678000     11.20000  0.1691000     0.7690000E-01  0.2382000 
1 1 1 3  8  7  o 32.79000  0.2623000     32.95000  0.3722000     32.63000  0.3696000     0.3169000      0.5245000 
1 1 1 3  8  8  o 9.811000  0.1344000     9.819000  0.1916000     9.803000  0.1885000     0.1540000E-01  0.2688000 
1 1 1 3  8  9  o 20.33000  0.1850000     20.27000  0.2613000     20.39000  0.2620000     -0.1208000     0.3700000 
1 1 1 3  8  10 o 4.542000  0.3875000     4.413000  0.6419000     4.671000  0.4343000     -0.2587000     0.7751000 
1 1 1 3  8  11 o 4.688000  0.2470000     5.023000  0.3422000     4.353000  0.3562000     0.6698000      0.4939000 
1 1 1 3  8  12 o 8.591000  0.1895000     8.788000  0.2645000     8.393000  0.2715000     0.3953000      0.3790000 
1 1 1 3  8  13 o 8.814000  0.2021000     9.112000  0.2822000     8.517000  0.2894000     0.5952000      0.4042000 
1 1 1 3  8  14 o 13.30000  0.1992000     13.26000  0.2824000     13.34000  0.2811000     -0.7856000E-01 0.3985000 
1 1 1 3  8  15 o 14.60000  0.3586000     14.75000  0.4178000     14.45000  0.5830000     0.3070000      0.7173000 
1 1 1 3  8  16 o 7.158000  0.2897000     7.000000  0.4126000     7.315000  0.4067000     -0.3152000     0.5794000 
1 1 1 3  8  17 o 11.15000  0.2456000     11.13000  0.3472000     11.18000  0.3475000     -0.4724000E-01 0.4913000 
1 1 1 3  8  18 o 2.721000  0.6478000     2.388000  0.9222000     3.053000  0.9100000     -0.6647000     1.296000  
1 1 1 3  8  19 o 7.493000  0.3598000     7.664000  0.4950000     7.323000  0.5222000     0.3405000      0.7196000 
1 1 1 3  8  20 o 5.325000  0.9012000     5.169000  0.9025000     5.480000  1.560000      -0.3115000     1.802000  
1 1 1 3  8  21 o 2.301000  0.6665000     2.020000  0.8891000     2.581000  0.9933000     -0.5606000     1.333000  
1 1 1 3  8  22 o 2.892000  0.6777000     3.067000  0.9547000     2.717000  0.9622000     0.3509000      1.355000  
1 1 1 3  8  23 o 1.880000  0.5707000     1.723000  0.7735000     2.037000  0.8394000     -0.3140000     1.141000  
1 1 1 3  8  24 o 2.208000  0.5587000     2.663000  0.8343000     1.753000  0.7434000     0.9106000      1.117000  
1 1 1 3  8  25 o 1.658000  0.5482000     1.739000  0.8071000     1.577000  0.7421000     0.1618000      1.096000  
1 1 1 3  8  26 o 2.004000  0.5757000     2.333000  0.8756000     1.674000  0.7479000     0.6590000      1.151000  
1 1 1 3  8  27 o 1.884000  0.5667000     1.611000  0.7311000     2.156000  0.8660000     -0.5445000     1.133000  
1 1 1 3  9  0  o 8.743000  0.1280000     8.743000  0.1280000     8.743000  0.1280000     0.000000       0.000000  
1 1 1 3  9  1  o 29.64000  0.2328000     29.33000  0.3262000     29.95000  0.3321000     -0.6174000     0.4655000 
1 1 1 3  9  2  o 34.25000  0.2677000     34.37000  0.3798000     34.14000  0.3774000     0.2220000      0.5354000 
1 1 1 3  9  3  o 18.49000  0.1678000     18.95000  0.2590000     18.04000  0.2134000     0.9113000      0.3356000 
1 1 1 3  9  4  o 11.35000  0.2010000     11.24000  0.2213000     11.46000  0.3355000     -0.2242000     0.4019000 
1 1 1 3  9  5  o 32.91000  0.2602000     32.99000  0.3687000     32.84000  0.3671000     0.1491000      0.5203000 
1 1 1 3  9  6  o 21.10000  0.1770000     20.89000  0.2480000     21.31000  0.2527000     -0.4128000     0.3540000 
1 1 1 3  9  7  o 8.372000  0.1413000     8.287000  0.2128000     8.457000  0.1860000     -0.1702000     0.2826000 
1 1 1 3  9  8  o 26.45000  0.2199000     26.13000  0.3075000     26.77000  0.3144000     -0.6433000     0.4398000 
1 1 1 3  9  9  o 6.509000  0.1578000     6.520000  0.2230000     6.499000  0.2232000     0.2162000E-01  0.3155000 
1 1 1 3  9  10 o 13.86000  0.2878000     13.43000  0.4649000     14.28000  0.3395000     -0.8466000     0.5756000 
1 1 1 3  9  11 o 8.005000  0.1830000     8.045000  0.2565000     7.966000  0.2611000     0.7862000E-01  0.3660000 
1 1 1 3  9  12 o 3.763000  0.3428000     3.764000  0.4899000     3.762000  0.4797000     0.2698000E-02  0.6856000 
1 1 1 3  9  13 o 2.161000  0.5072000     2.025000  0.7176000     2.297000  0.7171000     -0.2724000     1.014000  
1 1 1 3  9  14 o 9.208000  0.2182000     9.025000  0.3120000     9.390000  0.3052000     -0.3651000     0.4364000 
1 1 1 3  9  15 o 6.681000  0.5651000     7.328000  0.7075000     6.033000  0.8813000     1.295000       1.130000  
1 1 1 3  9  16 o 8.179000  0.2729000     8.453000  0.3715000     7.906000  0.3998000     0.5463000      0.5458000 
1 1 1 3  9  17 o 4.340000  0.4900000     4.473000  0.6627000     4.208000  0.7221000     0.2651000      0.9800000 
1 1 1 3  9  18 o 3.902000  0.5815000     3.392000  0.8969000     4.412000  0.7403000     -1.020000      1.163000  
1 1 1 3  9  19 f 3.316000  0.6729000     3.283000  0.9570000     3.350000  0.9462000     -0.6759000E-01 1.346000  
1 1 1 3  9  20 o 3.178000  0.9066000     3.822000  1.351000      2.535000  1.209000      1.287000       1.813000  
1 1 1 3  9  21 o 5.412000  0.5070000     5.673000  0.6687000     5.150000  0.7623000     0.5225000      1.014000  
1 1 1 3  9  22 f 2.665000  0.6362000     2.043000  0.8758000     3.286000  0.9230000     -1.243000      1.272000  
1 1 1 3  9  23 o 1.837000  0.5553000     2.017000  0.8240000     1.657000  0.7446000     0.3608000      1.111000  
1 1 1 3  9  24 o 2.704000  0.5783000     2.814000  0.8088000     2.594000  0.8267000     0.2200000      1.157000  
1 1 1 3  9  25 o 2.054000  0.6286000     2.320000  0.9566000     1.789000  0.8159000     0.5303000      1.257000  
1 1 1 3  9  26 o 1.698000  0.5197000     1.228000  0.6036000     2.167000  0.8461000     -0.9388000     1.039000  
1 1 1 3  9  27 o 1.341000  0.4554000     1.208000  0.5951000     1.474000  0.6894000     -0.2659000     0.9107000 
1 1 1 3  10 0  o 3.774000  0.1323000     3.774000  0.1323000     3.774000  0.1323000     -0.000000      0.000000  
1 1 1 3  10 1  o 16.47000  0.1387000     16.69000  0.1984000     16.25000  0.1940000     0.4371000      0.2775000 
1 1 1 3  10 2  o 10.10000  0.1011000     10.20000  0.1435000     9.998000  0.1424000     0.2057000      0.2021000 
1 1 1 3  10 3  o 4.776000  0.1907000     4.776000  0.1907000     ?         ?             ?              ?         
1 1 1 3  10 4  o 17.14000  0.1475000     16.82000  0.2061000     17.45000  0.2110000     -0.6309000     0.2949000 
1 1 1 3  10 5  o 18.45000  0.1579000     18.72000  0.2256000     18.18000  0.2210000     0.5415000      0.3158000 
1 1 1 3  10 6  f 7.514000  0.1058000     7.496000  0.1504000     7.531000  0.1490000     -0.3447000E-01 0.2117000 
1 1 1 3  10 7  o 9.704000  0.1231000     9.844000  0.1976000     9.565000  0.1467000     0.2789000      0.2461000 
1 1 1 3  10 8  o 3.735000  0.1654000     3.934000  0.2243000     3.536000  0.2431000     0.3983000      0.3308000 
1 1 1 3  10 9  o 4.503000  0.1674000     4.752000  0.2245000     4.254000  0.2484000     0.4980000      0.3349000 
1 1 1 3  10 10 o 9.881000  0.1845000     9.568000  0.2547000     10.19000  0.2668000     -0.6251000     0.3689000 
1 1 1 3  10 11 o 2.572000  0.4120000     3.281000  0.4912000     1.862000  0.6617000     1.419000       0.8241000 
1 1 1 3  10 12 o 5.116000  0.2677000     4.952000  0.3890000     5.281000  0.3680000     -0.3296000     0.5355000 
1 1 1 3  10 13 o 3.730000  0.3958000     3.257000  0.6287000     4.203000  0.4809000     -0.9454000     0.7916000 
1 1 1 3  10 14 o 7.627000  0.2393000     7.075000  0.3530000     8.179000  0.3233000     -1.104000      0.4786000 
1 1 1 3  10 15 o 17.17000  0.3019000     17.12000  0.4310000     17.22000  0.4229000     -0.9757000E-01 0.6038000 
1 1 1 3  10 16 o 5.422000  0.3754000     5.640000  0.5122000     5.204000  0.5491000     0.4360000      0.7509000 
1 1 1 3  10 17 o 7.383000  0.3109000     7.101000  0.4488000     7.664000  0.4303000     -0.5623000     0.6218000 
1 1 1 3  10 18 o 2.358000  0.6018000     3.039000  0.9217000     1.678000  0.7741000     1.361000       1.204000  
1 1 1 3  10 19 o 5.655000  0.4580000     5.361000  0.6904000     5.949000  0.6021000     -0.5880000     0.9161000 
1 1 1 3  10 20 f 4.633000  0.9541000     4.926000  1.083000      4.340000  1.571000      0.5855000      1.908000  
1 1 1 3  10 21 o 2.172000  0.6433000     2.607000  0.9965000     1.736000  0.8139000     0.8710000      1.287000  
1 1 1 3  10 22 o 1.627000  0.5355000     1.657000  0.7653000     1.598000  0.7493000     0.5870000E-01  1.071000  
1 1 1 3  10 23 o 1.796000  0.5380000     1.455000  0.6844000     2.137000  0.8303000     -0.6819000     1.076000  
1 1 1 3  10 24 o 2.112000  0.5586000     2.353000  0.8116000     1.872000  0.7679000     0.4808000      1.117000  
1 1 1 3  10 25 o 1.925000  0.6495000     2.081000  0.9727000     1.769000  0.8609000     0.3123000      1.299000  
1 1 1 3  10 26 o 1.637000  0.5256000     1.740000  0.7691000     1.534000  0.7166000     0.2056000      1.051000  
1 1 1 3  10 27 o 1.343000  0.4520000     1.587000  0.7223000     1.099000  0.5437000     0.4889000      0.9040000 
1 1 1 3  11 0  o 20.42000  0.2368000     20.42000  0.2368000     20.42000  0.2368000     -0.000000      0.000000  
1 1 1 3  11 1  o 23.51000  0.1893000     23.49000  0.2675000     23.53000  0.2679000     -0.3610000E-01 0.3786000 
1 1 1 3  11 2  o 13.99000  0.1768000     13.82000  0.2475000     14.16000  0.2525000     -0.3443000     0.3536000 
1 1 1 3  11 3  o 5.352000  0.1401000     5.430000  0.1925000     5.274000  0.2036000     0.1560000      0.2802000 
1 1 1 3  11 4  o 8.985000  0.1141000     9.200000  0.1751000     8.769000  0.1461000     0.4311000      0.2281000 
1 1 1 3  11 5  o 21.02000  0.1761000     21.14000  0.2503000     20.90000  0.2478000     0.2362000      0.3522000 
1 1 1 3  11 6  o 5.815000  0.1088000     5.923000  0.1524000     5.706000  0.1554000     0.2165000      0.2177000 
1 1 1 3  11 7  o 16.99000  0.1536000     16.90000  0.2168000     17.09000  0.2177000     -0.1930000     0.3072000 
1 1 1 3  11 8  o 18.01000  0.1660000     18.15000  0.2354000     17.87000  0.2342000     0.2706000      0.3321000 
1 1 1 3  11 9  o 4.787000  0.1726000     4.845000  0.2404000     4.728000  0.2477000     0.1176000      0.3452000 
1 1 1 3  11 10 o 16.85000  0.1683000     16.79000  0.2375000     16.92000  0.2384000     -0.1323000     0.3365000 
1 1 1 3  11 11 o 11.26000  0.1753000     11.12000  0.1973000     11.41000  0.2899000     -0.2868000     0.3507000 
1 1 1 3  11 12 o 5.622000  0.2516000     5.556000  0.3595000     5.688000  0.3522000     -0.1323000     0.5033000 
1 1 1 3  11 13 o 7.576000  0.2235000     7.871000  0.3082000     7.282000  0.3238000     0.5886000      0.4471000 
1 1 1 3  11 14 o 8.989000  0.2230000     9.091000  0.3168000     8.887000  0.3141000     0.2037000      0.4461000 
1 1 1 3  11 15 o 9.092000  0.4962000     9.477000  0.6621000     8.706000  0.7392000     0.7712000      0.9924000 
1 1 1 3  11 16 o 11.24000  0.2412000     11.39000  0.3418000     11.10000  0.3404000     0.2885000      0.4824000 
1 1 1 3  11 17 o 14.79000  0.2316000     14.88000  0.3233000     14.70000  0.3316000     0.1759000      0.4631000 
1 1 1 3  11 18 o 2.102000  0.5813000     2.736000  0.9234000     1.469000  0.7065000     1.266000       1.163000  
1 1 1 3  11 19 o 3.060000  0.6213000     2.044000  0.8895000     4.076000  0.8678000     -2.032000      1.243000  
1 1 1 3  11 20 o 2.512000  0.7497000     3.147000  1.187000      1.877000  0.9162000     1.270000       1.499000  
1 1 1 3  11 21 o 2.508000  0.6688000     3.052000  1.007000      1.964000  0.8806000     1.088000       1.338000  
1 1 1 3  11 22 f 2.278000  0.6200000     2.763000  0.9430000     1.792000  0.8051000     0.9709000      1.240000  
1 1 1 3  11 23 o 1.749000  0.5375000     1.677000  0.7482000     1.821000  0.7718000     -0.1447000     1.075000  
1 1 1 3  11 24 o 2.210000  0.5484000     1.800000  0.7527000     2.620000  0.7977000     -0.8206000     1.097000  
1 1 1 3  11 25 o 2.084000  0.6485000     2.104000  0.9821000     2.065000  0.8471000     0.3872000E-01  1.297000  
1 1 1 3  11 26 o 1.708000  0.5346000     1.461000  0.6879000     1.956000  0.8185000     -0.4952000     1.069000  
1 1 1 3  11 27 o 1.322000  0.4470000     1.300000  0.6281000     1.344000  0.6362000     -0.4417000E-01 0.8940000 
1 1 1 3  12 0  o 19.53000  0.3248000     19.53000  0.3248000     19.53000  0.3248000     0.000000       0.000000  
1 1 1 3  12 1  o 7.517000  0.1343000     7.598000  0.1901000     7.435000  0.1897000     0.1636000      0.2685000 
1 1 1 3  12 2  o 18.32000  0.3095000     18.32000  0.3095000     ?         ?             ?              ?         
1 1 1 3  12 3  o 13.90000  0.1271000     14.29000  0.1832000     13.51000  0.1763000     0.7873000      0.2543000 
1 1 1 3  12 4  o 17.33000  0.1631000     17.11000  0.2454000     17.56000  0.2148000     -0.4565000     0.3261000 
1 1 1 3  12 5  o 11.24000  0.1179000     11.42000  0.1679000     11.05000  0.1656000     0.3654000      0.2358000 
1 1 1 3  12 6  o 39.52000  0.3362000     39.11000  0.4358000     39.93000  0.5120000     -0.8220000     0.6723000 
1 1 1 3  12 7  o 9.081000  0.1232000     9.062000  0.1816000     9.100000  0.1666000     -0.3800000E-01 0.2465000 
1 1 1 3  12 8  o 12.54000  0.1496000     12.60000  0.2121000     12.48000  0.2110000     0.1150000      0.2992000 
1 1 1 3  12 9  o 16.38000  0.2628000     16.38000  0.2628000     ?         ?             ?              ?         
1 1 1 3  12 10 o 9.136000  0.1459000     9.443000  0.2058000     8.830000  0.2068000     0.6136000      0.2918000 
1 1 1 3  12 11 o 9.955000  0.1581000     9.792000  0.2231000     10.12000  0.2241000     -0.3247000     0.3162000 
1 1 1 3  12 12 o 6.765000  0.1845000     6.840000  0.2622000     6.690000  0.2595000     0.1493000      0.3689000 
1 1 1 3  12 13 o 2.615000  0.5031000     2.365000  0.7365000     2.864000  0.6854000     -0.4986000     1.006000  
1 1 1 3  12 14 o 4.206000  0.4017000     3.723000  0.6342000     4.689000  0.4931000     -0.9652000     0.8034000 
1 1 1 3  12 15 o 14.11000  0.2801000     14.44000  0.4310000     13.78000  0.3578000     0.6629000      0.5601000 
1 1 1 3  12 16 o 18.90000  0.2293000     19.30000  0.3246000     18.50000  0.3240000     0.7992000      0.4587000 
1 1 1 3  12 17 o 4.798000  0.4448000     4.687000  0.6411000     4.909000  0.6168000     -0.2222000     0.8896000 
1 1 1 3  12 18 o 8.152000  0.3144000     8.348000  0.4384000     7.956000  0.4507000     0.3916000      0.6287000 
1 1 1 3  12 19 o 2.021000  0.6226000     1.903000  0.8586000     2.140000  0.9018000     -0.2367000     1.245000  
1 1 1 3  12 20 o 5.103000  1.018000      5.616000  1.364000      4.591000  1.512000      1.025000       2.036000  
1 1 1 3  12 21 o 3.491000  0.6611000     3.081000  0.9919000     3.901000  0.8742000     -0.8198000     1.322000  
1 1 1 3  12 22 o 2.855000  0.6482000     3.154000  0.9246000     2.557000  0.9088000     0.5962000      1.296000  
1 1 1 3  12 23 o 2.526000  0.5845000     2.746000  0.8308000     2.306000  0.8222000     0.4404000      1.169000  
1 1 1 3  12 24 o 3.218000  0.5094000     2.519000  0.8090000     3.918000  0.6192000     -1.399000      1.019000  
1 1 1 3  12 25 o 1.252000  0.4344000     1.317000  0.6376000     1.186000  0.5902000     0.1314000      0.8688000 
1 1 1 3  12 26 o 1.488000  0.4887000     1.583000  0.7167000     1.394000  0.6645000     0.1892000      0.9774000 
1 1 1 3  12 27 o 1.345000  0.4482000     1.258000  0.6131000     1.431000  0.6540000     -0.1722000     0.8964000 
1 1 1 3  13 0  o 12.85000  0.2413000     12.85000  0.2413000     12.85000  0.2413000     0.000000       0.000000  
1 1 1 3  13 1  o 16.86000  0.2050000     16.74000  0.2883000     16.98000  0.2916000     -0.2361000     0.4100000 
1 1 1 3  13 2  o 9.825000  0.1057000     9.861000  0.1496000     9.790000  0.1493000     0.7072000E-01  0.2114000 
1 1 1 3  13 3  o 15.71000  0.1396000     15.70000  0.1974000     15.72000  0.1975000     -0.2211000E-01 0.2792000 
1 1 1 3  13 4  o 12.42000  0.1225000     12.31000  0.1721000     12.53000  0.1744000     -0.2237000     0.2450000 
1 1 1 3  13 5  o 8.475000  0.1091000     8.472000  0.1546000     8.479000  0.1540000     -0.7429000E-02 0.2182000 
1 1 1 3  13 6  o 30.81000  0.2474000     30.93000  0.3512000     30.69000  0.3484000     0.2481000      0.4947000 
1 1 1 3  13 7  o 2.607000  0.1970000     2.393000  0.3060000     2.821000  0.2482000     -0.4276000     0.3940000 
1 1 1 3  13 8  o 4.607000  0.1406000     4.674000  0.1987000     4.540000  0.1991000     0.1336000      0.2813000 
1 1 1 3  13 9  o 21.69000  0.3350000     22.16000  0.3870000     21.22000  0.5469000     0.9426000      0.6699000 
1 1 1 3  13 10 o 9.147000  0.1492000     9.113000  0.2120000     9.181000  0.2099000     -0.6759000E-01 0.2983000 
1 1 1 3  13 11 o 11.69000  0.1595000     11.57000  0.2251000     11.80000  0.2260000     -0.2396000     0.3189000 
1 1 1 3  13 12 o 7.059000  0.1852000     7.230000  0.2601000     6.887000  0.2636000     0.3434000      0.3704000 
1 1 1 3  13 13 o 5.058000  0.2447000     5.201000  0.3325000     4.915000  0.3591000     0.2865000      0.4894000 
1 1 1 3  13 14 o 4.240000  0.4091000     4.703000  0.5230000     3.778000  0.6292000     0.9247000      0.8182000 
1 1 1 3  13 15 o 19.95000  0.2595000     19.98000  0.3640000     19.91000  0.3698000     0.7221000E-01  0.5189000 
1 1 1 3  13 16 o 8.899000  0.2708000     8.661000  0.3900000     9.137000  0.3758000     -0.4755000     0.5416000 
1 1 1 3  13 17 o 8.734000  0.2866000     9.343000  0.3809000     8.125000  0.4284000     1.218000       0.5732000 
1 1 1 3  13 18 o 3.402000  0.5832000     2.212000  0.9031000     4.591000  0.7383000     -2.379000      1.166000  
1 1 1 3  13 19 o 5.822000  0.4627000     6.186000  0.6284000     5.458000  0.6794000     0.7281000      0.9255000 
1 1 1 3  13 20 o 5.432000  0.6535000     5.740000  0.9989000     5.124000  0.8430000     0.6158000      1.307000  
1 1 1 3  13 21 o 3.130000  0.6424000     3.988000  0.8920000     2.272000  0.9247000     1.715000       1.285000  
1 1 1 3  13 22 o 2.555000  0.6428000     2.713000  0.9189000     2.396000  0.8992000     0.3174000      1.286000  
1 1 1 3  13 23 o 2.506000  0.5568000     1.917000  0.7918000     3.094000  0.7830000     -1.178000      1.114000  
1 1 1 3  13 24 o 1.255000  0.4259000     1.381000  0.6448000     1.129000  0.5567000     0.2524000      0.8519000 
1 1 1 3  13 25 o 1.598000  0.5191000     1.422000  0.6781000     1.774000  0.7861000     -0.3513000     1.038000  
1 1 1 3  13 26 o 1.485000  0.4913000     1.411000  0.6654000     1.558000  0.7230000     -0.1465000     0.9826000 
1 1 1 3  13 27 o 1.514000  0.4856000     1.779000  0.7628000     1.249000  0.6010000     0.5296000      0.9712000 
1 1 1 3  14 0  o 4.547000  0.1523000     4.547000  0.1523000     4.547000  0.1523000     0.000000       0.000000  
1 1 1 3  14 1  o 14.35000  0.1307000     14.43000  0.1856000     14.28000  0.1840000     0.1533000      0.2613000 
1 1 1 3  14 2  o 12.07000  0.1184000     12.08000  0.1674000     12.06000  0.1675000     0.1472000E-01  0.2369000 
1 1 1 3  14 3  o 14.38000  0.1327000     14.31000  0.1871000     14.45000  0.1884000     -0.1354000     0.2655000 
1 1 1 3  14 4  o 9.139000  0.1096000     9.108000  0.1545000     9.170000  0.1555000     -0.6219000E-01 0.2192000 
1 1 1 3  14 5  o 11.47000  0.1207000     11.48000  0.1709000     11.47000  0.1706000     0.1626000E-01  0.2415000 
1 1 1 3  14 6  o 19.98000  0.1729000     19.58000  0.2409000     20.39000  0.2481000     -0.8173000     0.3458000 
1 1 1 3  14 7  o 29.69000  0.2420000     29.89000  0.3442000     29.48000  0.3403000     0.4045000      0.4841000 
1 1 1 3  14 8  o 11.01000  0.1511000     10.99000  0.2222000     11.03000  0.2049000     -0.4406000E-01 0.3022000 
1 1 1 3  14 9  o 5.928000  0.1681000     6.338000  0.2680000     5.518000  0.2031000     0.8195000      0.3363000 
1 1 1 3  14 10 o 3.868000  0.2289000     4.362000  0.2830000     3.374000  0.3599000     0.9880000      0.4578000 
1 1 1 3  14 11 o 11.50000  0.1894000     11.89000  0.2997000     11.11000  0.2317000     0.7815000      0.3788000 
1 1 1 3  14 12 o 6.340000  0.1934000     6.217000  0.2756000     6.463000  0.2715000     -0.2463000     0.3869000 
1 1 1 3  14 13 o 17.39000  0.1909000     17.48000  0.2710000     17.30000  0.2690000     0.1750000      0.3819000 
1 1 1 3  14 14 o 15.99000  0.2173000     15.94000  0.3073000     16.05000  0.3074000     -0.1042000     0.4347000 
1 1 1 3  14 15 o 7.705000  0.2222000     7.881000  0.2987000     7.529000  0.3290000     0.3522000      0.4444000 
1 1 1 3  14 16 o 7.101000  0.3175000     6.928000  0.4507000     7.274000  0.4474000     -0.3458000     0.6350000 
1 1 1 3  14 17 o 10.20000  0.2617000     10.19000  0.3699000     10.21000  0.3702000     -0.2190000E-01 0.5234000 
1 1 1 3  14 18 o 7.005000  0.3658000     7.049000  0.5156000     6.961000  0.5190000     0.8852000E-01  0.7316000 
1 1 1 3  14 19 o 2.438000  0.6851000     2.598000  0.9907000     2.278000  0.9466000     0.3201000      1.370000  
1 1 1 3  14 20 o 2.796000  0.7521000     2.726000  1.082000      2.867000  1.044000      -0.1408000     1.504000  
1 1 1 3  14 21 o 4.226000  0.5684000     3.890000  0.8688000     4.562000  0.7332000     -0.6717000     1.137000  
1 1 1 3  14 22 o 1.715000  0.5434000     2.010000  0.8455000     1.420000  0.6829000     0.5899000      1.087000  
1 1 1 3  14 23 o 2.140000  0.5544000     2.515000  0.8164000     1.764000  0.7503000     0.7511000      1.109000  
1 1 1 3  14 24 o 1.491000  0.4843000     1.542000  0.7061000     1.440000  0.6630000     0.1022000      0.9686000 
1 1 1 3  14 25 o 1.444000  0.4831000     1.300000  0.6285000     1.588000  0.7338000     -0.2890000     0.9662000 
1 1 1 3  14 26 o 2.153000  0.5908000     2.293000  0.8341000     2.013000  0.8370000     0.2806000      1.182000  
1 1 1 3  14 27 o 1.582000  0.5039000     1.682000  0.7487000     1.483000  0.6746000     0.1986000      1.008000  
1 1 1 3  15 0  o 0.8195000 0.4417000     0.8195000 0.4417000     0.8195000 0.4417000     -0.000000      0.000000  
1 1 1 3  15 1  o 5.849000  0.1033000     5.947000  0.1466000     5.750000  0.1456000     0.1971000      0.2066000 
1 1 1 3  15 2  o 17.48000  0.1520000     17.70000  0.2170000     17.26000  0.2129000     0.4460000      0.3040000 
1 1 1 3  15 3  o 10.99000  0.1161000     11.13000  0.1653000     10.85000  0.1631000     0.2759000      0.2322000 
1 1 1 3  15 4  o 4.836000  0.1188000     4.812000  0.1689000     4.861000  0.1670000     -0.4885000E-01 0.2375000 
1 1 1 3  15 5  o 11.11000  0.1205000     11.31000  0.1719000     10.90000  0.1689000     0.4045000      0.2409000 
1 1 1 3  15 6  o 10.43000  0.1220000     10.63000  0.1740000     10.23000  0.1711000     0.4011000      0.2440000 
1 1 1 3  15 7  o 12.96000  0.1361000     12.98000  0.1925000     12.93000  0.1924000     0.4584000E-01  0.2721000 
1 1 1 3  15 8  o 10.15000  0.1624000     10.62000  0.2580000     9.685000  0.1973000     0.9346000      0.3248000 
1 1 1 3  15 9  o 7.599000  0.1497000     7.795000  0.2328000     7.403000  0.1882000     0.3921000      0.2994000 
1 1 1 3  15 10 o 8.879000  0.1653000     8.851000  0.2459000     8.908000  0.2210000     -0.5704000E-01 0.3306000 
1 1 1 3  15 11 o 2.908000  0.3350000     2.848000  0.4793000     2.968000  0.4682000     -0.1200000     0.6700000 
1 1 1 3  15 12 o 6.166000  0.2017000     5.983000  0.2941000     6.349000  0.2762000     -0.3665000     0.4035000 
1 1 1 3  15 13 o 8.047000  0.1898000     8.243000  0.2707000     7.850000  0.2661000     0.3926000      0.3796000 
1 1 1 3  15 14 o 7.098000  0.3383000     7.098000  0.3383000     ?         ?             ?              ?         
1 1 1 3  15 15 o 6.952000  0.2543000     6.450000  0.3731000     7.454000  0.3455000     -1.004000      0.5085000 
1 1 1 3  15 16 f 3.486000  0.4648000     4.174000  0.5473000     2.797000  0.7513000     1.377000       0.9295000 
1 1 1 3  15 17 o 7.718000  0.3198000     8.399000  0.3212000     7.038000  0.5530000     1.361000       0.6395000 
1 1 1 3  15 18 o 2.778000  0.6653000     3.170000  0.9463000     2.386000  0.9354000     0.7848000      1.331000  
1 1 1 3  15 19 o 5.198000  0.5841000     5.719000  0.8234000     4.678000  0.8287000     1.042000       1.168000  
1 1 1 3  15 20 o 4.999000  0.6235000     5.121000  0.8834000     4.876000  0.8800000     0.2457000      1.247000  
1 1 1 3  15 21 o 1.861000  0.5829000     1.933000  0.8421000     1.789000  0.8062000     0.1440000      1.166000  
1 1 1 3  15 22 o 2.494000  0.6227000     2.034000  0.8533000     2.955000  0.9071000     -0.9210000     1.245000  
1 1 1 3  15 23 o 1.988000  0.5516000     1.907000  0.7707000     2.070000  0.7892000     -0.1630000     1.103000  
1 1 1 3  15 24 o 1.551000  0.4915000     1.876000  0.7779000     1.226000  0.6010000     0.6497000      0.9831000 
1 1 1 3  15 25 o 1.782000  0.5355000     1.419000  0.6562000     2.145000  0.8464000     -0.7261000     1.071000  
1 1 1 3  15 26 o 1.615000  0.5188000     1.602000  0.7221000     1.628000  0.7452000     -0.2559000E-01 1.038000  
1 1 1 3  15 27 o 1.289000  0.4373000     1.499000  0.6931000     1.079000  0.5333000     0.4206000      0.8745000 
1 1 1 3  16 0  o 16.28000  0.2050000     16.28000  0.2050000     16.28000  0.2050000     -0.000000      0.000000  
1 1 1 3  16 1  o 12.42000  0.1226000     12.38000  0.1735000     12.46000  0.1734000     -0.7366000E-01 0.2453000 
1 1 1 3  16 2  o 15.97000  0.1436000     15.75000  0.2015000     16.19000  0.2048000     -0.4346000     0.2873000 
1 1 1 3  16 3  o 2.472000  0.1843000     2.399000  0.2669000     2.546000  0.2542000     -0.1468000     0.3685000 
1 1 1 3  16 4  o 9.201000  0.1131000     9.346000  0.1612000     9.055000  0.1587000     0.2905000      0.2262000 
1 1 1 3  16 5  o 18.02000  0.1603000     18.16000  0.2277000     17.88000  0.2255000     0.2830000      0.3205000 
1 1 1 3  16 6  o 7.636000  0.1204000     7.700000  0.1689000     7.572000  0.1716000     0.1281000      0.2408000 
1 1 1 3  16 7  o 16.36000  0.1655000     16.61000  0.2507000     16.10000  0.2163000     0.5062000      0.3311000 
1 1 1 3  16 8  o 7.122000  0.2612000     7.122000  0.2612000     ?         ?             ?              ?         
1 1 1 3  16 9  o 14.53000  0.1658000     14.32000  0.2129000     14.74000  0.2542000     -0.4209000     0.3316000 
1 1 1 3  16 10 f 7.212000  0.1471000     7.221000  0.2090000     7.202000  0.2071000     0.1846000E-01  0.2943000 
1 1 1 3  16 11 o 1.334000  0.3780000     1.668000  0.5886000     0.9991000 0.4744000     0.6690000      0.7560000 
1 1 1 3  16 12 o 6.730000  0.1974000     6.490000  0.2820000     6.971000  0.2765000     -0.4805000     0.3949000 
1 1 1 3  16 13 o 16.97000  0.1898000     16.67000  0.2679000     17.26000  0.2689000     -0.5961000     0.3796000 
1 1 1 3  16 14 o 24.45000  0.3769000     24.45000  0.3769000     ?         ?             ?              ?         
1 1 1 3  16 15 o 13.42000  0.2020000     13.50000  0.2812000     13.34000  0.2901000     0.1589000      0.4041000 
1 1 1 3  16 16 o 10.37000  0.2317000     10.48000  0.3427000     10.25000  0.3118000     0.2285000      0.4633000 
1 1 1 3  16 17 o 2.799000  0.5364000     3.508000  0.7114000     2.091000  0.8031000     1.416000       1.073000  
1 1 1 3  16 18 o 2.817000  0.5794000     2.234000  0.8490000     3.400000  0.7887000     -1.166000      1.159000  
1 1 1 3  16 19 o 7.897000  0.3854000     7.518000  0.4358000     8.277000  0.6358000     -0.7589000     0.7708000 
1 1 1 3  16 20 o 2.287000  0.6584000     2.675000  0.9967000     1.898000  0.8607000     0.7766000      1.317000  
1 1 1 3  16 21 o 2.909000  0.5571000     1.730000  0.7923000     4.089000  0.7835000     -2.359000      1.114000  
1 1 1 3  16 22 o 3.235000  0.6151000     3.209000  0.8809000     3.262000  0.8588000     -0.5270000E-01 1.230000  
1 1 1 3  16 23 o 1.376000  0.4569000     1.493000  0.6844000     1.259000  0.6056000     0.2342000      0.9138000 
1 1 1 3  16 24 o 2.393000  0.5931000     2.074000  0.8267000     2.712000  0.8508000     -0.6374000     1.186000  
1 1 1 3  16 25 o 1.999000  0.5543000     1.489000  0.6826000     2.508000  0.8737000     -1.019000      1.109000  
1 1 1 3  16 26 o 2.371000  0.5854000     1.916000  0.7849000     2.826000  0.8687000     -0.9097000     1.171000  
1 1 1 3  16 27 o 1.196000  0.4110000     1.064000  0.5331000     1.329000  0.6257000     -0.2650000     0.8221000 
1 1 1 3  17 0  o 8.001000  0.1529000     8.001000  0.1529000     8.001000  0.1529000     -0.000000      0.000000  
1 1 1 3  17 1  o 4.571000  0.1185000     4.669000  0.1666000     4.473000  0.1687000     0.1952000      0.2371000 
1 1 1 3  17 2  o 7.719000  0.1089000     7.694000  0.1540000     7.743000  0.1541000     -0.4948000E-01 0.2178000 
1 1 1 3  17 3  o 2.093000  0.2171000     2.028000  0.3117000     2.158000  0.3022000     -0.1306000     0.4342000 
1 1 1 3  17 4  f 14.78000  0.1396000     14.64000  0.1971000     14.92000  0.1978000     -0.2773000     0.2792000 
1 1 1 3  17 5  f 3.785000  0.1483000     3.812000  0.2061000     3.758000  0.2132000     0.5385000E-01  0.2965000 
1 1 1 3  17 6  o 12.58000  0.1425000     12.58000  0.2134000     12.58000  0.1888000     0.3928000E-02  0.2849000 
1 1 1 3  17 7  o 3.983000  0.1592000     4.189000  0.2201000     3.777000  0.2301000     0.4120000      0.3184000 
1 1 1 3  17 8  o 6.714000  0.2687000     6.705000  0.2629000     6.724000  0.4686000     -0.1883000E-01 0.5373000 
1 1 1 3  17 9  o 14.13000  0.1506000     14.30000  0.2144000     13.96000  0.2115000     0.3375000      0.3011000 
1 1 1 3  17 10 o 6.517000  0.1520000     6.496000  0.2164000     6.538000  0.2135000     -0.4271000E-01 0.3040000 
1 1 1 3  17 11 o 4.990000  0.2056000     5.201000  0.3218000     4.779000  0.2561000     0.4223000      0.4113000 
1 1 1 3  17 12 o 6.264000  0.2074000     6.285000  0.2913000     6.243000  0.2953000     0.4201000E-01  0.4148000 
1 1 1 3  17 13 o 21.87000  0.2133000     21.69000  0.2996000     22.06000  0.3036000     -0.3632000     0.4265000 
1 1 1 3  17 14 o 2.855000  0.7946000     2.096000  0.9510000     3.614000  1.273000      -1.518000      1.589000  
1 1 1 3  17 15 o 6.162000  0.2836000     6.075000  0.3987000     6.250000  0.4034000     -0.1748000     0.5672000 
1 1 1 3  17 16 o 7.139000  0.2643000     6.671000  0.3925000     7.607000  0.3542000     -0.9359000     0.5287000 
1 1 1 3  17 17 o 5.115000  0.3596000     5.501000  0.4794000     4.729000  0.5360000     0.7716000      0.7191000 
1 1 1 3  17 18 o 2.557000  0.5998000     2.109000  0.8462000     3.004000  0.8503000     -0.8951000     1.200000  
1 1 1 3  17 19 f 5.217000  0.6828000     5.217000  0.6828000     ?         ?             ?              ?         
1 1 1 3  17 20 o 2.371000  0.6098000     2.203000  0.8486000     2.540000  0.8758000     -0.3377000     1.220000  
1 1 1 3  17 21 o 1.985000  0.5867000     1.957000  0.7609000     2.014000  0.8932000     -0.5682000E-01 1.173000  
1 1 1 3  17 22 o 2.217000  0.6073000     2.023000  0.8372000     2.410000  0.8798000     -0.3872000     1.215000  
1 1 1 3  17 23 o 1.582000  0.4972000     1.502000  0.6806000     1.662000  0.7249000     -0.1600000     0.9944000 
1 1 1 3  17 24 o 1.667000  0.5493000     1.457000  0.6825000     1.876000  0.8609000     -0.4187000     1.099000  
1 1 1 3  17 25 o 1.930000  0.5593000     1.564000  0.6863000     2.296000  0.8833000     -0.7314000     1.119000  
1 1 1 3  17 26 o 1.280000  0.4375000     1.389000  0.6551000     1.170000  0.5800000     0.2195000      0.8749000 
1 1 1 3  17 27 o 1.301000  0.4457000     1.285000  0.6301000     1.316000  0.6304000     -0.3100000E-01 0.8913000 
1 1 1 3  18 0  o 18.09000  0.2234000     18.09000  0.2234000     18.09000  0.2234000     0.000000       0.000000  
1 1 1 3  18 1  o 8.760000  0.1111000     8.573000  0.1573000     8.946000  0.1569000     -0.3730000     0.2222000 
1 1 1 3  18 2  o 12.82000  0.1276000     12.75000  0.1808000     12.89000  0.1802000     -0.1460000     0.2553000 
1 1 1 3  18 3  o 14.20000  0.1362000     14.28000  0.1931000     14.12000  0.1920000     0.1604000      0.2723000 
1 1 1 3  18 4  f 6.602000  0.1170000     6.710000  0.1642000     6.495000  0.1667000     0.2142000      0.2339000 
1 1 1 3  18 5  o 10.52000  0.1240000     10.61000  0.1760000     10.44000  0.1748000     0.1624000      0.2481000 
1 1 1 3  18 6  o 10.05000  0.1261000     10.03000  0.1779000     10.06000  0.1788000     -0.2699000E-01 0.2523000 
1 1 1 3  18 7  o 12.85000  0.2016000     12.61000  0.2769000     13.09000  0.2931000     -0.4852000     0.4032000 
1 1 1 3  18 8  o 8.328000  0.1340000     8.275000  0.1913000     8.381000  0.1876000     -0.1061000     0.2680000 
1 1 1 3  18 9  o 2.432000  0.2830000     2.652000  0.3569000     2.211000  0.4393000     0.4406000      0.5660000 
1 1 1 3  18 10 o 5.086000  0.1733000     4.981000  0.2447000     5.190000  0.2456000     -0.2090000     0.3467000 
1 1 1 3  18 11 o 6.241000  0.1662000     6.341000  0.2279000     6.141000  0.2419000     0.1991000      0.3324000 
1 1 1 3  18 12 o 14.02000  0.1770000     14.24000  0.2496000     13.81000  0.2511000     0.4243000      0.3540000 
1 1 1 3  18 13 o 12.46000  0.1840000     12.42000  0.2600000     12.50000  0.2604000     -0.8335000E-01 0.3680000 
1 1 1 3  18 14 f 2.512000  0.6012000     2.460000  0.9510000     2.564000  0.7359000     -0.1043000     1.202000  
1 1 1 3  18 15 o 2.027000  0.5421000     2.202000  0.7738000     1.853000  0.7594000     0.3491000      1.084000  
1 1 1 3  18 16 o 3.651000  0.4545000     4.003000  0.5755000     3.300000  0.7036000     0.7036000      0.9090000 
1 1 1 3  18 17 o 4.236000  0.4456000     3.742000  0.6976000     4.730000  0.5547000     -0.9885000     0.8912000 
1 1 1 3  18 18 o 2.104000  0.5971000     1.983000  0.8173000     2.225000  0.8706000     -0.2427000     1.194000  
1 1 1 3  18 19 o 2.696000  0.9460000     2.696000  0.9460000     ?         ?             ?              ?         
1 1 1 3  18 20 o 3.608000  0.5504000     3.385000  0.7785000     3.830000  0.7782000     -0.4458000     1.101000  
1 1 1 3  18 21 o 1.971000  0.5490000     2.340000  0.8354000     1.601000  0.7124000     0.7394000      1.098000  
1 1 1 3  18 22 o 2.108000  0.5580000     2.221000  0.7942000     1.995000  0.7840000     0.2255000      1.116000  
1 1 1 3  18 23 o 1.539000  0.4696000     1.593000  0.6720000     1.484000  0.6561000     0.1086000      0.9392000 
1 1 1 3  18 24 o 1.567000  0.5142000     1.584000  0.6973000     1.549000  0.7559000     0.3478000E-01  1.028000  
1 1 1 3  18 25 o 1.447000  0.4775000     1.219000  0.5868000     1.674000  0.7535000     -0.4548000     0.9550000 
1 1 1 3  18 26 f 1.455000  0.4823000     1.138000  0.5616000     1.773000  0.7843000     -0.6349000     0.9646000 
1 1 1 3  18 27 o 1.352000  0.6780000     1.352000  0.6780000     ?         ?             ?              ?         
1 1 1 3  19 0  o 1.017000  0.5028000     1.017000  0.5028000     1.017000  0.5028000     0.000000       0.000000  
1 1 1 3  19 1  o 12.33000  0.1368000     12.26000  0.2075000     12.41000  0.1784000     -0.1466000     0.2737000 
1 1 1 3  19 2  o 11.38000  0.1224000     11.52000  0.1740000     11.23000  0.1721000     0.2882000      0.2447000 
1 1 1 3  19 3  o 15.64000  0.1455000     15.77000  0.2070000     15.51000  0.2045000     0.2611000      0.2910000 
1 1 1 3  19 4  o 14.08000  0.1389000     14.03000  0.1966000     14.13000  0.1964000     -0.1018000     0.2779000 
1 1 1 3  19 5  o 8.057000  0.1222000     8.177000  0.1731000     7.936000  0.1725000     0.2414000      0.2444000 
1 1 1 3  19 6  o 30.58000  0.2711000     29.86000  0.3452000     31.31000  0.4182000     -1.446000      0.5423000 
1 1 1 3  19 7  o 4.841000  0.3071000     4.841000  0.3071000     ?         ?             ?              ?         
1 1 1 3  19 8  o 4.531000  0.1624000     4.538000  0.2290000     4.524000  0.2304000     0.1387000E-01  0.3249000 
1 1 1 3  19 9  f 6.616000  0.1505000     6.728000  0.2142000     6.504000  0.2114000     0.2241000      0.3010000 
1 1 1 3  19 10 o 14.10000  0.1558000     14.24000  0.2211000     13.97000  0.2196000     0.2680000      0.3116000 
1 1 1 3  19 11 o 22.52000  0.2041000     22.20000  0.2859000     22.84000  0.2915000     -0.6352000     0.4083000 
1 1 1 3  19 12 o 2.722000  0.3712000     3.157000  0.5339000     2.288000  0.5160000     0.8691000      0.7425000 
1 1 1 3  19 13 o 2.432000  0.4937000     2.653000  0.6804000     2.212000  0.7155000     0.4411000      0.9873000 
1 1 1 3  19 14 o 6.529000  0.2565000     6.316000  0.3709000     6.742000  0.3546000     -0.4257000     0.5131000 
1 1 1 3  19 15 o 9.353000  0.2270000     10.06000  0.3062000     8.646000  0.3351000     1.414000       0.4539000 
1 1 1 3  19 16 o 2.945000  0.5439000     3.062000  0.7538000     2.829000  0.7843000     0.2333000      1.088000  
1 1 1 3  19 17 o 4.425000  0.4837000     3.291000  0.8223000     5.559000  0.5096000     -2.268000      0.9674000 
1 1 1 3  19 18 o 3.354000  0.6007000     3.221000  0.8742000     3.487000  0.8241000     -0.2657000     1.201000  
1 1 1 3  19 19 o 3.854000  0.9688000     4.722000  1.408000      2.986000  1.332000      1.735000       1.938000  
1 1 1 3  19 20 o 4.749000  0.4284000     5.074000  0.5753000     4.424000  0.6350000     0.6503000      0.8569000 
1 1 1 3  19 21 o 1.633000  0.5099000     1.838000  0.7715000     1.429000  0.6668000     0.4091000      1.020000  
1 1 1 3  19 22 o 1.533000  0.4898000     1.567000  0.7029000     1.500000  0.6824000     0.6690000E-01  0.9796000 
1 1 1 3  19 23 o 2.447000  0.4753000     1.531000  0.6734000     3.362000  0.6711000     -1.831000      0.9507000 
1 1 1 3  19 24 o 2.381000  0.7334000     2.020000  0.9489000     2.741000  1.119000      -0.7208000     1.467000  
1 1 1 3  19 25 o 1.665000  0.4877000     1.437000  0.6450000     1.893000  0.7317000     -0.4567000     0.9754000 
1 1 1 3  19 26 o 2.131000  0.5441000     2.105000  0.7849000     2.158000  0.7538000     -0.5284000E-01 1.088000  
1 1 1 3  20 0  o 1.823000  0.4160000     1.823000  0.4160000     1.823000  0.4160000     -0.000000      0.000000  
1 1 1 3  20 1  o 4.113000  0.1400000     4.079000  0.1976000     4.148000  0.1984000     -0.6959000E-01 0.2800000 
1 1 1 3  20 2  o 26.35000  0.2165000     26.60000  0.3085000     26.10000  0.3039000     0.5045000      0.4331000 
1 1 1 3  20 3  f 5.561000  0.1265000     5.567000  0.1779000     5.554000  0.1798000     0.1239000E-01  0.2529000 
1 1 1 3  20 4  o 7.528000  0.1214000     7.478000  0.1716000     7.577000  0.1718000     -0.9844000E-01 0.2428000 
1 1 1 3  20 5  o 11.31000  0.1283000     11.26000  0.1813000     11.35000  0.1817000     -0.9004000E-01 0.2567000 
1 1 1 3  20 6  o 2.970000  0.2966000     2.950000  0.4015000     2.991000  0.4366000     -0.4084000E-01 0.5932000 
1 1 1 3  20 7  o 3.820000  0.2113000     3.860000  0.3409000     3.780000  0.2498000     0.8000000E-01  0.4226000 
1 1 1 3  20 8  o 12.13000  0.1432000     12.24000  0.2029000     12.03000  0.2021000     0.2064000      0.2864000 
1 1 1 3  20 9  o 4.239000  0.1870000     4.196000  0.2656000     4.282000  0.2634000     -0.8664000E-01 0.3741000 
1 1 1 3  20 10 o 5.956000  0.1647000     5.959000  0.2349000     5.953000  0.2309000     0.6035000E-02  0.3294000 
1 1 1 3  20 11 o 9.381000  0.1536000     9.256000  0.2178000     9.505000  0.2167000     -0.2485000     0.3073000 
1 1 1 3  20 12 o 13.36000  0.1655000     13.07000  0.2341000     13.66000  0.2340000     -0.5905000     0.3310000 
1 1 1 3  20 13 o 7.847000  0.3547000     7.847000  0.3547000     ?         ?             ?              ?         
1 1 1 3  20 14 o 10.56000  0.2045000     10.57000  0.2851000     10.55000  0.2933000     0.1305000E-01  0.4091000 
1 1 1 3  20 15 o 2.352000  0.5517000     2.105000  0.7774000     2.600000  0.7830000     -0.4957000     1.103000  
1 1 1 3  20 16 o 7.005000  0.2720000     6.970000  0.3860000     7.039000  0.3832000     -0.6847000E-01 0.5440000 
1 1 1 3  20 17 o 8.044000  0.2819000     7.914000  0.3986000     8.173000  0.3987000     -0.2595000     0.5638000 
1 1 1 3  20 18 o 2.500000  0.6214000     3.042000  0.9162000     1.958000  0.8397000     1.084000       1.243000  
1 1 1 3  20 19 o 6.170000  0.6768000     6.047000  1.253000      6.293000  0.5113000     -0.2465000     1.354000  
1 1 1 3  20 20 o 2.870000  0.5757000     3.414000  0.7698000     2.326000  0.8563000     1.088000       1.151000  
1 1 1 3  20 21 o 2.198000  0.5573000     1.743000  0.7391000     2.653000  0.8343000     -0.9104000     1.115000  
1 1 1 3  20 22 o 2.320000  0.5636000     2.475000  0.8051000     2.165000  0.7889000     0.3102000      1.127000  
1 1 1 3  20 23 o 1.756000  0.4934000     1.399000  0.6349000     2.113000  0.7553000     -0.7138000     0.9867000 
1 1 1 3  20 24 o 2.786000  0.6110000     2.292000  1.017000      3.281000  0.6768000     -0.9891000     1.222000  
1 1 1 3  20 25 o 1.410000  0.4373000     1.821000  0.7219000     0.9986000 0.4939000     0.8225000      0.8747000 
1 1 1 3  20 26 o 1.129000  0.3874000     1.238000  0.5887000     1.020000  0.5037000     0.2182000      0.7748000 
1 1 1 3  21 0  o 8.739000  0.1671000     8.739000  0.1671000     8.739000  0.1671000     0.000000       0.000000  
1 1 1 3  21 1  o 12.59000  0.1312000     12.77000  0.1870000     12.41000  0.1840000     0.3651000      0.2623000 
1 1 1 3  21 2  o 3.345000  0.1684000     3.618000  0.2221000     3.073000  0.2533000     0.5451000      0.3369000 
1 1 1 3  21 3  o 7.313000  0.1203000     7.263000  0.1705000     7.362000  0.1699000     -0.9854000E-01 0.2407000 
1 1 1 3  21 4  o 3.931000  0.1570000     4.088000  0.2184000     3.774000  0.2257000     0.3138000      0.3141000 
1 1 1 3  21 5  o 8.296000  0.1535000     8.396000  0.2509000     8.196000  0.1769000     0.1996000      0.3070000 
1 1 1 3  21 6  o 1.100000  0.4887000     1.100000  0.4887000     ?         ?             ?              ?         
1 1 1 3  21 7  o 13.81000  0.1479000     13.94000  0.2092000     13.69000  0.2090000     0.2511000      0.2957000 
1 1 1 3  21 8  o 4.474000  0.1774000     4.203000  0.2567000     4.744000  0.2450000     -0.5414000     0.3549000 
1 1 1 3  21 9  o 9.599000  0.1439000     9.656000  0.2029000     9.543000  0.2042000     0.1132000      0.2879000 
1 1 1 3  21 10 o 8.650000  0.1529000     8.537000  0.2176000     8.764000  0.2148000     -0.2268000     0.3058000 
1 1 1 3  21 11 f 8.604000  0.1592000     8.403000  0.2250000     8.805000  0.2253000     -0.4012000     0.3184000 
1 1 1 3  21 12 o 3.003000  0.3307000     2.919000  0.4786000     3.086000  0.4565000     -0.1664000     0.6614000 
1 1 1 3  21 13 o 14.73000  0.4203000     14.03000  0.5681000     15.43000  0.6197000     -1.402000      0.8406000 
1 1 1 3  21 14 o 7.898000  0.2330000     8.308000  0.3101000     7.487000  0.3477000     0.8206000      0.4659000 
1 1 1 3  21 15 o 5.373000  0.3237000     5.147000  0.4640000     5.599000  0.4514000     -0.4518000     0.6473000 
1 1 1 3  21 16 o 7.044000  0.2709000     6.792000  0.3883000     7.297000  0.3777000     -0.5050000     0.5417000 
1 1 1 3  21 17 o 6.519000  0.3296000     6.345000  0.4640000     6.694000  0.4682000     -0.3487000     0.6592000 
1 1 1 3  21 18 o 4.498000  0.5402000     4.727000  0.7579000     4.268000  0.7699000     0.4592000      1.080000  
1 1 1 3  21 19 o 3.042000  0.7328000     2.914000  1.177000      3.170000  0.8737000     -0.2560000     1.466000  
1 1 1 3  21 20 o 3.487000  0.5213000     2.411000  0.8560000     4.562000  0.5953000     -2.150000      1.043000  
1 1 1 3  21 21 o 5.514000  0.3485000     5.186000  0.5220000     5.842000  0.4620000     -0.6565000     0.6971000 
1 1 1 3  21 22 o 3.641000  0.4659000     3.355000  0.7195000     3.928000  0.5922000     -0.5732000     0.9318000 
1 1 1 3  21 23 o 1.804000  0.5054000     1.550000  0.6757000     2.057000  0.7518000     -0.5063000     1.011000  
1 1 1 3  21 24 o 1.359000  0.4555000     1.299000  0.6459000     1.419000  0.6425000     -0.1205000     0.9110000 
1 1 1 3  21 25 o 1.792000  0.5088000     1.784000  0.7165000     1.799000  0.7227000     -0.1442000E-01 1.018000  
1 1 1 3  21 26 o 1.572000  0.4865000     1.726000  0.7354000     1.417000  0.6370000     0.3086000      0.9730000 
1 1 1 3  22 0  o 1.973000  0.4074000     1.973000  0.4074000     1.973000  0.4074000     -0.000000      0.000000  
1 1 1 3  22 1  o 2.363000  0.2217000     2.311000  0.3218000     2.416000  0.3049000     -0.1048000     0.4433000 
1 1 1 3  22 2  o 10.86000  0.1260000     10.88000  0.1787000     10.84000  0.1777000     0.4461000E-01  0.2520000 
1 1 1 3  22 3  o 4.348000  0.1461000     4.222000  0.2088000     4.474000  0.2046000     -0.2523000     0.2923000 
1 1 1 3  22 4  o 11.92000  0.1325000     11.89000  0.1877000     11.96000  0.1872000     -0.6862000E-01 0.2651000 
1 1 1 3  22 5  o 11.94000  0.2764000     11.94000  0.2764000     ?         ?             ?              ?         
1 1 1 3  22 6  o 7.402000  0.1362000     7.344000  0.1950000     7.460000  0.1903000     -0.1153000     0.2725000 
1 1 1 3  22 7  o 7.253000  0.1387000     7.243000  0.1951000     7.263000  0.1972000     -0.2055000E-01 0.2774000 
1 1 1 3  22 8  o 7.071000  0.1469000     7.121000  0.2069000     7.021000  0.2085000     0.1002000      0.2937000 
1 1 1 3  22 9  o 7.227000  0.1519000     7.171000  0.2146000     7.283000  0.2149000     -0.1125000     0.3037000 
1 1 1 3  22 10 o 1.021000  0.3302000     1.024000  0.4677000     1.019000  0.4663000     0.4448000E-02  0.6604000 
1 1 1 3  22 11 o 2.129000  0.4013000     2.365000  0.5437000     1.892000  0.5905000     0.4731000      0.8027000 
1 1 1 3  22 12 o 10.82000  0.2025000     10.61000  0.3314000     11.03000  0.2329000     -0.4241000     0.4051000 
1 1 1 3  22 13 o 6.820000  0.2396000     7.176000  0.3821000     6.465000  0.2891000     0.7110000      0.4791000 
1 1 1 3  22 14 o 13.40000  0.2009000     13.25000  0.2808000     13.56000  0.2873000     -0.3053000     0.4018000 
1 1 1 3  22 15 o 5.781000  0.2945000     5.537000  0.4194000     6.025000  0.4135000     -0.4885000     0.5890000 
1 1 1 3  22 16 o 5.374000  0.3418000     5.242000  0.4787000     5.505000  0.4880000     -0.2628000     0.6836000 
1 1 1 3  22 17 o 12.29000  0.2385000     12.42000  0.3348000     12.17000  0.3397000     0.2535000      0.4770000 
1 1 1 3  22 18 o 8.530000  0.3227000     8.765000  0.4597000     8.295000  0.4529000     0.4701000      0.6453000 
1 1 1 3  22 19 o 2.133000  0.6300000     2.233000  0.8627000     2.034000  0.9184000     0.1995000      1.260000  
1 1 1 3  22 20 o 2.979000  0.5737000     2.526000  0.8448000     3.432000  0.7765000     -0.9057000     1.147000  
1 1 1 3  22 21 o 2.236000  0.5361000     2.832000  0.7896000     1.639000  0.7253000     1.193000       1.072000  
1 1 1 3  22 22 o 1.570000  0.4945000     1.529000  0.6911000     1.610000  0.7076000     -0.8091000E-01 0.9891000 
1 1 1 3  22 23 o 1.511000  0.4768000     1.656000  0.7147000     1.366000  0.6313000     0.2898000      0.9536000 
1 1 1 3  22 24 o 2.936000  0.5040000     2.576000  0.7740000     3.295000  0.6458000     -0.7190000     1.008000  
1 1 1 3  22 25 o 2.013000  0.5195000     1.913000  0.7350000     2.112000  0.7345000     -0.1991000     1.039000  
1 1 1 3  22 26 o 1.501000  0.4676000     0.9001000 0.4558000     2.103000  0.8167000     -1.202000      0.9353000 
1 1 1 3  23 0  o 6.625000  0.1752000     6.625000  0.1752000     6.625000  0.1752000     0.000000       0.000000  
1 1 1 3  23 1  o 9.808000  0.1239000     9.867000  0.1752000     9.750000  0.1753000     0.1170000      0.2478000 
1 1 1 3  23 2  o 13.18000  0.1365000     13.13000  0.1931000     13.23000  0.1930000     -0.1080000     0.2730000 
1 1 1 3  23 3  o 4.350000  0.1523000     4.190000  0.2216000     4.511000  0.2090000     -0.3215000     0.3046000 
1 1 1 3  23 4  o 8.754000  0.2568000     8.754000  0.2568000     ?         ?             ?              ?         
1 1 1 3  23 5  o 14.93000  0.2282000     14.46000  0.4018000     15.40000  0.2163000     -0.9377000     0.4563000 
1 1 1 3  23 6  o 11.99000  0.1392000     11.73000  0.1954000     12.24000  0.1984000     -0.5036000     0.2785000 
1 1 1 3  23 7  o 7.425000  0.1407000     7.407000  0.1991000     7.442000  0.1990000     -0.3492000E-01 0.2814000 
1 1 1 3  23 8  o 7.815000  0.1453000     7.988000  0.2043000     7.643000  0.2067000     0.3456000      0.2906000 
1 1 1 3  23 9  o 2.530000  0.3260000     2.108000  0.5151000     2.951000  0.3996000     -0.8433000     0.6519000 
1 1 1 3  23 10 o 15.10000  0.1645000     15.29000  0.2331000     14.92000  0.2321000     0.3666000      0.3290000 
1 1 1 3  23 11 o 10.61000  0.1609000     10.66000  0.2267000     10.56000  0.2283000     0.9926000E-01  0.3217000 
1 1 1 3  23 12 o 4.157000  0.5132000     4.157000  0.5132000     ?         ?             ?              ?         
1 1 1 3  23 13 o 7.722000  0.1926000     7.667000  0.2748000     7.777000  0.2700000     -0.1096000     0.3852000 
1 1 1 3  23 14 o 8.270000  0.2290000     7.858000  0.3567000     8.682000  0.2873000     -0.8236000     0.4579000 
1 1 1 3  23 15 o 2.666000  0.5075000     3.216000  0.6726000     2.117000  0.7602000     1.099000       1.015000  
1 1 1 3  23 16 o 6.998000  0.2893000     7.450000  0.3831000     6.545000  0.4336000     0.9057000      0.5786000 
1 1 1 3  23 17 o 8.386000  0.2828000     8.141000  0.3937000     8.632000  0.4062000     -0.4908000     0.5657000 
1 1 1 3  23 18 o 3.580000  0.9526000     3.580000  0.9526000     ?         ?             ?              ?         
1 1 1 3  23 19 o 6.025000  0.3594000     6.214000  0.4859000     5.836000  0.5296000     0.3783000      0.7187000 
1 1 1 3  23 20 o 1.964000  0.5612000     2.226000  0.8325000     1.701000  0.7529000     0.5249000      1.122000  
1 1 1 3  23 21 o 1.561000  0.4920000     1.848000  0.7706000     1.274000  0.6119000     0.5732000      0.9841000 
1 1 1 3  23 22 o 1.505000  0.4769000     1.291000  0.6169000     1.718000  0.7275000     -0.4269000     0.9538000 
1 1 1 3  23 23 o 6.509000  0.3205000     6.827000  0.4207000     6.191000  0.4836000     0.6368000      0.6410000 
1 1 1 3  23 24 o 1.717000  0.5017000     1.698000  0.7027000     1.736000  0.7164000     -0.3796000E-01 1.003000  
1 1 1 3  23 25 o 1.385000  0.4344000     1.092000  0.5300000     1.678000  0.6883000     -0.5852000     0.8688000 
1 1 1 3  23 26 o 1.320000  0.4334000     1.220000  0.5849000     1.421000  0.6398000     -0.2011000     0.8668000 
1 1 1 3  24 0  o 3.124000  0.2668000     3.124000  0.2668000     3.124000  0.2668000     -0.000000      0.000000  
1 1 1 3  24 1  o 4.436000  0.1489000     4.304000  0.2138000     4.567000  0.2073000     -0.2628000     0.2978000 
1 1 1 3  24 2  o 3.933000  0.2328000     3.606000  0.3519000     4.260000  0.3049000     -0.6540000     0.4656000 
1 1 1 3  24 3  o 11.96000  0.3740000     11.96000  0.3740000     ?         ?             ?              ?         
1 1 1 3  24 4  o 6.069000  0.1747000     6.054000  0.2703000     6.084000  0.2213000     -0.2970000E-01 0.3493000 
1 1 1 3  24 5  o 7.558000  0.1337000     7.536000  0.1887000     7.581000  0.1896000     -0.4434000E-01 0.2675000 
1 1 1 3  24 6  o 1.823000  0.3334000     1.980000  0.4482000     1.666000  0.4938000     0.3137000      0.6669000 
1 1 1 3  24 7  o 10.60000  0.1556000     10.47000  0.2006000     10.73000  0.2380000     -0.2656000     0.3113000 
1 1 1 3  24 8  f 6.468000  0.1563000     6.345000  0.2246000     6.591000  0.2175000     -0.2455000     0.3127000 
1 1 1 3  24 9  o 12.72000  0.1543000     12.82000  0.2184000     12.63000  0.2180000     0.1819000      0.3086000 
1 1 1 3  24 10 f 13.67000  0.1615000     13.50000  0.2274000     13.84000  0.2293000     -0.3422000     0.3229000 
1 1 1 3  24 11 o 8.002000  0.1665000     8.169000  0.2340000     7.836000  0.2368000     0.3331000      0.3329000 
1 1 1 3  24 12 o 7.879000  0.3728000     7.879000  0.3728000     ?         ?             ?              ?         
1 1 1 3  24 13 o 11.65000  0.1781000     11.78000  0.2533000     11.52000  0.2505000     0.2582000      0.3562000 
1 1 1 3  24 14 o 9.871000  0.1873000     10.30000  0.2626000     9.440000  0.2671000     0.8632000      0.3745000 
1 1 1 3  24 15 o 12.10000  0.2071000     12.19000  0.2890000     12.02000  0.2966000     0.1736000      0.4142000 
1 1 1 3  24 16 o 1.677000  0.5007000     1.112000  0.5515000     2.242000  0.8358000     -1.130000      1.001000  
1 1 1 3  24 17 o 4.825000  0.4400000     4.561000  0.6416000     5.090000  0.6022000     -0.5286000     0.8799000 
1 1 1 3  24 18 o 2.979000  0.9371000     2.519000  1.128000      3.440000  1.497000      -0.9212000     1.874000  
1 1 1 3  24 19 o 5.357000  0.4144000     5.506000  0.5293000     5.209000  0.6379000     0.2968000      0.8289000 
1 1 1 3  24 20 o 3.567000  0.5355000     3.253000  0.8011000     3.882000  0.7107000     -0.6290000     1.071000  
1 1 1 3  24 21 o 1.931000  0.5424000     2.313000  0.8282000     1.549000  0.7008000     0.7636000      1.085000  
1 1 1 3  24 22 o 2.202000  0.5258000     1.608000  0.7073000     2.796000  0.7782000     -1.188000      1.052000  
1 1 1 3  24 23 o 1.172000  0.5842000     1.172000  0.5842000     ?         ?             ?              ?         
1 1 1 3  24 24 o 2.249000  0.5146000     2.698000  0.7302000     1.801000  0.7254000     0.8968000      1.029000  
1 1 1 3  24 25 o 1.186000  0.4015000     1.154000  0.5549000     1.218000  0.5805000     -0.6438000E-01 0.8030000 
1 1 1 3  24 26 o 1.704000  0.4708000     2.339000  0.7844000     1.068000  0.5209000     1.271000       0.9416000 
1 1 1 3  25 0  o 4.227000  0.5094000     4.227000  0.5094000     4.227000  0.5094000     -0.000000      0.000000  
1 1 1 3  25 2  o 14.04000  0.2512000     14.18000  0.2899000     13.91000  0.4103000     0.2708000      0.5024000 
1 1 1 3  25 3  o 6.169000  0.1661000     6.262000  0.2694000     6.077000  0.1944000     0.1850000      0.3322000 
1 1 1 3  25 4  o 13.14000  0.1421000     13.25000  0.2008000     13.04000  0.2012000     0.2060000      0.2843000 
1 1 1 3  25 5  o 3.710000  0.1916000     3.903000  0.2631000     3.517000  0.2787000     0.3855000      0.3833000 
1 1 1 3  25 6  o 13.24000  0.1480000     13.12000  0.2093000     13.36000  0.2092000     -0.2379000     0.2959000 
1 1 1 3  25 7  o 7.436000  0.1482000     7.358000  0.2095000     7.514000  0.2096000     -0.1557000     0.2963000 
1 1 1 3  25 8  o 5.517000  0.1715000     5.723000  0.2365000     5.311000  0.2484000     0.4120000      0.3430000 
1 1 1 3  25 9  o 11.85000  0.1534000     11.78000  0.2166000     11.91000  0.2172000     -0.1360000     0.3068000 
1 1 1 3  25 10 o 9.951000  0.1646000     9.892000  0.2216000     10.01000  0.2434000     -0.1169000     0.3292000 
1 1 1 3  25 11 o 14.80000  0.2112000     14.87000  0.3466000     14.73000  0.2414000     0.1421000      0.4224000 
1 1 1 3  25 12 o 7.674000  0.2300000     7.799000  0.3786000     7.550000  0.2611000     0.2489000      0.4599000 
1 1 1 3  25 13 o 11.87000  0.1787000     11.94000  0.2549000     11.79000  0.2506000     0.1498000      0.3575000 
1 1 1 3  25 14 o 5.219000  0.2588000     5.527000  0.3450000     4.911000  0.3859000     0.6160000      0.5177000 
1 1 1 3  25 15 o 10.31000  0.2137000     9.805000  0.3403000     10.82000  0.2587000     -1.019000      0.4275000 
1 1 1 3  25 16 o 3.776000  0.4869000     3.616000  0.7011000     3.936000  0.6757000     -0.3198000     0.9737000 
1 1 1 3  25 17 o 2.379000  0.6076000     2.069000  0.8257000     2.689000  0.8915000     -0.6201000     1.215000  
1 1 1 3  25 18 o 1.853000  0.6147000     2.120000  0.9859000     1.585000  0.7345000     0.5344000      1.229000  
1 1 1 3  25 19 o 1.472000  0.4874000     1.338000  0.6465000     1.607000  0.7297000     -0.2697000     0.9749000 
1 1 1 3  25 20 o 1.339000  0.4467000     1.041000  0.5225000     1.637000  0.7247000     -0.5964000     0.8934000 
1 1 1 3  25 21 o 2.677000  0.5639000     2.450000  0.8092000     2.904000  0.7856000     -0.4535000     1.128000  
1 1 1 3  25 22 o 2.627000  0.5236000     3.202000  0.7002000     2.053000  0.7786000     1.149000       1.047000  
1 1 1 3  25 23 o 1.714000  0.5719000     1.676000  0.7649000     1.752000  0.8504000     -0.7599000E-01 1.144000  
1 1 1 3  25 24 o 1.979000  0.5317000     1.891000  0.7377000     2.067000  0.7659000     -0.1761000     1.063000  
1 1 1 3  25 25 o 1.474000  0.4507000     1.079000  0.5277000     1.869000  0.7308000     -0.7902000     0.9014000 
1 1 1 3  26 0  o 32.47000  0.4319000     32.47000  0.4319000     32.47000  0.4319000     -0.000000      0.000000  
1 1 1 3  26 1  o 12.17000  0.1386000     12.40000  0.1991000     11.94000  0.1929000     0.4609000      0.2772000 
1 1 1 3  26 2  o 11.28000  0.1345000     11.13000  0.1902000     11.43000  0.1903000     -0.3042000     0.2690000 
1 1 1 3  26 3  o 19.43000  0.1762000     19.44000  0.2496000     19.41000  0.2489000     0.2722000E-01  0.3525000 
1 1 1 3  26 4  o 5.571000  0.1496000     5.643000  0.2112000     5.499000  0.2119000     0.1438000      0.2992000 
1 1 1 3  26 5  o 4.018000  0.1918000     4.047000  0.2649000     3.990000  0.2774000     0.5708000E-01  0.3836000 
1 1 1 3  26 6  o 1.199000  0.3491000     1.347000  0.5196000     1.050000  0.4664000     0.2967000      0.6982000 
1 1 1 3  26 7  o 9.847000  0.1443000     9.586000  0.2042000     10.11000  0.2039000     -0.5223000     0.2886000 
1 1 1 3  26 8  o 2.796000  0.2942000     2.827000  0.4124000     2.765000  0.4196000     0.6215000E-01  0.5884000 
1 1 1 3  26 9  o 20.76000  0.2254000     21.07000  0.3259000     20.45000  0.3113000     0.6175000      0.4508000 
1 1 1 3  26 10 o 8.684000  0.1626000     8.664000  0.2305000     8.703000  0.2295000     -0.3881000E-01 0.3253000 
1 1 1 3  26 11 o 8.167000  0.3424000     8.167000  0.3424000     ?         ?             ?              ?         
1 1 1 3  26 12 o 11.89000  0.1901000     12.52000  0.2460000     11.27000  0.2899000     1.254000       0.3802000 
1 1 1 3  26 13 o 11.94000  0.1797000     11.70000  0.2556000     12.19000  0.2526000     -0.4876000     0.3594000 
1 1 1 3  26 14 f 8.909000  0.1920000     8.950000  0.2714000     8.868000  0.2717000     0.8231000E-01  0.3841000 
1 1 1 3  26 15 o 5.554000  0.2703000     5.463000  0.3858000     5.645000  0.3788000     -0.1814000     0.5407000 
1 1 1 3  26 16 o 5.342000  0.3747000     5.196000  0.5403000     5.488000  0.5193000     -0.2923000     0.7494000 
1 1 1 3  26 17 o 4.958000  0.4689000     5.552000  0.5868000     4.364000  0.7315000     1.188000       0.9377000 
1 1 1 3  26 18 o 6.244000  0.3459000     6.040000  0.4893000     6.447000  0.4891000     -0.4063000     0.6918000 
1 1 1 3  26 19 o 3.915000  0.5012000     5.113000  0.5196000     2.717000  0.8573000     2.395000       1.002000  
1 1 1 3  26 20 o 2.440000  0.5228000     3.171000  0.7459000     1.710000  0.7327000     1.461000       1.046000  
1 1 1 3  26 21 f 2.182000  0.5311000     2.740000  0.7873000     1.625000  0.7130000     1.114000       1.062000  
1 1 1 3  26 22 o 2.234000  0.5447000     1.979000  0.7558000     2.490000  0.7846000     -0.5115000     1.089000  
1 1 1 3  26 23 o 1.425000  0.4991000     1.619000  0.8037000     1.231000  0.5919000     0.3884000      0.9981000 
1 1 1 3  26 24 o 1.407000  0.4527000     1.296000  0.6089000     1.517000  0.6701000     -0.2212000     0.9055000 
1 1 1 3  26 25 o 1.091000  0.3757000     0.8735000 0.4418000     1.308000  0.6078000     -0.4341000     0.7514000 
1 1 1 3  27 0  o 8.096000  0.1883000     8.096000  0.1883000     8.096000  0.1883000     -0.000000      0.000000  
1 1 1 3  27 1  o 12.69000  0.1412000     12.54000  0.1990000     12.84000  0.2004000     -0.3014000     0.2824000 
1 1 1 3  27 2  o 22.83000  0.1986000     22.45000  0.2780000     23.21000  0.2837000     -0.7631000     0.3972000 
1 1 1 3  27 3  o 15.75000  0.1569000     15.85000  0.2229000     15.65000  0.2209000     0.2027000      0.3139000 
1 1 1 3  27 4  o 14.15000  0.1506000     14.24000  0.2135000     14.07000  0.2123000     0.1734000      0.3011000 
1 1 1 3  27 5  o 12.74000  0.1469000     12.76000  0.2078000     12.72000  0.2077000     0.3895000E-01  0.2938000 
1 1 1 3  27 6  o 20.31000  0.1866000     19.98000  0.2610000     20.65000  0.2668000     -0.6704000     0.3732000 
1 1 1 3  27 7  o 3.369000  0.2396000     3.388000  0.3331000     3.350000  0.3446000     0.3757000E-01  0.4793000 
1 1 1 3  27 8  o 8.203000  0.1533000     8.221000  0.2167000     8.185000  0.2169000     0.3528000E-01  0.3066000 
1 1 1 3  27 9  o 4.146000  0.2267000     4.407000  0.3036000     3.886000  0.3367000     0.5212000      0.4533000 
1 1 1 3  27 10 o 3.637000  0.2747000     3.188000  0.4281000     4.086000  0.3444000     -0.8981000     0.5494000 
1 1 1 3  27 11 o 7.284000  0.3644000     6.718000  0.3756000     7.849000  0.6245000     -1.131000      0.7288000 
1 1 1 3  27 12 o 7.775000  0.1905000     7.736000  0.2744000     7.814000  0.2642000     -0.7812000E-01 0.3809000 
1 1 1 3  27 13 o 2.760000  0.4322000     2.841000  0.6062000     2.680000  0.6161000     0.1609000      0.8643000 
1 1 1 3  27 14 o 2.681000  0.4393000     2.020000  0.6987000     3.342000  0.5326000     -1.322000      0.8785000 
1 1 1 3  27 15 o 3.092000  0.4494000     2.283000  0.7292000     3.900000  0.5256000     -1.617000      0.8988000 
1 1 1 3  27 16 o 4.215000  0.4805000     4.185000  0.7082000     4.246000  0.6496000     -0.6114000E-01 0.9610000 
1 1 1 3  27 17 f 3.642000  0.9338000     3.642000  0.9338000     ?         ?             ?              ?         
1 1 1 3  27 18 o 8.440000  0.2837000     8.059000  0.4057000     8.820000  0.3966000     -0.7614000     0.5673000 
1 1 1 3  27 19 o 2.864000  0.5426000     3.563000  0.7102000     2.165000  0.8204000     1.397000       1.085000  
1 1 1 3  27 20 o 1.913000  0.5251000     2.233000  0.7802000     1.594000  0.7031000     0.6390000      1.050000  
1 1 1 3  27 21 o 2.236000  0.5326000     2.800000  0.7853000     1.671000  0.7196000     1.129000       1.065000  
1 1 1 3  27 22 o 2.780000  0.4923000     1.792000  0.7550000     3.767000  0.6320000     -1.975000      0.9846000 
1 1 1 3  27 23 o 2.893000  0.5871000     2.439000  0.9549000     3.346000  0.6834000     -0.9073000     1.174000  
1 1 1 3  27 24 o 1.562000  0.4738000     1.313000  0.6124000     1.810000  0.7230000     -0.4967000     0.9475000 
1 1 1 3  27 25 o 1.414000  0.4531000     1.538000  0.6744000     1.290000  0.6052000     0.2480000      0.9061000 
1 1 1 3  28 0  o 11.22000  0.1958000     11.22000  0.1958000     11.22000  0.1958000     0.000000       0.000000  
1 1 1 3  28 1  o 13.22000  0.1451000     13.05000  0.2045000     13.39000  0.2060000     -0.3416000     0.2902000 
1 1 1 3  28 2  o 16.77000  0.1632000     16.81000  0.2315000     16.72000  0.2302000     0.8256000E-01  0.3265000 
1 1 1 3  28 3  o 15.61000  0.1582000     15.92000  0.2263000     15.30000  0.2211000     0.6234000      0.3164000 
1 1 1 3  28 4  o 17.71000  0.1701000     17.46000  0.2387000     17.96000  0.2425000     -0.5029000     0.3403000 
1 1 1 3  28 5  f 14.69000  0.1560000     14.39000  0.2184000     14.99000  0.2227000     -0.6048000     0.3119000 
1 1 1 3  28 6  o 12.86000  0.1516000     12.76000  0.2139000     12.96000  0.2149000     -0.2008000     0.3032000 
1 1 1 3  28 7  o 7.358000  0.1544000     7.276000  0.2196000     7.441000  0.2172000     -0.1645000     0.3088000 
1 1 1 3  28 8  o 18.75000  0.1984000     18.61000  0.3007000     18.90000  0.2589000     -0.2960000     0.3968000 
1 1 1 3  28 9  o 15.77000  0.1721000     16.07000  0.2456000     15.47000  0.2411000     0.5910000      0.3442000 
1 1 1 3  28 10 o 11.02000  0.2429000     10.91000  0.3297000     11.13000  0.3567000     -0.2217000     0.4857000 
1 1 1 3  28 11 o 8.769000  0.1993000     9.061000  0.3114000     8.477000  0.2488000     0.5839000      0.3986000 
1 1 1 3  28 12 o 10.94000  0.1770000     10.69000  0.2537000     11.20000  0.2468000     -0.5073000     0.3540000 
1 1 1 3  28 13 o 1.575000  0.4356000     1.150000  0.5430000     2.000000  0.6812000     -0.8497000     0.8711000 
1 1 1 3  28 14 o 1.674000  0.4765000     1.544000  0.6543000     1.805000  0.6930000     -0.2610000     0.9530000 
1 1 1 3  28 15 o 8.638000  0.2158000     8.484000  0.3104000     8.792000  0.3000000     -0.3084000     0.4317000 
1 1 1 3  28 16 o 10.80000  0.2121000     11.10000  0.2983000     10.50000  0.3015000     0.6010000      0.4241000 
1 1 1 3  28 17 o 4.749000  1.026000      3.874000  1.281000      5.623000  1.604000      -1.750000      2.053000  
1 1 1 3  28 18 o 9.283000  0.2937000     9.155000  0.4061000     9.410000  0.4243000     -0.2548000     0.5873000 
1 1 1 3  28 19 o 1.696000  0.5131000     2.088000  0.8142000     1.304000  0.6248000     0.7843000      1.026000  
1 1 1 3  28 20 o 3.921000  0.4426000     4.333000  0.5722000     3.510000  0.6754000     0.8225000      0.8852000 
1 1 1 3  28 21 o 1.795000  0.5204000     1.740000  0.7275000     1.849000  0.7442000     -0.1085000     1.041000  
1 1 1 3  28 22 o 2.198000  0.5266000     1.445000  0.6634000     2.951000  0.8181000     -1.506000      1.053000  
1 1 1 3  28 23 o 2.269000  0.5486000     2.373000  0.7737000     2.166000  0.7779000     0.2073000      1.097000  
1 1 1 3  28 24 o 1.356000  0.4394000     1.154000  0.5594000     1.557000  0.6778000     -0.4033000     0.8788000 
1 1 1 3  28 25 o 1.207000  0.4032000     0.8943000 0.4511000     1.520000  0.6686000     -0.6259000     0.8065000 
1 1 1 3  29 0  o 8.665000  0.1961000     8.665000  0.1961000     8.665000  0.1961000     0.000000       0.000000  
1 1 1 3  29 1  o 13.31000  0.1477000     13.23000  0.2086000     13.40000  0.2091000     -0.1662000     0.2954000 
1 1 1 3  29 2  o 14.68000  0.1541000     15.05000  0.2209000     14.32000  0.2150000     0.7284000      0.3083000 
1 1 1 3  29 3  o 7.896000  0.1430000     8.035000  0.2015000     7.757000  0.2028000     0.2772000      0.2859000 
1 1 1 3  29 4  o 15.54000  0.1599000     15.38000  0.2247000     15.70000  0.2275000     -0.3190000     0.3198000 
1 1 1 3  29 5  o 12.80000  0.1505000     13.15000  0.2141000     12.46000  0.2116000     0.6877000      0.3010000 
1 1 1 3  29 6  o 9.898000  0.1471000     9.825000  0.2077000     9.972000  0.2083000     -0.1471000     0.2942000 
1 1 1 3  29 7  o 8.475000  0.1534000     8.534000  0.2161000     8.416000  0.2177000     0.1183000      0.3067000 
1 1 1 3  29 8  o 13.43000  0.1752000     13.41000  0.2256000     13.46000  0.2682000     -0.4508000E-01 0.3505000 
1 1 1 3  29 9  o 21.87000  0.2037000     21.58000  0.2856000     22.17000  0.2904000     -0.5835000     0.4073000 
1 1 1 3  29 10 o 9.606000  0.3284000     9.606000  0.3284000     ?         ?             ?              ?         
1 1 1 3  29 11 o 2.330000  0.4256000     2.724000  0.5618000     1.936000  0.6394000     0.7887000      0.8511000 
1 1 1 3  29 12 o 6.232000  0.2187000     6.094000  0.3170000     6.370000  0.3013000     -0.2762000     0.4373000 
1 1 1 3  29 13 o 14.15000  0.1821000     14.22000  0.2571000     14.08000  0.2578000     0.1392000      0.3641000 
1 1 1 3  29 14 o 5.077000  0.2747000     5.235000  0.3855000     4.919000  0.3913000     0.3161000      0.5494000 
1 1 1 3  29 15 o 10.45000  0.2044000     10.69000  0.2880000     10.22000  0.2900000     0.4652000      0.4087000 
1 1 1 3  29 16 o 7.875000  0.2961000     7.370000  0.4930000     8.380000  0.3280000     -1.010000      0.5921000 
1 1 1 3  29 17 o 7.827000  0.4426000     6.544000  0.8040000     9.111000  0.3705000     -2.567000      0.8853000 
1 1 1 3  29 18 o 4.346000  0.4569000     3.909000  0.7015000     4.784000  0.5856000     -0.8742000     0.9138000 
1 1 1 3  29 19 o 5.335000  0.3509000     4.870000  0.5263000     5.800000  0.4641000     -0.9295000     0.7017000 
1 1 1 3  29 20 o 2.430000  0.5567000     2.634000  0.7927000     2.226000  0.7819000     0.4084000      1.113000  
1 1 1 3  29 21 o 2.334000  0.5257000     1.681000  0.7200000     2.988000  0.7663000     -1.307000      1.051000  
1 1 1 3  29 22 o 1.837000  0.7832000     1.837000  0.7832000     ?         ?             ?              ?         
1 1 1 3  29 23 f 1.464000  0.4625000     1.318000  0.6147000     1.610000  0.6912000     -0.2922000     0.9250000 
1 1 1 3  29 24 o 1.593000  0.4843000     1.661000  0.6972000     1.524000  0.6723000     0.1373000      0.9685000 
1 1 1 3  29 25 o 1.296000  0.4225000     0.9716000 0.4857000     1.620000  0.6915000     -0.6487000     0.8450000 
1 1 1 3  30 0  o 5.932000  0.2213000     5.932000  0.2213000     5.932000  0.2213000     0.000000       0.000000  
1 1 1 3  30 1  o 6.541000  0.1527000     6.452000  0.2162000     6.631000  0.2157000     -0.1794000     0.3054000 
1 1 1 3  30 2  o 17.66000  0.1704000     17.53000  0.2404000     17.78000  0.2416000     -0.2456000     0.3408000 
1 1 1 3  30 3  o 11.63000  0.1458000     11.32000  0.2059000     11.94000  0.2063000     -0.6138000     0.2915000 
1 1 1 3  30 4  o 5.319000  0.1705000     5.400000  0.2388000     5.238000  0.2434000     0.1621000      0.3410000 
1 1 1 3  30 5  o 7.403000  0.1531000     7.019000  0.2182000     7.786000  0.2147000     -0.7679000     0.3061000 
1 1 1 3  30 6  o 17.56000  0.1740000     18.01000  0.2486000     17.10000  0.2435000     0.9066000      0.3480000 
1 1 1 3  30 7  o 1.452000  0.3611000     1.029000  0.4722000     1.875000  0.5464000     -0.8454000     0.7221000 
1 1 1 3  30 8  o 11.75000  0.1580000     11.75000  0.2235000     11.74000  0.2233000     0.1142000E-01  0.3159000 
1 1 1 3  30 9  o 8.924000  0.3349000     8.924000  0.3349000     ?         ?             ?              ?         
1 1 1 3  30 10 o 10.27000  0.1871000     10.42000  0.2860000     10.11000  0.2412000     0.3061000      0.3741000 
1 1 1 3  30 11 o 12.76000  0.1741000     12.69000  0.2470000     12.83000  0.2454000     -0.1445000     0.3482000 
1 1 1 3  30 12 o 6.308000  0.2176000     6.394000  0.3087000     6.221000  0.3068000     0.1729000      0.4352000 
1 1 1 3  30 13 o 5.535000  0.2450000     5.696000  0.3350000     5.375000  0.3576000     0.3216000      0.4900000 
1 1 1 3  30 14 o 3.586000  0.4032000     3.988000  0.4923000     3.185000  0.6388000     0.8034000      0.8065000 
1 1 1 3  30 15 o 3.981000  0.3928000     4.199000  0.5278000     3.763000  0.5821000     0.4360000      0.7857000 
1 1 1 3  30 16 o 7.449000  0.5079000     7.449000  0.5079000     ?         ?             ?              ?         
1 1 1 3  30 17 o 5.532000  0.3134000     5.676000  0.4278000     5.389000  0.4583000     0.2866000      0.6269000 
1 1 1 3  30 18 o 2.973000  0.5649000     3.081000  0.7840000     2.864000  0.8135000     0.2175000      1.130000  
1 1 1 3  30 19 o 1.730000  0.5199000     1.769000  0.7434000     1.691000  0.7271000     0.7787000E-01  1.040000  
1 1 1 3  30 20 o 2.279000  0.5504000     2.563000  0.7828000     1.996000  0.7739000     0.5665000      1.101000  
1 1 1 3  30 21 o 4.590000  0.3959000     3.791000  0.6430000     5.388000  0.4621000     -1.597000      0.7918000 
1 1 1 3  30 22 o 1.982000  0.6597000     2.407000  1.067000      1.557000  0.7760000     0.8500000      1.319000  
1 1 1 3  30 23 f 2.298000  0.5296000     1.984000  0.7518000     2.613000  0.7462000     -0.6283000     1.059000  
1 1 1 3  30 24 o 1.482000  0.4646000     1.298000  0.6114000     1.665000  0.6996000     -0.3670000     0.9291000 
1 1 1 3  30 25 o 1.533000  0.4925000     1.205000  0.5923000     1.861000  0.7871000     -0.6562000     0.9850000 
1 1 1 3  31 0  o 8.157000  0.2046000     8.157000  0.2046000     8.157000  0.2046000     -0.000000      0.000000  
1 1 1 3  31 1  o 11.21000  0.1450000     11.31000  0.2061000     11.10000  0.2039000     0.2052000      0.2899000 
1 1 1 3  31 2  o 2.823000  0.2762000     2.707000  0.4000000     2.939000  0.3809000     -0.2317000     0.5524000 
1 1 1 3  31 3  o 22.46000  0.2004000     22.40000  0.2831000     22.52000  0.2838000     -0.1287000     0.4008000 
1 1 1 3  31 4  o 9.324000  0.1468000     9.473000  0.2065000     9.176000  0.2087000     0.2971000      0.2936000 
1 1 1 3  31 5  o 14.02000  0.1578000     13.81000  0.2214000     14.24000  0.2250000     -0.4314000     0.3156000 
1 1 1 3  31 6  o 5.138000  0.1893000     5.272000  0.2640000     5.004000  0.2714000     0.2677000      0.3786000 
1 1 1 3  31 7  o 18.49000  0.1821000     18.56000  0.2581000     18.42000  0.2568000     0.1406000      0.3641000 
1 1 1 3  31 8  o 7.238000  0.2142000     7.176000  0.3530000     7.299000  0.2426000     -0.1227000     0.4283000 
1 1 1 3  31 9  o 13.32000  0.3024000     13.30000  0.3294000     13.33000  0.5072000     -0.3266000E-01 0.6048000 
1 1 1 3  31 10 o 6.087000  0.2071000     6.029000  0.2935000     6.146000  0.2921000     -0.1169000     0.4141000 
1 1 1 3  31 11 o 11.81000  0.1738000     11.58000  0.2477000     12.04000  0.2438000     -0.4600000     0.3475000 
1 1 1 3  31 12 o 4.839000  0.2583000     4.757000  0.3720000     4.921000  0.3584000     -0.1646000     0.5165000 
1 1 1 3  31 13 o 14.30000  0.1865000     14.71000  0.2651000     13.89000  0.2623000     0.8225000      0.3729000 
1 1 1 3  31 14 o 4.992000  0.3053000     4.558000  0.4631000     5.427000  0.3980000     -0.8695000     0.6106000 
1 1 1 3  31 15 o 4.832000  0.3347000     5.033000  0.4500000     4.631000  0.4955000     0.4021000      0.6693000 
1 1 1 3  31 16 o 2.798000  0.9354000     2.798000  0.9354000     ?         ?             ?              ?         
1 1 1 3  31 17 o 8.720000  0.2309000     8.877000  0.3246000     8.563000  0.3285000     0.3134000      0.4619000 
1 1 1 3  31 18 o 2.295000  0.5697000     2.020000  0.8016000     2.571000  0.8097000     -0.5510000     1.139000  
1 1 1 3  31 19 o 2.667000  0.5630000     2.315000  0.8112000     3.020000  0.7809000     -0.7054000     1.126000  
1 1 1 3  31 20 o 2.626000  0.5547000     2.611000  0.7862000     2.641000  0.7827000     -0.3006000E-01 1.109000  
1 1 1 3  31 21 o 1.669000  0.4959000     1.865000  0.7359000     1.473000  0.6649000     0.3914000      0.9918000 
1 1 1 3  31 22 o 1.564000  0.5181000     1.805000  0.8318000     1.323000  0.6178000     0.4820000      1.036000  
1 1 1 3  31 23 o 1.201000  0.4041000     1.306000  0.6077000     1.095000  0.5329000     0.2112000      0.8083000 
1 1 1 3  31 24 o 1.496000  0.4646000     1.714000  0.7077000     1.279000  0.6021000     0.4353000      0.9292000 
1 1 1 3  32 0  o 18.43000  0.2501000     18.43000  0.2501000     18.43000  0.2501000     -0.000000      0.000000  
1 1 1 3  32 1  o 11.65000  0.1474000     11.63000  0.2088000     11.66000  0.2081000     -0.3058000E-01 0.2948000 
1 1 1 3  32 2  o 19.93000  0.1856000     20.32000  0.2659000     19.55000  0.2591000     0.7635000      0.3713000 
1 1 1 3  32 3  o 1.808000  0.3656000     1.385000  0.5386000     2.232000  0.4947000     -0.8469000     0.7313000 
1 1 1 3  32 4  o 4.914000  0.1902000     4.999000  0.2669000     4.828000  0.2710000     0.1713000      0.3803000 
1 1 1 3  32 5  o 25.25000  0.2206000     25.52000  0.3142000     24.97000  0.3097000     0.5478000      0.4412000 
1 1 1 3  32 6  o 14.75000  0.1641000     14.88000  0.2336000     14.62000  0.2304000     0.2504000      0.3282000 
1 1 1 3  32 7  o 15.35000  0.1688000     14.94000  0.2368000     15.76000  0.2408000     -0.8174000     0.3377000 
1 1 1 3  32 8  o 13.75000  0.4492000     13.75000  0.4492000     ?         ?             ?              ?         
1 1 1 3  32 9  o 15.98000  0.1768000     16.32000  0.2524000     15.63000  0.2476000     0.6871000      0.3536000 
1 1 1 3  32 10 o 10.58000  0.1893000     10.80000  0.2436000     10.35000  0.2898000     0.4544000      0.3786000 
1 1 1 3  32 11 o 18.52000  0.1927000     18.08000  0.2698000     18.96000  0.2753000     -0.8738000     0.3855000 
1 1 1 3  32 12 o 14.67000  0.1831000     14.39000  0.2576000     14.95000  0.2603000     -0.5676000     0.3662000 
1 1 1 3  32 13 o 12.19000  0.1873000     12.31000  0.2660000     12.07000  0.2637000     0.2459000      0.3746000 
1 1 1 3  32 14 o 7.977000  0.2236000     7.937000  0.3181000     8.017000  0.3144000     -0.8011000E-01 0.4473000 
1 1 1 3  32 15 o 5.315000  0.3735000     4.942000  0.6281000     5.687000  0.4042000     -0.7444000     0.7470000 
1 1 1 3  32 16 o 7.744000  0.2938000     7.771000  0.4763000     7.717000  0.3443000     0.5406000E-01  0.5877000 
1 1 1 3  32 17 o 3.614000  0.4550000     2.639000  0.7681000     4.589000  0.4879000     -1.950000      0.9100000 
1 1 1 3  32 18 o 3.754000  0.4658000     4.100000  0.6858000     3.407000  0.6304000     0.6935000      0.9315000 
1 1 1 3  32 19 o 3.907000  0.4663000     4.731000  0.5352000     3.082000  0.7638000     1.648000       0.9326000 
1 1 1 3  32 20 o 1.810000  0.4812000     1.191000  0.5742000     2.429000  0.7723000     -1.238000      0.9624000 
1 1 1 3  32 21 o 2.153000  0.5689000     2.301000  0.8110000     2.005000  0.7982000     0.2967000      1.138000  
1 1 1 3  32 22 o 1.617000  0.4798000     1.265000  0.5996000     1.970000  0.7492000     -0.7046000     0.9596000 
1 1 1 3  32 23 o 1.927000  0.5097000     1.501000  0.6698000     2.354000  0.7685000     -0.8528000     1.019000  
1 1 1 3  32 24 o 1.778000  0.5048000     1.573000  0.6784000     1.982000  0.7476000     -0.4090000     1.010000  
1 1 1 3  33 0  o 3.927000  0.3102000     3.927000  0.3102000     3.927000  0.3102000     0.000000       0.000000  
1 1 1 3  33 1  o 4.713000  0.1920000     4.644000  0.2738000     4.783000  0.2694000     -0.1384000     0.3841000 
1 1 1 3  33 2  o 12.57000  0.1534000     12.35000  0.2172000     12.78000  0.2167000     -0.4342000     0.3068000 
1 1 1 3  33 3  o 14.47000  0.1610000     14.51000  0.2291000     14.44000  0.2264000     0.6711000E-01  0.3221000 
1 1 1 3  33 4  o 15.86000  0.1668000     15.80000  0.2358000     15.92000  0.2361000     -0.1226000     0.3337000 
1 1 1 3  33 5  o 16.16000  0.1692000     16.54000  0.2420000     15.78000  0.2367000     0.7677000      0.3385000 
1 1 1 3  33 6  o 18.19000  0.1813000     17.97000  0.2543000     18.42000  0.2584000     -0.4441000     0.3625000 
1 1 1 3  33 7  o 7.179000  0.3562000     7.179000  0.3562000     ?         ?             ?              ?         
1 1 1 3  33 8  o 7.125000  0.2147000     7.177000  0.3443000     7.073000  0.2565000     0.1036000      0.4293000 
1 1 1 3  33 9  o 9.700000  0.1833000     9.630000  0.2383000     9.770000  0.2787000     -0.1410000     0.3667000 
1 1 1 3  33 10 o 10.05000  0.1748000     10.31000  0.2495000     9.782000  0.2450000     0.5265000      0.3496000 
1 1 1 3  33 11 o 7.216000  0.1987000     7.036000  0.2865000     7.396000  0.2754000     -0.3609000     0.3974000 
1 1 1 3  33 12 o 10.16000  0.1874000     10.33000  0.2634000     9.982000  0.2666000     0.3484000      0.3748000 
1 1 1 3  33 13 o 5.093000  0.2867000     5.424000  0.3876000     4.761000  0.4226000     0.6635000      0.5734000 
1 1 1 3  33 14 o 7.108000  0.2454000     6.948000  0.3478000     7.267000  0.3464000     -0.3190000     0.4908000 
1 1 1 3  33 15 o 2.597000  0.8951000     2.597000  0.8951000     ?         ?             ?              ?         
1 1 1 3  33 16 o 1.850000  0.4796000     1.252000  0.5974000     2.448000  0.7504000     -1.196000      0.9591000 
1 1 1 3  33 17 o 1.955000  0.5103000     1.467000  0.6633000     2.442000  0.7756000     -0.9747000     1.021000  
1 1 1 3  33 18 o 2.675000  0.5155000     2.324000  0.7415000     3.025000  0.7164000     -0.7008000     1.031000  
1 1 1 3  33 19 o 1.965000  0.5328000     1.560000  0.6941000     2.370000  0.8085000     -0.8092000     1.066000  
1 1 1 3  33 20 o 3.231000  0.4932000     2.997000  0.7411000     3.465000  0.6509000     -0.4682000     0.9863000 
1 1 1 3  33 21 o 2.756000  0.8276000     2.756000  0.8276000     ?         ?             ?              ?         
1 1 1 3  33 22 o 2.137000  0.5396000     2.030000  0.7616000     2.244000  0.7647000     -0.2148000     1.079000  
1 1 1 3  33 23 o 1.591000  0.4839000     1.617000  0.6868000     1.566000  0.6817000     0.5069000E-01  0.9677000 
1 1 1 3  33 24 o 1.735000  0.4974000     1.554000  0.6776000     1.916000  0.7283000     -0.3623000     0.9948000 
1 1 1 3  34 0  o 0.7943000 0.5240000     0.7943000 0.5240000     0.7943000 0.5240000     0.000000       0.000000  
1 1 1 3  34 1  o 14.90000  0.1621000     15.18000  0.2314000     14.63000  0.2269000     0.5418000      0.3241000 
1 1 1 3  34 2  f 14.09000  0.1601000     14.13000  0.2279000     14.05000  0.2249000     0.8272000E-01  0.3202000 
1 1 1 3  34 3  o 25.89000  0.2254000     25.82000  0.3186000     25.95000  0.3189000     -0.1267000     0.4508000 
1 1 1 3  34 4  o 4.963000  0.1972000     5.026000  0.2786000     4.899000  0.2791000     0.1268000      0.3944000 
1 1 1 3  34 5  o 9.986000  0.1707000     9.801000  0.2216000     10.17000  0.2597000     -0.3699000     0.3414000 
1 1 1 3  34 6  o 5.392000  0.3089000     5.463000  0.4272000     5.322000  0.4463000     0.1410000      0.6178000 
1 1 1 3  34 7  o 7.550000  0.2389000     7.013000  0.3427000     8.088000  0.3329000     -1.075000      0.4778000 
1 1 1 3  34 8  o 12.37000  0.1661000     12.50000  0.2339000     12.24000  0.2359000     0.2576000      0.3322000 
1 1 1 3  34 9  o 16.15000  0.1794000     16.31000  0.2540000     16.00000  0.2534000     0.3141000      0.3588000 
1 1 1 3  34 10 o 16.54000  0.1840000     16.75000  0.2598000     16.33000  0.2607000     0.4260000      0.3681000 
1 1 1 3  34 11 o 4.344000  0.2827000     4.325000  0.4007000     4.362000  0.3990000     -0.3765000E-01 0.5655000 
1 1 1 3  34 12 f 9.064000  0.1941000     8.869000  0.2783000     9.258000  0.2708000     -0.3899000     0.3883000 
1 1 1 3  34 13 o 2.237000  0.5150000     2.086000  0.7450000     2.387000  0.7112000     -0.3011000     1.030000  
1 1 1 3  34 14 o 2.056000  0.5191000     2.402000  0.7558000     1.710000  0.7119000     0.6912000      1.038000  
1 1 1 3  34 15 o 2.520000  0.9130000     2.520000  0.9130000     ?         ?             ?              ?         
1 1 1 3  34 16 o 2.276000  0.5226000     1.840000  0.7351000     2.713000  0.7431000     -0.8731000     1.045000  
1 1 1 3  34 17 o 1.344000  0.4370000     1.494000  0.6597000     1.194000  0.5732000     0.2998000      0.8739000 
1 1 1 3  34 18 o 2.798000  0.4644000     3.738000  0.5797000     1.858000  0.7256000     1.880000       0.9287000 
1 1 1 3  34 19 o 2.272000  0.5539000     2.556000  0.7918000     1.988000  0.7748000     0.5684000      1.108000  
1 1 1 3  34 20 f 1.487000  0.4687000     1.405000  0.6430000     1.570000  0.6820000     -0.1646000     0.9373000 
1 1 1 3  34 21 o 2.041000  0.6644000     1.994000  0.9399000     2.088000  0.9394000     -0.9389000E-01 1.329000  
1 1 1 3  34 22 o 1.707000  0.5054000     1.848000  0.7425000     1.566000  0.6859000     0.2816000      1.011000  
1 1 1 3  34 23 o 1.882000  0.4612000     1.105000  0.5414000     2.659000  0.7469000     -1.554000      0.9224000 
1 1 1 3  34 24 o 1.410000  0.4534000     1.433000  0.6469000     1.387000  0.6353000     0.4629000E-01  0.9067000 
1 1 1 3  35 0  o 1.640000  0.6899000     1.640000  0.6899000     1.640000  0.6899000     -0.000000      0.000000  
1 1 1 3  35 1  o 6.698000  0.1672000     6.550000  0.2396000     6.846000  0.2333000     -0.2964000     0.3344000 
1 1 1 3  35 2  o 19.17000  0.1854000     19.20000  0.2629000     19.14000  0.2616000     0.6775000E-01  0.3709000 
1 1 1 3  35 3  o 16.16000  0.1705000     16.25000  0.2421000     16.08000  0.2401000     0.1748000      0.3410000 
1 1 1 3  35 4  o 18.65000  0.1834000     19.00000  0.2624000     18.30000  0.2563000     0.7046000      0.3668000 
1 1 1 3  35 5  o 7.233000  0.2555000     7.204000  0.3565000     7.261000  0.3662000     -0.5716000E-01 0.5111000 
1 1 1 3  35 6  o 6.529000  0.2546000     6.803000  0.3513000     6.255000  0.3687000     0.5484000      0.5093000 
1 1 1 3  35 7  o 3.672000  0.2827000     3.901000  0.3816000     3.443000  0.4171000     0.4581000      0.5653000 
1 1 1 3  35 8  o 11.57000  0.1665000     11.64000  0.2352000     11.51000  0.2357000     0.1268000      0.3330000 
1 1 1 3  35 9  o 6.854000  0.1922000     6.957000  0.2697000     6.752000  0.2739000     0.2049000      0.3844000 
1 1 1 3  35 10 o 2.741000  0.4074000     2.688000  0.5946000     2.794000  0.5570000     -0.1063000     0.8147000 
1 1 1 3  35 11 o 3.647000  0.3424000     3.718000  0.4766000     3.575000  0.4918000     0.1426000      0.6848000 
1 1 1 3  35 12 o 9.397000  0.1965000     9.399000  0.2785000     9.394000  0.2773000     0.5164000E-02  0.3930000 
1 1 1 3  35 13 o 5.571000  0.2765000     5.502000  0.3961000     5.640000  0.3860000     -0.1378000     0.5531000 
1 1 1 3  35 14 f 5.502000  0.3494000     5.610000  0.5539000     5.394000  0.4262000     0.2152000      0.6989000 
1 1 1 3  35 15 o 5.849000  0.3156000     5.802000  0.4952000     5.897000  0.3913000     -0.9500000E-01 0.6312000 
1 1 1 3  35 16 o 4.122000  0.3818000     4.253000  0.5216000     3.991000  0.5577000     0.2619000      0.7636000 
1 1 1 3  35 17 o 6.344000  0.2626000     6.431000  0.3643000     6.258000  0.3784000     0.1726000      0.5253000 
1 1 1 3  35 18 o 3.251000  0.4643000     3.080000  0.6784000     3.422000  0.6339000     -0.3412000     0.9285000 
1 1 1 3  35 19 o 2.366000  0.4995000     1.777000  0.7151000     2.955000  0.6975000     -1.178000      0.9989000 
1 1 1 3  35 20 o 1.835000  0.5312000     1.927000  0.7827000     1.744000  0.7184000     0.1832000      1.062000  
1 1 1 3  35 21 o 1.510000  0.4738000     1.262000  0.6281000     1.758000  0.7096000     -0.4959000     0.9477000 
1 1 1 3  35 22 o 2.198000  0.4613000     3.099000  0.6950000     1.297000  0.6068000     1.802000       0.9227000 
1 1 1 3  35 23 o 1.381000  0.4495000     1.362000  0.6295000     1.400000  0.6419000     -0.3731000E-01 0.8991000 
1 1 1 3  36 0  o 11.61000  0.2211000     11.61000  0.2211000     11.61000  0.2211000     0.000000       0.000000  
1 1 1 3  36 1  f 8.072000  0.1611000     7.717000  0.2308000     8.428000  0.2250000     -0.7108000     0.3223000 
1 1 1 3  36 2  o 5.224000  0.1978000     5.401000  0.2747000     5.046000  0.2847000     0.3541000      0.3956000 
1 1 1 3  36 3  o 4.892000  0.3027000     5.102000  0.4241000     4.682000  0.4319000     0.4203000      0.6053000 
1 1 1 3  36 4  o 12.62000  0.4559000     12.62000  0.4559000     ?         ?             ?              ?         
1 1 1 3  36 5  o 28.46000  0.3465000     28.91000  0.4966000     28.00000  0.4833000     0.9170000      0.6929000 
1 1 1 3  36 6  o 9.743000  0.1670000     9.735000  0.2372000     9.752000  0.2353000     -0.1720000E-01 0.3341000 
1 1 1 3  36 7  o 12.22000  0.1671000     12.35000  0.2369000     12.09000  0.2359000     0.2607000      0.3343000 
1 1 1 3  36 8  o 10.46000  0.1679000     10.55000  0.2375000     10.37000  0.2375000     0.1740000      0.3359000 
1 1 1 3  36 9  o 14.23000  0.1749000     14.08000  0.2461000     14.37000  0.2485000     -0.2915000     0.3497000 
1 1 1 3  36 10 o 7.187000  0.1965000     7.447000  0.2700000     6.927000  0.2856000     0.5196000      0.3931000 
1 1 1 3  36 11 f 12.83000  0.1832000     13.03000  0.2602000     12.63000  0.2580000     0.3941000      0.3664000 
1 1 1 3  36 12 o 6.532000  0.2372000     6.906000  0.3226000     6.159000  0.3477000     0.7463000      0.4743000 
1 1 1 3  36 13 o 5.167000  0.2948000     5.252000  0.4167000     5.083000  0.4170000     0.1691000      0.5895000 
1 1 1 3  36 14 o 6.822000  0.4027000     6.822000  0.4027000     ?         ?             ?              ?         
1 1 1 3  36 15 o 4.748000  0.3342000     4.946000  0.4484000     4.550000  0.4956000     0.3959000      0.6684000 
1 1 1 3  36 16 o 1.966000  0.5086000     1.568000  0.6801000     2.365000  0.7565000     -0.7972000     1.017000  
1 1 1 3  36 17 o 1.545000  0.4769000     1.554000  0.6713000     1.536000  0.6775000     0.1771000E-01  0.9538000 
1 1 1 3  36 18 o 1.780000  0.5029000     1.642000  0.6891000     1.917000  0.7328000     -0.2746000     1.006000  
1 1 1 3  36 19 o 2.033000  0.5142000     1.703000  0.7061000     2.364000  0.7478000     -0.6617000     1.028000  
1 1 1 3  36 20 o 1.352000  0.6300000     1.352000  0.6300000     ?         ?             ?              ?         
1 1 1 3  36 21 o 1.283000  0.4245000     1.218000  0.5773000     1.347000  0.6224000     -0.1289000     0.8489000 
1 1 1 3  36 22 o 1.336000  0.4378000     1.354000  0.6266000     1.318000  0.6115000     0.3632000E-01  0.8756000 
1 1 1 3  36 23 o 1.098000  0.3779000     1.023000  0.5048000     1.172000  0.5624000     -0.1488000     0.7557000 
1 1 1 3  37 0  o 5.935000  0.4010000     5.935000  0.4010000     5.935000  0.4010000     0.000000       0.000000  
1 1 1 3  37 1  o 8.211000  0.2402000     8.232000  0.3399000     8.190000  0.3395000     0.4231000E-01  0.4804000 
1 1 1 3  37 3  o 15.59000  0.2985000     15.77000  0.3448000     15.41000  0.4875000     0.3560000      0.5971000 
1 1 1 3  37 4  o 27.20000  0.2890000     26.64000  0.4664000     27.77000  0.3416000     -1.130000      0.5781000 
1 1 1 3  37 5  f 19.21000  0.1899000     19.29000  0.2686000     19.12000  0.2685000     0.1655000      0.3798000 
1 1 1 3  37 6  o 3.295000  0.3376000     3.839000  0.3889000     2.751000  0.5521000     1.089000       0.6753000 
1 1 1 3  37 7  o 3.676000  0.2942000     3.512000  0.4321000     3.840000  0.3994000     -0.3280000     0.5884000 
1 1 1 3  37 8  o 13.18000  0.1729000     13.31000  0.2444000     13.06000  0.2446000     0.2493000      0.3458000 
1 1 1 3  37 9  o 5.984000  0.2132000     6.024000  0.2972000     5.943000  0.3058000     0.8027000E-01  0.4264000 
1 1 1 3  37 10 o 9.752000  0.1800000     9.552000  0.2576000     9.952000  0.2513000     -0.4000000     0.3599000 
1 1 1 3  37 11 o 2.354000  0.4901000     2.187000  0.6995000     2.521000  0.6867000     -0.3342000     0.9802000 
1 1 1 3  37 12 o 4.979000  0.2911000     4.861000  0.4278000     5.097000  0.3948000     -0.2361000     0.5822000 
1 1 1 3  37 13 o 5.057000  0.3751000     5.728000  0.5455000     4.387000  0.5151000     1.341000       0.7503000 
1 1 1 3  37 14 o 6.536000  0.3227000     6.006000  0.5420000     7.067000  0.3505000     -1.062000      0.6454000 
1 1 1 3  37 15 o 2.516000  0.5100000     3.002000  0.6941000     2.030000  0.7474000     0.9712000      1.020000  
1 1 1 3  37 16 o 2.584000  0.5407000     2.344000  0.7561000     2.824000  0.7731000     -0.4799000     1.081000  
1 1 1 3  37 17 o 5.112000  0.3109000     4.788000  0.4624000     5.437000  0.4158000     -0.6491000     0.6219000 
1 1 1 3  37 18 o 2.109000  0.5304000     2.215000  0.7588000     2.003000  0.7412000     0.2124000      1.061000  
1 1 1 3  37 19 o 1.590000  0.4623000     1.900000  0.7089000     1.280000  0.5935000     0.6197000      0.9245000 
1 1 1 3  37 20 o 1.506000  0.5098000     1.560000  0.7186000     1.452000  0.7234000     0.1087000      1.020000  
1 1 1 3  37 21 o 1.564000  0.4768000     1.705000  0.7039000     1.423000  0.6433000     0.2822000      0.9536000 
1 1 1 3  37 22 o 1.575000  0.4798000     1.497000  0.6587000     1.653000  0.6978000     -0.1560000     0.9596000 
1 1 1 3  37 23 o 1.242000  0.4129000     1.447000  0.6478000     1.037000  0.5121000     0.4099000      0.8258000 
1 1 1 3  38 0  o 7.362000  0.3422000     7.362000  0.3422000     7.362000  0.3422000     0.000000       0.000000  
1 1 1 3  38 1  o 11.51000  0.2246000     11.82000  0.3181000     11.20000  0.3172000     0.6133000      0.4493000 
1 1 1 3  38 2  o 25.23000  0.2433000     25.25000  0.3682000     25.22000  0.3181000     0.3207000E-01  0.4866000 
1 1 1 3  38 3  o 13.30000  0.1672000     13.65000  0.2373000     12.95000  0.2357000     0.6912000      0.3345000 
1 1 1 3  38 4  o 7.420000  0.1776000     7.442000  0.2485000     7.399000  0.2537000     0.4296000E-01  0.3551000 
1 1 1 3  38 5  o 8.776000  0.1692000     8.781000  0.2408000     8.772000  0.2377000     0.9686000E-02  0.3384000 
1 1 1 3  38 6  o 13.90000  0.1712000     13.91000  0.2419000     13.90000  0.2423000     0.1664000E-01  0.3424000 
1 1 1 3  38 7  o 8.019000  0.1805000     7.845000  0.2567000     8.194000  0.2539000     -0.3497000     0.3611000 
1 1 1 3  38 8  o 5.679000  0.2158000     5.595000  0.3075000     5.764000  0.3030000     -0.1689000     0.4317000 
1 1 1 3  38 9  o 14.09000  0.1778000     14.12000  0.2508000     14.07000  0.2522000     0.5794000E-01  0.3556000 
1 1 1 3  38 10 o 2.180000  0.4734000     2.111000  0.6743000     2.248000  0.6647000     -0.1366000     0.9469000 
1 1 1 3  38 11 o 2.181000  0.4868000     1.927000  0.6930000     2.435000  0.6838000     -0.5076000     0.9736000 
1 1 1 3  38 12 o 12.48000  0.1924000     12.82000  0.2721000     12.15000  0.2720000     0.6609000      0.3847000 
1 1 1 3  38 13 o 1.687000  0.7269000     1.687000  0.7269000     ?         ?             ?              ?         
1 1 1 3  38 14 o 6.779000  0.2549000     7.136000  0.3492000     6.422000  0.3716000     0.7145000      0.5099000 
1 1 1 3  38 15 o 2.444000  0.5350000     2.429000  0.7483000     2.459000  0.7649000     -0.2977000E-01 1.070000  
1 1 1 3  38 16 f 1.873000  0.5115000     1.605000  0.6901000     2.141000  0.7551000     -0.5366000     1.023000  
1 1 1 3  38 17 o 3.305000  0.4632000     3.327000  0.6376000     3.282000  0.6722000     0.4528000E-01  0.9264000 
1 1 1 3  38 18 o 2.032000  0.5207000     2.085000  0.7322000     1.980000  0.7406000     0.1052000      1.041000  
1 1 1 3  38 19 o 2.728000  0.5026000     2.716000  0.7477000     2.739000  0.6718000     -0.2302000E-01 1.005000  
1 1 1 3  38 20 o 1.356000  0.4473000     1.482000  0.6863000     1.230000  0.5738000     0.2516000      0.8946000 
1 1 1 3  38 21 o 3.625000  0.4432000     2.959000  0.7190000     4.291000  0.5184000     -1.333000      0.8864000 
1 1 1 3  38 22 o 2.173000  0.5309000     2.032000  0.7417000     2.313000  0.7598000     -0.2811000     1.062000  
1 1 1 3  38 23 o 1.698000  0.5203000     1.417000  0.6674000     1.979000  0.7984000     -0.5622000     1.041000  
1 1 1 3  39 0  o 18.30000  0.2637000     18.30000  0.2637000     18.30000  0.2637000     0.000000       0.000000  
1 1 1 3  39 1  o 3.477000  0.2865000     3.696000  0.3891000     3.258000  0.4205000     0.4378000      0.5729000 
1 1 1 3  39 2  o 8.131000  0.1731000     7.886000  0.2475000     8.377000  0.2422000     -0.4901000     0.3463000 
1 1 1 3  39 3  o 11.95000  0.1666000     11.81000  0.2359000     12.10000  0.2353000     -0.2917000     0.3332000 
1 1 1 3  39 4  o 12.39000  0.1670000     12.32000  0.2363000     12.46000  0.2360000     -0.1350000     0.3339000 
1 1 1 3  39 5  o 10.71000  0.1668000     10.49000  0.2354000     10.93000  0.2365000     -0.4397000     0.3337000 
1 1 1 3  39 6  o 34.29000  0.2877000     33.83000  0.4020000     34.76000  0.4118000     -0.9313000     0.5755000 
1 1 1 3  39 7  o 13.62000  0.1735000     13.33000  0.2461000     13.91000  0.2446000     -0.5739000     0.3470000 
1 1 1 3  39 8  o 5.002000  0.2403000     4.990000  0.3401000     5.014000  0.3396000     -0.2368000E-01 0.4806000 
1 1 1 3  39 9  o 18.86000  0.2318000     18.87000  0.3307000     18.86000  0.3248000     0.1414000E-01  0.4636000 
1 1 1 3  39 10 o 11.03000  0.1854000     10.78000  0.2651000     11.28000  0.2592000     -0.5059000     0.3708000 
1 1 1 3  39 11 o 6.583000  0.2338000     6.672000  0.3290000     6.495000  0.3322000     0.1775000      0.4676000 
1 1 1 3  39 12 o 3.086000  0.5517000     3.367000  0.8396000     2.804000  0.7159000     0.5628000      1.103000  
1 1 1 3  39 13 o 3.634000  0.5227000     3.402000  0.8833000     3.867000  0.5590000     -0.4649000     1.045000  
1 1 1 3  39 14 o 2.995000  0.5056000     3.162000  0.7053000     2.827000  0.7248000     0.3351000      1.011000  
1 1 1 3  39 15 o 2.710000  0.5185000     2.884000  0.7099000     2.535000  0.7560000     0.3490000      1.037000  
1 1 1 3  39 16 o 1.520000  0.4702000     1.600000  0.6808000     1.440000  0.6487000     0.1600000      0.9404000 
1 1 1 3  39 17 o 1.512000  0.4719000     1.512000  0.6672000     1.512000  0.6675000     0.2383000E-03  0.9437000 
1 1 1 3  39 18 o 2.282000  0.5168000     2.279000  0.7176000     2.285000  0.7440000     -0.6176000E-02 1.034000  
1 1 1 3  39 19 o 2.715000  0.6766000     2.785000  0.8826000     2.645000  1.026000      0.1408000      1.353000  
1 1 1 3  39 20 o 2.141000  0.4995000     1.989000  0.7088000     2.293000  0.7041000     -0.3043000     0.9991000 
1 1 1 3  39 21 o 1.462000  0.4473000     1.854000  0.7242000     1.071000  0.5251000     0.7824000      0.8946000 
1 1 1 3  39 22 o 1.535000  0.4664000     1.219000  0.5785000     1.851000  0.7317000     -0.6319000     0.9327000 
1 1 1 3  40 0  o 8.461000  0.2419000     8.461000  0.2419000     8.461000  0.2419000     -0.000000      0.000000  
1 1 1 3  40 1  o 4.794000  0.2305000     4.838000  0.3272000     4.750000  0.3248000     0.8842000E-01  0.4611000 
1 1 1 3  40 2  o 8.110000  0.1744000     8.277000  0.2453000     7.942000  0.2479000     0.3347000      0.3487000 
1 1 1 3  40 3  o 8.234000  0.1755000     8.110000  0.2494000     8.358000  0.2471000     -0.2481000     0.3511000 
1 1 1 3  40 4  o 16.72000  0.1811000     17.01000  0.2573000     16.43000  0.2548000     0.5791000      0.3621000 
1 1 1 3  40 5  o 17.88000  0.1869000     17.74000  0.2625000     18.01000  0.2662000     -0.2700000     0.3739000 
1 1 1 3  40 6  o 18.91000  0.1926000     18.87000  0.2714000     18.95000  0.2734000     -0.8058000E-01 0.3853000 
1 1 1 3  40 7  o 6.058000  0.2120000     6.095000  0.2970000     6.020000  0.3025000     0.7412000E-01  0.4239000 
1 1 1 3  40 8  o 4.855000  0.2591000     5.326000  0.3440000     4.384000  0.3876000     0.9420000      0.5183000 
1 1 1 3  40 9  o 12.17000  0.1958000     12.39000  0.2570000     11.95000  0.2955000     0.4438000      0.3917000 
1 1 1 3  40 10 o 4.739000  0.2851000     4.907000  0.3955000     4.571000  0.4108000     0.3360000      0.5703000 
1 1 1 3  40 11 o 2.167000  0.5031000     2.199000  0.7096000     2.136000  0.7132000     0.6282000E-01  1.006000  
1 1 1 3  40 12 o 3.579000  0.8393000     3.579000  0.8393000     ?         ?             ?              ?         
1 1 1 3  40 13 o 1.675000  0.4911000     1.937000  0.7426000     1.414000  0.6429000     0.5236000      0.9822000 
1 1 1 3  40 14 o 1.357000  0.4428000     1.451000  0.6543000     1.262000  0.5967000     0.1889000      0.8855000 
1 1 1 3  40 15 o 1.256000  0.4169000     1.090000  0.5315000     1.423000  0.6425000     -0.3330000     0.8339000 
1 1 1 3  40 16 o 2.473000  0.4982000     3.029000  0.6708000     1.918000  0.7369000     1.111000       0.9965000 
1 1 1 3  40 17 o 2.068000  0.4885000     2.663000  0.7221000     1.473000  0.6583000     1.190000       0.9771000 
1 1 1 3  40 18 o 1.802000  0.4963000     1.662000  0.6787000     1.941000  0.7243000     -0.2786000     0.9926000 
1 1 1 3  40 19 o 3.499000  0.7174000     3.499000  0.7174000     ?         ?             ?              ?         
1 1 1 3  40 20 o 3.296000  0.4265000     3.527000  0.5796000     3.065000  0.6259000     0.4622000      0.8531000 
1 1 1 3  40 21 o 1.569000  0.4610000     1.418000  0.6155000     1.721000  0.6864000     -0.3023000     0.9220000 
1 1 1 3  40 22 o 1.187000  0.4029000     1.252000  0.5923000     1.122000  0.5463000     0.1299000      0.8058000 
1 1 1 3  41 0  o 8.006000  0.2522000     8.006000  0.2522000     8.006000  0.2522000     0.000000       0.000000  
1 1 1 3  41 1  o 10.45000  0.1676000     10.53000  0.2377000     10.37000  0.2362000     0.1599000      0.3351000 
1 1 1 3  41 2  o 11.23000  0.1811000     11.32000  0.2734000     11.14000  0.2375000     0.1824000      0.3621000 
1 1 1 3  41 3  o 11.95000  0.1701000     12.07000  0.2402000     11.84000  0.2407000     0.2257000      0.3401000 
1 1 1 3  41 4  o 5.829000  0.2068000     5.882000  0.2945000     5.775000  0.2905000     0.1072000      0.4136000 
1 1 1 3  41 5  o 13.05000  0.1707000     13.12000  0.2414000     12.97000  0.2415000     0.1492000      0.3414000 
1 1 1 3  41 6  o 9.426000  0.1772000     8.954000  0.2524000     9.898000  0.2488000     -0.9437000     0.3544000 
1 1 1 3  41 7  o 3.146000  0.3812000     3.560000  0.4797000     2.732000  0.5926000     0.8279000      0.7624000 
1 1 1 3  41 8  o 7.813000  0.1995000     7.965000  0.2808000     7.662000  0.2835000     0.3025000      0.3990000 
1 1 1 3  41 9  o 9.729000  0.1898000     9.574000  0.2703000     9.883000  0.2665000     -0.3090000     0.3795000 
1 1 1 3  41 10 o 10.35000  0.1921000     10.26000  0.2737000     10.44000  0.2697000     -0.1785000     0.3842000 
1 1 1 3  41 11 o 3.596000  0.5847000     3.092000  0.8608000     4.099000  0.7917000     -1.007000      1.169000  
1 1 1 3  41 12 o 3.957000  0.4643000     3.540000  0.7986000     4.374000  0.4737000     -0.8334000     0.9285000 
1 1 1 3  41 13 o 7.452000  0.2398000     7.498000  0.3411000     7.407000  0.3371000     0.9121000E-01  0.4796000 
1 1 1 3  41 14 o 7.318000  0.2461000     7.040000  0.3537000     7.596000  0.3424000     -0.5562000     0.4923000 
1 1 1 3  41 15 o 6.016000  0.2745000     6.331000  0.3662000     5.700000  0.4090000     0.6309000      0.5490000 
1 1 1 3  41 16 o 5.594000  0.2926000     5.492000  0.4146000     5.696000  0.4129000     -0.2045000     0.5851000 
1 1 1 3  41 17 o 2.468000  0.5278000     2.518000  0.7385000     2.418000  0.7543000     0.1001000      1.056000  
1 1 1 3  41 18 o 1.243000  0.4239000     1.339000  0.6450000     1.147000  0.5501000     0.1916000      0.8478000 
1 1 1 3  41 19 o 1.587000  0.4848000     1.537000  0.6976000     1.636000  0.6734000     -0.9927000E-01 0.9696000 
1 1 1 3  41 20 o 1.678000  0.4767000     1.598000  0.6659000     1.758000  0.6822000     -0.1600000     0.9533000 
1 1 1 3  41 21 o 1.227000  0.4015000     1.222000  0.5653000     1.232000  0.5702000     -0.1014000E-01 0.8029000 
1 1 1 3  41 22 o 1.202000  0.4049000     1.016000  0.5033000     1.388000  0.6344000     -0.3720000     0.8098000 
1 1 1 3  42 0  o 7.578000  0.2619000     7.578000  0.2619000     7.578000  0.2619000     0.000000       0.000000  
1 1 1 3  42 1  f 7.250000  0.1859000     7.552000  0.2618000     6.948000  0.2641000     0.6043000      0.3719000 
1 1 1 3  42 2  o 14.03000  0.1734000     14.00000  0.2459000     14.05000  0.2446000     -0.5267000E-01 0.3468000 
1 1 1 3  42 3  o 3.372000  0.3229000     3.345000  0.4577000     3.399000  0.4556000     -0.5391000E-01 0.6458000 
1 1 1 3  42 4  o 15.67000  0.1793000     15.95000  0.2552000     15.39000  0.2519000     0.5647000      0.3586000 
1 1 1 3  42 5  o 12.57000  0.1737000     12.19000  0.2446000     12.96000  0.2467000     -0.7689000     0.3474000 
1 1 1 3  42 6  o 9.471000  0.1784000     9.476000  0.2524000     9.465000  0.2523000     0.1046000E-01  0.3568000 
1 1 1 3  42 7  o 8.487000  0.1937000     8.483000  0.2704000     8.492000  0.2774000     -0.9411000E-02 0.3874000 
1 1 1 3  42 8  o 4.438000  0.2972000     4.519000  0.4116000     4.357000  0.4290000     0.1622000      0.5945000 
1 1 1 3  42 9  o 7.607000  0.2154000     7.889000  0.2990000     7.325000  0.3101000     0.5644000      0.4308000 
1 1 1 3  42 10 o 2.473000  0.5515000     2.914000  0.8533000     2.033000  0.6988000     0.8804000      1.103000  
1 1 1 3  42 11 o 4.654000  0.5755000     4.589000  0.6069000     4.720000  0.9779000     -0.1308000     1.151000  
1 1 1 3  42 12 o 4.440000  0.3373000     4.314000  0.4927000     4.565000  0.4608000     -0.2508000     0.6746000 
1 1 1 3  42 13 o 4.870000  0.3324000     4.837000  0.4797000     4.903000  0.4604000     -0.6599000E-01 0.6649000 
1 1 1 3  42 14 f 8.005000  0.2344000     7.775000  0.3341000     8.235000  0.3289000     -0.4602000     0.4688000 
1 1 1 3  42 15 o 3.810000  0.4222000     2.809000  0.7173000     4.812000  0.4454000     -2.003000      0.8443000 
1 1 1 3  42 16 o 3.412000  0.4445000     3.818000  0.5690000     3.006000  0.6831000     0.8118000      0.8890000 
1 1 1 3  42 17 o 2.398000  0.5167000     2.368000  0.7242000     2.428000  0.7372000     -0.6011000E-01 1.033000  
1 1 1 3  42 18 o 2.200000  0.8605000     2.200000  0.8605000     ?         ?             ?              ?         
1 1 1 3  42 19 o 1.436000  0.4434000     1.209000  0.5684000     1.664000  0.6806000     -0.4552000     0.8867000 
1 1 1 3  42 20 o 1.536000  0.4519000     1.286000  0.5874000     1.787000  0.6870000     -0.5012000     0.9039000 
1 1 1 3  42 21 o 1.046000  0.3592000     0.9907000 0.4873000     1.102000  0.5280000     -0.1114000     0.7185000 
1 1 1 3  43 0  o 23.56000  0.3082000     23.56000  0.3082000     23.56000  0.3082000     0.000000       0.000000  
1 1 1 3  43 1  o 16.04000  0.1959000     15.80000  0.2962000     16.27000  0.2564000     -0.4645000     0.3918000 
1 1 1 3  43 2  o 10.46000  0.1727000     10.33000  0.2461000     10.59000  0.2424000     -0.2671000     0.3454000 
1 1 1 3  43 3  o 9.315000  0.1765000     9.356000  0.2503000     9.274000  0.2488000     0.8236000E-01  0.3530000 
1 1 1 3  43 4  o 5.842000  0.2154000     5.708000  0.3095000     5.975000  0.2998000     -0.2668000     0.4309000 
1 1 1 3  43 5  o 4.385000  0.2780000     4.424000  0.3947000     4.346000  0.3917000     0.7760000E-01  0.5561000 
1 1 1 3  43 6  f 11.72000  0.1787000     11.79000  0.2521000     11.66000  0.2534000     0.1331000      0.3574000 
1 1 1 3  43 7  o 6.061000  0.2357000     6.225000  0.3278000     5.897000  0.3388000     0.3280000      0.4714000 
1 1 1 3  43 8  o 7.249000  0.2183000     6.918000  0.3174000     7.580000  0.2999000     -0.6625000     0.4367000 
1 1 1 3  43 9  o 6.857000  0.2273000     6.908000  0.3190000     6.805000  0.3240000     0.1031000      0.4547000 
1 1 1 3  43 10 o 1.472000  0.6648000     1.472000  0.6648000     ?         ?             ?              ?         
1 1 1 3  43 11 o 7.641000  0.2278000     7.309000  0.3354000     7.972000  0.3084000     -0.6629000     0.4556000 
1 1 1 3  43 12 o 3.359000  0.4440000     3.176000  0.6646000     3.541000  0.5890000     -0.3645000     0.8880000 
1 1 1 3  43 13 o 3.792000  0.4065000     3.909000  0.5652000     3.675000  0.5844000     0.2334000      0.8130000 
1 1 1 3  43 14 o 1.509000  0.4722000     1.394000  0.6359000     1.625000  0.6983000     -0.2316000     0.9444000 
1 1 1 3  43 15 o 2.576000  0.4758000     3.380000  0.6344000     1.773000  0.7091000     1.607000       0.9515000 
1 1 1 3  43 16 o 2.993000  0.4980000     3.067000  0.6940000     2.920000  0.7144000     0.1465000      0.9959000 
1 1 1 3  43 17 o 2.546000  0.5082000     2.540000  0.7346000     2.551000  0.7026000     -0.1040000E-01 1.016000  
1 1 1 3  43 18 o 1.546000  0.4967000     1.731000  0.7466000     1.361000  0.6552000     0.3698000      0.9933000 
1 1 1 3  43 19 o 1.554000  0.4549000     1.192000  0.5627000     1.916000  0.7149000     -0.7233000     0.9098000 
1 1 1 3  43 20 f 0.9907000 0.3453000     0.8480000 0.4275000     1.133000  0.5423000     -0.2854000     0.6906000 
1 1 1 3  43 21 o 1.757000  0.4685000     1.341000  0.6072000     2.172000  0.7136000     -0.8306000     0.9370000 
1 1 1 3  44 0  o 3.392000  0.4800000     3.392000  0.4800000     3.392000  0.4800000     0.000000       0.000000  
1 1 1 3  44 1  o 9.666000  0.1781000     9.824000  0.2504000     9.507000  0.2534000     0.3168000      0.3563000 
1 1 1 3  44 2  o 12.24000  0.1743000     12.24000  0.2466000     12.24000  0.2466000     -0.8202000E-03 0.3487000 
1 1 1 3  44 3  o 9.059000  0.1819000     8.924000  0.2596000     9.194000  0.2549000     -0.2698000     0.3639000 
1 1 1 3  44 4  o 12.39000  0.1768000     12.52000  0.2499000     12.26000  0.2503000     0.2622000      0.3537000 
1 1 1 3  44 5  o 15.43000  0.1848000     15.30000  0.2606000     15.55000  0.2621000     -0.2593000     0.3696000 
1 1 1 3  44 6  o 3.580000  0.3598000     3.165000  0.5699000     3.995000  0.4394000     -0.8300000     0.7196000 
1 1 1 3  44 7  o 10.68000  0.1889000     10.85000  0.2650000     10.50000  0.2692000     0.3575000      0.3778000 
1 1 1 3  44 8  o 7.875000  0.2122000     7.498000  0.3058000     8.252000  0.2942000     -0.7538000     0.4243000 
1 1 1 3  44 9  o 2.026000  0.8317000     2.026000  0.8317000     ?         ?             ?              ?         
1 1 1 3  44 10 o 5.009000  0.3242000     5.359000  0.4824000     4.659000  0.4333000     0.7005000      0.6484000 
1 1 1 3  44 11 o 6.698000  0.2441000     7.127000  0.3272000     6.269000  0.3624000     0.8583000      0.4882000 
1 1 1 3  44 12 o 6.152000  0.2592000     6.257000  0.3635000     6.048000  0.3695000     0.2087000      0.5184000 
1 1 1 3  44 13 o 2.019000  0.5244000     1.927000  0.7411000     2.110000  0.7422000     -0.1834000     1.049000  
1 1 1 3  44 14 o 7.919000  0.2317000     7.702000  0.3309000     8.137000  0.3244000     -0.4344000     0.4634000 
1 1 1 3  44 15 o 7.921000  0.2371000     7.918000  0.3354000     7.924000  0.3353000     -0.6014000E-02 0.4742000 
1 1 1 3  44 16 o 2.794000  0.4964000     2.423000  0.7397000     3.164000  0.6620000     -0.7410000     0.9927000 
1 1 1 3  44 17 o 1.999000  0.5686000     2.612000  0.9159000     1.386000  0.6741000     1.226000       1.137000  
1 1 1 3  44 18 o 1.684000  0.4914000     1.731000  0.7025000     1.638000  0.6872000     0.9281000E-01  0.9827000 
1 1 1 3  44 19 o 1.302000  0.4111000     1.653000  0.6742000     0.9509000 0.4705000     0.7019000      0.8221000 
1 1 1 3  44 20 o 1.689000  0.4722000     1.877000  0.6988000     1.501000  0.6352000     0.3764000      0.9443000 
1 1 1 3  44 21 o 1.372000  0.4318000     1.622000  0.6743000     1.123000  0.5394000     0.4986000      0.8635000 
1 1 1 3  45 0  o 1.329000  0.7521000     1.329000  0.7521000     1.329000  0.7521000     0.000000       0.000000  
1 1 1 3  45 1  o 9.309000  0.1827000     9.485000  0.2567000     9.133000  0.2601000     0.3520000      0.3654000 
1 1 1 3  45 2  o 4.710000  0.2610000     4.622000  0.3738000     4.797000  0.3644000     -0.1751000     0.5220000 
1 1 1 3  45 3  o 2.631000  0.4144000     3.453000  0.4878000     1.809000  0.6700000     1.644000       0.8288000 
1 1 1 3  45 4  o 11.47000  0.1825000     11.40000  0.2574000     11.53000  0.2588000     -0.1285000     0.3651000 
1 1 1 3  45 5  o 12.23000  0.1825000     12.50000  0.2580000     11.95000  0.2582000     0.5534000      0.3650000 
1 1 1 3  45 6  o 12.69000  0.1851000     12.41000  0.2613000     12.97000  0.2623000     -0.5626000     0.3703000 
1 1 1 3  45 7  o 8.387000  0.2057000     8.411000  0.2886000     8.363000  0.2932000     0.4804000E-01  0.4114000 
1 1 1 3  45 8  o 6.489000  0.5098000     6.489000  0.5098000     ?         ?             ?              ?         
1 1 1 3  45 9  f 3.961000  0.4378000     3.917000  0.7175000     4.005000  0.5018000     -0.8856000E-01 0.8756000 
1 1 1 3  45 10 o 5.097000  0.2985000     4.747000  0.4501000     5.446000  0.3923000     -0.6992000     0.5970000 
1 1 1 3  45 11 o 6.300000  0.2589000     6.360000  0.3645000     6.239000  0.3677000     0.1202000      0.5177000 
1 1 1 3  45 12 o 1.585000  0.4685000     1.314000  0.6092000     1.856000  0.7119000     -0.5417000     0.9370000 
1 1 1 3  45 13 o 3.627000  0.4171000     3.539000  0.6045000     3.716000  0.5750000     -0.1767000     0.8343000 
1 1 1 3  45 14 o 3.960000  0.3785000     4.120000  0.5172000     3.801000  0.5529000     0.3184000      0.7571000 
1 1 1 3  45 15 o 3.173000  0.5110000     2.777000  0.8206000     3.568000  0.6092000     -0.7906000     1.022000  
1 1 1 3  45 16 o 2.801000  0.4819000     3.355000  0.6147000     2.247000  0.7423000     1.109000       0.9637000 
1 1 1 3  45 17 o 1.376000  0.6555000     1.376000  0.6555000     ?         ?             ?              ?         
1 1 1 3  45 18 o 3.024000  0.4585000     3.221000  0.6077000     2.827000  0.6868000     0.3940000      0.9171000 
1 1 1 3  45 19 o 1.870000  0.4889000     2.058000  0.7048000     1.682000  0.6777000     0.3757000      0.9778000 
1 1 1 3  45 20 o 1.415000  0.4409000     1.282000  0.5878000     1.548000  0.6572000     -0.2661000     0.8817000 
1 1 1 3  46 0  o 20.20000  0.2905000     20.20000  0.2905000     20.20000  0.2905000     0.000000       0.000000  
1 1 1 3  46 1  o 7.582000  0.2019000     7.830000  0.2842000     7.334000  0.2869000     0.4968000      0.4038000 
1 1 1 3  46 2  o 6.056000  0.2287000     5.913000  0.3334000     6.199000  0.3133000     -0.2856000     0.4575000 
1 1 1 3  46 3  o 6.260000  0.2275000     6.057000  0.3249000     6.463000  0.3184000     -0.4059000     0.4549000 
1 1 1 3  46 4  o 8.243000  0.2008000     8.088000  0.2892000     8.399000  0.2787000     -0.3114000     0.4017000 
1 1 1 3  46 5  f 10.97000  0.1861000     11.06000  0.2619000     10.88000  0.2646000     0.1868000      0.3723000 
1 1 1 3  46 6  o 4.702000  0.2934000     4.698000  0.4173000     4.707000  0.4125000     -0.9073000E-02 0.5868000 
1 1 1 3  46 8  o 2.507000  0.5702000     2.003000  0.8027000     3.012000  0.8102000     -1.008000      1.140000  
1 1 1 3  46 9  o 5.635000  0.2713000     5.760000  0.3786000     5.510000  0.3886000     0.2506000      0.5426000 
1 1 1 3  46 10 o 8.647000  0.2137000     8.426000  0.3067000     8.867000  0.2977000     -0.4410000     0.4274000 
1 1 1 3  46 11 o 4.351000  0.3413000     4.360000  0.4767000     4.343000  0.4887000     0.1704000E-01  0.6826000 
1 1 1 3  46 12 o 3.677000  0.4021000     4.033000  0.5170000     3.320000  0.6161000     0.7131000      0.8043000 
1 1 1 3  46 13 o 2.183000  0.4912000     1.631000  0.6873000     2.735000  0.7020000     -1.105000      0.9824000 
1 1 1 3  46 14 o 3.054000  0.4713000     2.417000  0.7430000     3.691000  0.5801000     -1.274000      0.9426000 
1 1 1 3  46 15 o 1.660000  0.4599000     1.113000  0.5398000     2.208000  0.7447000     -1.095000      0.9198000 
1 1 1 3  46 16 o 3.331000  0.5574000     3.613000  0.8437000     3.049000  0.7285000     0.5634000      1.115000  
1 1 1 3  46 17 o 4.186000  0.3967000     4.068000  0.6256000     4.304000  0.4878000     -0.2355000     0.7933000 
1 1 1 3  46 18 o 1.907000  0.5041000     1.832000  0.7060000     1.981000  0.7196000     -0.1491000     1.008000  
1 1 1 3  46 19 o 1.483000  0.4499000     1.231000  0.5723000     1.734000  0.6943000     -0.5023000     0.8998000 
1 1 1 3  46 20 o 1.306000  0.4222000     1.351000  0.6067000     1.261000  0.5873000     0.9012000E-01  0.8444000 
1 1 1 3  47 0  o 4.426000  0.4133000     4.426000  0.4133000     4.426000  0.4133000     -0.000000      0.000000  
1 1 1 3  47 1  o 4.336000  0.2972000     4.486000  0.4139000     4.187000  0.4266000     0.2988000      0.5944000 
1 1 1 3  47 2  o 7.681000  0.2080000     7.410000  0.2993000     7.952000  0.2889000     -0.5416000     0.4160000 
1 1 1 3  47 3  o 14.95000  0.1894000     15.00000  0.2696000     14.91000  0.2660000     0.9523000E-01  0.3788000 
1 1 1 3  47 4  o 6.198000  0.2332000     6.293000  0.3283000     6.104000  0.3314000     0.1884000      0.4665000 
1 1 1 3  47 5  o 8.270000  0.2776000     7.884000  0.4440000     8.656000  0.3334000     -0.7724000     0.5552000 
1 1 1 3  47 6  o 2.492000  0.9602000     2.492000  0.9602000     ?         ?             ?              ?         
1 1 1 3  47 7  o 10.49000  0.2377000     10.52000  0.3780000     10.47000  0.2881000     0.4983000E-01  0.4753000 
1 1 1 3  47 8  o 1.846000  0.4986000     1.653000  0.6901000     2.040000  0.7198000     -0.3870000     0.9972000 
1 1 1 3  47 9  f 3.278000  0.4398000     3.587000  0.5711000     2.968000  0.6691000     0.6196000      0.8797000 
1 1 1 3  47 10 o 7.858000  0.2248000     7.984000  0.3184000     7.731000  0.3174000     0.2525000      0.4496000 
1 1 1 3  47 11 o 3.358000  0.4371000     4.053000  0.5083000     2.662000  0.7113000     1.391000       0.8742000 
1 1 1 3  47 12 o 3.061000  0.4589000     2.902000  0.6719000     3.220000  0.6252000     -0.3177000     0.9178000 
1 1 1 3  47 13 o 1.054000  0.3662000     1.071000  0.5248000     1.037000  0.5107000     0.3416000E-01  0.7323000 
1 1 1 3  47 14 o 4.032000  0.4152000     3.699000  0.6737000     4.365000  0.4854000     -0.6657000     0.8304000 
1 1 1 3  47 15 o 1.845000  0.5096000     1.928000  0.7308000     1.762000  0.7105000     0.1656000      1.019000  
1 1 1 3  47 16 o 2.910000  0.8491000     2.910000  0.8491000     ?         ?             ?              ?         
1 1 1 3  47 17 o 2.698000  0.5006000     2.680000  0.7102000     2.716000  0.7058000     -0.3624000E-01 1.001000  
1 1 1 3  47 18 o 2.255000  0.4374000     1.348000  0.6128000     3.161000  0.6242000     -1.813000      0.8748000 
1 1 1 3  47 19 o 1.461000  0.4359000     1.056000  0.5118000     1.866000  0.7059000     -0.8099000     0.8719000 
1 1 1 3  47 20 o 1.247000  0.4434000     1.236000  0.6209000     1.258000  0.6332000     -0.2134000E-01 0.8869000 
1 1 1 3  48 0  o 8.984000  0.2768000     8.984000  0.2768000     8.984000  0.2768000     -0.000000      0.000000  
1 1 1 3  48 1  o 6.714000  0.2254000     6.873000  0.3179000     6.555000  0.3197000     0.3172000      0.4508000 
1 1 1 3  48 2  o 8.770000  0.2027000     9.215000  0.2835000     8.325000  0.2898000     0.8901000      0.4054000 
1 1 1 3  48 3  o 6.857000  0.3332000     6.429000  0.4935000     7.285000  0.4478000     -0.8555000     0.6664000 
1 1 1 3  48 4  o 13.06000  0.3470000     13.17000  0.3837000     12.95000  0.5783000     0.2161000      0.6940000 
1 1 1 3  48 5  f 6.982000  0.3994000     6.293000  0.4707000     7.670000  0.6455000     -1.377000      0.7989000 
1 1 1 3  48 6  o 7.190000  0.2428000     7.292000  0.3660000     7.089000  0.3193000     0.2032000      0.4857000 
1 1 1 3  48 7  o 3.737000  0.3906000     4.223000  0.4845000     3.251000  0.6128000     0.9719000      0.7812000 
1 1 1 3  48 8  o 4.942000  0.3107000     5.423000  0.4022000     4.460000  0.4736000     0.9629000      0.6214000 
1 1 1 3  48 9  f 3.795000  0.3976000     3.212000  0.6374000     4.378000  0.4757000     -1.166000      0.7953000 
1 1 1 3  48 10 o 2.110000  0.5193000     2.149000  0.7335000     2.072000  0.7352000     0.7704000E-01  1.039000  
1 1 1 3  48 11 o 2.770000  0.4879000     2.947000  0.6600000     2.593000  0.7188000     0.3543000      0.9758000 
1 1 1 3  48 12 o 2.510000  0.4984000     2.880000  0.6793000     2.140000  0.7295000     0.7401000      0.9968000 
1 1 1 3  48 13 f 2.603000  0.5140000     2.585000  0.7365000     2.621000  0.7173000     -0.3536000E-01 1.028000  
1 1 1 3  48 14 o 1.939000  0.5102000     1.669000  0.7010000     2.208000  0.7415000     -0.5391000     1.020000  
1 1 1 3  48 15 o 1.671000  0.5371000     1.659000  0.7552000     1.684000  0.7639000     -0.2497000E-01 1.074000  
1 1 1 3  48 16 o 1.454000  0.4624000     1.644000  0.7125000     1.265000  0.5897000     0.3787000      0.9249000 
1 1 1 3  48 17 o 1.349000  0.4330000     1.253000  0.5832000     1.446000  0.6401000     -0.1934000     0.8659000 
1 1 1 3  48 18 o 1.425000  0.4469000     1.349000  0.6112000     1.501000  0.6523000     -0.1524000     0.8939000 
1 1 1 3  48 19 o 1.508000  0.4423000     1.937000  0.7146000     1.079000  0.5215000     0.8585000      0.8847000 
1 1 1 3  49 0  o 3.487000  1.275000      3.487000  1.275000      3.487000  1.275000      0.000000       0.000000  
1 1 1 3  49 1  o 8.188000  0.4666000     8.645000  0.6266000     7.731000  0.6915000     0.9134000      0.9332000 
1 1 1 3  49 3  o 9.930000  0.2750000     9.989000  0.3839000     9.872000  0.3938000     0.1172000      0.5500000 
1 1 1 3  49 4  o 9.436000  0.2533000     9.545000  0.3835000     9.327000  0.3310000     0.2176000      0.5067000 
1 1 1 3  49 5  f 11.87000  0.1916000     12.06000  0.2698000     11.67000  0.2722000     0.3862000      0.3833000 
1 1 1 3  49 6  o 2.106000  0.5068000     1.866000  0.7081000     2.346000  0.7252000     -0.4795000     1.014000  
1 1 1 3  49 7  o 3.693000  0.4083000     3.200000  0.6432000     4.185000  0.5032000     -0.9847000     0.8166000 
1 1 1 3  49 8  f 1.968000  0.5039000     2.352000  0.7453000     1.585000  0.6782000     0.7671000      1.008000  
1 1 1 3  49 9  o 2.830000  0.4884000     3.072000  0.6583000     2.588000  0.7217000     0.4849000      0.9769000 
1 1 1 3  49 10 o 2.958000  0.4773000     2.846000  0.6904000     3.070000  0.6592000     -0.2237000     0.9546000 
1 1 1 3  49 11 o 3.110000  0.4609000     3.502000  0.5814000     2.718000  0.7154000     0.7841000      0.9219000 
1 1 1 3  49 12 o 1.475000  0.4571000     1.645000  0.6859000     1.305000  0.6043000     0.3396000      0.9141000 
1 1 1 3  49 13 o 2.311000  0.5189000     2.185000  0.7413000     2.437000  0.7264000     -0.2517000     1.038000  
1 1 1 3  49 14 o 4.821000  0.3237000     4.726000  0.4652000     4.916000  0.4503000     -0.1898000     0.6475000 
1 1 1 3  49 15 o 4.284000  0.6586000     4.898000  0.5672000     3.670000  1.189000      1.228000       1.317000  
1 1 1 3  49 16 o 2.426000  0.4942000     2.879000  0.6750000     1.973000  0.7219000     0.9062000      0.9883000 
1 1 1 3  49 17 o 2.071000  0.5148000     2.020000  0.7354000     2.121000  0.7207000     -0.1007000     1.030000  
1 1 1 3  49 18 o 1.296000  0.4239000     1.377000  0.6242000     1.215000  0.5736000     0.1619000      0.8477000 
1 1 1 3  49 19 o 2.048000  0.5157000     2.489000  0.7550000     1.607000  0.7026000     0.8817000      1.031000  
1 1 1 3  50 0  o 17.43000  0.3297000     17.43000  0.3297000     17.43000  0.3297000     0.000000       0.000000  
1 1 1 3  50 1  o 5.182000  0.3147000     5.221000  0.4507000     5.143000  0.4392000     0.7821000E-01  0.6294000 
1 1 1 3  50 2  o 8.379000  0.2122000     8.167000  0.3061000     8.591000  0.2941000     -0.4240000     0.4245000 
1 1 1 3  50 3  o 9.133000  0.2037000     9.355000  0.2884000     8.910000  0.2879000     0.4448000      0.4075000 
1 1 1 3  50 4  o 4.832000  0.2985000     4.752000  0.4343000     4.913000  0.4097000     -0.1606000     0.5971000 
1 1 1 3  50 5  o 2.893000  0.4673000     2.799000  0.6709000     2.986000  0.6507000     -0.1872000     0.9347000 
1 1 1 3  50 6  f 1.359000  0.4329000     1.196000  0.5689000     1.522000  0.6526000     -0.3264000     0.8658000 
1 1 1 3  50 7  o 7.428000  0.2344000     7.696000  0.3228000     7.159000  0.3399000     0.5367000      0.4688000 
1 1 1 3  50 8  o 4.063000  0.3642000     3.927000  0.5274000     4.200000  0.5023000     -0.2728000     0.7283000 
1 1 1 3  50 9  o 6.070000  0.2622000     6.007000  0.3682000     6.133000  0.3733000     -0.1260000     0.5244000 
1 1 1 3  50 10 o 7.678000  0.2277000     7.591000  0.3238000     7.766000  0.3204000     -0.1748000     0.4555000 
1 1 1 3  50 11 o 4.012000  0.3678000     3.973000  0.5327000     4.050000  0.5073000     -0.7662000E-01 0.7356000 
1 1 1 3  50 12 o 3.723000  0.4052000     3.696000  0.5751000     3.749000  0.5710000     -0.5342000E-01 0.8105000 
1 1 1 3  50 13 o 6.703000  0.2528000     6.448000  0.3636000     6.958000  0.3513000     -0.5104000     0.5056000 
1 1 1 3  50 14 o 2.247000  0.8815000     2.247000  0.8815000     ?         ?             ?              ?         
1 1 1 3  50 15 o 1.925000  0.5020000     1.696000  0.6872000     2.155000  0.7320000     -0.4581000     1.004000  
1 1 1 3  50 16 f 2.943000  0.4652000     2.872000  0.6755000     3.014000  0.6399000     -0.1413000     0.9305000 
1 1 1 3  50 17 o 3.281000  0.4506000     3.793000  0.5268000     2.768000  0.7313000     1.025000       0.9013000 
1 1 1 3  50 18 o 1.171000  0.3936000     1.259000  0.5867000     1.083000  0.5249000     0.1759000      0.7872000 
1 1 1 3  51 0  o 4.433000  0.4642000     4.433000  0.4642000     4.433000  0.4642000     -0.000000      0.000000  
1 1 1 3  51 1  o 3.103000  0.4392000     3.356000  0.5820000     2.850000  0.6579000     0.5065000      0.8784000 
1 1 1 3  51 2  o 2.141000  0.5083000     2.151000  0.7173000     2.131000  0.7203000     0.2052000E-01  1.017000  
1 1 1 3  51 3  o 5.102000  0.2952000     5.766000  0.3741000     4.438000  0.4568000     1.328000       0.5904000 
1 1 1 3  51 4  o 8.125000  0.2179000     8.098000  0.3125000     8.152000  0.3037000     -0.5439000E-01 0.4358000 
1 1 1 3  51 5  o 4.603000  0.3353000     3.701000  0.5437000     5.505000  0.3926000     -1.804000      0.6706000 
1 1 1 3  51 6  o 2.876000  0.4742000     3.282000  0.6145000     2.471000  0.7224000     0.8109000      0.9484000 
1 1 1 3  51 7  f 1.592000  0.4742000     1.388000  0.6279000     1.796000  0.7108000     -0.4079000     0.9484000 
1 1 1 3  51 8  o 4.354000  0.3504000     3.871000  0.5465000     4.837000  0.4387000     -0.9659000     0.7008000 
1 1 1 3  51 9  o 2.341000  0.5243000     2.166000  0.7467000     2.517000  0.7361000     -0.3514000     1.049000  
1 1 1 3  51 10 o 4.124000  0.3688000     3.816000  0.5621000     4.432000  0.4778000     -0.6166000     0.7377000 
1 1 1 3  51 11 o 2.251000  0.5297000     2.264000  0.7531000     2.239000  0.7452000     0.2536000E-01  1.059000  
1 1 1 3  51 12 o 3.600000  0.4188000     3.171000  0.6471000     4.029000  0.5317000     -0.8574000     0.8375000 
1 1 1 3  51 13 o 1.800000  0.5024000     1.470000  0.6925000     2.130000  0.7280000     -0.6597000     1.005000  
1 1 1 3  51 14 f 1.362000  0.4546000     1.539000  0.7047000     1.184000  0.5745000     0.3542000      0.9092000 
1 1 1 3  51 15 o 2.329000  0.5002000     2.761000  0.6965000     1.897000  0.7182000     0.8640000      1.000000  
1 1 1 3  51 16 o 2.698000  0.4980000     2.648000  0.7092000     2.749000  0.6995000     -0.1011000     0.9961000 
1 1 1 3  51 17 o 2.597000  0.4990000     2.971000  0.6634000     2.222000  0.7455000     0.7492000      0.9980000 
1 1 1 3  51 18 o 1.441000  0.4517000     1.276000  0.5972000     1.607000  0.6778000     -0.3301000     0.9033000 
1 1 1 3  52 0  o 4.325000  0.4783000     4.325000  0.4783000     4.325000  0.4783000     0.000000       0.000000  
1 1 1 3  52 1  o 5.348000  0.2797000     5.692000  0.3750000     5.003000  0.4151000     0.6898000      0.5594000 
1 1 1 3  52 2  o 7.886000  0.2236000     7.964000  0.3164000     7.808000  0.3160000     0.1562000      0.4471000 
1 1 1 3  52 3  f 1.145000  0.3877000     1.000000  0.4937000     1.290000  0.5979000     -0.2896000     0.7754000 
1 1 1 3  52 4  o 6.177000  0.2561000     6.294000  0.3556000     6.060000  0.3687000     0.2345000      0.5122000 
1 1 1 3  52 5  o 2.986000  0.4543000     3.677000  0.5377000     2.294000  0.7324000     1.383000       0.9086000 
1 1 1 3  52 6  o 9.984000  0.2026000     10.44000  0.2827000     9.525000  0.2903000     0.9187000      0.4052000 
1 1 1 3  52 7  o 2.012000  0.4929000     2.339000  0.7025000     1.685000  0.6917000     0.6541000      0.9858000 
1 1 1 3  52 8  o 5.138000  0.2951000     5.057000  0.4213000     5.220000  0.4134000     -0.1634000     0.5903000 
1 1 1 3  52 9  o 1.882000  0.5060000     2.145000  0.7428000     1.619000  0.6872000     0.5267000      1.012000  
1 1 1 3  52 10 o 4.904000  0.3195000     5.076000  0.4386000     4.731000  0.4646000     0.3447000      0.6389000 
1 1 1 3  52 11 o 3.400000  0.4432000     3.639000  0.5972000     3.161000  0.6549000     0.4778000      0.8863000 
1 1 1 3  52 12 o 5.275000  0.2997000     5.598000  0.4080000     4.953000  0.4393000     0.6450000      0.5995000 
1 1 1 3  52 13 o 5.747000  0.5326000     5.747000  0.5326000     ?         ?             ?              ?         
1 1 1 3  52 14 o 4.862000  0.3458000     4.275000  0.5600000     5.449000  0.4061000     -1.173000      0.6917000 
1 1 1 3  52 15 o 2.510000  0.4914000     3.017000  0.6545000     2.003000  0.7331000     1.014000       0.9827000 
1 1 1 3  52 16 o 1.650000  0.4780000     1.754000  0.6885000     1.546000  0.6633000     0.2080000      0.9560000 
1 1 1 3  52 17 o 3.239000  0.4418000     3.243000  0.6263000     3.235000  0.6232000     0.8506000E-02  0.8836000 
1 1 1 3  53 0  o 3.347000  0.6511000     3.347000  0.6511000     3.347000  0.6511000     0.000000       0.000000  
1 1 1 3  53 1  o 4.760000  0.3130000     4.868000  0.4343000     4.652000  0.4510000     0.2165000      0.6261000 
1 1 1 3  53 2  o 3.125000  0.4368000     3.802000  0.5210000     2.449000  0.7011000     1.353000       0.8735000 
1 1 1 3  53 3  o 10.40000  0.2010000     10.21000  0.2869000     10.58000  0.2815000     -0.3626000     0.4020000 
1 1 1 3  53 4  o 1.706000  0.4872000     1.706000  0.6861000     1.706000  0.6920000     0.6686000E-03  0.9745000 
1 1 1 3  53 5  o 8.216000  0.2177000     8.062000  0.3042000     8.371000  0.3114000     -0.3094000     0.4353000 
1 1 1 3  53 6  o 4.970000  0.3006000     5.178000  0.4094000     4.762000  0.4402000     0.4157000      0.6011000 
1 1 1 3  53 7  o 1.609000  0.4747000     1.402000  0.6299000     1.816000  0.7104000     -0.4134000     0.9495000 
1 1 1 3  53 8  o 5.064000  0.3043000     5.141000  0.4187000     4.987000  0.4417000     0.1540000      0.6086000 
1 1 1 3  53 9  o 2.459000  0.5269000     2.761000  0.7288000     2.157000  0.7613000     0.6039000      1.054000  
1 1 1 3  53 10 o 3.904000  0.4044000     3.188000  0.6628000     4.619000  0.4635000     -1.431000      0.8088000 
1 1 1 3  53 11 o 3.563000  0.4247000     3.138000  0.6676000     3.988000  0.5251000     -0.8506000     0.8494000 
1 1 1 3  53 12 o 6.620000  0.5506000     6.620000  0.5506000     ?         ?             ?              ?         
1 1 1 3  53 13 f 2.632000  0.5191000     3.153000  0.7406000     2.112000  0.7276000     1.041000       1.038000  
1 1 1 3  53 14 o 1.674000  0.4895000     1.810000  0.7160000     1.538000  0.6675000     0.2720000      0.9789000 
1 1 1 3  53 15 o 1.715000  0.4905000     1.791000  0.7013000     1.640000  0.6859000     0.1509000      0.9810000 
1 1 1 3  53 16 o 1.876000  0.4964000     2.083000  0.7262000     1.669000  0.6771000     0.4139000      0.9929000 
1 1 1 3  53 17 o 1.205000  0.4025000     1.244000  0.5797000     1.166000  0.5585000     0.7758000E-01  0.8050000 
1 1 1 3  54 0  o 3.541000  0.6022000     3.541000  0.6022000     3.541000  0.6022000     0.000000       0.000000  
1 1 1 3  54 1  o 2.698000  0.4644000     1.966000  0.7212000     3.430000  0.5854000     -1.465000      0.9289000 
1 1 1 3  54 2  o 2.133000  0.4942000     1.664000  0.6947000     2.603000  0.7031000     -0.9392000     0.9885000 
1 1 1 3  54 3  o 3.641000  0.4005000     3.277000  0.6107000     4.005000  0.5182000     -0.7273000     0.8009000 
1 1 1 3  54 4  o 11.39000  0.2168000     11.40000  0.3275000     11.37000  0.2842000     0.2566000E-01  0.4336000 
1 1 1 3  54 5  o 3.406000  0.4120000     3.589000  0.5500000     3.222000  0.6134000     0.3669000      0.8239000 
1 1 1 3  54 6  o 5.212000  0.2901000     4.815000  0.4363000     5.609000  0.3826000     -0.7933000     0.5803000 
1 1 1 3  54 7  o 5.624000  0.2749000     5.536000  0.3918000     5.711000  0.3856000     -0.1750000     0.5498000 
1 1 1 3  54 8  o 2.373000  0.4848000     1.677000  0.7047000     3.069000  0.6660000     -1.391000      0.9696000 
1 1 1 3  54 9  o 5.266000  0.3072000     5.575000  0.4024000     4.957000  0.4643000     0.6183000      0.6144000 
1 1 1 3  54 10 f 1.187000  0.4003000     0.9935000 0.4918000     1.380000  0.6317000     -0.3864000     0.8006000 
1 1 1 3  54 11 o 1.886000  0.5644000     1.473000  0.6990000     2.299000  0.8863000     -0.8268000     1.129000  
1 1 1 3  54 12 o 1.712000  0.5047000     1.492000  0.6913000     1.932000  0.7356000     -0.4401000     1.009000  
1 1 1 3  54 13 o 1.859000  0.5020000     2.041000  0.7276000     1.676000  0.6918000     0.3654000      1.004000  
1 1 1 3  54 14 o 2.153000  0.5117000     2.372000  0.7240000     1.934000  0.7233000     0.4381000      1.023000  
1 1 1 3  54 15 o 2.215000  0.5173000     2.217000  0.7279000     2.212000  0.7352000     0.4759000E-02  1.035000  
1 1 1 3  54 16 o 1.837000  0.4909000     2.158000  0.7275000     1.515000  0.6594000     0.6423000      0.9819000 
1 1 1 3  55 0  o 2.706000  0.7833000     2.706000  0.7833000     2.706000  0.7833000     0.000000       0.000000  
1 1 1 3  55 1  o 8.747000  0.2109000     8.813000  0.2992000     8.681000  0.2973000     0.1317000      0.4218000 
1 1 1 3  55 2  o 9.893000  0.2057000     10.17000  0.2891000     9.612000  0.2928000     0.5622000      0.4115000 
1 1 1 3  55 3  o 6.185000  0.2602000     6.196000  0.3730000     6.174000  0.3629000     0.2213000E-01  0.5204000 
1 1 1 3  55 4  o 5.945000  0.2720000     6.072000  0.3784000     5.817000  0.3907000     0.2552000      0.5439000 
1 1 1 3  55 5  o 2.244000  0.4756000     1.587000  0.6762000     2.901000  0.6690000     -1.314000      0.9512000 
1 1 1 3  55 6  o 3.222000  0.4529000     2.798000  0.7025000     3.647000  0.5719000     -0.8490000     0.9058000 
1 1 1 3  55 7  o 3.099000  0.4632000     3.086000  0.6675000     3.112000  0.6424000     -0.2596000E-01 0.9264000 
1 1 1 3  55 8  o 1.268000  0.4201000     1.285000  0.6008000     1.250000  0.5873000     0.3545000E-01  0.8401000 
1 1 1 3  55 9  o 2.875000  0.4841000     3.325000  0.6223000     2.425000  0.7417000     0.9000000      0.9682000 
1 1 1 3  55 10 o 2.016000  0.5873000     2.110000  0.8455000     1.921000  0.8154000     0.1891000      1.175000  
1 1 1 3  55 11 o 2.281000  0.6002000     2.667000  0.8863000     1.895000  0.8096000     0.7721000      1.200000  
1 1 1 3  55 12 o 2.110000  0.5067000     2.471000  0.7335000     1.749000  0.6993000     0.7214000      1.013000  
1 1 1 3  55 13 o 1.406000  0.4516000     1.605000  0.6995000     1.208000  0.5714000     0.3963000      0.9032000 
1 1 1 3  55 14 o 1.537000  0.4597000     1.263000  0.5854000     1.811000  0.7088000     -0.5473000     0.9193000 
1 1 1 3  55 15 o 1.014000  0.3531000     0.9665000 0.4803000     1.061000  0.5178000     -0.9416000E-01 0.7062000 
1 1 1 3  55 16 o 3.008000  0.5365000     2.909000  0.7772000     3.107000  0.7398000     -0.1978000     1.073000  
1 1 1 3  56 0  o 11.99000  0.2806000     11.99000  0.2806000     11.99000  0.2806000     -0.000000      0.000000  
1 1 1 3  56 1  o 9.006000  0.2120000     8.855000  0.3007000     9.156000  0.2990000     -0.3006000     0.4240000 
1 1 1 3  56 2  o 3.865000  0.3666000     3.899000  0.5027000     3.831000  0.5336000     0.6861000E-01  0.7331000 
1 1 1 3  56 3  o 2.703000  0.4932000     2.205000  0.7482000     3.200000  0.6428000     -0.9953000     0.9864000 
1 1 1 3  56 4  o 3.783000  0.4023000     3.356000  0.6300000     4.211000  0.5006000     -0.8547000     0.8047000 
1 1 1 3  56 5  o 4.852000  0.3271000     4.368000  0.4888000     5.336000  0.4349000     -0.9682000     0.6543000 
1 1 1 3  56 6  o 2.133000  0.5175000     2.257000  0.7297000     2.009000  0.7340000     0.2482000      1.035000  
1 1 1 3  56 7  o 1.852000  0.5068000     1.946000  0.7243000     1.759000  0.7092000     0.1871000      1.014000  
1 1 1 3  56 8  o 1.704000  0.4917000     1.564000  0.6746000     1.843000  0.7155000     -0.2788000     0.9834000 
1 1 1 3  56 9  o 2.707000  0.6648000     2.749000  0.9355000     2.666000  0.9449000     0.8333000E-01  1.330000  
1 1 1 3  56 10 o 2.025000  0.5596000     1.512000  0.6975000     2.539000  0.8754000     -1.027000      1.119000  
1 1 1 3  56 11 o 1.096000  0.3760000     1.205000  0.5707000     0.9875000 0.4899000     0.2177000      0.7521000 
1 1 1 3  56 12 o 2.013000  0.5188000     2.020000  0.7326000     2.006000  0.7347000     0.1391000E-01  1.038000  
1 1 1 3  56 13 o 1.443000  0.4524000     1.465000  0.6452000     1.420000  0.6342000     0.4544000E-01  0.9047000 
1 1 1 3  56 14 o 1.556000  0.4709000     1.554000  0.6630000     1.557000  0.6689000     -0.2253000E-02 0.9418000 
1 1 1 3  56 15 o 2.812000  0.5016000     3.192000  0.6505000     2.432000  0.7639000     0.7598000      1.003000  
1 1 1 3  57 0  o 5.783000  0.3914000     5.783000  0.3914000     5.783000  0.3914000     -0.000000      0.000000  
1 1 1 3  57 1  o 6.556000  0.2534000     6.576000  0.3531000     6.536000  0.3636000     0.4027000E-01  0.5069000 
1 1 1 3  57 2  o 2.917000  0.4774000     3.568000  0.5967000     2.265000  0.7454000     1.303000       0.9549000 
1 1 1 3  57 3  o 1.880000  0.5048000     2.084000  0.7285000     1.676000  0.6990000     0.4083000      1.010000  
1 1 1 3  57 4  o 2.944000  0.4881000     2.997000  0.6856000     2.891000  0.6948000     0.1058000      0.9762000 
1 1 1 3  57 5  o 7.383000  0.2426000     7.272000  0.3490000     7.494000  0.3372000     -0.2214000     0.4852000 
1 1 1 3  57 6  o 3.554000  0.4276000     2.999000  0.6834000     4.110000  0.5142000     -1.112000      0.8553000 
1 1 1 3  57 7  o 1.487000  0.4580000     1.280000  0.5979000     1.693000  0.6939000     -0.4126000     0.9160000 
1 1 1 3  57 8  o 1.797000  0.5502000     2.205000  0.8687000     1.390000  0.6755000     0.8157000      1.100000  
1 1 1 3  57 9  o 4.996000  0.4326000     5.181000  0.5789000     4.811000  0.6429000     0.3692000      0.8651000 
1 1 1 3  57 10 o 1.881000  0.5042000     1.611000  0.6833000     2.151000  0.7415000     -0.5395000     1.008000  
1 1 1 3  57 11 o 1.796000  0.4827000     2.264000  0.7465000     1.328000  0.6121000     0.9367000      0.9654000 
1 1 1 3  57 12 o 3.996000  0.3864000     4.217000  0.5209000     3.774000  0.5709000     0.4429000      0.7728000 
1 1 1 3  57 13 f 1.670000  0.4776000     1.383000  0.6205000     1.957000  0.7263000     -0.5737000     0.9552000 
1 1 1 3  57 14 o 1.653000  0.4869000     1.758000  0.7074000     1.547000  0.6691000     0.2114000      0.9737000 
1 1 1 3  58 0  o 8.191000  0.3189000     8.191000  0.3189000     8.191000  0.3189000     -0.000000      0.000000  
1 1 1 3  58 1  o 2.661000  0.5048000     2.437000  0.7252000     2.885000  0.7024000     -0.4482000     1.010000  
1 1 1 3  58 2  o 6.154000  0.2718000     6.082000  0.3880000     6.226000  0.3807000     -0.1442000     0.5436000 
1 1 1 3  58 3  o 7.898000  0.2359000     7.951000  0.3325000     7.844000  0.3348000     0.1073000      0.4718000 
1 1 1 3  58 4  o 2.664000  0.4970000     2.898000  0.6878000     2.431000  0.7176000     0.4672000      0.9940000 
1 1 1 3  58 5  o 2.929000  0.4745000     2.965000  0.6691000     2.892000  0.6730000     0.7327000E-01  0.9491000 
1 1 1 3  58 6  o 1.762000  0.5291000     2.241000  0.8719000     1.283000  0.5997000     0.9576000      1.058000  
1 1 1 3  58 7  f 3.428000  0.9205000     3.428000  0.9205000     ?         ?             ?              ?         
1 1 1 3  58 8  o 3.936000  0.5366000     3.720000  0.8034000     4.152000  0.7114000     -0.4321000     1.073000  
1 1 1 3  58 9  o 1.455000  0.4522000     1.150000  0.5530000     1.760000  0.7156000     -0.6101000     0.9044000 
1 1 1 3  58 10 o 1.755000  0.4670000     1.225000  0.5821000     2.284000  0.7305000     -1.060000      0.9341000 
1 1 1 3  58 11 o 1.679000  0.4908000     1.718000  0.7010000     1.640000  0.6870000     0.7846000E-01  0.9816000 
1 1 1 3  58 12 o 2.875000  0.4637000     2.156000  0.7319000     3.594000  0.5698000     -1.438000      0.9275000 
1 1 1 3  58 13 o 1.772000  0.4975000     1.659000  0.6859000     1.885000  0.7210000     -0.2258000     0.9951000 
1 1 1 3  58 14 o 1.424000  0.4450000     1.182000  0.5624000     1.665000  0.6898000     -0.4835000     0.8901000 
1 1 1 3  59 0  o 4.732000  0.4680000     4.732000  0.4680000     4.732000  0.4680000     0.000000       0.000000  
1 1 1 3  59 1  o 5.874000  0.2825000     6.335000  0.3714000     5.413000  0.4257000     0.9216000      0.5650000 
1 1 1 3  59 2  o 1.654000  0.4881000     1.665000  0.6937000     1.643000  0.6869000     0.2201000E-01  0.9763000 
1 1 1 3  59 3  o 5.937000  0.2775000     5.898000  0.3974000     5.975000  0.3874000     -0.7746000E-01 0.5550000 
1 1 1 3  59 4  o 1.953000  0.5494000     1.826000  0.7798000     2.081000  0.7741000     -0.2554000     1.099000  
1 1 1 3  59 5  o 1.772000  0.5528000     1.601000  0.7331000     1.943000  0.8276000     -0.3422000     1.106000  
1 1 1 3  59 6  f 2.466000  0.6717000     2.700000  0.8984000     2.233000  0.9987000     0.4676000      1.343000  
1 1 1 3  59 7  o 1.429000  0.4658000     1.421000  0.6738000     1.438000  0.6432000     -0.1670000E-01 0.9316000 
1 1 1 3  59 8  o 3.599000  0.4265000     3.751000  0.5838000     3.447000  0.6221000     0.3036000      0.8531000 
1 1 1 3  59 9  o 1.776000  0.5092000     1.713000  0.7179000     1.839000  0.7224000     -0.1259000     1.018000  
1 1 1 3  59 10 o 1.496000  0.4641000     1.400000  0.6357000     1.592000  0.6762000     -0.1917000     0.9281000 
1 1 1 3  59 11 o 1.661000  0.4736000     1.287000  0.5983000     2.035000  0.7343000     -0.7480000     0.9472000 
1 1 1 3  59 12 o 2.196000  0.4951000     1.545000  0.6886000     2.847000  0.7114000     -1.301000      0.9901000 
1 1 1 3  59 13 o 1.841000  0.4676000     1.175000  0.5650000     2.508000  0.7454000     -1.332000      0.9353000 
1 1 1 3  60 0  o 1.537000  0.9505000     1.537000  0.9505000     1.537000  0.9505000     0.000000       0.000000  
1 1 1 3  60 1  o 2.016000  0.5793000     1.657000  0.7507000     2.375000  0.8825000     -0.7179000     1.159000  
1 1 1 3  60 2  o 3.947000  0.5981000     4.410000  0.8184000     3.483000  0.8724000     0.9273000      1.196000  
1 1 1 3  60 3  o 1.632000  0.7872000     1.632000  0.7872000     ?         ?             ?              ?         
1 1 1 3  60 4  o 2.035000  0.5979000     2.397000  0.8854000     1.674000  0.8038000     0.7222000      1.196000  
1 1 1 3  60 5  o 1.887000  0.5663000     2.197000  0.8417000     1.576000  0.7578000     0.6211000      1.133000  
1 1 1 3  60 6  f 0.9971000 0.3481000     1.049000  0.5132000     0.9448000 0.4706000     0.1045000      0.6962000 
1 1 1 3  60 7  o 1.948000  0.4414000     1.096000  0.5344000     2.800000  0.7026000     -1.705000      0.8827000 
1 1 1 3  60 8  o 2.675000  0.5284000     2.739000  0.7335000     2.612000  0.7607000     0.1267000      1.057000  
1 1 1 3  60 9  o 1.988000  0.5228000     2.203000  0.7571000     1.773000  0.7211000     0.4306000      1.046000  
1 1 1 3  60 10 o 3.486000  0.4271000     3.416000  0.6158000     3.556000  0.5920000     -0.1397000     0.8542000 
1 1 1 3  60 11 o 1.583000  0.4746000     1.777000  0.7122000     1.390000  0.6273000     0.3873000      0.9491000 
1 1 1 3  60 12 o 1.551000  0.4743000     1.691000  0.6973000     1.412000  0.6431000     0.2786000      0.9486000 
1 1 1 3  61 0  o 2.518000  1.060000      2.518000  1.060000      2.518000  1.060000      -0.000000      0.000000  
1 1 1 3  61 1  o 4.702000  0.4762000     4.657000  0.6897000     4.747000  0.6569000     -0.8967000E-01 0.9524000 
1 1 1 3  61 2  o 2.662000  0.5913000     3.252000  0.8399000     2.073000  0.8326000     1.178000       1.183000  
1 1 1 3  61 3  o 6.804000  0.2940000     6.197000  0.4679000     7.411000  0.3560000     -1.213000      0.5879000 
1 1 1 3  61 4  o 2.747000  0.5119000     2.842000  0.7017000     2.651000  0.7456000     0.1906000      1.024000  
1 1 1 3  61 5  o 2.254000  0.5260000     2.130000  0.7410000     2.378000  0.7468000     -0.2482000     1.052000  
1 1 1 3  61 6  o 1.682000  0.4727000     1.290000  0.5986000     2.074000  0.7319000     -0.7843000     0.9455000 
1 1 1 3  61 7  o 2.975000  0.4934000     2.886000  0.7266000     3.064000  0.6678000     -0.1789000     0.9868000 
1 1 1 3  61 8  o 1.396000  0.4464000     1.605000  0.6895000     1.187000  0.5671000     0.4189000      0.8927000 
1 1 1 3  61 9  o 1.465000  0.4617000     1.435000  0.6429000     1.496000  0.6627000     -0.6083000E-01 0.9233000 
1 1 1 3  61 10 o 1.389000  0.4451000     1.436000  0.6415000     1.341000  0.6173000     0.9478000E-01  0.8903000 
1 1 1 3  61 11 f 1.647000  0.4847000     1.799000  0.7155000     1.496000  0.6542000     0.3030000      0.9694000 
1 1 1 3  62 0  f 3.606000  0.6350000     3.606000  0.6350000     3.606000  0.6350000     0.000000       0.000000  
1 1 1 3  62 1  o 3.391000  0.4346000     4.739000  0.4573000     2.042000  0.7392000     2.697000       0.8692000 
1 1 1 3  62 2  o 1.279000  0.4234000     1.189000  0.5691000     1.369000  0.6271000     -0.1800000     0.8468000 
1 1 1 3  62 3  o 6.425000  0.2682000     6.506000  0.3756000     6.343000  0.3829000     0.1631000      0.5364000 
1 1 1 3  62 4  o 1.759000  0.5045000     1.902000  0.7361000     1.615000  0.6902000     0.2869000      1.009000  
1 1 1 3  62 5  f 4.819000  0.3334000     4.766000  0.4692000     4.872000  0.4737000     -0.1058000     0.6667000 
1 1 1 3  62 6  o 1.634000  0.4871000     1.762000  0.7156000     1.505000  0.6611000     0.2575000      0.9742000 
1 1 1 3  62 7  o 1.785000  0.4845000     2.271000  0.7577000     1.300000  0.6039000     0.9708000      0.9689000 
1 1 1 3  62 8  o 4.316000  0.3604000     4.332000  0.4941000     4.301000  0.5247000     0.3078000E-01  0.7208000 
1 1 1 3  62 9  o 1.722000  0.5049000     1.759000  0.7212000     1.684000  0.7067000     0.7477000E-01  1.010000  
1 1 1 3  62 10 o 1.763000  0.4814000     1.267000  0.5946000     2.260000  0.7572000     -0.9924000     0.9628000 
1 1 1 3  63 0  o 1.895000  0.9121000     1.895000  0.9121000     1.895000  0.9121000     -0.000000      0.000000  
1 1 1 3  63 1  o 5.910000  0.2919000     5.872000  0.4119000     5.947000  0.4138000     -0.7472000E-01 0.5839000 
1 1 1 3  63 2  o 3.604000  0.4251000     3.891000  0.5617000     3.317000  0.6382000     0.5745000      0.8502000 
1 1 1 3  63 3  o 1.586000  0.4593000     1.132000  0.5480000     2.041000  0.7373000     -0.9092000     0.9187000 
1 1 1 3  63 4  o 4.573000  0.3485000     4.445000  0.5048000     4.700000  0.4805000     -0.2547000     0.6969000 
1 1 1 3  63 5  o 2.174000  0.5308000     2.287000  0.7554000     2.061000  0.7459000     0.2267000      1.062000  
1 1 1 3  63 6  o 1.441000  0.4436000     1.108000  0.5360000     1.774000  0.7070000     -0.6663000     0.8872000 
1 1 1 3  63 7  o 2.212000  0.5340000     2.273000  0.7616000     2.152000  0.7486000     0.1215000      1.068000  
1 1 1 3  63 8  o 4.510000  0.3672000     5.088000  0.4518000     3.932000  0.5791000     1.157000       0.7344000 
1 1 1 3  63 9  o 1.103000  0.3789000     0.9466000 0.4735000     1.259000  0.5916000     -0.3128000     0.7577000 
1 1 1 3  64 0  f 3.531000  0.6760000     3.531000  0.6760000     3.531000  0.6760000     0.000000       0.000000  
1 1 1 3  64 1  o 1.743000  0.5010000     1.737000  0.7065000     1.748000  0.7105000     -0.1121000E-01 1.002000  
1 1 1 3  64 2  o 1.541000  0.4766000     1.560000  0.6814000     1.523000  0.6667000     0.3654000E-01  0.9533000 
1 1 1 3  64 3  o 1.508000  0.4705000     1.644000  0.6992000     1.372000  0.6298000     0.2717000      0.9411000 
1 1 1 3  64 4  o 1.739000  0.4938000     1.623000  0.6793000     1.856000  0.7170000     -0.2328000     0.9877000 
1 1 1 3  64 5  o 2.517000  0.5138000     2.813000  0.7086000     2.220000  0.7442000     0.5937000      1.028000  
1 1 1 3  64 6  o 1.677000  0.4881000     1.475000  0.6542000     1.880000  0.7246000     -0.4052000     0.9762000 
1 1 1 3  64 7  o 2.024000  0.5132000     2.441000  0.7644000     1.608000  0.6850000     0.8325000      1.026000  
1 1 1 3  64 8  o 1.571000  0.4810000     1.359000  0.6250000     1.784000  0.7313000     -0.4247000     0.9620000 
1 1 1 3  65 0  o 1.615000  0.8757000     1.615000  0.8757000     1.615000  0.8757000     -0.000000      0.000000  
1 1 1 3  65 1  o 2.502000  0.5289000     2.277000  0.7663000     2.728000  0.7293000     -0.4510000     1.058000  
1 1 1 3  65 2  o 3.738000  0.4443000     3.048000  0.7284000     4.428000  0.5091000     -1.380000      0.8886000 
1 1 1 3  65 3  o 1.303000  0.4277000     1.378000  0.6272000     1.228000  0.5816000     0.1500000      0.8553000 
1 1 1 3  65 4  o 1.433000  0.4549000     1.349000  0.6215000     1.518000  0.6645000     -0.1688000     0.9099000 
1 1 1 3  65 5  o 1.425000  0.4538000     1.536000  0.6726000     1.314000  0.6094000     0.2220000      0.9076000 
1 1 1 3  65 6  o 1.117000  0.3819000     1.053000  0.5143000     1.180000  0.5648000     -0.1268000     0.7639000 
1 1 1 3  65 7  o 1.598000  0.4783000     1.636000  0.6850000     1.560000  0.6677000     0.7575000E-01  0.9566000 
1 1 1 3  66 0  o 0.6739000 0.4903000     0.6739000 0.4903000     0.6739000 0.4903000     -0.000000      0.000000  
1 1 1 3  66 1  o 1.357000  0.4393000     1.200000  0.5736000     1.514000  0.6655000     -0.3136000     0.8786000 
1 1 1 3  66 2  o 1.977000  0.5112000     1.600000  0.6773000     2.354000  0.7659000     -0.7544000     1.022000  
1 1 1 3  66 3  o 3.499000  0.4762000     4.185000  0.5580000     2.813000  0.7718000     1.372000       0.9524000 
1 1 1 3  66 4  o 3.469000  0.4429000     4.034000  0.5282000     2.904000  0.7111000     1.130000       0.8858000 
1 1 1 3  66 5  f 1.688000  0.4882000     1.494000  0.6554000     1.882000  0.7237000     -0.3881000     0.9764000 
1 1 1 3  67 0  o 5.608000  0.4393000     5.608000  0.4393000     5.608000  0.4393000     -0.000000      0.000000  
1 1 1 3  67 1  o 2.333000  0.5391000     2.217000  0.7615000     2.449000  0.7632000     -0.2315000     1.078000  
1 1 1 3  67 2  o 4.164000  0.3916000     3.884000  0.5807000     4.443000  0.5255000     -0.5591000     0.7831000 
1 1 1 3  67 3  o 1.317000  0.6702000     ?         ?             1.317000  0.6702000     ?              ?         
1 1 1 4  0  1  o 34.98000  0.4386000     34.98000  0.4386000     34.98000  0.4386000     -0.000000      0.000000  
1 1 1 4  0  2  o 1.623000  0.1656000     1.623000  0.1656000     1.623000  0.1656000     0.000000       0.000000  
1 1 1 4  0  3  o 19.98000  0.2272000     19.98000  0.2272000     19.98000  0.2272000     0.000000       0.000000  
1 1 1 4  0  4  o 43.97000  0.4816000     43.97000  0.4816000     43.97000  0.4816000     -0.000000      0.000000  
1 1 1 4  0  5  o 13.45000  0.2483000     13.45000  0.2483000     13.45000  0.2483000     -0.000000      0.000000  
1 1 1 4  0  6  o 20.48000  0.2454000     20.48000  0.2454000     20.48000  0.2454000     -0.000000      0.000000  
1 1 1 4  0  7  o 17.66000  0.2246000     17.66000  0.2246000     17.66000  0.2246000     0.000000       0.000000  
1 1 1 4  0  8  o 20.84000  0.2568000     20.84000  0.2568000     20.84000  0.2568000     0.000000       0.000000  
1 1 1 4  0  9  o 5.450000  0.2360000     5.450000  0.2360000     5.450000  0.2360000     0.000000       0.000000  
1 1 1 4  0  10 o 0.8502000 0.5663000     0.8502000 0.5663000     0.8502000 0.5663000     0.000000       0.000000  
1 1 1 4  0  11 o 14.90000  0.2781000     14.90000  0.2781000     14.90000  0.2781000     0.000000       0.000000  
1 1 1 4  0  12 o 13.17000  0.2504000     13.17000  0.2504000     13.17000  0.2504000     -0.000000      0.000000  
1 1 1 4  0  13 o 8.069000  0.2879000     8.069000  0.2879000     8.069000  0.2879000     0.000000       0.000000  
1 1 1 4  0  14 o 2.685000  0.8374000     2.685000  0.8374000     2.685000  0.8374000     0.000000       0.000000  
1 1 1 4  0  15 o 15.13000  0.3313000     15.13000  0.3313000     15.13000  0.3313000     0.000000       0.000000  
1 1 1 4  0  16 o 2.691000  1.046000      2.691000  1.046000      2.691000  1.046000      -0.000000      0.000000  
1 1 1 4  0  17 o 5.073000  0.5746000     5.073000  0.5746000     5.073000  0.5746000     0.000000       0.000000  
1 1 1 4  0  18 o 1.981000  1.058000      1.981000  1.058000      1.981000  1.058000      0.000000       0.000000  
1 1 1 4  0  19 o 1.836000  1.103000      1.836000  1.103000      1.836000  1.103000      -0.000000      0.000000  
1 1 1 4  0  20 o 3.216000  1.446000      3.216000  1.446000      3.216000  1.446000      -0.000000      0.000000  
1 1 1 4  0  21 o 1.920000  1.152000      1.920000  1.152000      1.920000  1.152000      -0.000000      0.000000  
1 1 1 4  0  22 o 1.482000  0.9490000     1.482000  0.9490000     1.482000  0.9490000     0.000000       0.000000  
1 1 1 4  0  23 o 1.056000  0.7351000     1.056000  0.7351000     1.056000  0.7351000     -0.000000      0.000000  
1 1 1 4  0  24 o 3.018000  0.9030000     3.018000  0.9030000     3.018000  0.9030000     0.000000       0.000000  
1 1 1 4  0  25 f 2.105000  1.128000      2.105000  1.128000      2.105000  1.128000      -0.000000      0.000000  
1 1 1 4  0  26 o 1.886000  0.9458000     1.886000  0.9458000     1.886000  0.9458000     -0.000000      0.000000  
1 1 1 4  0  27 o 0.6842000 0.5000000     0.6842000 0.5000000     0.6842000 0.5000000     0.000000       0.000000  
1 1 1 4  1  0  o 58.67000  0.8992000     58.67000  0.8992000     58.67000  0.8992000     -0.000000      0.000000  
1 1 1 4  1  1  o 32.08000  0.2664000     32.12000  0.3488000     32.04000  0.4027000     0.8158000E-01  0.5327000 
1 1 1 4  1  2  o 50.27000  0.3860000     50.56000  0.5489000     49.98000  0.5428000     0.5882000      0.7719000 
1 1 1 4  1  3  o 16.48000  0.1360000     16.56000  0.1931000     16.41000  0.1915000     0.1500000      0.2720000 
1 1 1 4  1  4  o 19.69000  0.1617000     19.48000  0.2266000     19.91000  0.2309000     -0.4238000     0.3235000 
1 1 1 4  1  5  o 17.54000  0.2118000     17.44000  0.2981000     17.63000  0.3009000     -0.1843000     0.4235000 
1 1 1 4  1  6  o 14.04000  0.1337000     13.89000  0.1879000     14.20000  0.1903000     -0.3115000     0.2675000 
1 1 1 4  1  7  o 14.20000  0.1394000     14.19000  0.1970000     14.20000  0.1973000     -0.9780000E-02 0.2788000 
1 1 1 4  1  8  o 16.62000  0.1562000     16.66000  0.2211000     16.59000  0.2207000     0.6611000E-01  0.3124000 
1 1 1 4  1  9  o 7.423000  0.1475000     7.579000  0.2054000     7.267000  0.2118000     0.3125000      0.2950000 
1 1 1 4  1  10 o 1.826000  0.4220000     1.478000  0.5851000     2.174000  0.6085000     -0.6959000     0.8441000 
1 1 1 4  1  11 f 2.370000  0.4647000     2.344000  0.6496000     2.396000  0.6647000     -0.5110000E-01 0.9293000 
1 1 1 4  1  12 o 18.02000  0.1904000     18.23000  0.2701000     17.81000  0.2683000     0.4153000      0.3807000 
1 1 1 4  1  13 o 3.858000  0.3610000     4.315000  0.4458000     3.400000  0.5679000     0.9152000      0.7220000 
1 1 1 4  1  14 o 13.24000  0.1962000     13.50000  0.2783000     12.97000  0.2766000     0.5291000      0.3924000 
1 1 1 4  1  15 o 18.24000  0.2432000     18.14000  0.3449000     18.34000  0.3431000     -0.2053000     0.4865000 
1 1 1 4  1  16 o 9.312000  0.2807000     8.538000  0.4092000     10.09000  0.3843000     -1.547000      0.5614000 
1 1 1 4  1  17 o 6.733000  0.3121000     6.789000  0.4447000     6.677000  0.4380000     0.1121000      0.6242000 
1 1 1 4  1  18 f 2.941000  0.6108000     3.572000  0.8294000     2.310000  0.8968000     1.261000       1.222000  
1 1 1 4  1  19 o 9.942000  0.3318000     10.22000  0.4671000     9.665000  0.4715000     0.5531000      0.6636000 
1 1 1 4  1  20 o 3.747000  0.8016000     4.590000  1.119000      2.904000  1.148000      1.686000       1.603000  
1 1 1 4  1  21 o 3.665000  0.7388000     3.835000  1.041000      3.495000  1.049000      0.3401000      1.478000  
1 1 1 4  1  22 o 1.733000  0.5616000     1.864000  0.8316000     1.602000  0.7551000     0.2622000      1.123000  
1 1 1 4  1  23 o 3.318000  0.5930000     3.237000  0.8519000     3.398000  0.8251000     -0.1614000     1.186000  
1 1 1 4  1  24 o 1.753000  0.5182000     1.471000  0.6749000     2.035000  0.7865000     -0.5637000     1.036000  
1 1 1 4  1  25 o 1.788000  0.5738000     1.936000  0.8543000     1.640000  0.7662000     0.2953000      1.148000  
1 1 1 4  1  26 o 1.753000  0.5241000     1.665000  0.7241000     1.840000  0.7580000     -0.1744000     1.048000  
1 1 1 4  1  27 o 1.809000  0.5139000     1.392000  0.6497000     2.227000  0.7964000     -0.8349000     1.028000  
1 1 1 4  2  0  o 28.49000  0.3576000     28.49000  0.3576000     28.49000  0.3576000     0.000000       0.000000  
1 1 1 4  2  1  o 42.03000  0.3227000     41.90000  0.4544000     42.16000  0.4583000     -0.2576000     0.6454000 
1 1 1 4  2  2  o 2.711000  0.8107000E-01 2.647000  0.1181000     2.775000  0.1111000     -0.1279000     0.1621000 
1 1 1 4  2  3  o 18.82000  0.1527000     18.55000  0.2132000     19.08000  0.2187000     -0.5232000     0.3054000 
1 1 1 4  2  4  o 60.37000  0.4661000     60.20000  0.6574000     60.54000  0.6609000     -0.3357000     0.9322000 
1 1 1 4  2  5  f 13.17000  0.1739000     13.15000  0.2456000     13.19000  0.2464000     -0.3904000E-01 0.3479000 
1 1 1 4  2  6  o 14.74000  0.1379000     14.90000  0.1964000     14.59000  0.1936000     0.3077000      0.2758000 
1 1 1 4  2  7  o 22.92000  0.1929000     23.00000  0.2736000     22.84000  0.2719000     0.1624000      0.3857000 
1 1 1 4  2  8  o 10.39000  0.1304000     10.30000  0.1838000     10.49000  0.1851000     -0.1921000     0.2608000 
1 1 1 4  2  9  o 10.20000  0.1427000     10.15000  0.2032000     10.24000  0.2005000     -0.8530000E-01 0.2854000 
1 1 1 4  2  10 o 6.903000  0.1866000     7.117000  0.2628000     6.688000  0.2650000     0.4296000      0.3732000 
1 1 1 4  2  11 o 3.629000  0.3367000     3.922000  0.4458000     3.337000  0.5046000     0.5842000      0.6733000 
1 1 1 4  2  12 o 11.78000  0.1749000     11.68000  0.2471000     11.88000  0.2476000     -0.2006000     0.3498000 
1 1 1 4  2  13 o 14.39000  0.1856000     14.80000  0.2634000     13.99000  0.2615000     0.8064000      0.3712000 
1 1 1 4  2  14 o 10.56000  0.2035000     10.63000  0.2859000     10.50000  0.2895000     0.1334000      0.4069000 
1 1 1 4  2  15 f 9.732000  0.2866000     10.07000  0.3554000     9.391000  0.4497000     0.6821000      0.5732000 
1 1 1 4  2  16 o 6.274000  0.3573000     6.251000  0.5094000     6.297000  0.5011000     -0.4603000E-01 0.7146000 
1 1 1 4  2  17 o 12.39000  0.2322000     12.43000  0.3264000     12.35000  0.3304000     0.7902000E-01  0.4644000 
1 1 1 4  2  18 o 5.353000  0.4233000     4.642000  0.6635000     6.063000  0.5259000     -1.421000      0.8466000 
1 1 1 4  2  19 o 2.545000  0.6992000     2.757000  1.022000      2.333000  0.9541000     0.4234000      1.398000  
1 1 1 4  2  20 o 4.993000  0.7321000     4.085000  1.179000      5.901000  0.8689000     -1.816000      1.464000  
1 1 1 4  2  21 o 2.186000  0.6887000     2.315000  1.027000      2.058000  0.9183000     0.2575000      1.377000  
1 1 1 4  2  22 o 1.776000  0.5716000     1.536000  0.7311000     2.016000  0.8789000     -0.4792000     1.143000  
1 1 1 4  2  23 o 2.287000  0.6175000     2.143000  0.8574000     2.431000  0.8888000     -0.2887000     1.235000  
1 1 1 4  2  24 o 2.831000  0.5820000     2.880000  0.8231000     2.782000  0.8231000     0.9810000E-01  1.164000  
1 1 1 4  2  25 o 1.799000  0.5733000     1.925000  0.8465000     1.674000  0.7736000     0.2514000      1.147000  
1 1 1 4  2  26 o 1.834000  0.5277000     1.741000  0.7296000     1.927000  0.7625000     -0.1864000     1.055000  
1 1 1 4  2  27 o 1.632000  0.5048000     1.736000  0.7400000     1.528000  0.6867000     0.2085000      1.010000  
1 1 1 4  3  0  f 39.96000  0.4334000     39.96000  0.4334000     39.96000  0.4334000     -0.000000      0.000000  
1 1 1 4  3  1  o 8.309000  0.8372000E-01 8.371000  0.1185000     8.248000  0.1183000     0.1232000      0.1674000 
1 1 1 4  3  2  o 45.15000  0.3470000     45.28000  0.4921000     45.03000  0.4894000     0.2529000      0.6941000 
1 1 1 4  3  3  o 23.16000  0.1842000     22.91000  0.2579000     23.42000  0.2632000     -0.5091000     0.3685000 
1 1 1 4  3  4  o 14.83000  0.1297000     14.73000  0.1825000     14.93000  0.1845000     -0.1985000     0.2595000 
1 1 1 4  3  5  o 6.284000  0.1533000     6.203000  0.2228000     6.364000  0.2107000     -0.1611000     0.3067000 
1 1 1 4  3  6  o 11.08000  0.1208000     10.97000  0.1697000     11.18000  0.1719000     -0.2075000     0.2416000 
1 1 1 4  3  7  o 20.78000  0.1788000     20.82000  0.2535000     20.74000  0.2523000     0.7627000E-01  0.3576000 
1 1 1 4  3  8  o 13.53000  0.1413000     13.60000  0.1998000     13.46000  0.1998000     0.1461000      0.2826000 
1 1 1 4  3  9  o 9.586000  0.1420000     9.760000  0.2005000     9.412000  0.2012000     0.3477000      0.2840000 
1 1 1 4  3  10 o 5.702000  0.2048000     5.869000  0.2870000     5.534000  0.2922000     0.3352000      0.4096000 
1 1 1 4  3  11 o 18.58000  0.1862000     18.17000  0.2601000     18.99000  0.2666000     -0.8199000     0.3725000 
1 1 1 4  3  12 o 13.24000  0.1763000     13.27000  0.2502000     13.22000  0.2485000     0.4188000E-01  0.3526000 
1 1 1 4  3  13 o 1.660000  0.4693000     1.910000  0.7041000     1.410000  0.6207000     0.5007000      0.9387000 
1 1 1 4  3  14 o 7.519000  0.2346000     7.404000  0.3383000     7.633000  0.3251000     -0.2291000     0.4692000 
1 1 1 4  3  15 o 7.526000  0.2863000     7.111000  0.4198000     7.941000  0.3894000     -0.8302000     0.5726000 
1 1 1 4  3  16 o 5.722000  0.4004000     5.157000  0.6260000     6.287000  0.4994000     -1.130000      0.8008000 
1 1 1 4  3  17 o 5.756000  0.3618000     5.261000  0.5417000     6.252000  0.4797000     -0.9917000     0.7235000 
1 1 1 4  3  18 o 7.014000  0.3403000     7.856000  0.4306000     6.172000  0.5271000     1.685000       0.6806000 
1 1 1 4  3  19 o 3.162000  0.6185000     1.923000  0.8726000     4.401000  0.8769000     -2.478000      1.237000  
1 1 1 4  3  20 o 2.592000  0.7609000     2.298000  1.031000      2.885000  1.120000      -0.5864000     1.522000  
1 1 1 4  3  21 o 2.488000  0.7226000     2.154000  0.9864000     2.822000  1.056000      -0.6674000     1.445000  
1 1 1 4  3  22 o 1.986000  0.5994000     2.280000  0.9078000     1.692000  0.7829000     0.5879000      1.199000  
1 1 1 4  3  23 o 2.022000  0.5958000     1.890000  0.8234000     2.155000  0.8614000     -0.2646000     1.192000  
1 1 1 4  3  24 o 1.706000  0.5233000     1.616000  0.7139000     1.795000  0.7653000     -0.1790000     1.047000  
1 1 1 4  3  25 o 2.071000  0.5874000     2.821000  0.9749000     1.321000  0.6554000     1.500000       1.175000  
1 1 1 4  3  26 o 1.899000  0.5213000     1.361000  0.6397000     2.436000  0.8232000     -1.074000      1.043000  
1 1 1 4  3  27 o 1.701000  0.5059000     1.957000  0.7653000     1.444000  0.6619000     0.5134000      1.012000  
1 1 1 4  4  0  o 42.56000  0.4619000     42.56000  0.4619000     42.56000  0.4619000     0.000000       0.000000  
1 1 1 4  4  1  o 43.03000  0.3306000     43.37000  0.4713000     42.68000  0.4638000     0.6887000      0.6612000 
1 1 1 4  4  2  o 7.276000  0.8242000E-01 7.400000  0.1174000     7.152000  0.1157000     0.2480000      0.1648000 
1 1 1 4  4  3  o 28.66000  0.2323000     28.88000  0.3693000     28.44000  0.2820000     0.4408000      0.4647000 
1 1 1 4  4  4  o 34.32000  0.2692000     34.41000  0.3818000     34.22000  0.3795000     0.1900000      0.5383000 
1 1 1 4  4  5  o 11.59000  0.1652000     11.88000  0.2397000     11.30000  0.2274000     0.5757000      0.3304000 
1 1 1 4  4  6  o 24.96000  0.2049000     25.06000  0.2907000     24.85000  0.2889000     0.2109000      0.4098000 
1 1 1 4  4  7  o 21.92000  0.1868000     22.06000  0.2652000     21.79000  0.2631000     0.2644000      0.3735000 
1 1 1 4  4  8  f 16.74000  0.1583000     16.77000  0.2242000     16.72000  0.2236000     0.4987000E-01  0.3167000 
1 1 1 4  4  9  o 5.478000  0.1702000     5.427000  0.2417000     5.529000  0.2396000     -0.1014000     0.3403000 
1 1 1 4  4  10 o 10.23000  0.1752000     10.15000  0.2480000     10.31000  0.2476000     -0.1548000     0.3504000 
1 1 1 4  4  11 o 12.96000  0.1662000     12.88000  0.2331000     13.05000  0.2369000     -0.1650000     0.3323000 
1 1 1 4  4  12 o 7.272000  0.2064000     7.343000  0.2916000     7.202000  0.2920000     0.1410000      0.4127000 
1 1 1 4  4  13 o 17.11000  0.1937000     16.88000  0.2725000     17.34000  0.2753000     -0.4595000     0.3873000 
1 1 1 4  4  14 o 1.853000  0.5172000     1.901000  0.7339000     1.806000  0.7288000     0.9554000E-01  1.034000  
1 1 1 4  4  15 o 17.48000  0.2418000     17.65000  0.3411000     17.32000  0.3429000     0.3321000      0.4837000 
1 1 1 4  4  16 o 6.891000  0.3389000     6.757000  0.4965000     7.025000  0.4613000     -0.2687000     0.6777000 
1 1 1 4  4  17 o 1.549000  0.5032000     1.774000  0.7734000     1.323000  0.6440000     0.4512000      1.006000  
1 1 1 4  4  18 f 5.161000  0.4662000     5.622000  0.5749000     4.699000  0.7342000     0.9233000      0.9325000 
1 1 1 4  4  19 o 2.564000  0.6863000     1.969000  0.8944000     3.160000  1.041000      -1.191000      1.373000  
1 1 1 4  4  20 o 7.865000  0.5122000     7.841000  0.7244000     7.888000  0.7243000     -0.4716000E-01 1.024000  
1 1 1 4  4  21 o 3.276000  0.7194000     3.438000  1.006000      3.115000  1.029000      0.3227000      1.439000  
1 1 1 4  4  22 o 5.863000  0.4361000     5.885000  0.6083000     5.840000  0.6251000     0.4506000E-01  0.8722000 
1 1 1 4  4  23 o 1.749000  0.5479000     1.394000  0.6721000     2.105000  0.8654000     -0.7116000     1.096000  
1 1 1 4  4  24 o 2.632000  0.5722000     2.638000  0.8109000     2.627000  0.8075000     0.1123000E-01  1.144000  
1 1 1 4  4  25 o 1.676000  0.5395000     2.081000  0.8673000     1.271000  0.6420000     0.8101000      1.079000  
1 1 1 4  4  26 o 1.633000  0.4985000     1.307000  0.6227000     1.959000  0.7786000     -0.6516000     0.9970000 
1 1 1 4  4  27 o 2.109000  0.5277000     1.605000  0.7152000     2.613000  0.7761000     -1.008000      1.055000  
1 1 1 4  5  0  o 4.026000  0.8678000E-01 4.026000  0.8678000E-01 4.026000  0.8678000E-01 0.000000       0.000000  
1 1 1 4  5  1  o 34.94000  0.2697000     34.81000  0.3800000     35.06000  0.3827000     -0.2525000     0.5393000 
1 1 1 4  5  2  f 7.880000  0.7875000E-01 7.866000  0.1117000     7.893000  0.1111000     -0.2678000E-01 0.1575000 
1 1 1 4  5  3  o 25.99000  0.2048000     25.98000  0.2895000     26.01000  0.2898000     -0.3216000E-01 0.4096000 
1 1 1 4  5  4  o 19.00000  0.1572000     18.77000  0.2195000     19.22000  0.2251000     -0.4546000     0.3144000 
1 1 1 4  5  5  o 13.54000  0.2578000     13.42000  0.3654000     13.65000  0.3637000     -0.2361000     0.5156000 
1 1 1 4  5  6  o 15.58000  0.1439000     15.64000  0.2038000     15.52000  0.2032000     0.1220000      0.2878000 
1 1 1 4  5  7  o 12.64000  0.1328000     12.83000  0.1891000     12.46000  0.1865000     0.3741000      0.2656000 
1 1 1 4  5  8  o 12.93000  0.1399000     13.03000  0.1987000     12.83000  0.1969000     0.1983000      0.2797000 
1 1 1 4  5  9  o 20.37000  0.1847000     20.29000  0.2606000     20.45000  0.2618000     -0.1616000     0.3694000 
1 1 1 4  5  10 o 4.366000  0.3145000     4.475000  0.4343000     4.256000  0.4551000     0.2192000      0.6291000 
1 1 1 4  5  11 o 4.571000  0.2479000     4.693000  0.3426000     4.450000  0.3583000     0.2428000      0.4958000 
1 1 1 4  5  12 o 6.836000  0.2148000     6.734000  0.3041000     6.939000  0.3035000     -0.2055000     0.4297000 
1 1 1 4  5  13 o 11.30000  0.1883000     11.16000  0.2684000     11.43000  0.2643000     -0.2668000     0.3767000 
1 1 1 4  5  14 o 13.35000  0.1990000     13.47000  0.2830000     13.24000  0.2798000     0.2326000      0.3980000 
1 1 1 4  5  15 o 4.097000  0.4776000     4.095000  0.6615000     4.098000  0.6891000     -0.3562000E-02 0.9552000 
1 1 1 4  5  16 o 15.61000  0.2361000     15.71000  0.3071000     15.51000  0.3586000     0.1990000      0.4721000 
1 1 1 4  5  17 o 4.358000  0.4954000     3.874000  0.7659000     4.842000  0.6286000     -0.9674000     0.9909000 
1 1 1 4  5  18 f 10.09000  0.2741000     10.40000  0.3787000     9.779000  0.3964000     0.6253000      0.5483000 
1 1 1 4  5  19 o 7.677000  0.4019000     7.414000  0.5913000     7.940000  0.5443000     -0.5260000     0.8037000 
1 1 1 4  5  20 o 5.254000  0.7224000     5.435000  1.004000      5.073000  1.039000      0.3620000      1.445000  
1 1 1 4  5  21 o 1.823000  0.5932000     1.913000  0.8660000     1.734000  0.8109000     0.1789000      1.186000  
1 1 1 4  5  22 o 2.037000  0.6309000     2.100000  0.8910000     1.974000  0.8935000     0.1265000      1.262000  
1 1 1 4  5  23 o 2.535000  0.6343000     2.465000  0.8941000     2.604000  0.9000000     -0.1391000     1.269000  
1 1 1 4  5  24 o 1.230000  0.4226000     1.332000  0.6357000     1.128000  0.5570000     0.2040000      0.8453000 
1 1 1 4  5  25 o 1.686000  0.5501000     1.500000  0.7249000     1.872000  0.8278000     -0.3720000     1.100000  
1 1 1 4  5  26 o 1.460000  0.4739000     1.339000  0.6314000     1.580000  0.7069000     -0.2401000     0.9478000 
1 1 1 4  5  27 o 1.168000  0.4031000     1.215000  0.5883000     1.120000  0.5512000     0.9472000E-01  0.8061000 
1 1 1 4  6  0  o 18.63000  0.2104000     18.63000  0.2104000     18.63000  0.2104000     -0.000000      0.000000  
1 1 1 4  6  1  o 17.31000  0.1395000     17.31000  0.1973000     17.30000  0.1972000     0.9363000E-02  0.2790000 
1 1 1 4  6  2  o 13.58000  0.1151000     13.53000  0.1622000     13.64000  0.1634000     -0.1107000     0.2303000 
1 1 1 4  6  3  o 30.27000  0.2370000     30.16000  0.3340000     30.39000  0.3364000     -0.2212000     0.4741000 
1 1 1 4  6  4  o 13.61000  0.1324000     13.66000  0.2024000     13.56000  0.1707000     0.1012000      0.2648000 
1 1 1 4  6  5  o 12.33000  0.1502000     12.34000  0.2484000     12.33000  0.1690000     0.1532000E-01  0.3004000 
1 1 1 4  6  6  o 27.74000  0.2250000     27.52000  0.3157000     27.96000  0.3207000     -0.4401000     0.4500000 
1 1 1 4  6  7  o 18.40000  0.1640000     18.25000  0.2307000     18.56000  0.2333000     -0.3122000     0.3281000 
1 1 1 4  6  8  o 27.99000  0.2311000     27.98000  0.3267000     28.00000  0.3269000     -0.2476000E-01 0.4622000 
1 1 1 4  6  9  o 10.58000  0.1437000     10.60000  0.2033000     10.56000  0.2032000     0.3523000E-01  0.2874000 
1 1 1 4  6  10 o 5.824000  0.2733000     5.225000  0.4048000     6.424000  0.3673000     -1.199000      0.5466000 
1 1 1 4  6  11 o 7.116000  0.1870000     7.182000  0.2648000     7.051000  0.2641000     0.1308000      0.3740000 
1 1 1 4  6  12 o 10.69000  0.1820000     10.68000  0.2561000     10.69000  0.2586000     -0.1091000E-01 0.3640000 
1 1 1 4  6  13 o 7.286000  0.2242000     7.186000  0.3217000     7.386000  0.3124000     -0.2007000     0.4484000 
1 1 1 4  6  14 o 7.945000  0.2315000     8.076000  0.3274000     7.814000  0.3273000     0.2626000      0.4629000 
1 1 1 4  6  15 o 11.62000  0.2474000     11.03000  0.3577000     12.20000  0.3418000     -1.166000      0.4948000 
1 1 1 4  6  16 o 3.477000  0.5282000     2.643000  0.8592000     4.310000  0.6146000     -1.666000      1.056000  
1 1 1 4  6  17 o 4.161000  0.5014000     4.258000  0.6846000     4.064000  0.7326000     0.1942000      1.003000  
1 1 1 4  6  18 o 8.180000  0.3102000     8.039000  0.4406000     8.321000  0.4368000     -0.2821000     0.6204000 
1 1 1 4  6  19 o 6.197000  0.5000000     6.746000  0.6600000     5.647000  0.7513000     1.099000       1.000000  
1 1 1 4  6  20 o 2.158000  0.7032000     2.157000  0.9977000     2.159000  0.9913000     -0.2979000E-02 1.406000  
1 1 1 4  6  21 f 2.789000  0.6978000     2.381000  0.9649000     3.197000  1.008000      -0.8164000     1.396000  
1 1 1 4  6  22 o 2.252000  0.6359000     2.675000  0.9660000     1.830000  0.8271000     0.8456000      1.272000  
1 1 1 4  6  23 o 2.533000  0.6310000     2.478000  0.8880000     2.589000  0.8967000     -0.1108000     1.262000  
1 1 1 4  6  24 o 1.919000  0.5515000     1.887000  0.7726000     1.951000  0.7871000     -0.6453000E-01 1.103000  
1 1 1 4  6  25 o 1.742000  0.5674000     1.927000  0.8615000     1.558000  0.7386000     0.3692000      1.135000  
1 1 1 4  6  26 o 1.235000  0.4217000     1.281000  0.6152000     1.189000  0.5768000     0.9284000E-01  0.8433000 
1 1 1 4  6  27 o 1.778000  0.5252000     1.679000  0.7278000     1.877000  0.7575000     -0.1984000     1.050000  
1 1 1 4  7  0  o 7.383000  0.1107000     7.383000  0.1107000     7.383000  0.1107000     0.000000       0.000000  
1 1 1 4  7  1  o 18.17000  0.1469000     18.36000  0.2098000     17.97000  0.2058000     0.3871000      0.2938000 
1 1 1 4  7  2  o 15.73000  0.1313000     15.74000  0.1857000     15.73000  0.1857000     0.2657000E-02  0.2626000 
1 1 1 4  7  3  o 18.88000  0.1547000     18.57000  0.2158000     19.19000  0.2216000     -0.6193000     0.3093000 
1 1 1 4  7  4  o 13.35000  0.1469000     13.49000  0.2407000     13.21000  0.1685000     0.2741000      0.2938000 
1 1 1 4  7  5  o 7.657000  0.1725000     7.476000  0.3220000     7.838000  0.1241000     -0.3622000     0.3451000 
1 1 1 4  7  6  o 6.168000  0.1306000     5.959000  0.1589000     6.377000  0.2074000     -0.4180000     0.2612000 
1 1 1 4  7  7  o 12.41000  0.1326000     12.41000  0.1876000     12.41000  0.1873000     -0.8268000E-03 0.2651000 
1 1 1 4  7  8  f 20.67000  0.1826000     20.72000  0.2588000     20.61000  0.2577000     0.1056000      0.3653000 
1 1 1 4  7  9  o 10.31000  0.1445000     10.50000  0.2035000     10.11000  0.2052000     0.3874000      0.2890000 
1 1 1 4  7  10 o 8.084000  0.2309000     8.178000  0.3283000     7.991000  0.3248000     0.1862000      0.4619000 
1 1 1 4  7  11 o 8.662000  0.1747000     8.666000  0.2448000     8.658000  0.2492000     0.7112000E-02  0.3493000 
1 1 1 4  7  12 o 6.179000  0.2270000     6.315000  0.3105000     6.042000  0.3313000     0.2738000      0.4541000 
1 1 1 4  7  13 o 10.46000  0.1894000     10.49000  0.2699000     10.43000  0.2660000     0.5877000E-01  0.3789000 
1 1 1 4  7  14 f 10.96000  0.2045000     11.13000  0.2938000     10.79000  0.2845000     0.3356000      0.4089000 
1 1 1 4  7  15 o 10.59000  0.2821000     10.64000  0.3625000     10.53000  0.4323000     0.1135000      0.5642000 
1 1 1 4  7  16 o 7.162000  0.2988000     6.947000  0.4226000     7.377000  0.4225000     -0.4300000     0.5976000 
1 1 1 4  7  17 o 8.231000  0.2915000     8.711000  0.3912000     7.751000  0.4322000     0.9596000      0.5829000 
1 1 1 4  7  18 o 2.276000  0.6082000     1.665000  0.7663000     2.886000  0.9447000     -1.221000      1.216000  
1 1 1 4  7  19 o 5.481000  0.5488000     6.218000  0.6951000     4.743000  0.8496000     1.474000       1.098000  
1 1 1 4  7  20 o 5.455000  0.8853000     4.685000  1.207000      6.226000  1.295000      -1.541000      1.771000  
1 1 1 4  7  21 o 2.733000  0.7007000     3.004000  1.013000      2.461000  0.9688000     0.5423000      1.401000  
1 1 1 4  7  22 o 2.128000  0.6171000     1.721000  0.7937000     2.535000  0.9451000     -0.8145000     1.234000  
1 1 1 4  7  23 o 1.951000  0.5674000     2.297000  0.8642000     1.605000  0.7355000     0.6927000      1.135000  
1 1 1 4  7  24 o 1.195000  0.4133000     1.245000  0.6033000     1.145000  0.5650000     0.9986000E-01  0.8265000 
1 1 1 4  7  25 o 1.480000  0.5071000     1.485000  0.7249000     1.475000  0.7093000     0.9015000E-02  1.014000  
1 1 1 4  7  26 o 1.616000  0.4938000     1.891000  0.7596000     1.341000  0.6313000     0.5502000      0.9877000 
1 1 1 4  7  27 o 1.274000  0.4312000     1.229000  0.5931000     1.319000  0.6262000     -0.9035000E-01 0.8625000 
1 1 1 4  8  0  o 7.263000  0.1148000     7.263000  0.1148000     7.263000  0.1148000     0.000000       0.000000  
1 1 1 4  8  1  o 15.58000  0.1301000     15.44000  0.1824000     15.72000  0.1857000     -0.2799000     0.2602000 
1 1 1 4  8  2  o 17.05000  0.1411000     17.02000  0.1993000     17.08000  0.1999000     -0.5704000E-01 0.2823000 
1 1 1 4  8  3  o 11.82000  0.1194000     11.98000  0.1559000     11.67000  0.1807000     0.3074000      0.2387000 
1 1 1 4  8  4  o 27.34000  0.3086000     27.34000  0.3086000     ?         ?             ?              ?         
1 1 1 4  8  5  o 22.98000  0.2260000     22.62000  0.3631000     23.35000  0.2692000     -0.7246000     0.4520000 
1 1 1 4  8  6  o 2.433000  0.1880000     2.471000  0.2564000     2.395000  0.2750000     0.7586000E-01  0.3759000 
1 1 1 4  8  7  o 13.25000  0.1333000     13.51000  0.1890000     13.00000  0.1881000     0.5060000      0.2667000 
1 1 1 4  8  8  o 29.81000  0.2446000     30.28000  0.3506000     29.34000  0.3411000     0.9410000      0.4891000 
1 1 1 4  8  9  o 19.61000  0.1809000     19.60000  0.2560000     19.62000  0.2557000     -0.2254000E-01 0.3619000 
1 1 1 4  8  10 o 12.67000  0.2260000     12.73000  0.3246000     12.61000  0.3146000     0.1272000      0.4521000 
1 1 1 4  8  11 o 3.428000  0.3253000     3.205000  0.4995000     3.652000  0.4167000     -0.4474000     0.6505000 
1 1 1 4  8  12 o 6.170000  0.2326000     6.178000  0.3336000     6.162000  0.3242000     0.1600000E-01  0.4652000 
1 1 1 4  8  13 o 8.516000  0.2049000     8.482000  0.2906000     8.549000  0.2890000     -0.6677000E-01 0.4098000 
1 1 1 4  8  14 o 11.13000  0.2073000     11.03000  0.2937000     11.22000  0.2925000     -0.1868000     0.4145000 
1 1 1 4  8  15 o 8.294000  0.3451000     8.383000  0.4772000     8.205000  0.4988000     0.1775000      0.6903000 
1 1 1 4  8  16 o 8.085000  0.2737000     8.255000  0.3796000     7.915000  0.3944000     0.3403000      0.5474000 
1 1 1 4  8  17 o 7.720000  0.2968000     7.691000  0.4262000     7.748000  0.4131000     -0.5719000E-01 0.5936000 
1 1 1 4  8  18 o 3.259000  0.6730000     3.338000  0.9096000     3.181000  0.9923000     0.1571000      1.346000  
1 1 1 4  8  19 o 8.046000  0.3922000     7.661000  0.5961000     8.430000  0.5098000     -0.7685000     0.7844000 
1 1 1 4  8  20 o 2.855000  0.8701000     2.313000  1.103000      3.396000  1.346000      -1.083000      1.740000  
1 1 1 4  8  21 o 4.688000  0.5788000     4.877000  0.8023000     4.498000  0.8346000     0.3791000      1.158000  
1 1 1 4  8  22 o 1.939000  0.5870000     1.530000  0.7333000     2.348000  0.9169000     -0.8181000     1.174000  
1 1 1 4  8  23 o 2.561000  0.6081000     2.996000  0.8783000     2.125000  0.8413000     0.8707000      1.216000  
1 1 1 4  8  24 o 2.104000  0.5398000     1.551000  0.7060000     2.658000  0.8168000     -1.107000      1.080000  
1 1 1 4  8  25 o 1.577000  0.5279000     1.473000  0.7142000     1.681000  0.7777000     -0.2077000     1.056000  
1 1 1 4  8  26 o 1.460000  0.4769000     1.439000  0.6683000     1.481000  0.6805000     -0.4212000E-01 0.9539000 
1 1 1 4  8  27 o 1.452000  0.4751000     1.531000  0.6873000     1.373000  0.6561000     0.1575000      0.9502000 
1 1 1 4  9  0  o 34.20000  0.3770000     34.20000  0.3770000     34.20000  0.3770000     -0.000000      0.000000  
1 1 1 4  9  1  o 4.314000  0.8398000E-01 4.267000  0.1189000     4.362000  0.1187000     -0.9518000E-01 0.1680000 
1 1 1 4  9  2  o 11.63000  0.1075000     11.58000  0.1517000     11.68000  0.1523000     -0.1035000     0.2150000 
1 1 1 4  9  3  o 31.16000  0.3005000     31.12000  0.4903000     31.20000  0.3475000     -0.8177000E-01 0.6009000 
1 1 1 4  9  4  f 8.964000  0.1443000     8.876000  0.1997000     9.052000  0.2083000     -0.1760000     0.2886000 
1 1 1 4  9  5  o 29.53000  0.2354000     30.12000  0.3389000     28.93000  0.3266000     1.194000       0.4707000 
1 1 1 4  9  6  o 23.06000  0.1905000     23.26000  0.2710000     22.86000  0.2677000     0.3960000      0.3809000 
1 1 1 4  9  7  o 29.85000  0.2413000     29.73000  0.3394000     29.97000  0.3431000     -0.2423000     0.4826000 
1 1 1 4  9  8  o 9.382000  0.1285000     9.349000  0.1795000     9.415000  0.1840000     -0.6535000E-01 0.2570000 
1 1 1 4  9  9  o 10.12000  0.1452000     10.10000  0.2047000     10.14000  0.2059000     -0.3596000E-01 0.2904000 
1 1 1 4  9  10 o 10.62000  0.2260000     10.77000  0.3140000     10.46000  0.3251000     0.3050000      0.4520000 
1 1 1 4  9  11 o 5.688000  0.2249000     5.613000  0.3199000     5.763000  0.3162000     -0.1500000     0.4498000 
1 1 1 4  9  12 o 9.916000  0.1869000     9.952000  0.2674000     9.881000  0.2611000     0.7034000E-01  0.3737000 
1 1 1 4  9  13 o 4.850000  0.2978000     5.021000  0.4068000     4.680000  0.4349000     0.3412000      0.5955000 
1 1 1 4  9  14 o 14.56000  0.1988000     14.64000  0.2816000     14.48000  0.2807000     0.1601000      0.3976000 
1 1 1 4  9  15 o 11.64000  0.3077000     11.36000  0.4420000     11.93000  0.4282000     -0.5752000     0.6154000 
1 1 1 4  9  16 o 2.245000  0.5945000     2.185000  0.8392000     2.304000  0.8424000     -0.1188000     1.189000  
1 1 1 4  9  17 o 10.84000  0.2488000     11.15000  0.3471000     10.53000  0.3567000     0.6192000      0.4976000 
1 1 1 4  9  18 o 2.350000  0.6463000     2.617000  0.9284000     2.082000  0.8994000     0.5350000      1.293000  
1 1 1 4  9  19 o 2.844000  0.7313000     2.716000  1.037000      2.972000  1.032000      -0.2561000     1.463000  
1 1 1 4  9  20 o 2.501000  1.093000      2.501000  1.093000      ?         ?             ?              ?         
1 1 1 4  9  21 o 2.344000  0.6789000     2.364000  0.9682000     2.325000  0.9520000     0.3940000E-01  1.358000  
1 1 1 4  9  22 o 2.422000  0.6580000     2.305000  0.9266000     2.539000  0.9344000     -0.2333000     1.316000  
1 1 1 4  9  23 o 1.590000  0.5118000     1.557000  0.7158000     1.623000  0.7317000     -0.6594000E-01 1.024000  
1 1 1 4  9  24 o 1.416000  0.4665000     1.439000  0.6672000     1.393000  0.6522000     0.4626000E-01  0.9330000 
1 1 1 4  9  25 o 2.205000  0.6407000     2.607000  0.9911000     1.804000  0.8122000     0.8024000      1.281000  
1 1 1 4  9  26 o 1.416000  0.4567000     1.121000  0.5513000     1.712000  0.7284000     -0.5916000     0.9135000 
1 1 1 4  9  27 o 1.552000  0.4834000     1.231000  0.5948000     1.874000  0.7620000     -0.6426000     0.9667000 
1 1 1 4  10 0  o 23.95000  0.2712000     23.95000  0.2712000     23.95000  0.2712000     0.000000       0.000000  
1 1 1 4  10 1  o 16.79000  0.1409000     16.71000  0.1984000     16.87000  0.2001000     -0.1619000     0.2818000 
1 1 1 4  10 2  o 4.514000  0.9129000E-01 4.627000  0.1289000     4.400000  0.1293000     0.2271000      0.1826000 
1 1 1 4  10 3  o 9.373000  0.1984000     9.373000  0.1984000     ?         ?             ?              ?         
1 1 1 4  10 4  o 7.074000  0.1085000     7.165000  0.1682000     6.984000  0.1371000     0.1818000      0.2170000 
1 1 1 4  10 5  f 14.26000  0.1410000     14.13000  0.1845000     14.39000  0.2132000     -0.2642000     0.2820000 
1 1 1 4  10 6  o 19.36000  0.1776000     19.18000  0.2658000     19.54000  0.2355000     -0.3612000     0.3551000 
1 1 1 4  10 7  o 18.69000  0.1704000     18.67000  0.2700000     18.71000  0.2082000     -0.3549000E-01 0.3409000 
1 1 1 4  10 8  o 9.506000  0.1298000     9.606000  0.1827000     9.406000  0.1845000     0.2000000      0.2596000 
1 1 1 4  10 9  o 7.272000  0.1441000     7.436000  0.2105000     7.108000  0.1969000     0.3280000      0.2882000 
1 1 1 4  10 10 o 14.34000  0.1905000     14.26000  0.2668000     14.42000  0.2719000     -0.1647000     0.3809000 
1 1 1 4  10 11 o 2.466000  0.4409000     2.056000  0.6720000     2.876000  0.5709000     -0.8205000     0.8818000 
1 1 1 4  10 12 o 2.639000  0.4673000     2.393000  0.7094000     2.885000  0.6085000     -0.4926000     0.9346000 
1 1 1 4  10 13 o 7.335000  0.2311000     7.749000  0.3199000     6.920000  0.3334000     0.8292000      0.4621000 
1 1 1 4  10 14 f 4.699000  0.3456000     4.336000  0.5258000     5.063000  0.4487000     -0.7271000     0.6913000 
1 1 1 4  10 15 o 4.668000  0.5560000     4.316000  0.8017000     5.020000  0.7707000     -0.7039000     1.112000  
1 1 1 4  10 16 o 13.48000  0.2446000     13.58000  0.3181000     13.38000  0.3716000     0.1975000      0.4891000 
1 1 1 4  10 17 o 11.20000  0.2466000     11.08000  0.3502000     11.31000  0.3472000     -0.2259000     0.4932000 
1 1 1 4  10 18 o 3.651000  0.6511000     3.878000  0.8522000     3.425000  0.9847000     0.4529000      1.302000  
1 1 1 4  10 19 o 3.594000  0.7264000     3.351000  1.071000      3.836000  0.9813000     -0.4848000     1.453000  
1 1 1 4  10 20 o 4.427000  0.9894000     5.296000  1.368000      3.559000  1.430000      1.737000       1.979000  
1 1 1 4  10 21 o 2.967000  0.7093000     2.703000  1.003000      3.232000  1.004000      -0.5292000     1.419000  
1 1 1 4  10 22 o 2.692000  0.6539000     2.954000  0.9279000     2.429000  0.9216000     0.5246000      1.308000  
1 1 1 4  10 23 o 1.801000  0.5385000     1.522000  0.7050000     2.080000  0.8142000     -0.5586000     1.077000  
1 1 1 4  10 24 o 1.614000  0.5036000     1.537000  0.6916000     1.690000  0.7321000     -0.1530000     1.007000  
1 1 1 4  10 25 o 1.833000  0.6254000     2.456000  1.099000      1.209000  0.5962000     1.247000       1.251000  
1 1 1 4  10 26 o 1.437000  0.4550000     1.840000  0.7503000     1.035000  0.5149000     0.8054000      0.9100000 
1 1 1 4  10 27 o 1.603000  0.4845000     1.248000  0.5985000     1.959000  0.7621000     -0.7111000     0.9690000 
1 1 1 4  11 0  o 0.9012000 0.4132000     0.9012000 0.4132000     0.9012000 0.4132000     0.000000       0.000000  
1 1 1 4  11 1  o 24.61000  0.1973000     24.50000  0.2782000     24.72000  0.2799000     -0.2166000     0.3946000 
1 1 1 4  11 2  o 23.14000  0.2421000     23.39000  0.3779000     22.89000  0.3028000     0.5071000      0.4843000 
1 1 1 4  11 3  o 1.620000  0.3392000     1.819000  0.3783000     1.422000  0.5630000     0.3976000      0.6783000 
1 1 1 4  11 4  o 19.05000  0.1611000     19.17000  0.2292000     18.93000  0.2265000     0.2436000      0.3223000 
1 1 1 4  11 5  f 21.33000  0.1918000     21.28000  0.2887000     21.39000  0.2525000     -0.1106000     0.3836000 
1 1 1 4  11 6  o 17.87000  0.1568000     17.60000  0.2191000     18.15000  0.2245000     -0.5432000     0.3137000 
1 1 1 4  11 7  o 20.19000  0.1738000     20.10000  0.2451000     20.29000  0.2466000     -0.1885000     0.3477000 
1 1 1 4  11 8  o 23.75000  0.2031000     23.66000  0.2863000     23.84000  0.2883000     -0.1803000     0.4063000 
1 1 1 4  11 9  o 6.756000  0.1572000     7.138000  0.2159000     6.374000  0.2285000     0.7646000      0.3144000 
1 1 1 4  11 10 o 6.310000  0.2228000     6.024000  0.3876000     6.595000  0.2198000     -0.5710000     0.4455000 
1 1 1 4  11 11 o 4.994000  0.2502000     5.174000  0.2460000     4.813000  0.4357000     0.3611000      0.5004000 
1 1 1 4  11 12 o 8.020000  0.2039000     8.040000  0.2882000     8.000000  0.2884000     0.3998000E-01  0.4077000 
1 1 1 4  11 13 o 3.893000  0.4053000     2.906000  0.6827000     4.880000  0.4369000     -1.974000      0.8105000 
1 1 1 4  11 14 o 20.21000  0.2150000     20.37000  0.3050000     20.05000  0.3032000     0.3230000      0.4300000 
1 1 1 4  11 15 o 14.39000  0.3673000     14.56000  0.6007000     14.22000  0.4230000     0.3467000      0.7347000 
1 1 1 4  11 16 o 7.702000  0.2947000     8.297000  0.4016000     7.106000  0.4313000     1.190000       0.5893000 
1 1 1 4  11 17 o 9.097000  0.2760000     9.320000  0.3819000     8.873000  0.3985000     0.4476000      0.5520000 
1 1 1 4  11 18 o 2.444000  0.6649000     2.169000  0.8852000     2.718000  0.9923000     -0.5493000     1.330000  
1 1 1 4  11 19 o 9.087000  0.3628000     8.997000  0.5333000     9.177000  0.4920000     -0.1796000     0.7256000 
1 1 1 4  11 20 o 10.09000  0.5811000     9.369000  0.9553000     10.81000  0.6620000     -1.442000      1.162000  
1 1 1 4  11 21 o 2.855000  0.6518000     1.990000  0.8800000     3.720000  0.9617000     -1.730000      1.304000  
1 1 1 4  11 22 o 2.155000  0.6230000     2.215000  0.8886000     2.095000  0.8734000     0.1195000      1.246000  
1 1 1 4  11 23 o 2.436000  0.5799000     2.812000  0.8306000     2.059000  0.8095000     0.7533000      1.160000  
1 1 1 4  11 24 o 1.482000  0.4864000     1.433000  0.6804000     1.531000  0.6951000     -0.9771000E-01 0.9727000 
1 1 1 4  11 25 o 1.594000  0.5298000     1.874000  0.8334000     1.313000  0.6544000     0.5610000      1.060000  
1 1 1 4  11 26 o 1.356000  0.4490000     1.130000  0.5541000     1.582000  0.7066000     -0.4523000     0.8979000 
1 1 1 4  11 27 o 1.527000  0.4843000     1.389000  0.6501000     1.665000  0.7179000     -0.2760000     0.9685000 
1 1 1 4  12 0  o 23.38000  0.3791000     23.38000  0.3791000     23.38000  0.3791000     0.000000       0.000000  
1 1 1 4  12 1  o 8.761000  0.1710000     8.839000  0.2776000     8.683000  0.1996000     0.1565000      0.3419000 
1 1 1 4  12 2  o 18.33000  0.3092000     18.33000  0.3092000     ?         ?             ?              ?         
1 1 1 4  12 3  o 9.945000  0.1067000     9.965000  0.1521000     9.925000  0.1496000     0.3925000E-01  0.2134000 
1 1 1 4  12 4  f 20.53000  0.1851000     20.51000  0.2786000     20.54000  0.2438000     -0.2651000E-01 0.3702000 
1 1 1 4  12 5  o 34.48000  0.2732000     34.80000  0.3899000     34.16000  0.3827000     0.6409000      0.5464000 
1 1 1 4  12 6  o 35.31000  0.2799000     35.16000  0.3942000     35.46000  0.3975000     -0.2957000     0.5598000 
1 1 1 4  12 7  o 6.989000  0.1171000     7.034000  0.1635000     6.945000  0.1676000     0.8903000E-01  0.2342000 
1 1 1 4  12 8  o 16.68000  0.1493000     16.73000  0.2218000     16.63000  0.1998000     0.1027000      0.2986000 
1 1 1 4  12 9  o 12.77000  0.2333000     12.77000  0.2333000     ?         ?             ?              ?         
1 1 1 4  12 10 o 6.988000  0.1873000     7.328000  0.2172000     6.647000  0.3051000     0.6816000      0.3745000 
1 1 1 4  12 11 o 2.354000  0.3607000     2.753000  0.4270000     1.955000  0.5814000     0.7978000      0.7214000 
1 1 1 4  12 12 o 10.87000  0.1683000     10.75000  0.2359000     10.98000  0.2402000     -0.2360000     0.3367000 
1 1 1 4  12 13 o 7.097000  0.2431000     7.761000  0.3255000     6.433000  0.3613000     1.328000       0.4863000 
1 1 1 4  12 14 o 6.574000  0.2762000     6.317000  0.4035000     6.831000  0.3772000     -0.5132000     0.5524000 
1 1 1 4  12 15 o 9.234000  0.3456000     9.043000  0.5015000     9.425000  0.4758000     -0.3827000     0.6913000 
1 1 1 4  12 16 o 14.32000  0.2261000     14.37000  0.3215000     14.27000  0.3180000     0.9403000E-01  0.4522000 
1 1 1 4  12 17 o 5.299000  0.4107000     5.434000  0.5715000     5.165000  0.5900000     0.2688000      0.8214000 
1 1 1 4  12 18 o 7.290000  0.3780000     6.256000  0.5618000     8.324000  0.5060000     -2.068000      0.7561000 
1 1 1 4  12 19 o 6.198000  0.5316000     7.249000  0.6626000     5.148000  0.8315000     2.101000       1.063000  
1 1 1 4  12 20 o 3.497000  0.9537000     3.343000  1.384000      3.651000  1.313000      -0.3077000     1.907000  
1 1 1 4  12 21 o 3.720000  0.6726000     3.720000  0.9649000     3.719000  0.9373000     0.1207000E-02  1.345000  
1 1 1 4  12 22 o 3.009000  0.6201000     2.317000  0.9038000     3.701000  0.8493000     -1.385000      1.240000  
1 1 1 4  12 23 o 1.755000  0.5271000     1.499000  0.6909000     2.010000  0.7961000     -0.5106000     1.054000  
1 1 1 4  12 24 o 1.922000  0.5309000     2.319000  0.8076000     1.526000  0.6895000     0.7933000      1.062000  
1 1 1 4  12 25 o 1.609000  0.5274000     1.698000  0.7778000     1.521000  0.7125000     0.1768000      1.055000  
1 1 1 4  12 26 o 1.333000  0.4426000     1.470000  0.6687000     1.196000  0.5799000     0.2734000      0.8852000 
1 1 1 4  12 27 o 1.412000  0.4586000     1.535000  0.6829000     1.289000  0.6122000     0.2465000      0.9172000 
1 1 1 4  13 0  o 8.814000  0.2036000     8.814000  0.2036000     8.814000  0.2036000     -0.000000      0.000000  
1 1 1 4  13 1  o 25.43000  0.2895000     25.50000  0.4106000     25.35000  0.4083000     0.1468000      0.5790000 
1 1 1 4  13 2  o 5.453000  0.1000000     5.443000  0.1425000     5.462000  0.1403000     -0.1896000E-01 0.2000000 
1 1 1 4  13 3  o 10.55000  0.1109000     10.28000  0.1557000     10.82000  0.1581000     -0.5402000     0.2219000 
1 1 1 4  13 4  o 14.41000  0.1330000     14.25000  0.1866000     14.56000  0.1897000     -0.3104000     0.2661000 
1 1 1 4  13 5  o 38.81000  0.3302000     38.67000  0.4987000     38.95000  0.4329000     -0.2852000     0.6604000 
1 1 1 4  13 6  o 43.08000  0.3382000     43.26000  0.4796000     42.90000  0.4771000     0.3675000      0.6764000 
1 1 1 4  13 7  o 10.06000  0.1231000     10.07000  0.1731000     10.05000  0.1751000     0.1810000E-01  0.2462000 
1 1 1 4  13 8  o 12.69000  0.1352000     12.81000  0.1918000     12.57000  0.1905000     0.2352000      0.2703000 
1 1 1 4  13 9  o 11.45000  0.2446000     11.41000  0.2297000     11.49000  0.4320000     -0.7459000E-01 0.4893000 
1 1 1 4  13 10 o 8.525000  0.1534000     8.620000  0.2194000     8.430000  0.2145000     0.1902000      0.3069000 
1 1 1 4  13 11 o 2.428000  0.3771000     2.564000  0.4986000     2.292000  0.5660000     0.2717000      0.7542000 
1 1 1 4  13 12 o 10.45000  0.1679000     10.86000  0.2362000     10.04000  0.2386000     0.8178000      0.3357000 
1 1 1 4  13 13 o 1.946000  0.4577000     1.827000  0.6394000     2.065000  0.6551000     -0.2386000     0.9154000 
1 1 1 4  13 14 o 16.10000  0.2191000     16.07000  0.2695000     16.13000  0.3457000     -0.6203000E-01 0.4383000 
1 1 1 4  13 15 o 6.497000  0.3581000     6.484000  0.5028000     6.510000  0.5100000     -0.2650000E-01 0.7162000 
1 1 1 4  13 16 o 5.512000  0.3750000     5.673000  0.5187000     5.351000  0.5416000     0.3215000      0.7499000 
1 1 1 4  13 17 o 6.291000  0.3518000     6.362000  0.5014000     6.221000  0.4938000     0.1405000      0.7037000 
1 1 1 4  13 18 o 5.603000  0.4742000     5.816000  0.6046000     5.390000  0.7306000     0.4257000      0.9484000 
1 1 1 4  13 19 o 3.980000  0.7241000     3.823000  1.076000      4.137000  0.9695000     -0.3141000     1.448000  
1 1 1 4  13 20 o 3.279000  0.8071000     4.059000  1.195000      2.498000  1.085000      1.561000       1.614000  
1 1 1 4  13 21 o 3.814000  0.6123000     4.699000  0.7513000     2.930000  0.9671000     1.769000       1.225000  
1 1 1 4  13 22 o 2.337000  0.6382000     2.337000  0.8949000     2.336000  0.9102000     0.1695000E-03  1.276000  
1 1 1 4  13 23 o 2.951000  0.5318000     2.164000  0.8059000     3.738000  0.6940000     -1.574000      1.064000  
1 1 1 4  13 24 f 1.526000  0.4889000     1.530000  0.6942000     1.522000  0.6887000     0.8376000E-02  0.9778000 
1 1 1 4  13 25 o 2.556000  0.6172000     2.948000  0.8844000     2.164000  0.8612000     0.7844000      1.234000  
1 1 1 4  13 26 o 1.453000  0.4641000     1.722000  0.7282000     1.184000  0.5755000     0.5376000      0.9282000 
1 1 1 4  13 27 o 1.320000  0.4378000     1.543000  0.6879000     1.097000  0.5416000     0.4466000      0.8755000 
1 1 1 4  14 0  o 21.36000  0.2499000     21.36000  0.2499000     21.36000  0.2499000     0.000000       0.000000  
1 1 1 4  14 1  o 17.69000  0.1515000     17.61000  0.2136000     17.76000  0.2149000     -0.1535000     0.3030000 
1 1 1 4  14 2  o 20.90000  0.1736000     20.89000  0.2454000     20.91000  0.2456000     -0.2185000E-01 0.3472000 
1 1 1 4  14 3  o 17.52000  0.1520000     17.50000  0.2147000     17.53000  0.2152000     -0.3664000E-01 0.3040000 
1 1 1 4  14 4  o 1.214000  0.2672000     0.9785000 0.3812000     1.450000  0.3745000     -0.4715000     0.5344000 
1 1 1 4  14 5  o 15.81000  0.1440000     15.64000  0.2021000     15.97000  0.2052000     -0.3321000     0.2881000 
1 1 1 4  14 6  o 13.96000  0.1362000     13.63000  0.1900000     14.29000  0.1953000     -0.6518000     0.2725000 
1 1 1 4  14 7  f 18.29000  0.1643000     18.22000  0.2317000     18.37000  0.2329000     -0.1490000     0.3285000 
1 1 1 4  14 8  o 16.55000  0.1940000     16.35000  0.2220000     16.74000  0.3182000     -0.3903000     0.3879000 
1 1 1 4  14 9  o 5.482000  0.1914000     5.514000  0.2841000     5.450000  0.2565000     0.6438000E-01  0.3828000 
1 1 1 4  14 10 o 1.471000  0.3661000     1.074000  0.4778000     1.869000  0.5548000     -0.7952000     0.7322000 
1 1 1 4  14 11 o 1.564000  0.3780000     2.047000  0.5712000     1.081000  0.4952000     0.9660000      0.7560000 
1 1 1 4  14 12 o 1.813000  0.4285000     1.889000  0.6129000     1.736000  0.5988000     0.1537000      0.8569000 
1 1 1 4  14 13 o 15.52000  0.1850000     15.51000  0.2615000     15.53000  0.2619000     -0.1755000E-01 0.3701000 
1 1 1 4  14 14 o 9.681000  0.2177000     9.784000  0.3078000     9.579000  0.3079000     0.2054000      0.4353000 
1 1 1 4  14 15 o 9.873000  0.2281000     10.19000  0.3484000     9.558000  0.2944000     0.6301000      0.4562000 
1 1 1 4  14 16 o 14.99000  0.2304000     15.31000  0.3236000     14.67000  0.3280000     0.6397000      0.4607000 
1 1 1 4  14 17 o 10.07000  0.2631000     10.26000  0.3633000     9.882000  0.3806000     0.3767000      0.5261000 
1 1 1 4  14 18 o 2.797000  0.6947000     2.581000  0.9509000     3.012000  1.013000      -0.4310000     1.389000  
1 1 1 4  14 19 o 2.679000  0.6574000     1.721000  0.8283000     3.636000  1.021000      -1.915000      1.315000  
1 1 1 4  14 20 o 4.293000  0.6986000     3.443000  1.116000      5.143000  0.8401000     -1.701000      1.397000  
1 1 1 4  14 21 f 2.286000  0.6169000     2.893000  0.9569000     1.678000  0.7789000     1.215000       1.234000  
1 1 1 4  14 22 o 2.094000  0.6085000     1.920000  0.8319000     2.268000  0.8884000     -0.3478000     1.217000  
1 1 1 4  14 23 o 3.646000  0.4783000     3.726000  0.6635000     3.566000  0.6892000     0.1593000      0.9567000 
1 1 1 4  14 24 o 1.513000  0.4867000     1.851000  0.7820000     1.175000  0.5795000     0.6764000      0.9733000 
1 1 1 4  14 25 o 2.741000  0.6216000     2.487000  0.8563000     2.995000  0.9014000     -0.5080000     1.243000  
1 1 1 4  14 26 o 1.628000  0.5015000     1.572000  0.6943000     1.683000  0.7238000     -0.1104000     1.003000  
1 1 1 4  14 27 o 1.339000  0.4453000     1.426000  0.6597000     1.251000  0.5983000     0.1746000      0.8906000 
1 1 1 4  15 0  f 28.35000  0.3213000     28.35000  0.3213000     28.35000  0.3213000     0.000000       0.000000  
1 1 1 4  15 1  o 5.340000  0.1051000     5.460000  0.1480000     5.220000  0.1493000     0.2408000      0.2102000 
1 1 1 4  15 2  o 17.30000  0.1504000     17.41000  0.2137000     17.18000  0.2117000     0.2325000      0.3008000 
1 1 1 4  15 3  o 11.10000  0.1166000     11.12000  0.1649000     11.07000  0.1648000     0.5110000E-01  0.2331000 
1 1 1 4  15 4  o 11.00000  0.1183000     11.09000  0.1670000     10.91000  0.1677000     0.1798000      0.2367000 
1 1 1 4  15 5  o 21.61000  0.1823000     21.72000  0.2588000     21.50000  0.2570000     0.2110000      0.3647000 
1 1 1 4  15 6  o 28.40000  0.2316000     28.51000  0.3285000     28.30000  0.3266000     0.2088000      0.4632000 
1 1 1 4  15 7  f 19.60000  0.1739000     19.83000  0.2479000     19.37000  0.2438000     0.4569000      0.3477000 
1 1 1 4  15 8  o 3.367000  0.2211000     3.431000  0.3565000     3.304000  0.2614000     0.1272000      0.4421000 
1 1 1 4  15 9  o 9.114000  0.2473000     8.791000  0.4566000     9.436000  0.1902000     -0.6442000     0.4946000 
1 1 1 4  15 10 o 9.888000  0.1639000     9.792000  0.2429000     9.983000  0.2200000     -0.1905000     0.3278000 
1 1 1 4  15 11 o 4.392000  0.2408000     4.677000  0.3225000     4.107000  0.3576000     0.5700000      0.4816000 
1 1 1 4  15 12 f 13.48000  0.1739000     13.75000  0.2477000     13.22000  0.2442000     0.5271000      0.3478000 
1 1 1 4  15 13 o 5.259000  0.2399000     5.512000  0.3281000     5.006000  0.3500000     0.5062000      0.4798000 
1 1 1 4  15 14 o 4.791000  0.5626000     4.778000  0.4180000     4.803000  1.045000      -0.2454000E-01 1.125000  
1 1 1 4  15 15 o 9.730000  0.2108000     9.629000  0.2971000     9.831000  0.2992000     -0.2020000     0.4216000 
1 1 1 4  15 16 o 6.731000  0.2692000     7.056000  0.3686000     6.407000  0.3925000     0.6491000      0.5384000 
1 1 1 4  15 17 o 9.268000  0.2836000     9.118000  0.3183000     9.418000  0.4696000     -0.3000000     0.5673000 
1 1 1 4  15 18 o 8.669000  0.3443000     9.026000  0.4448000     8.311000  0.5256000     0.7153000      0.6885000 
1 1 1 4  15 19 o 7.744000  0.5504000     6.928000  0.9097000     8.560000  0.6198000     -1.632000      1.101000  
1 1 1 4  15 20 o 2.057000  0.6567000     1.999000  0.9225000     2.115000  0.9350000     -0.1155000     1.313000  
1 1 1 4  15 21 o 4.764000  0.5030000     4.538000  0.7471000     4.990000  0.6739000     -0.4522000     1.006000  
1 1 1 4  15 22 o 3.815000  0.5487000     5.162000  0.6179000     2.469000  0.9069000     2.693000       1.097000  
1 1 1 4  15 23 o 1.790000  0.5264000     1.657000  0.7198000     1.923000  0.7682000     -0.2660000     1.053000  
1 1 1 4  15 24 o 1.701000  0.5294000     1.617000  0.7257000     1.785000  0.7709000     -0.1680000     1.059000  
1 1 1 4  15 25 o 1.860000  0.5464000     1.385000  0.6476000     2.335000  0.8803000     -0.9498000     1.093000  
1 1 1 4  15 26 o 1.402000  0.4558000     1.147000  0.5610000     1.658000  0.7186000     -0.5106000     0.9116000 
1 1 1 4  15 27 o 1.526000  0.4820000     1.345000  0.6332000     1.708000  0.7270000     -0.3626000     0.9640000 
1 1 1 4  16 0  o 11.59000  0.1664000     11.59000  0.1664000     11.59000  0.1664000     -0.000000      0.000000  
1 1 1 4  16 1  o 13.00000  0.1253000     12.97000  0.1769000     13.03000  0.1774000     -0.5979000E-01 0.2505000 
1 1 1 4  16 2  o 7.244000  0.1061000     7.045000  0.1496000     7.443000  0.1505000     -0.3988000     0.2122000 
1 1 1 4  16 3  o 25.14000  0.2052000     24.85000  0.2874000     25.42000  0.2930000     -0.5746000     0.4104000 
1 1 1 4  16 4  o 3.078000  0.1587000     2.770000  0.2419000     3.386000  0.2055000     -0.6158000     0.3174000 
1 1 1 4  16 5  o 11.98000  0.1354000     12.20000  0.1800000     11.76000  0.2024000     0.4370000      0.2709000 
1 1 1 4  16 6  o 9.152000  0.1205000     9.174000  0.1704000     9.131000  0.1705000     0.4291000E-01  0.2411000 
1 1 1 4  16 7  o 5.136000  0.1371000     5.240000  0.1915000     5.031000  0.1963000     0.2085000      0.2742000 
1 1 1 4  16 8  o 5.658000  0.1981000     5.658000  0.1981000     ?         ?             ?              ?         
1 1 1 4  16 9  o 11.29000  0.1395000     11.31000  0.1962000     11.27000  0.1983000     0.3371000E-01  0.2790000 
1 1 1 4  16 10 o 10.23000  0.1442000     10.04000  0.2014000     10.43000  0.2066000     -0.3995000     0.2885000 
1 1 1 4  16 11 o 3.471000  0.2966000     3.201000  0.4452000     3.740000  0.3921000     -0.5393000     0.5932000 
1 1 1 4  16 12 o 5.779000  0.2099000     5.867000  0.2914000     5.691000  0.3021000     0.1766000      0.4197000 
1 1 1 4  16 13 o 15.20000  0.1859000     15.15000  0.2640000     15.25000  0.2617000     -0.9609000E-01 0.3717000 
1 1 1 4  16 14 o 13.77000  0.3589000     13.96000  0.3032000     13.58000  0.6506000     0.3827000      0.7178000 
1 1 1 4  16 15 o 6.706000  0.2574000     6.950000  0.3481000     6.463000  0.3794000     0.4870000      0.5149000 
1 1 1 4  16 16 o 3.542000  0.4742000     2.762000  0.7784000     4.321000  0.5417000     -1.559000      0.9483000 
1 1 1 4  16 17 o 4.846000  0.3700000     4.927000  0.5042000     4.766000  0.5417000     0.1615000      0.7400000 
1 1 1 4  16 18 o 6.184000  0.3315000     6.077000  0.4822000     6.290000  0.4551000     -0.2135000     0.6631000 
1 1 1 4  16 19 o 4.310000  0.6794000     3.756000  0.8892000     4.864000  1.027000      -1.107000      1.359000  
1 1 1 4  16 20 o 3.459000  0.6567000     2.358000  1.012000      4.559000  0.8373000     -2.201000      1.313000  
1 1 1 4  16 21 o 2.178000  0.6183000     2.609000  0.9457000     1.748000  0.7969000     0.8610000      1.237000  
1 1 1 4  16 22 o 2.653000  0.5951000     1.901000  0.8239000     3.405000  0.8588000     -1.505000      1.190000  
1 1 1 4  16 23 o 1.842000  0.5293000     2.061000  0.7820000     1.623000  0.7136000     0.4383000      1.059000  
1 1 1 4  16 24 o 1.663000  0.5250000     1.610000  0.7229000     1.717000  0.7615000     -0.1066000     1.050000  
1 1 1 4  16 25 o 1.562000  0.4911000     1.689000  0.7270000     1.434000  0.6603000     0.2545000      0.9821000 
1 1 1 4  16 26 o 1.589000  0.4976000     1.621000  0.7102000     1.557000  0.6972000     0.6394000E-01  0.9952000 
1 1 1 4  16 27 o 1.523000  0.4944000     1.650000  0.7378000     1.396000  0.6583000     0.2546000      0.9888000 
1 1 1 4  17 0  o 11.91000  0.1709000     11.91000  0.1709000     11.91000  0.1709000     0.000000       0.000000  
1 1 1 4  17 1  o 11.38000  0.1186000     11.42000  0.1679000     11.34000  0.1674000     0.7569000E-01  0.2371000 
1 1 1 4  17 2  o 5.416000  0.1130000     5.374000  0.1599000     5.459000  0.1596000     -0.8521000E-01 0.2259000 
1 1 1 4  17 3  o 19.65000  0.1683000     19.57000  0.2372000     19.74000  0.2389000     -0.1700000     0.3367000 
1 1 1 4  17 4  o 3.822000  0.1440000     3.898000  0.1972000     3.746000  0.2097000     0.1517000      0.2879000 
1 1 1 4  17 5  o 7.702000  0.1169000     7.781000  0.1655000     7.624000  0.1651000     0.1570000      0.2338000 
1 1 1 4  17 6  o 7.781000  0.1225000     7.675000  0.1742000     7.888000  0.1722000     -0.2131000     0.2449000 
1 1 1 4  17 7  o 13.82000  0.1568000     13.98000  0.2417000     13.65000  0.1997000     0.3309000      0.3135000 
1 1 1 4  17 8  o 3.183000  0.2983000     3.240000  0.4106000     3.127000  0.4327000     0.1131000      0.5965000 
1 1 1 4  17 9  o 4.655000  0.1672000     4.578000  0.2381000     4.731000  0.2347000     -0.1530000     0.3344000 
1 1 1 4  17 10 o 11.94000  0.1471000     12.04000  0.2091000     11.84000  0.2068000     0.2072000      0.2941000 
1 1 1 4  17 11 o 11.52000  0.1649000     11.45000  0.2630000     11.59000  0.1991000     -0.1397000     0.3298000 
1 1 1 4  17 12 o 7.385000  0.1927000     7.615000  0.2675000     7.156000  0.2776000     0.4588000      0.3855000 
1 1 1 4  17 13 o 5.612000  0.2406000     5.581000  0.3355000     5.644000  0.3449000     -0.6255000E-01 0.4812000 
1 1 1 4  17 14 o 15.78000  0.4394000     15.03000  0.5993000     16.52000  0.6428000     -1.490000      0.8788000 
1 1 1 4  17 15 o 5.652000  0.2982000     5.545000  0.4154000     5.759000  0.4281000     -0.2139000     0.5965000 
1 1 1 4  17 16 o 12.00000  0.2118000     11.86000  0.2978000     12.14000  0.3014000     -0.2840000     0.4237000 
1 1 1 4  17 17 o 11.20000  0.2236000     11.18000  0.3190000     11.22000  0.3134000     -0.4073000E-01 0.4472000 
1 1 1 4  17 18 o 5.742000  0.3676000     5.924000  0.5114000     5.560000  0.5283000     0.3637000      0.7353000 
1 1 1 4  17 19 o 2.121000  0.6962000     1.797000  0.8130000     2.445000  1.130000      -0.6476000     1.392000  
1 1 1 4  17 20 o 1.676000  0.5320000     1.774000  0.7840000     1.577000  0.7195000     0.1975000      1.064000  
1 1 1 4  17 21 o 2.213000  0.6184000     1.848000  0.7604000     2.578000  0.9754000     -0.7294000     1.237000  
1 1 1 4  17 22 o 2.185000  0.5616000     1.453000  0.6925000     2.918000  0.8843000     -1.465000      1.123000  
1 1 1 4  17 23 o 1.695000  0.5061000     1.370000  0.6417000     2.019000  0.7828000     -0.6497000     1.012000  
1 1 1 4  17 24 o 1.782000  0.5760000     1.334000  0.6602000     2.230000  0.9441000     -0.8960000     1.152000  
1 1 1 4  17 25 o 1.847000  0.5286000     2.114000  0.7931000     1.579000  0.6991000     0.5349000      1.057000  
1 1 1 4  17 26 o 1.496000  0.4763000     1.607000  0.7017000     1.384000  0.6444000     0.2234000      0.9527000 
1 1 1 4  17 27 o 1.189000  0.4276000     1.283000  0.6476000     1.096000  0.5585000     0.1872000      0.8551000 
1 1 1 4  18 0  o 14.68000  0.1933000     14.68000  0.1933000     14.68000  0.1933000     0.000000       0.000000  
1 1 1 4  18 1  o 15.29000  0.1408000     15.04000  0.1973000     15.53000  0.2008000     -0.4917000     0.2815000 
1 1 1 4  18 2  o 8.952000  0.1127000     8.913000  0.1588000     8.991000  0.1599000     -0.7785000E-01 0.2253000 
1 1 1 4  18 3  o 12.59000  0.1274000     12.54000  0.1802000     12.65000  0.1800000     -0.1070000     0.2547000 
1 1 1 4  18 4  o 15.84000  0.1471000     15.85000  0.2080000     15.83000  0.2081000     0.1778000E-01  0.2942000 
1 1 1 4  18 5  o 15.06000  0.1447000     14.87000  0.2030000     15.25000  0.2063000     -0.3766000     0.2895000 
1 1 1 4  18 6  o 7.326000  0.1246000     7.381000  0.1748000     7.271000  0.1775000     0.1095000      0.2491000 
1 1 1 4  18 7  o 16.48000  0.2661000     16.17000  0.3134000     16.78000  0.4300000     -0.6075000     0.5321000 
1 1 1 4  18 8  o 5.240000  0.1717000     4.970000  0.2765000     5.510000  0.2037000     -0.5403000     0.3434000 
1 1 1 4  18 9  o 4.350000  0.1777000     4.454000  0.2443000     4.247000  0.2582000     0.2066000      0.3554000 
1 1 1 4  18 10 o 2.339000  0.3237000     1.811000  0.5262000     2.866000  0.3772000     -1.055000      0.6474000 
1 1 1 4  18 11 o 4.493000  0.2046000     4.731000  0.2731000     4.254000  0.3046000     0.4771000      0.4091000 
1 1 1 4  18 12 o 1.977000  0.4321000     2.383000  0.6039000     1.571000  0.6183000     0.8123000      0.8643000 
1 1 1 4  18 13 o 17.35000  0.1958000     17.41000  0.2781000     17.28000  0.2757000     0.1367000      0.3915000 
1 1 1 4  18 14 o 13.27000  0.3626000     12.68000  0.5912000     13.86000  0.4201000     -1.177000      0.7252000 
1 1 1 4  18 15 o 14.05000  0.2051000     14.48000  0.2887000     13.62000  0.2914000     0.8632000      0.4103000 
1 1 1 4  18 16 o 2.482000  0.5536000     2.459000  0.7789000     2.505000  0.7868000     -0.4647000E-01 1.107000  
1 1 1 4  18 17 o 1.982000  0.5565000     2.265000  0.8298000     1.699000  0.7419000     0.5661000      1.113000  
1 1 1 4  18 18 o 6.292000  0.3655000     6.178000  0.5596000     6.407000  0.4705000     -0.2287000     0.7311000 
1 1 1 4  18 19 o 6.892000  0.8381000     8.014000  0.4954000     5.770000  1.601000      2.244000       1.676000  
1 1 1 4  18 20 o 6.056000  0.3669000     5.758000  0.5593000     6.353000  0.4751000     -0.5949000     0.7339000 
1 1 1 4  18 21 o 4.399000  0.4481000     3.614000  0.7383000     5.184000  0.5080000     -1.570000      0.8962000 
1 1 1 4  18 22 o 2.264000  0.5483000     1.874000  0.7616000     2.655000  0.7889000     -0.7817000     1.097000  
1 1 1 4  18 23 o 1.933000  0.5043000     1.603000  0.6769000     2.262000  0.7478000     -0.6585000     1.009000  
1 1 1 4  18 24 o 2.228000  0.6401000     2.214000  0.7682000     2.242000  1.024000      -0.2779000E-01 1.280000  
1 1 1 4  18 25 o 1.624000  0.4991000     1.611000  0.7035000     1.638000  0.7082000     -0.2668000E-01 0.9982000 
1 1 1 4  18 26 o 2.394000  0.5438000     1.954000  0.7649000     2.834000  0.7733000     -0.8805000     1.088000  
1 1 1 4  19 0  o 29.69000  0.3376000     29.69000  0.3376000     29.69000  0.3376000     -0.000000      0.000000  
1 1 1 4  19 1  o 3.835000  0.1400000     4.020000  0.1904000     3.649000  0.2053000     0.3711000      0.2800000 
1 1 1 4  19 2  o 15.05000  0.1410000     15.34000  0.2016000     14.77000  0.1973000     0.5730000      0.2821000 
1 1 1 4  19 3  o 6.416000  0.1172000     6.456000  0.1649000     6.375000  0.1666000     0.8084000E-01  0.2344000 
1 1 1 4  19 4  o 6.838000  0.1199000     6.839000  0.1681000     6.836000  0.1711000     0.3078000E-02  0.2399000 
1 1 1 4  19 5  o 18.30000  0.1647000     17.93000  0.2292000     18.68000  0.2367000     -0.7446000     0.3295000 
1 1 1 4  19 6  o 7.661000  0.1260000     7.787000  0.1769000     7.536000  0.1794000     0.2511000      0.2519000 
1 1 1 4  19 7  o 10.54000  0.2639000     10.54000  0.2639000     ?         ?             ?              ?         
1 1 1 4  19 8  f 9.986000  0.1354000     9.780000  0.1904000     10.19000  0.1925000     -0.4121000     0.2708000 
1 1 1 4  19 9  f 9.396000  0.1422000     9.504000  0.2014000     9.287000  0.2007000     0.2168000      0.2844000 
1 1 1 4  19 10 o 8.775000  0.1486000     8.467000  0.2108000     9.083000  0.2094000     -0.6159000     0.2972000 
1 1 1 4  19 11 o 2.087000  0.3680000     2.445000  0.4702000     1.730000  0.5662000     0.7154000      0.7360000 
1 1 1 4  19 12 o 6.229000  0.2017000     6.304000  0.3226000     6.153000  0.2424000     0.1511000      0.4035000 
1 1 1 4  19 13 o 12.11000  0.2071000     11.96000  0.2930000     12.26000  0.2929000     -0.3031000     0.4143000 
1 1 1 4  19 14 o 18.13000  0.2317000     18.28000  0.3592000     17.98000  0.2929000     0.2961000      0.4635000 
1 1 1 4  19 15 o 5.243000  0.3239000     5.630000  0.4187000     4.856000  0.4942000     0.7746000      0.6477000 
1 1 1 4  19 16 o 3.632000  0.4648000     2.990000  0.7407000     4.274000  0.5615000     -1.284000      0.9295000 
1 1 1 4  19 17 o 6.392000  0.3223000     6.773000  0.4263000     6.010000  0.4835000     0.7639000      0.6446000 
1 1 1 4  19 18 o 2.412000  0.6171000     2.744000  0.9132000     2.081000  0.8304000     0.6637000      1.234000  
1 1 1 4  19 19 o 4.352000  0.8148000     5.192000  0.7166000     3.513000  1.464000      1.679000       1.630000  
1 1 1 4  19 20 o 2.219000  0.6095000     2.175000  0.8767000     2.263000  0.8470000     -0.8879000E-01 1.219000  
1 1 1 4  19 21 f 2.869000  0.5855000     2.989000  0.8156000     2.748000  0.8403000     0.2407000      1.171000  
1 1 1 4  19 22 o 4.228000  0.4178000     4.277000  0.5787000     4.178000  0.6028000     0.9906000E-01  0.8356000 
1 1 1 4  19 23 o 2.159000  0.5091000     1.658000  0.6985000     2.661000  0.7409000     -1.002000      1.018000  
1 1 1 4  19 24 o 2.033000  0.5812000     2.343000  0.8105000     1.722000  0.8334000     0.6213000      1.162000  
1 1 1 4  19 25 o 1.969000  0.5179000     1.766000  0.7092000     2.173000  0.7550000     -0.4068000     1.036000  
1 1 1 4  19 26 o 1.751000  0.4994000     1.864000  0.7142000     1.638000  0.6983000     0.2263000      0.9988000 
1 1 1 4  20 0  o 4.277000  0.1923000     4.277000  0.1923000     4.277000  0.1923000     0.000000       0.000000  
1 1 1 4  20 1  o 10.68000  0.1208000     10.77000  0.1714000     10.60000  0.1704000     0.1649000      0.2417000 
1 1 1 4  20 2  o 7.071000  0.1169000     7.216000  0.1637000     6.925000  0.1670000     0.2904000      0.2339000 
1 1 1 4  20 3  o 21.35000  0.1826000     21.48000  0.2597000     21.22000  0.2569000     0.2567000      0.3653000 
1 1 1 4  20 4  o 5.240000  0.1335000     5.151000  0.1910000     5.328000  0.1868000     -0.1768000     0.2671000 
1 1 1 4  20 5  o 4.948000  0.1392000     5.092000  0.1929000     4.804000  0.2008000     0.2880000      0.2784000 
1 1 1 4  20 6  o 5.966000  0.2004000     5.969000  0.2677000     5.963000  0.2984000     0.6396000E-02  0.4009000 
1 1 1 4  20 7  o 10.31000  0.1629000     10.32000  0.2650000     10.30000  0.1897000     0.1552000E-01  0.3258000 
1 1 1 4  20 8  o 5.202000  0.1601000     5.639000  0.2135000     4.765000  0.2387000     0.8744000      0.3202000 
1 1 1 4  20 9  o 4.121000  0.1925000     4.223000  0.2663000     4.019000  0.2780000     0.2039000      0.3850000 
1 1 1 4  20 10 o 2.812000  0.2976000     3.087000  0.3629000     2.537000  0.4718000     0.5500000      0.5952000 
1 1 1 4  20 11 o 7.901000  0.1815000     7.779000  0.2242000     8.023000  0.2854000     -0.2448000     0.3629000 
1 1 1 4  20 12 f 7.487000  0.1812000     7.401000  0.2642000     7.574000  0.2479000     -0.1739000     0.3623000 
1 1 1 4  20 13 o 3.175000  0.6183000     3.175000  0.6183000     ?         ?             ?              ?         
1 1 1 4  20 14 o 8.471000  0.2190000     8.470000  0.3026000     8.472000  0.3167000     -0.1743000E-02 0.4381000 
1 1 1 4  20 15 o 7.715000  0.2461000     7.848000  0.3420000     7.583000  0.3539000     0.2644000      0.4922000 
1 1 1 4  20 16 o 1.714000  0.5219000     1.724000  0.7372000     1.704000  0.7390000     0.1996000E-01  1.044000  
1 1 1 4  20 17 o 9.234000  0.2553000     9.440000  0.3541000     9.028000  0.3680000     0.4119000      0.5107000 
1 1 1 4  20 18 o 2.575000  0.6393000     2.358000  0.8954000     2.793000  0.9127000     -0.4345000     1.279000  
1 1 1 4  20 19 o 2.449000  0.6507000     1.962000  0.9503000     2.936000  0.8892000     -0.9740000     1.301000  
1 1 1 4  20 20 f 4.614000  0.4955000     5.703000  0.5977000     3.525000  0.7905000     2.178000       0.9911000 
1 1 1 4  20 21 o 5.169000  0.3669000     5.540000  0.4881000     4.798000  0.5478000     0.7413000      0.7337000 
1 1 1 4  20 22 o 1.589000  0.4871000     1.330000  0.6249000     1.847000  0.7475000     -0.5170000     0.9743000 
1 1 1 4  20 23 o 3.015000  0.4926000     2.614000  0.7430000     3.417000  0.6468000     -0.8027000     0.9851000 
1 1 1 4  20 24 o 1.199000  0.4345000     1.439000  0.7233000     0.9587000 0.4818000     0.4807000      0.8691000 
1 1 1 4  20 25 o 1.335000  0.4317000     1.188000  0.5661000     1.481000  0.6518000     -0.2931000     0.8633000 
1 1 1 4  20 26 o 1.213000  0.4060000     1.097000  0.5329000     1.329000  0.6127000     -0.2319000     0.8121000 
1 1 1 4  21 0  o 7.345000  0.1653000     7.345000  0.1653000     7.345000  0.1653000     0.000000       0.000000  
1 1 1 4  21 1  o 11.09000  0.1242000     11.09000  0.1755000     11.08000  0.1759000     0.1267000E-01  0.2485000 
1 1 1 4  21 2  f 1.158000  0.3031000     1.048000  0.4204000     1.267000  0.4367000     -0.2194000     0.6062000 
1 1 1 4  21 3  f 12.39000  0.1310000     12.27000  0.1844000     12.52000  0.1863000     -0.2470000     0.2621000 
1 1 1 4  21 4  o 10.08000  0.1252000     10.06000  0.1781000     10.10000  0.1760000     -0.3883000E-01 0.2504000 
1 1 1 4  21 5  o 4.480000  0.1822000     4.417000  0.2961000     4.544000  0.2125000     -0.1270000     0.3645000 
1 1 1 4  21 6  o 7.963000  0.2594000     7.963000  0.2594000     ?         ?             ?              ?         
1 1 1 4  21 7  o 8.541000  0.1481000     8.691000  0.1891000     8.391000  0.2281000     0.3000000      0.2963000 
1 1 1 4  21 8  o 8.559000  0.1463000     8.651000  0.2163000     8.466000  0.1971000     0.1849000      0.2927000 
1 1 1 4  21 9  o 8.551000  0.1457000     8.523000  0.2065000     8.579000  0.2057000     -0.5574000E-01 0.2914000 
1 1 1 4  21 10 o 6.623000  0.1637000     6.686000  0.2301000     6.559000  0.2330000     0.1270000      0.3275000 
1 1 1 4  21 11 o 14.24000  0.1751000     14.14000  0.2602000     14.35000  0.2344000     -0.2085000     0.3502000 
1 1 1 4  21 12 o 11.74000  0.1633000     11.93000  0.2312000     11.56000  0.2308000     0.3641000      0.3267000 
1 1 1 4  21 13 o 17.65000  0.4270000     17.35000  0.5894000     17.95000  0.6181000     -0.6036000     0.8541000 
1 1 1 4  21 14 o 5.023000  0.3160000     4.894000  0.4401000     5.152000  0.4535000     -0.2581000     0.6320000 
1 1 1 4  21 15 f 5.086000  0.3221000     4.962000  0.4477000     5.209000  0.4632000     -0.2473000     0.6442000 
1 1 1 4  21 16 o 9.814000  0.2308000     9.472000  0.3296000     10.16000  0.3232000     -0.6838000     0.4616000 
1 1 1 4  21 17 o 2.192000  0.5825000     2.561000  0.8592000     1.822000  0.7867000     0.7382000      1.165000  
1 1 1 4  21 18 f 2.156000  0.6274000     2.384000  0.9337000     1.928000  0.8384000     0.4563000      1.255000  
1 1 1 4  21 19 o 2.916000  0.6903000     2.534000  1.092000      3.297000  0.8442000     -0.7632000     1.381000  
1 1 1 4  21 20 o 5.884000  0.3538000     5.679000  0.5322000     6.088000  0.4665000     -0.4093000     0.7077000 
1 1 1 4  21 21 f 2.754000  0.5837000     2.846000  0.8188000     2.662000  0.8320000     0.1840000      1.167000  
1 1 1 4  21 22 o 1.820000  0.4961000     2.303000  0.7695000     1.337000  0.6265000     0.9664000      0.9922000 
1 1 1 4  21 23 o 2.237000  0.5239000     1.795000  0.7321000     2.678000  0.7497000     -0.8822000     1.048000  
1 1 1 4  21 24 o 1.770000  0.5509000     1.881000  0.8530000     1.659000  0.6975000     0.2219000      1.102000  
1 1 1 4  21 25 o 1.269000  0.4189000     1.061000  0.5195000     1.478000  0.6572000     -0.4176000     0.8377000 
1 1 1 4  21 26 o 1.306000  0.4251000     1.444000  0.6425000     1.168000  0.5569000     0.2757000      0.8502000 
1 1 1 4  22 0  o 32.68000  0.3711000     32.68000  0.3711000     32.68000  0.3711000     -0.000000      0.000000  
1 1 1 4  22 1  o 15.71000  0.1480000     15.80000  0.2099000     15.61000  0.2087000     0.1898000      0.2960000 
1 1 1 4  22 2  o 20.98000  0.1813000     20.80000  0.2545000     21.16000  0.2584000     -0.3644000     0.3627000 
1 1 1 4  22 3  o 5.772000  0.1280000     5.773000  0.1817000     5.771000  0.1802000     0.1937000E-02  0.2559000 
1 1 1 4  22 4  o 13.27000  0.1389000     13.25000  0.1961000     13.29000  0.1967000     -0.3384000E-01 0.2778000 
1 1 1 4  22 5  f 5.252000  0.2972000     5.252000  0.2972000     ?         ?             ?              ?         
1 1 1 4  22 6  o 21.69000  0.2067000     21.47000  0.3118000     21.90000  0.2715000     -0.4291000     0.4134000 
1 1 1 4  22 7  o 6.966000  0.1401000     6.946000  0.1976000     6.985000  0.1987000     -0.3805000E-01 0.2802000 
1 1 1 4  22 8  o 8.312000  0.1436000     8.667000  0.2019000     7.956000  0.2041000     0.7117000      0.2871000 
1 1 1 4  22 9  o 6.211000  0.1618000     5.930000  0.2326000     6.492000  0.2251000     -0.5621000     0.3237000 
1 1 1 4  22 10 o 6.529000  0.1675000     6.443000  0.2382000     6.616000  0.2354000     -0.1727000     0.3350000 
1 1 1 4  22 11 o 7.295000  0.1703000     7.234000  0.2429000     7.356000  0.2387000     -0.1217000     0.3405000 
1 1 1 4  22 12 o 11.76000  0.2011000     11.52000  0.3297000     12.01000  0.2303000     -0.4905000     0.4022000 
1 1 1 4  22 13 f 8.794000  0.2183000     8.855000  0.3533000     8.733000  0.2564000     0.1220000      0.4365000 
1 1 1 4  22 14 o 3.886000  0.3937000     3.710000  0.5641000     4.061000  0.5493000     -0.3507000     0.7874000 
1 1 1 4  22 15 o 8.909000  0.2265000     8.627000  0.3225000     9.192000  0.3180000     -0.5653000     0.4529000 
1 1 1 4  22 16 o 2.258000  0.5743000     2.479000  0.8236000     2.038000  0.8006000     0.4416000      1.149000  
1 1 1 4  22 17 o 7.794000  0.2898000     7.779000  0.4007000     7.809000  0.4188000     -0.3051000E-01 0.5796000 
1 1 1 4  22 18 o 2.608000  0.6996000     2.892000  0.9594000     2.325000  1.019000      0.5663000      1.399000  
1 1 1 4  22 19 o 4.486000  0.4844000     4.331000  0.7284000     4.641000  0.6387000     -0.3099000     0.9688000 
1 1 1 4  22 20 o 3.653000  0.5311000     4.149000  0.6914000     3.157000  0.8062000     0.9923000      1.062000  
1 1 1 4  22 21 o 1.836000  0.5215000     1.346000  0.6395000     2.327000  0.8239000     -0.9818000     1.043000  
1 1 1 4  22 22 o 2.124000  0.5226000     1.548000  0.6877000     2.701000  0.7871000     -1.153000      1.045000  
1 1 1 4  22 23 o 2.510000  0.5542000     2.088000  0.7818000     2.932000  0.7858000     -0.8436000     1.108000  
1 1 1 4  22 24 o 1.690000  0.5415000     2.114000  0.9053000     1.266000  0.5944000     0.8482000      1.083000  
1 1 1 4  22 25 o 1.925000  0.5119000     1.805000  0.7064000     2.045000  0.7411000     -0.2403000     1.024000  
1 1 1 4  22 26 o 1.062000  0.3681000     0.9330000 0.4670000     1.191000  0.5691000     -0.2576000     0.7362000 
1 1 1 4  23 0  o 17.52000  0.2255000     17.52000  0.2255000     17.52000  0.2255000     -0.000000      0.000000  
1 1 1 4  23 1  o 9.623000  0.1232000     9.624000  0.1738000     9.621000  0.1745000     0.2938000E-02  0.2463000 
1 1 1 4  23 2  f 8.433000  0.1221000     8.233000  0.1727000     8.634000  0.1727000     -0.4012000     0.2442000 
1 1 1 4  23 3  o 8.739000  0.1349000     8.695000  0.2044000     8.783000  0.1760000     -0.8812000E-01 0.2698000 
1 1 1 4  23 4  o 2.982000  0.4086000     2.982000  0.4086000     ?         ?             ?              ?         
1 1 1 4  23 5  o 8.640000  0.1583000     8.734000  0.2575000     8.546000  0.1841000     0.1874000      0.3166000 
1 1 1 4  23 6  o 3.044000  0.2181000     2.889000  0.3239000     3.200000  0.2920000     -0.3110000     0.4361000 
1 1 1 4  23 7  o 7.376000  0.1408000     7.287000  0.1987000     7.466000  0.1995000     -0.1786000     0.2816000 
1 1 1 4  23 8  o 7.633000  0.1475000     7.633000  0.2081000     7.632000  0.2092000     0.1313000E-02  0.2951000 
1 1 1 4  23 9  o 5.628000  0.1731000     5.803000  0.2403000     5.453000  0.2493000     0.3497000      0.3463000 
1 1 1 4  23 10 o 9.262000  0.1538000     9.328000  0.2159000     9.196000  0.2191000     0.1323000      0.3076000 
1 1 1 4  23 11 o 2.302000  0.3949000     2.336000  0.5438000     2.268000  0.5728000     0.6809000E-01  0.7898000 
1 1 1 4  23 12 o 5.366000  0.3464000     5.504000  0.4231000     5.228000  0.5486000     0.2763000      0.6928000 
1 1 1 4  23 13 o 10.49000  0.1753000     10.46000  0.2486000     10.52000  0.2472000     -0.5422000E-01 0.3506000 
1 1 1 4  23 14 o 5.563000  0.2722000     5.767000  0.4115000     5.358000  0.3565000     0.4091000      0.5444000 
1 1 1 4  23 15 o 9.888000  0.2228000     9.392000  0.3200000     10.38000  0.3100000     -0.9916000     0.4456000 
1 1 1 4  23 16 o 6.040000  0.3192000     5.906000  0.4570000     6.174000  0.4456000     -0.2685000     0.6384000 
1 1 1 4  23 17 f 7.209000  0.3068000     6.982000  0.4410000     7.436000  0.4267000     -0.4539000     0.6137000 
1 1 1 4  23 18 o 11.22000  0.3741000     11.22000  0.3741000     ?         ?             ?              ?         
1 1 1 4  23 19 o 2.892000  0.6270000     3.067000  0.9038000     2.717000  0.8692000     0.3495000      1.254000  
1 1 1 4  23 20 o 2.126000  0.5698000     1.681000  0.7595000     2.571000  0.8495000     -0.8900000     1.140000  
1 1 1 4  23 21 o 1.570000  0.4787000     2.107000  0.8054000     1.032000  0.5175000     1.075000       0.9573000 
1 1 1 4  23 22 o 1.450000  0.4625000     1.148000  0.5637000     1.753000  0.7335000     -0.6047000     0.9251000 
1 1 1 4  23 23 o 1.575000  0.5287000     1.349000  0.6305000     1.802000  0.8488000     -0.4534000     1.057000  
1 1 1 4  23 24 o 1.762000  0.5028000     1.577000  0.6820000     1.947000  0.7389000     -0.3693000     1.006000  
1 1 1 4  23 25 o 1.639000  0.4836000     1.783000  0.7092000     1.495000  0.6577000     0.2874000      0.9672000 
1 1 1 4  23 26 o 1.370000  0.4403000     1.390000  0.6269000     1.349000  0.6184000     0.4065000E-01  0.8806000 
1 1 1 4  24 0  o 9.736000  0.1767000     9.736000  0.1767000     9.736000  0.1767000     -0.000000      0.000000  
1 1 1 4  24 1  o 15.35000  0.1488000     15.08000  0.2082000     15.63000  0.2127000     -0.5569000     0.2977000 
1 1 1 4  24 2  o 8.154000  0.1791000     8.185000  0.2530000     8.124000  0.2537000     0.6066000E-01  0.3583000 
1 1 1 4  24 3  o 8.155000  0.3429000     8.155000  0.3429000     ?         ?             ?              ?         
1 1 1 4  24 4  o 7.533000  0.1661000     7.671000  0.2573000     7.395000  0.2100000     0.2759000      0.3321000 
1 1 1 4  24 5  o 13.70000  0.1457000     13.68000  0.2056000     13.71000  0.2066000     -0.3067000E-01 0.2915000 
1 1 1 4  24 6  o 5.849000  0.1497000     5.812000  0.2132000     5.887000  0.2102000     -0.7464000E-01 0.2994000 
1 1 1 4  24 7  o 10.83000  0.1434000     10.70000  0.2010000     10.96000  0.2047000     -0.2626000     0.2869000 
1 1 1 4  24 8  o 4.390000  0.1980000     4.400000  0.2789000     4.380000  0.2812000     0.1998000E-01  0.3961000 
1 1 1 4  24 9  o 14.46000  0.1600000     14.36000  0.2251000     14.56000  0.2273000     -0.2034000     0.3199000 
1 1 1 4  24 10 o 8.788000  0.1660000     9.020000  0.2414000     8.557000  0.2279000     0.4622000      0.3320000 
1 1 1 4  24 11 f 6.019000  0.1909000     6.136000  0.2648000     5.902000  0.2752000     0.2337000      0.3819000 
1 1 1 4  24 12 o 6.789000  0.2892000     6.789000  0.2892000     ?         ?             ?              ?         
1 1 1 4  24 13 o 14.35000  0.1806000     14.57000  0.2552000     14.13000  0.2555000     0.4349000      0.3611000 
1 1 1 4  24 14 o 22.92000  0.2193000     22.78000  0.3089000     23.05000  0.3114000     -0.2751000     0.4386000 
1 1 1 4  24 15 o 10.89000  0.2165000     11.38000  0.2977000     10.40000  0.3146000     0.9773000      0.4331000 
1 1 1 4  24 16 o 4.981000  0.3764000     4.926000  0.5164000     5.037000  0.5477000     -0.1109000     0.7528000 
1 1 1 4  24 17 f 6.218000  0.3560000     6.472000  0.4768000     5.964000  0.5288000     0.5079000      0.7120000 
1 1 1 4  24 18 o 4.349000  1.010000      5.058000  1.295000      3.639000  1.551000      1.419000       2.021000  
1 1 1 4  24 19 o 3.814000  0.5510000     3.398000  0.8726000     4.230000  0.6730000     -0.8321000     1.102000  
1 1 1 4  24 20 f 3.124000  0.5627000     3.715000  0.7537000     2.532000  0.8357000     1.183000       1.125000  
1 1 1 4  24 21 o 1.954000  0.5542000     1.973000  0.7845000     1.935000  0.7831000     0.3742000E-01  1.108000  
1 1 1 4  24 22 o 3.620000  0.4756000     2.926000  0.7768000     4.314000  0.5490000     -1.387000      0.9513000 
1 1 1 4  24 23 o 2.391000  0.7731000     2.391000  0.7731000     ?         ?             ?              ?         
1 1 1 4  24 24 o 1.680000  0.4871000     1.407000  0.6396000     1.953000  0.7349000     -0.5460000     0.9743000 
1 1 1 4  24 25 o 2.048000  0.5029000     1.603000  0.6825000     2.494000  0.7389000     -0.8912000     1.006000  
1 1 1 4  24 26 o 1.599000  0.4906000     1.722000  0.7220000     1.476000  0.6643000     0.2459000      0.9811000 
1 1 1 4  25 0  o 2.910000  0.7470000     2.910000  0.7470000     2.910000  0.7470000     -0.000000      0.000000  
1 1 1 4  25 2  o 13.02000  0.2430000     13.15000  0.2799000     12.88000  0.3972000     0.2729000      0.4859000 
1 1 1 4  25 3  o 13.39000  0.1734000     13.29000  0.2816000     13.49000  0.2024000     -0.1920000     0.3468000 
1 1 1 4  25 4  o 11.80000  0.1373000     12.05000  0.1954000     11.55000  0.1930000     0.5067000      0.2746000 
1 1 1 4  25 5  o 14.46000  0.1506000     14.59000  0.2134000     14.34000  0.2124000     0.2510000      0.3011000 
1 1 1 4  25 6  o 13.82000  0.1643000     14.13000  0.2143000     13.50000  0.2491000     0.6295000      0.3286000 
1 1 1 4  25 7  o 3.929000  0.2092000     4.359000  0.2739000     3.499000  0.3164000     0.8603000      0.4185000 
1 1 1 4  25 8  o 9.239000  0.1483000     9.324000  0.2092000     9.154000  0.2103000     0.1706000      0.2966000 
1 1 1 4  25 9  o 17.75000  0.1773000     17.68000  0.2496000     17.83000  0.2519000     -0.1551000     0.3546000 
1 1 1 4  25 10 o 10.78000  0.1672000     10.61000  0.2216000     10.95000  0.2505000     -0.3352000     0.3344000 
1 1 1 4  25 11 f 12.46000  0.2042000     12.65000  0.3354000     12.27000  0.2330000     0.3718000      0.4084000 
1 1 1 4  25 12 f 5.476000  0.2774000     5.350000  0.4648000     5.602000  0.3030000     -0.2519000     0.5549000 
1 1 1 4  25 13 o 4.396000  0.2836000     4.727000  0.3773000     4.065000  0.4234000     0.6618000      0.5671000 
1 1 1 4  25 14 o 1.651000  0.4595000     1.889000  0.6804000     1.412000  0.6176000     0.4765000      0.9189000 
1 1 1 4  25 15 o 7.548000  0.3345000     7.163000  0.5995000     7.933000  0.2970000     -0.7700000     0.6690000 
1 1 1 4  25 16 o 5.408000  0.3575000     5.033000  0.5239000     5.784000  0.4866000     -0.7508000     0.7150000 
1 1 1 4  25 17 o 3.876000  0.5148000     3.672000  0.7467000     4.080000  0.7088000     -0.4079000     1.030000  
1 1 1 4  25 18 o 2.630000  0.6896000     2.310000  1.070000      2.949000  0.8708000     -0.6383000     1.379000  
1 1 1 4  25 19 o 4.299000  0.4993000     5.061000  0.6109000     3.537000  0.7900000     1.524000       0.9987000 
1 1 1 4  25 20 o 2.212000  0.5498000     1.633000  0.7407000     2.791000  0.8128000     -1.158000      1.100000  
1 1 1 4  25 21 o 2.236000  0.5562000     2.510000  0.7950000     1.961000  0.7780000     0.5492000      1.112000  
1 1 1 4  25 22 o 1.874000  0.5265000     1.793000  0.7360000     1.955000  0.7531000     -0.1612000     1.053000  
1 1 1 4  25 23 o 1.546000  0.5391000     1.063000  0.5314000     2.029000  0.9381000     -0.9662000     1.078000  
1 1 1 4  25 24 o 1.415000  0.4541000     1.512000  0.6712000     1.317000  0.6119000     0.1950000      0.9082000 
1 1 1 4  25 25 f 1.278000  0.4244000     1.280000  0.6002000     1.275000  0.6001000     0.4963000E-02  0.8487000 
1 1 1 4  26 0  o 17.03000  0.2621000     17.03000  0.2621000     17.03000  0.2621000     0.000000       0.000000  
1 1 1 4  26 1  o 8.743000  0.1399000     8.695000  0.2110000     8.791000  0.1836000     -0.9643000E-01 0.2798000 
1 1 1 4  26 2  o 11.99000  0.1370000     12.34000  0.1956000     11.64000  0.1918000     0.6929000      0.2739000 
1 1 1 4  26 3  o 16.89000  0.1613000     16.84000  0.2275000     16.94000  0.2287000     -0.1063000     0.3225000 
1 1 1 4  26 4  o 8.362000  0.1357000     8.267000  0.1924000     8.457000  0.1914000     -0.1902000     0.2714000 
1 1 1 4  26 5  o 9.220000  0.1389000     9.369000  0.1955000     9.071000  0.1974000     0.2979000      0.2779000 
1 1 1 4  26 6  o 8.704000  0.1430000     8.674000  0.2013000     8.735000  0.2031000     -0.6130000E-01 0.2860000 
1 1 1 4  26 7  o 11.31000  0.1463000     11.30000  0.2061000     11.32000  0.2076000     -0.2256000E-01 0.2925000 
1 1 1 4  26 8  o 10.48000  0.1495000     10.28000  0.2106000     10.69000  0.2121000     -0.4156000     0.2989000 
1 1 1 4  26 9  o 8.864000  0.1564000     8.875000  0.2191000     8.852000  0.2233000     0.2366000E-01  0.3128000 
1 1 1 4  26 10 o 10.05000  0.1606000     9.989000  0.2278000     10.12000  0.2266000     -0.1309000     0.3213000 
1 1 1 4  26 11 o 10.99000  0.3321000     10.99000  0.3321000     ?         ?             ?              ?         
1 1 1 4  26 12 o 11.34000  0.1734000     11.61000  0.2443000     11.07000  0.2463000     0.5369000      0.3469000 
1 1 1 4  26 13 f 3.658000  0.3334000     3.530000  0.4822000     3.786000  0.4605000     -0.2560000     0.6668000 
1 1 1 4  26 14 o 11.58000  0.1834000     11.75000  0.2592000     11.41000  0.2596000     0.3368000      0.3668000 
1 1 1 4  26 15 o 2.802000  0.4908000     2.825000  0.7036000     2.779000  0.6845000     0.4617000E-01  0.9816000 
1 1 1 4  26 16 o 6.612000  0.3054000     6.212000  0.4437000     7.011000  0.4198000     -0.7983000     0.6108000 
1 1 1 4  26 17 f 5.128000  0.4386000     5.275000  0.5975000     4.980000  0.6424000     0.2943000      0.8773000 
1 1 1 4  26 18 f 4.991000  0.4421000     4.241000  0.7166000     5.741000  0.5178000     -1.500000      0.8841000 
1 1 1 4  26 19 o 3.506000  0.5519000     2.819000  0.8871000     4.193000  0.6568000     -1.374000      1.104000  
1 1 1 4  26 20 o 2.131000  0.5643000     1.929000  0.7867000     2.334000  0.8093000     -0.4046000     1.129000  
1 1 1 4  26 21 o 2.021000  0.5261000     2.502000  0.7939000     1.540000  0.6907000     0.9620000      1.052000  
1 1 1 4  26 22 o 1.685000  0.4976000     1.478000  0.6640000     1.892000  0.7414000     -0.4145000     0.9952000 
1 1 1 4  26 23 o 1.881000  0.5529000     1.579000  0.7849000     2.183000  0.7789000     -0.6035000     1.106000  
1 1 1 4  26 24 o 1.272000  0.4184000     1.563000  0.6798000     0.9804000 0.4878000     0.5831000      0.8367000 
1 1 1 4  26 25 o 1.236000  0.4145000     1.180000  0.5661000     1.292000  0.6056000     -0.1119000     0.8290000 
1 1 1 4  27 0  o 4.621000  0.2186000     4.621000  0.2186000     4.621000  0.2186000     0.000000       0.000000  
1 1 1 4  27 1  o 4.543000  0.1598000     4.766000  0.2172000     4.320000  0.2344000     0.4461000      0.3196000 
1 1 1 4  27 2  o 3.745000  0.1833000     3.821000  0.2565000     3.668000  0.2618000     0.1532000      0.3665000 
1 1 1 4  27 3  o 4.039000  0.1808000     3.843000  0.2652000     4.235000  0.2458000     -0.3920000     0.3616000 
1 1 1 4  27 4  o 8.275000  0.1391000     8.105000  0.1986000     8.445000  0.1947000     -0.3404000     0.2781000 
1 1 1 4  27 5  o 3.241000  0.2417000     3.404000  0.3267000     3.077000  0.3562000     0.3269000      0.4833000 
1 1 1 4  27 6  o 10.78000  0.1443000     10.86000  0.2054000     10.70000  0.2029000     0.1563000      0.2887000 
1 1 1 4  27 7  f 9.663000  0.1463000     9.670000  0.2061000     9.656000  0.2076000     0.1368000E-01  0.2925000 
1 1 1 4  27 8  o 6.448000  0.1685000     6.580000  0.2328000     6.316000  0.2437000     0.2642000      0.3370000 
1 1 1 4  27 9  o 13.84000  0.1632000     13.67000  0.2292000     14.00000  0.2325000     -0.3266000     0.3265000 
1 1 1 4  27 10 o 1.426000  0.3997000     1.562000  0.5857000     1.290000  0.5441000     0.2720000      0.7994000 
1 1 1 4  27 11 o 1.567000  0.6677000     1.567000  0.6677000     ?         ?             ?              ?         
1 1 1 4  27 12 o 11.40000  0.1762000     11.60000  0.2502000     11.20000  0.2481000     0.4075000      0.3524000 
1 1 1 4  27 13 o 4.255000  0.2958000     4.206000  0.4222000     4.303000  0.4143000     -0.9663000E-01 0.5915000 
1 1 1 4  27 14 o 10.28000  0.1885000     10.52000  0.2633000     10.04000  0.2698000     0.4859000      0.3770000 
1 1 1 4  27 15 o 3.933000  0.3580000     3.656000  0.5312000     4.211000  0.4802000     -0.5548000     0.7161000 
1 1 1 4  27 16 o 8.380000  0.2804000     8.475000  0.4082000     8.284000  0.3846000     0.1906000      0.5609000 
1 1 1 4  27 17 o 1.574000  0.7195000     1.574000  0.7195000     ?         ?             ?              ?         
1 1 1 4  27 18 o 1.780000  0.5384000     2.006000  0.8053000     1.554000  0.7149000     0.4525000      1.077000  
1 1 1 4  27 19 o 2.502000  0.5505000     1.774000  0.7762000     3.231000  0.7809000     -1.457000      1.101000  
1 1 1 4  27 20 o 2.552000  0.5675000     2.334000  0.8148000     2.770000  0.7902000     -0.4362000     1.135000  
1 1 1 4  27 21 o 2.732000  0.5613000     2.794000  0.7877000     2.670000  0.7998000     0.1239000      1.123000  
1 1 1 4  27 22 o 1.831000  0.5259000     2.055000  0.7868000     1.606000  0.6980000     0.4492000      1.052000  
1 1 1 4  27 23 o 1.905000  0.5739000     2.063000  0.8914000     1.747000  0.7230000     0.3158000      1.148000  
1 1 1 4  27 24 o 1.498000  0.4606000     1.820000  0.7264000     1.177000  0.5664000     0.6435000      0.9211000 
1 1 1 4  27 25 o 1.569000  0.4740000     1.383000  0.6244000     1.754000  0.7134000     -0.3714000     0.9480000 
1 1 1 4  28 0  o 0.9012000 0.5362000     0.9012000 0.5362000     0.9012000 0.5362000     0.000000       0.000000  
1 1 1 4  28 1  f 10.59000  0.1358000     10.51000  0.1911000     10.67000  0.1929000     -0.1605000     0.2715000 
1 1 1 4  28 2  o 11.17000  0.1398000     11.41000  0.1983000     10.94000  0.1971000     0.4711000      0.2796000 
1 1 1 4  28 3  o 7.114000  0.1442000     6.855000  0.2054000     7.374000  0.2026000     -0.5186000     0.2885000 
1 1 1 4  28 4  o 10.35000  0.1410000     10.20000  0.1987000     10.51000  0.2001000     -0.3117000     0.2820000 
1 1 1 4  28 5  o 5.950000  0.1612000     5.929000  0.2266000     5.972000  0.2293000     -0.4270000E-01 0.3224000 
1 1 1 4  28 6  o 15.99000  0.1641000     15.63000  0.2296000     16.35000  0.2345000     -0.7144000     0.3282000 
1 1 1 4  28 7  o 9.987000  0.1495000     9.802000  0.2117000     10.17000  0.2111000     -0.3697000     0.2990000 
1 1 1 4  28 8  o 7.581000  0.1611000     7.643000  0.2257000     7.519000  0.2299000     0.1236000      0.3222000 
1 1 1 4  28 9  o 8.938000  0.1622000     8.995000  0.2286000     8.882000  0.2302000     0.1135000      0.3244000 
1 1 1 4  28 10 o 11.37000  0.2666000     11.93000  0.3281000     10.80000  0.4203000     1.132000       0.5332000 
1 1 1 4  28 11 o 1.880000  0.4823000     1.937000  0.7322000     1.824000  0.6278000     0.1125000      0.9645000 
1 1 1 4  28 12 o 6.027000  0.2185000     6.274000  0.3032000     5.780000  0.3148000     0.4937000      0.4371000 
1 1 1 4  28 13 o 4.484000  0.2874000     5.105000  0.3601000     3.864000  0.4481000     1.240000       0.5748000 
1 1 1 4  28 14 o 1.329000  0.4251000     1.117000  0.5366000     1.542000  0.6594000     -0.4258000     0.8502000 
1 1 1 4  28 15 o 5.514000  0.2817000     5.518000  0.3959000     5.509000  0.4009000     0.8714000E-02  0.5634000 
1 1 1 4  28 16 o 4.229000  0.4327000     4.172000  0.6567000     4.286000  0.5637000     -0.1141000     0.8655000 
1 1 1 4  28 17 o 9.625000  0.7373000     10.83000  0.7487000     8.424000  1.270000      2.401000       1.475000  
1 1 1 4  28 18 o 3.541000  0.5493000     3.207000  0.8306000     3.875000  0.7192000     -0.6684000     1.099000  
1 1 1 4  28 19 o 4.898000  0.3958000     5.324000  0.5405000     4.472000  0.5782000     0.8523000      0.7915000 
1 1 1 4  28 20 o 3.699000  0.4718000     3.014000  0.7783000     4.384000  0.5336000     -1.371000      0.9436000 
1 1 1 4  28 21 o 2.264000  0.5260000     2.795000  0.7598000     1.733000  0.7276000     1.063000       1.052000  
1 1 1 4  28 22 o 1.752000  0.5337000     1.752000  0.7377000     1.753000  0.7714000     -0.6735000E-04 1.067000  
1 1 1 4  28 23 o 1.512000  0.4772000     1.714000  0.7261000     1.310000  0.6194000     0.4040000      0.9544000 
1 1 1 4  28 24 o 1.295000  0.4276000     1.296000  0.6024000     1.294000  0.6071000     0.2655000E-02  0.8552000 
1 1 1 4  28 25 o 1.748000  0.5039000     1.598000  0.6935000     1.898000  0.7314000     -0.3003000     1.008000  
1 1 1 4  29 0  o 4.025000  0.2708000     4.025000  0.2708000     4.025000  0.2708000     0.000000       0.000000  
1 1 1 4  29 1  o 7.064000  0.1439000     7.163000  0.2009000     6.964000  0.2062000     0.1990000      0.2879000 
1 1 1 4  29 2  o 6.150000  0.1530000     6.205000  0.2148000     6.095000  0.2180000     0.1096000      0.3060000 
1 1 1 4  29 3  o 13.52000  0.1501000     13.62000  0.2124000     13.42000  0.2121000     0.1946000      0.3002000 
1 1 1 4  29 4  o 11.66000  0.1453000     11.81000  0.2060000     11.51000  0.2049000     0.2970000      0.2906000 
1 1 1 4  29 5  o 10.67000  0.1461000     10.62000  0.2061000     10.71000  0.2072000     -0.9073000E-01 0.2923000 
1 1 1 4  29 6  o 2.007000  0.3747000     1.858000  0.5404000     2.156000  0.5194000     -0.2975000     0.7495000 
1 1 1 4  29 7  o 12.43000  0.1550000     12.18000  0.2179000     12.67000  0.2206000     -0.4946000     0.3101000 
1 1 1 4  29 8  o 4.078000  0.2302000     3.967000  0.3328000     4.188000  0.3182000     -0.2205000     0.4605000 
1 1 1 4  29 9  o 11.71000  0.1901000     12.03000  0.2625000     11.40000  0.2749000     0.6265000      0.3801000 
1 1 1 4  29 10 o 15.76000  0.3471000     15.76000  0.3471000     ?         ?             ?              ?         
1 1 1 4  29 11 o 1.878000  0.4278000     2.350000  0.6153000     1.407000  0.5947000     0.9424000      0.8557000 
1 1 1 4  29 12 o 15.29000  0.1942000     15.36000  0.2590000     15.23000  0.2895000     0.1345000      0.3884000 
1 1 1 4  29 13 o 7.104000  0.2082000     7.169000  0.2956000     7.040000  0.2933000     0.1292000      0.4164000 
1 1 1 4  29 14 o 8.907000  0.2259000     8.717000  0.3535000     9.096000  0.2814000     -0.3786000     0.4518000 
1 1 1 4  29 15 o 3.863000  0.4033000     3.563000  0.6058000     4.164000  0.5325000     -0.6019000     0.8066000 
1 1 1 4  29 16 o 3.197000  0.5934000     3.468000  0.9139000     2.926000  0.7570000     0.5425000      1.187000  
1 1 1 4  29 17 o 3.967000  0.6650000     3.764000  1.151000      4.170000  0.6664000     -0.4059000     1.330000  
1 1 1 4  29 18 o 4.519000  0.4264000     4.614000  0.5971000     4.424000  0.6089000     0.1904000      0.8528000 
1 1 1 4  29 19 o 2.369000  0.5973000     2.215000  0.8372000     2.522000  0.8521000     -0.3070000     1.195000  
1 1 1 4  29 20 o 3.457000  0.5051000     3.509000  0.7375000     3.404000  0.6905000     0.1049000      1.010000  
1 1 1 4  29 21 o 2.686000  0.5498000     2.543000  0.8027000     2.830000  0.7516000     -0.2866000     1.100000  
1 1 1 4  29 22 o 1.495000  0.6771000     1.495000  0.6771000     ?         ?             ?              ?         
1 1 1 4  29 23 o 1.566000  0.4839000     1.407000  0.6428000     1.725000  0.7234000     -0.3177000     0.9677000 
1 1 1 4  29 24 o 1.240000  0.4153000     1.205000  0.5782000     1.274000  0.5963000     -0.6897000E-01 0.8306000 
1 1 1 4  29 25 o 1.127000  0.3875000     1.051000  0.5187000     1.203000  0.5757000     -0.1515000     0.7749000 
1 1 1 4  30 0  o 13.53000  0.2127000     13.53000  0.2127000     13.53000  0.2127000     0.000000       0.000000  
1 1 1 4  30 1  o 9.492000  0.1411000     9.602000  0.1995000     9.383000  0.1997000     0.2190000      0.2822000 
1 1 1 4  30 2  o 4.491000  0.1876000     4.416000  0.2681000     4.565000  0.2624000     -0.1494000     0.3752000 
1 1 1 4  30 3  o 5.007000  0.1753000     5.135000  0.2429000     4.879000  0.2528000     0.2561000      0.3506000 
1 1 1 4  30 4  o 10.93000  0.1572000     10.65000  0.2042000     11.20000  0.2390000     -0.5493000     0.3144000 
1 1 1 4  30 5  o 7.075000  0.1575000     7.278000  0.2164000     6.872000  0.2288000     0.4055000      0.3149000 
1 1 1 4  30 6  o 4.494000  0.2037000     4.303000  0.2954000     4.685000  0.2804000     -0.3817000     0.4073000 
1 1 1 4  30 7  o 19.58000  0.1869000     19.28000  0.2617000     19.88000  0.2668000     -0.5938000     0.3737000 
1 1 1 4  30 8  o 12.06000  0.1592000     12.24000  0.2259000     11.88000  0.2243000     0.3538000      0.3183000 
1 1 1 4  30 9  f 10.57000  0.3236000     10.57000  0.3236000     ?         ?             ?              ?         
1 1 1 4  30 10 o 6.498000  0.2407000     6.277000  0.3981000     6.720000  0.2705000     -0.4425000     0.4813000 
1 1 1 4  30 11 o 5.648000  0.2244000     5.336000  0.3352000     5.960000  0.2984000     -0.6240000     0.4488000 
1 1 1 4  30 12 o 12.24000  0.1783000     12.49000  0.2539000     12.00000  0.2505000     0.4937000      0.3567000 
1 1 1 4  30 13 o 5.409000  0.2549000     5.515000  0.3499000     5.303000  0.3707000     0.2126000      0.5098000 
1 1 1 4  30 14 o 8.445000  0.2273000     8.353000  0.2994000     8.537000  0.3420000     -0.1845000     0.4545000 
1 1 1 4  30 15 o 1.981000  0.5262000     1.765000  0.7268000     2.196000  0.7611000     -0.4312000     1.052000  
1 1 1 4  30 16 o 2.195000  0.6341000     1.458000  0.6968000     2.933000  1.060000      -1.475000      1.268000  
1 1 1 4  30 17 o 5.823000  0.3323000     5.517000  0.4283000     6.129000  0.5083000     -0.6116000     0.6647000 
1 1 1 4  30 18 o 4.388000  0.4205000     4.429000  0.5960000     4.346000  0.5934000     0.8364000E-01  0.8410000 
1 1 1 4  30 19 o 2.134000  0.5729000     2.375000  0.8440000     1.894000  0.7750000     0.4808000      1.146000  
1 1 1 4  30 20 o 1.872000  0.5420000     1.973000  0.7982000     1.772000  0.7335000     0.2009000      1.084000  
1 1 1 4  30 21 o 1.676000  0.4958000     1.353000  0.6311000     1.999000  0.7649000     -0.6461000     0.9917000 
1 1 1 4  30 22 o 1.766000  0.5745000     1.814000  0.7932000     1.718000  0.8314000     0.9600000E-01  1.149000  
1 1 1 4  30 23 o 1.877000  0.5090000     2.084000  0.7407000     1.669000  0.6983000     0.4153000      1.018000  
1 1 1 4  30 24 o 1.427000  0.4565000     1.363000  0.6287000     1.492000  0.6620000     -0.1292000     0.9129000 
1 1 1 4  31 0  o 12.21000  0.2084000     12.21000  0.2084000     12.21000  0.2084000     0.000000       0.000000  
1 1 1 4  31 1  o 14.43000  0.1550000     14.17000  0.2171000     14.70000  0.2212000     -0.5351000     0.3099000 
1 1 1 4  31 2  o 8.048000  0.1468000     8.190000  0.2070000     7.905000  0.2083000     0.2849000      0.2937000 
1 1 1 4  31 3  o 22.55000  0.2010000     22.45000  0.2832000     22.65000  0.2852000     -0.1940000     0.4019000 
1 1 1 4  31 4  o 12.86000  0.1517000     12.74000  0.2136000     12.97000  0.2154000     -0.2210000     0.3034000 
1 1 1 4  31 5  o 26.42000  0.2278000     26.61000  0.3235000     26.24000  0.3209000     0.3716000      0.4556000 
1 1 1 4  31 6  o 16.68000  0.1718000     16.49000  0.2413000     16.87000  0.2446000     -0.3816000     0.3436000 
1 1 1 4  31 7  o 8.888000  0.1574000     9.121000  0.2211000     8.655000  0.2242000     0.4664000      0.3149000 
1 1 1 4  31 8  o 17.30000  0.2206000     17.61000  0.3632000     16.99000  0.2505000     0.6112000      0.4412000 
1 1 1 4  31 9  o 16.12000  0.3303000     16.93000  0.3581000     15.30000  0.5552000     1.633000       0.6607000 
1 1 1 4  31 10 o 19.02000  0.1932000     18.96000  0.2730000     19.08000  0.2736000     -0.1162000     0.3865000 
1 1 1 4  31 11 o 7.934000  0.1861000     7.948000  0.2656000     7.920000  0.2608000     0.2782000E-01  0.3722000 
1 1 1 4  31 12 o 13.57000  0.1995000     13.80000  0.3076000     13.33000  0.2542000     0.4659000      0.3991000 
1 1 1 4  31 13 o 13.73000  0.1871000     14.17000  0.2677000     13.28000  0.2616000     0.8854000      0.3742000 
1 1 1 4  31 14 f 6.327000  0.2581000     6.166000  0.3683000     6.487000  0.3616000     -0.3211000     0.5161000 
1 1 1 4  31 15 o 7.645000  0.2396000     7.586000  0.3387000     7.705000  0.3391000     -0.1186000     0.4792000 
1 1 1 4  31 16 o 1.760000  0.7435000     1.760000  0.7435000     ?         ?             ?              ?         
1 1 1 4  31 17 o 6.331000  0.3125000     6.670000  0.3683000     5.993000  0.5049000     0.6770000      0.6250000 
1 1 1 4  31 18 o 4.295000  0.4456000     4.785000  0.5579000     3.806000  0.6951000     0.9791000      0.8913000 
1 1 1 4  31 19 o 1.912000  0.5343000     2.421000  0.8438000     1.402000  0.6556000     1.019000       1.069000  
1 1 1 4  31 20 o 1.892000  0.5425000     1.954000  0.7916000     1.830000  0.7420000     0.1237000      1.085000  
1 1 1 4  31 21 o 3.688000  0.4581000     3.258000  0.7074000     4.118000  0.5821000     -0.8600000     0.9161000 
1 1 1 4  31 22 o 2.565000  0.6679000     2.579000  1.107000      2.552000  0.7480000     0.2706000E-01  1.336000  
1 1 1 4  31 23 o 1.746000  0.5020000     1.606000  0.6852000     1.886000  0.7338000     -0.2806000     1.004000  
1 1 1 4  31 24 o 1.416000  0.4533000     1.287000  0.6033000     1.545000  0.6767000     -0.2579000     0.9066000 
1 1 1 4  32 0  o 2.756000  0.4206000     2.756000  0.4206000     2.756000  0.4206000     0.000000       0.000000  
1 1 1 4  32 1  o 12.62000  0.1501000     12.43000  0.2116000     12.81000  0.2131000     -0.3886000     0.3003000 
1 1 1 4  32 2  o 6.112000  0.1647000     6.193000  0.2333000     6.030000  0.2327000     0.1624000      0.3295000 
1 1 1 4  32 3  o 15.73000  0.1641000     15.50000  0.2309000     15.96000  0.2332000     -0.4582000     0.3282000 
1 1 1 4  32 4  o 16.56000  0.1692000     16.40000  0.2385000     16.71000  0.2401000     -0.3151000     0.3385000 
1 1 1 4  32 5  f 4.371000  0.2142000     4.823000  0.2807000     3.920000  0.3237000     0.9033000      0.4285000 
1 1 1 4  32 6  o 9.980000  0.1553000     10.00000  0.2179000     9.957000  0.2214000     0.4639000E-01  0.3107000 
1 1 1 4  32 7  o 5.743000  0.1895000     5.803000  0.2687000     5.683000  0.2674000     0.1200000      0.3791000 
1 1 1 4  32 8  o 9.927000  0.2356000     9.927000  0.2356000     ?         ?             ?              ?         
1 1 1 4  32 9  o 9.700000  0.1669000     9.631000  0.2361000     9.769000  0.2361000     -0.1380000     0.3339000 
1 1 1 4  32 10 o 1.807000  0.4485000     2.016000  0.6415000     1.599000  0.6271000     0.4173000      0.8971000 
1 1 1 4  32 11 o 17.40000  0.1893000     17.69000  0.2689000     17.11000  0.2665000     0.5842000      0.3785000 
1 1 1 4  32 12 o 14.95000  0.1847000     14.92000  0.2615000     14.98000  0.2608000     -0.5507000E-01 0.3693000 
1 1 1 4  32 13 o 15.36000  0.2032000     15.60000  0.2753000     15.11000  0.2988000     0.4862000      0.4063000 
1 1 1 4  32 14 o 8.478000  0.2220000     8.360000  0.3179000     8.597000  0.3101000     -0.2379000     0.4441000 
1 1 1 4  32 15 o 3.246000  0.5506000     3.577000  0.8203000     2.915000  0.7347000     0.6616000      1.101000  
1 1 1 4  32 16 o 6.463000  0.3541000     6.740000  0.5183000     6.187000  0.4825000     0.5528000      0.7081000 
1 1 1 4  32 17 o 4.186000  0.4648000     4.833000  0.4750000     3.538000  0.7991000     1.295000       0.9296000 
1 1 1 4  32 18 f 2.477000  0.6374000     2.204000  0.8399000     2.750000  0.9589000     -0.5454000     1.275000  
1 1 1 4  32 19 o 3.033000  0.4987000     1.973000  0.8054000     4.093000  0.5884000     -2.120000      0.9975000 
1 1 1 4  32 20 f 2.259000  0.5005000     1.478000  0.6769000     3.040000  0.7374000     -1.562000      1.001000  
1 1 1 4  32 21 o 1.978000  0.5500000     1.740000  0.7376000     2.217000  0.8161000     -0.4769000     1.100000  
1 1 1 4  32 22 o 1.483000  0.4671000     1.373000  0.6369000     1.592000  0.6835000     -0.2190000     0.9343000 
1 1 1 4  32 23 o 1.505000  0.4705000     1.481000  0.6566000     1.530000  0.6741000     -0.4854000E-01 0.9410000 
1 1 1 4  32 24 o 2.087000  0.5103000     1.590000  0.6887000     2.584000  0.7531000     -0.9940000     1.021000  
1 1 1 4  33 0  o 10.62000  0.2099000     10.62000  0.2099000     10.62000  0.2099000     0.000000       0.000000  
1 1 1 4  33 1  o 9.414000  0.1476000     9.293000  0.2077000     9.536000  0.2098000     -0.2425000     0.2953000 
1 1 1 4  33 2  o 9.949000  0.1497000     9.891000  0.2119000     10.01000  0.2116000     -0.1162000     0.2994000 
1 1 1 4  33 3  o 22.13000  0.2005000     22.27000  0.2850000     21.99000  0.2822000     0.2727000      0.4010000 
1 1 1 4  33 4  o 15.46000  0.1649000     15.52000  0.2335000     15.39000  0.2328000     0.1239000      0.3298000 
1 1 1 4  33 5  o 18.66000  0.1825000     18.38000  0.2561000     18.94000  0.2600000     -0.5585000     0.3650000 
1 1 1 4  33 6  o 14.71000  0.1660000     14.71000  0.2348000     14.71000  0.2348000     0.5800000E-02  0.3320000 
1 1 1 4  33 7  o 13.48000  0.3324000     13.48000  0.3324000     ?         ?             ?              ?         
1 1 1 4  33 8  o 8.759000  0.2021000     8.875000  0.3255000     8.643000  0.2395000     0.2314000      0.4041000 
1 1 1 4  33 9  o 10.46000  0.1690000     10.27000  0.2388000     10.64000  0.2392000     -0.3697000     0.3380000 
1 1 1 4  33 10 o 4.904000  0.2433000     4.870000  0.3401000     4.937000  0.3480000     -0.6674000E-01 0.4866000 
1 1 1 4  33 11 o 5.715000  0.2293000     5.613000  0.3308000     5.818000  0.3175000     -0.2055000     0.4585000 
1 1 1 4  33 12 o 3.931000  0.3375000     3.350000  0.5415000     4.512000  0.4031000     -1.162000      0.6751000 
1 1 1 4  33 13 o 5.937000  0.2533000     5.558000  0.3741000     6.316000  0.3415000     -0.7578000     0.5066000 
1 1 1 4  33 14 o 1.818000  0.5042000     2.161000  0.7602000     1.476000  0.6624000     0.6857000      1.008000  
1 1 1 4  33 15 o 4.304000  0.7535000     4.304000  0.7535000     ?         ?             ?              ?         
1 1 1 4  33 16 o 7.502000  0.2824000     7.966000  0.3395000     7.037000  0.4513000     0.9288000      0.5647000 
1 1 1 4  33 17 o 3.640000  0.4875000     3.676000  0.6001000     3.605000  0.7685000     0.7052000E-01  0.9750000 
1 1 1 4  33 18 o 2.665000  0.5256000     1.957000  0.7506000     3.374000  0.7360000     -1.417000      1.051000  
1 1 1 4  33 19 o 2.642000  0.5371000     2.026000  0.8009000     3.259000  0.7159000     -1.233000      1.074000  
1 1 1 4  33 20 o 1.479000  0.4754000     1.475000  0.6778000     1.483000  0.6667000     -0.7330000E-02 0.9508000 
1 1 1 4  33 21 o 2.090000  0.7644000     2.090000  0.7644000     ?         ?             ?              ?         
1 1 1 4  33 22 o 2.280000  0.5390000     2.157000  0.7685000     2.404000  0.7561000     -0.2470000     1.078000  
1 1 1 4  33 23 o 1.824000  0.4974000     1.447000  0.6482000     2.200000  0.7546000     -0.7524000     0.9948000 
1 1 1 4  33 24 o 1.664000  0.4824000     1.295000  0.6079000     2.032000  0.7492000     -0.7373000     0.9648000 
1 1 1 4  34 0  o 6.956000  0.2261000     6.956000  0.2261000     6.956000  0.2261000     0.000000       0.000000  
1 1 1 4  34 1  o 9.925000  0.1503000     9.885000  0.2133000     9.965000  0.2119000     -0.8033000E-01 0.3007000 
1 1 1 4  34 2  o 8.664000  0.1540000     8.611000  0.2171000     8.717000  0.2185000     -0.1058000     0.3080000 
1 1 1 4  34 3  o 18.83000  0.1824000     18.94000  0.2591000     18.73000  0.2566000     0.2111000      0.3647000 
1 1 1 4  34 4  o 14.60000  0.1634000     14.93000  0.2335000     14.27000  0.2286000     0.6664000      0.3268000 
1 1 1 4  34 5  o 13.26000  0.1609000     13.21000  0.2264000     13.31000  0.2288000     -0.9716000E-01 0.3219000 
1 1 1 4  34 6  o 14.51000  0.2470000     14.81000  0.3394000     14.20000  0.3588000     0.6145000      0.4939000 
1 1 1 4  34 7  o 7.751000  0.2409000     7.863000  0.3364000     7.639000  0.3449000     0.2241000      0.4818000 
1 1 1 4  34 8  o 9.326000  0.1666000     9.314000  0.2352000     9.338000  0.2360000     -0.2383000E-01 0.3332000 
1 1 1 4  34 9  o 14.26000  0.1738000     14.43000  0.2458000     14.08000  0.2458000     0.3535000      0.3476000 
1 1 1 4  34 10 o 11.35000  0.1727000     11.32000  0.2432000     11.38000  0.2452000     -0.5689000E-01 0.3454000 
1 1 1 4  34 11 o 11.20000  0.1778000     10.95000  0.2520000     11.45000  0.2510000     -0.5052000     0.3557000 
1 1 1 4  34 12 o 13.66000  0.1863000     13.78000  0.2652000     13.54000  0.2616000     0.2493000      0.3725000 
1 1 1 4  34 13 o 8.494000  0.2141000     8.527000  0.3042000     8.460000  0.3012000     0.6632000E-01  0.4281000 
1 1 1 4  34 14 o 3.377000  0.4518000     3.211000  0.6620000     3.543000  0.6151000     -0.3321000     0.9036000 
1 1 1 4  34 15 o 5.931000  0.5749000     5.931000  0.5749000     ?         ?             ?              ?         
1 1 1 4  34 16 o 1.801000  0.5288000     1.377000  0.6384000     2.224000  0.8433000     -0.8468000     1.058000  
1 1 1 4  34 17 o 6.605000  0.2947000     6.237000  0.3837000     6.972000  0.4475000     -0.7352000     0.5895000 
1 1 1 4  34 18 o 1.799000  0.5066000     1.594000  0.6847000     2.005000  0.7469000     -0.4103000     1.013000  
1 1 1 4  34 19 o 1.630000  0.5053000     1.524000  0.6965000     1.736000  0.7322000     -0.2118000     1.011000  
1 1 1 4  34 20 o 1.894000  0.4985000     1.422000  0.6540000     2.365000  0.7525000     -0.9433000     0.9970000 
1 1 1 4  34 21 o 1.859000  0.6212000     1.766000  0.8548000     1.952000  0.9016000     -0.1855000     1.242000  
1 1 1 4  34 22 o 1.792000  0.5157000     1.828000  0.7379000     1.756000  0.7207000     0.7174000E-01  1.031000  
1 1 1 4  34 23 o 1.500000  0.4579000     1.189000  0.5705000     1.812000  0.7164000     -0.6231000     0.9158000 
1 1 1 4  34 24 o 1.354000  0.4516000     1.699000  0.7468000     1.009000  0.5080000     0.6891000      0.9032000 
1 1 1 4  35 0  o 21.54000  0.2799000     21.54000  0.2799000     21.54000  0.2799000     -0.000000      0.000000  
1 1 1 4  35 1  o 7.316000  0.1626000     7.089000  0.2310000     7.542000  0.2288000     -0.4538000     0.3251000 
1 1 1 4  35 2  o 13.21000  0.1593000     13.34000  0.2251000     13.07000  0.2255000     0.2666000      0.3186000 
1 1 1 4  35 3  o 4.139000  0.2227000     3.967000  0.3293000     4.311000  0.2999000     -0.3441000     0.4454000 
1 1 1 4  35 4  o 26.91000  0.2333000     26.83000  0.3293000     27.00000  0.3305000     -0.1700000     0.4666000 
1 1 1 4  35 5  o 30.71000  0.4580000     31.16000  0.5282000     30.26000  0.7484000     0.8996000      0.9161000 
1 1 1 4  35 6  o 11.37000  0.2290000     11.08000  0.3156000     11.66000  0.3318000     -0.5767000     0.4579000 
1 1 1 4  35 7  f 8.242000  0.1719000     8.380000  0.2418000     8.104000  0.2445000     0.2762000      0.3438000 
1 1 1 4  35 8  o 1.659000  0.4109000     1.237000  0.5483000     2.081000  0.6121000     -0.8445000     0.8218000 
1 1 1 4  35 9  o 7.007000  0.1916000     7.090000  0.2681000     6.925000  0.2739000     0.1653000      0.3833000 
1 1 1 4  35 10 o 7.853000  0.1889000     7.932000  0.2675000     7.775000  0.2667000     0.1568000      0.3777000 
1 1 1 4  35 11 o 5.673000  0.2425000     5.770000  0.3386000     5.577000  0.3473000     0.1934000      0.4850000 
1 1 1 4  35 12 o 3.605000  0.3829000     3.175000  0.6050000     4.035000  0.4694000     -0.8609000     0.7658000 
1 1 1 4  35 13 o 6.774000  0.2465000     6.724000  0.3540000     6.823000  0.3430000     -0.9856000E-01 0.4929000 
1 1 1 4  35 14 o 2.877000  0.5753000     2.913000  0.8918000     2.841000  0.7271000     0.7162000E-01  1.151000  
1 1 1 4  35 15 o 2.941000  0.5881000     2.923000  0.9210000     2.960000  0.7316000     -0.3670000E-01 1.176000  
1 1 1 4  35 16 o 8.377000  0.2568000     8.352000  0.3182000     8.401000  0.4030000     -0.4872000E-01 0.5135000 
1 1 1 4  35 17 o 4.000000  0.4321000     3.871000  0.5561000     4.128000  0.6614000     -0.2567000     0.8641000 
1 1 1 4  35 18 o 3.870000  0.4100000     4.287000  0.5072000     3.452000  0.6442000     0.8354000      0.8200000 
1 1 1 4  35 19 f 1.768000  0.5038000     1.460000  0.6601000     2.077000  0.7611000     -0.6176000     1.008000  
1 1 1 4  35 20 o 2.213000  0.5766000     2.479000  0.8649000     1.947000  0.7628000     0.5314000      1.153000  
1 1 1 4  35 21 o 2.372000  0.6015000     2.466000  0.9407000     2.278000  0.7499000     0.1884000      1.203000  
1 1 1 4  35 22 o 1.400000  0.4463000     1.659000  0.6994000     1.140000  0.5547000     0.5192000      0.8927000 
1 1 1 4  35 23 o 1.383000  0.4475000     1.458000  0.6561000     1.307000  0.6087000     0.1508000      0.8950000 
1 1 1 4  36 0  o 5.280000  0.2751000     5.280000  0.2751000     5.280000  0.2751000     -0.000000      0.000000  
1 1 1 4  36 1  o 24.47000  0.2171000     24.49000  0.3071000     24.45000  0.3071000     0.4214000E-01  0.4343000 
1 1 1 4  36 2  o 10.65000  0.1582000     10.67000  0.2236000     10.63000  0.2237000     0.3857000E-01  0.3163000 
1 1 1 4  36 3  o 11.51000  0.2266000     11.43000  0.3199000     11.60000  0.3211000     -0.1743000     0.4533000 
1 1 1 4  36 4  o 4.607000  0.6152000     4.607000  0.6152000     ?         ?             ?              ?         
1 1 1 4  36 5  o 25.94000  0.3231000     25.92000  0.4571000     25.95000  0.4568000     -0.3593000E-01 0.6462000 
1 1 1 4  36 6  o 4.064000  0.2559000     4.234000  0.3530000     3.894000  0.3707000     0.3400000      0.5119000 
1 1 1 4  36 7  f 19.81000  0.1956000     19.74000  0.2753000     19.87000  0.2778000     -0.1299000     0.3911000 
1 1 1 4  36 8  o 16.46000  0.1810000     16.50000  0.2554000     16.42000  0.2564000     0.8509000E-01  0.3619000 
1 1 1 4  36 9  o 11.76000  0.1723000     11.72000  0.2417000     11.81000  0.2457000     -0.9330000E-01 0.3447000 
1 1 1 4  36 10 o 4.757000  0.2836000     4.375000  0.4603000     5.138000  0.3313000     -0.7633000     0.5671000 
1 1 1 4  36 11 o 4.203000  0.3128000     4.086000  0.4482000     4.321000  0.4365000     -0.2344000     0.6256000 
1 1 1 4  36 12 o 8.312000  0.2091000     8.364000  0.2964000     8.261000  0.2949000     0.1028000      0.4181000 
1 1 1 4  36 13 o 1.739000  0.5004000     1.743000  0.7108000     1.736000  0.7046000     0.6386000E-02  1.001000  
1 1 1 4  36 14 o 1.670000  0.7153000     1.670000  0.7153000     ?         ?             ?              ?         
1 1 1 4  36 15 o 5.110000  0.3096000     5.040000  0.4339000     5.181000  0.4417000     -0.1409000     0.6191000 
1 1 1 4  36 16 o 7.014000  0.2856000     6.951000  0.3584000     7.078000  0.4448000     -0.1270000     0.5712000 
1 1 1 4  36 17 o 5.259000  0.3610000     5.886000  0.3975000     4.632000  0.6028000     1.253000       0.7220000 
1 1 1 4  36 18 o 1.923000  0.4742000     2.558000  0.7318000     1.289000  0.6032000     1.269000       0.9484000 
1 1 1 4  36 19 f 2.449000  0.5027000     3.016000  0.7108000     1.883000  0.7111000     1.133000       1.005000  
1 1 1 4  36 20 o 2.238000  0.8410000     2.238000  0.8410000     ?         ?             ?              ?         
1 1 1 4  36 21 o 2.507000  0.5080000     1.952000  0.7451000     3.063000  0.6908000     -1.111000      1.016000  
1 1 1 4  36 22 o 1.492000  0.4565000     1.172000  0.5610000     1.811000  0.7203000     -0.6388000     0.9130000 
1 1 1 4  36 23 o 1.201000  0.4048000     1.323000  0.6137000     1.079000  0.5281000     0.2436000      0.8096000 
1 1 1 4  37 0  o 15.95000  0.3470000     15.95000  0.3470000     15.95000  0.3470000     -0.000000      0.000000  
1 1 1 4  37 1  o 2.738000  0.4812000     2.576000  0.7024000     2.899000  0.6578000     -0.3227000     0.9623000 
1 1 1 4  37 2  o 13.63000  0.4796000     13.63000  0.4796000     ?         ?             ?              ?         
1 1 1 4  37 3  o 16.55000  0.3053000     16.91000  0.3540000     16.19000  0.4975000     0.7211000      0.6107000 
1 1 1 4  37 4  o 18.88000  0.2286000     18.52000  0.3690000     19.24000  0.2698000     -0.7188000     0.4571000 
1 1 1 4  37 5  o 4.153000  0.2451000     4.469000  0.3276000     3.836000  0.3647000     0.6326000      0.4902000 
1 1 1 4  37 6  o 8.308000  0.1745000     8.185000  0.2480000     8.430000  0.2455000     -0.2448000     0.3490000 
1 1 1 4  37 7  o 27.75000  0.2433000     27.99000  0.3464000     27.51000  0.3418000     0.4877000      0.4866000 
1 1 1 4  37 8  f 3.306000  0.3349000     3.503000  0.4419000     3.109000  0.5034000     0.3935000      0.6698000 
1 1 1 4  37 9  o 10.48000  0.1745000     10.30000  0.2459000     10.67000  0.2477000     -0.3771000     0.3490000 
1 1 1 4  37 10 o 4.491000  0.2755000     4.504000  0.3851000     4.478000  0.3941000     0.2616000E-01  0.5511000 
1 1 1 4  37 11 o 3.897000  0.3436000     3.853000  0.4942000     3.942000  0.4775000     -0.8926000E-01 0.6872000 
1 1 1 4  37 12 o 2.916000  0.4601000     3.558000  0.5796000     2.275000  0.7148000     1.283000       0.9202000 
1 1 1 4  37 13 o 1.643000  0.5143000     1.841000  0.7965000     1.446000  0.6509000     0.3957000      1.029000  
1 1 1 4  37 14 o 8.000000  0.2875000     7.844000  0.4758000     8.156000  0.3229000     -0.3120000     0.5750000 
1 1 1 4  37 15 o 3.282000  0.4699000     3.334000  0.6590000     3.229000  0.6700000     0.1050000      0.9398000 
1 1 1 4  37 16 o 3.356000  0.5082000     3.575000  0.5943000     3.137000  0.8245000     0.4381000      1.016000  
1 1 1 4  37 17 o 2.598000  0.5271000     3.121000  0.6590000     2.075000  0.8228000     1.046000       1.054000  
1 1 1 4  37 18 o 2.408000  0.5348000     2.505000  0.7419000     2.310000  0.7706000     0.1946000      1.070000  
1 1 1 4  37 19 o 2.646000  0.4733000     3.313000  0.6149000     1.979000  0.7197000     1.334000       0.9466000 
1 1 1 4  37 20 o 1.863000  0.5951000     1.645000  0.7394000     2.080000  0.9326000     -0.4348000     1.190000  
1 1 1 4  37 21 o 1.977000  0.5231000     1.838000  0.7221000     2.116000  0.7569000     -0.2775000     1.046000  
1 1 1 4  37 22 o 1.346000  0.4346000     1.514000  0.6596000     1.177000  0.5660000     0.3375000      0.8692000 
1 1 1 4  37 23 o 1.066000  0.3703000     1.146000  0.5522000     0.9864000 0.4936000     0.1591000      0.7407000 
1 1 1 4  38 0  o 2.896000  0.7371000     2.896000  0.7371000     2.896000  0.7371000     -0.000000      0.000000  
1 1 1 4  38 1  o 6.558000  0.2510000     6.886000  0.3484000     6.230000  0.3616000     0.6560000      0.5021000 
1 1 1 4  38 2  o 27.59000  0.2589000     27.29000  0.3890000     27.89000  0.3418000     -0.6011000     0.5179000 
1 1 1 4  38 3  o 20.17000  0.1947000     19.87000  0.2733000     20.47000  0.2775000     -0.6045000     0.3895000 
1 1 1 4  38 4  o 12.34000  0.1654000     12.52000  0.2341000     12.16000  0.2336000     0.3571000      0.3308000 
1 1 1 4  38 5  o 7.935000  0.1743000     7.787000  0.2502000     8.083000  0.2426000     -0.2962000     0.3485000 
1 1 1 4  38 6  o 5.766000  0.2079000     5.658000  0.2981000     5.874000  0.2900000     -0.2158000     0.4159000 
1 1 1 4  38 7  o 10.99000  0.1715000     10.90000  0.2406000     11.07000  0.2444000     -0.1746000     0.3430000 
1 1 1 4  38 8  o 15.51000  0.1799000     15.52000  0.2544000     15.50000  0.2543000     0.2017000E-01  0.3597000 
1 1 1 4  38 9  o 6.649000  0.2073000     6.825000  0.2900000     6.473000  0.2963000     0.3520000      0.4146000 
1 1 1 4  38 10 o 12.91000  0.1814000     13.00000  0.2562000     12.82000  0.2567000     0.1854000      0.3627000 
1 1 1 4  38 11 o 3.635000  0.3711000     3.537000  0.5407000     3.733000  0.5084000     -0.1958000     0.7422000 
1 1 1 4  38 12 o 3.356000  0.4490000     2.807000  0.7292000     3.904000  0.5239000     -1.096000      0.8979000 
1 1 1 4  38 13 o 1.884000  0.7366000     1.884000  0.7366000     ?         ?             ?              ?         
1 1 1 4  38 14 o 8.117000  0.2289000     8.065000  0.3229000     8.170000  0.3243000     -0.1047000     0.4577000 
1 1 1 4  38 15 o 5.170000  0.3098000     5.064000  0.4391000     5.276000  0.4371000     -0.2118000     0.6195000 
1 1 1 4  38 16 o 1.927000  0.5405000     1.639000  0.6924000     2.214000  0.8301000     -0.5752000     1.081000  
1 1 1 4  38 17 o 1.646000  0.5018000     1.247000  0.5881000     2.046000  0.8133000     -0.7991000     1.004000  
1 1 1 4  38 18 o 1.610000  0.4854000     1.526000  0.6684000     1.694000  0.7042000     -0.1683000     0.9709000 
1 1 1 4  38 19 o 1.585000  0.5141000     1.914000  0.8441000     1.256000  0.5871000     0.6577000      1.028000  
1 1 1 4  38 20 f 1.556000  0.4711000     2.124000  0.8070000     0.9894000 0.4864000     1.134000       0.9422000 
1 1 1 4  38 21 o 1.160000  0.3946000     1.145000  0.5538000     1.175000  0.5623000     -0.2970000E-01 0.7892000 
1 1 1 4  38 22 o 1.524000  0.4718000     1.562000  0.6744000     1.485000  0.6600000     0.7736000E-01  0.9436000 
1 1 1 4  38 23 o 1.082000  0.3932000     1.112000  0.5698000     1.052000  0.5420000     0.5978000E-01  0.7865000 
1 1 1 4  39 0  o 14.43000  0.2386000     14.43000  0.2386000     14.43000  0.2386000     -0.000000      0.000000  
1 1 1 4  39 1  o 12.41000  0.1640000     12.38000  0.2325000     12.43000  0.2315000     -0.5041000E-01 0.3281000 
1 1 1 4  39 2  o 10.74000  0.1631000     10.46000  0.2321000     11.03000  0.2293000     -0.5763000     0.3262000 
1 1 1 4  39 3  o 16.50000  0.1783000     16.43000  0.2522000     16.56000  0.2521000     -0.1309000     0.3566000 
1 1 1 4  39 4  o 11.64000  0.1652000     11.55000  0.2336000     11.74000  0.2335000     -0.1971000     0.3303000 
1 1 1 4  39 5  o 18.06000  0.1865000     18.22000  0.2647000     17.90000  0.2627000     0.3150000      0.3729000 
1 1 1 4  39 6  o 6.123000  0.2073000     6.054000  0.2885000     6.193000  0.2978000     -0.1398000     0.4146000 
1 1 1 4  39 7  o 5.428000  0.2258000     5.491000  0.3201000     5.365000  0.3185000     0.1261000      0.4516000 
1 1 1 4  39 8  f 16.07000  0.1835000     16.24000  0.2589000     15.91000  0.2601000     0.3313000      0.3669000 
1 1 1 4  39 9  o 12.62000  0.1785000     12.73000  0.2514000     12.50000  0.2534000     0.2278000      0.3570000 
1 1 1 4  39 10 o 7.030000  0.2173000     7.570000  0.2951000     6.491000  0.3192000     1.079000       0.4347000 
1 1 1 4  39 11 o 15.29000  0.2130000     14.84000  0.2719000     15.73000  0.3279000     -0.8952000     0.4260000 
1 1 1 4  39 12 o 7.007000  0.2981000     7.052000  0.4907000     6.962000  0.3388000     0.8998000E-01  0.5963000 
1 1 1 4  39 13 o 2.754000  0.5271000     2.052000  0.8433000     3.457000  0.6325000     -1.405000      1.054000  
1 1 1 4  39 14 o 1.787000  0.4904000     2.236000  0.7580000     1.337000  0.6223000     0.8996000      0.9807000 
1 1 1 4  39 15 o 2.566000  0.5284000     2.323000  0.7546000     2.809000  0.7398000     -0.4853000     1.057000  
1 1 1 4  39 16 o 3.204000  0.5107000     3.549000  0.5903000     2.860000  0.8335000     0.6884000      1.021000  
1 1 1 4  39 17 o 2.775000  0.5469000     2.362000  0.7469000     3.189000  0.7990000     -0.8272000     1.094000  
1 1 1 4  39 18 o 1.223000  0.4082000     1.119000  0.5399000     1.327000  0.6124000     -0.2078000     0.8164000 
1 1 1 4  39 19 o 2.456000  0.6607000     2.736000  0.9955000     2.177000  0.8688000     0.5589000      1.321000  
1 1 1 4  39 20 o 1.102000  0.3752000     1.049000  0.5130000     1.156000  0.5477000     -0.1064000     0.7504000 
1 1 1 4  39 21 o 1.645000  0.4835000     1.830000  0.7157000     1.461000  0.6501000     0.3688000      0.9669000 
1 1 1 4  39 22 o 1.479000  0.4593000     1.238000  0.5838000     1.720000  0.7092000     -0.4814000     0.9186000 
1 1 1 4  40 0  o 16.82000  0.2532000     16.82000  0.2532000     16.82000  0.2532000     0.000000       0.000000  
1 1 1 4  40 1  o 11.80000  0.1648000     11.98000  0.2329000     11.62000  0.2333000     0.3588000      0.3297000 
1 1 1 4  40 2  o 15.77000  0.1759000     15.87000  0.2490000     15.66000  0.2486000     0.2071000      0.3519000 
1 1 1 4  40 3  f 18.37000  0.1882000     18.44000  0.2677000     18.30000  0.2647000     0.1370000      0.3765000 
1 1 1 4  40 4  o 8.406000  0.1738000     8.701000  0.2440000     8.112000  0.2474000     0.5886000      0.3475000 
1 1 1 4  40 5  o 18.12000  0.1881000     18.51000  0.2685000     17.73000  0.2635000     0.7847000      0.3762000 
1 1 1 4  40 6  o 7.195000  0.1880000     7.135000  0.2662000     7.255000  0.2656000     -0.1195000     0.3760000 
1 1 1 4  40 7  o 15.02000  0.1793000     14.95000  0.2522000     15.09000  0.2549000     -0.1453000     0.3586000 
1 1 1 4  40 8  o 2.781000  0.4200000     2.606000  0.6256000     2.955000  0.5605000     -0.3493000     0.8400000 
1 1 1 4  40 9  f 14.70000  0.1860000     14.88000  0.2625000     14.52000  0.2636000     0.3616000      0.3720000 
1 1 1 4  40 10 f 18.41000  0.2016000     18.18000  0.2841000     18.64000  0.2862000     -0.4563000     0.4033000 
1 1 1 4  40 11 o 14.01000  0.1920000     14.04000  0.2719000     13.98000  0.2711000     0.5105000E-01  0.3839000 
1 1 1 4  40 12 o 1.235000  0.5911000     1.235000  0.5911000     ?         ?             ?              ?         
1 1 1 4  40 13 o 4.292000  0.3669000     3.968000  0.5559000     4.617000  0.4791000     -0.6494000     0.7339000 
1 1 1 4  40 14 o 4.596000  0.3408000     4.481000  0.4904000     4.711000  0.4734000     -0.2303000     0.6816000 
1 1 1 4  40 15 o 1.721000  0.4976000     1.877000  0.7266000     1.564000  0.6801000     0.3132000      0.9952000 
1 1 1 4  40 16 o 1.916000  0.5308000     2.061000  0.7381000     1.771000  0.7630000     0.2908000      1.062000  
1 1 1 4  40 17 o 3.602000  0.4717000     3.567000  0.5933000     3.637000  0.7334000     -0.6958000E-01 0.9434000 
1 1 1 4  40 18 o 3.956000  0.3735000     3.970000  0.5230000     3.943000  0.5333000     0.2755000E-01  0.7469000 
1 1 1 4  40 19 o 3.306000  0.6327000     3.306000  0.6327000     ?         ?             ?              ?         
1 1 1 4  40 20 o 2.045000  0.5010000     1.826000  0.7205000     2.264000  0.6964000     -0.4377000     1.002000  
1 1 1 4  40 21 o 1.336000  0.4213000     1.386000  0.6062000     1.286000  0.5851000     0.1002000      0.8425000 
1 1 1 4  40 22 o 1.793000  0.5056000     1.492000  0.6637000     2.093000  0.7628000     -0.6010000     1.011000  
1 1 1 4  41 0  o 5.151000  0.3133000     5.151000  0.3133000     5.151000  0.3133000     0.000000       0.000000  
1 1 1 4  41 1  o 17.53000  0.1840000     17.58000  0.2603000     17.48000  0.2603000     0.9466000E-01  0.3681000 
1 1 1 4  41 2  o 3.579000  0.3051000     3.869000  0.3958000     3.290000  0.4643000     0.5793000      0.6102000 
1 1 1 4  41 3  o 19.56000  0.1953000     19.47000  0.2754000     19.65000  0.2770000     -0.1758000     0.3906000 
1 1 1 4  41 4  o 10.52000  0.1709000     10.46000  0.2411000     10.58000  0.2422000     -0.1258000     0.3417000 
1 1 1 4  41 5  o 7.629000  0.1835000     7.854000  0.2544000     7.404000  0.2645000     0.4504000      0.3670000 
1 1 1 4  41 6  o 5.351000  0.2305000     5.546000  0.3135000     5.156000  0.3380000     0.3894000      0.4610000 
1 1 1 4  41 7  o 3.935000  0.3152000     3.736000  0.4709000     4.135000  0.4191000     -0.3985000     0.6304000 
1 1 1 4  41 8  o 5.170000  0.2611000     5.619000  0.3441000     4.721000  0.3927000     0.8982000      0.5222000 
1 1 1 4  41 9  o 2.074000  0.4901000     2.055000  0.6909000     2.093000  0.6954000     -0.3741000E-01 0.9802000 
1 1 1 4  41 10 o 13.69000  0.1901000     13.68000  0.2682000     13.70000  0.2696000     -0.2029000E-01 0.3803000 
1 1 1 4  41 11 o 5.824000  0.5401000     5.824000  0.5401000     ?         ?             ?              ?         
1 1 1 4  41 12 o 6.093000  0.3249000     5.630000  0.5462000     6.556000  0.3520000     -0.9266000     0.6498000 
1 1 1 4  41 13 o 2.542000  0.5361000     2.675000  0.7444000     2.409000  0.7717000     0.2655000      1.072000  
1 1 1 4  41 14 o 1.938000  0.5209000     1.768000  0.7174000     2.109000  0.7555000     -0.3413000     1.042000  
1 1 1 4  41 15 o 2.172000  0.5116000     1.597000  0.6828000     2.747000  0.7620000     -1.150000      1.023000  
1 1 1 4  41 16 f 1.392000  0.4554000     1.034000  0.5095000     1.750000  0.7549000     -0.7160000     0.9108000 
1 1 1 4  41 17 o 2.102000  0.4976000     2.651000  0.7026000     1.553000  0.7047000     1.099000       0.9951000 
1 1 1 4  41 18 f 3.410000  0.5284000     3.452000  0.8647000     3.368000  0.6076000     0.8404000E-01  1.057000  
1 1 1 4  41 19 o 1.710000  0.5010000     2.139000  0.8087000     1.282000  0.5917000     0.8569000      1.002000  
1 1 1 4  41 20 o 1.903000  0.4990000     1.963000  0.7193000     1.843000  0.6919000     0.1208000      0.9980000 
1 1 1 4  41 21 o 2.002000  0.4961000     1.978000  0.7078000     2.026000  0.6953000     -0.4756000E-01 0.9922000 
1 1 1 4  41 22 o 1.364000  0.4495000     1.332000  0.6230000     1.395000  0.6482000     -0.6239000E-01 0.8991000 
1 1 1 4  42 0  o 13.99000  0.2450000     13.99000  0.2450000     13.99000  0.2450000     0.000000       0.000000  
1 1 1 4  42 1  o 12.86000  0.1702000     12.84000  0.2401000     12.89000  0.2414000     -0.5242000E-01 0.3404000 
1 1 1 4  42 2  o 16.93000  0.1832000     17.15000  0.2608000     16.72000  0.2573000     0.4309000      0.3664000 
1 1 1 4  42 3  o 1.541000  0.4202000     1.765000  0.6215000     1.318000  0.5656000     0.4468000      0.8403000 
1 1 1 4  42 4  o 6.446000  0.1977000     6.474000  0.2774000     6.418000  0.2817000     0.5618000E-01  0.3954000 
1 1 1 4  42 5  o 4.098000  0.2855000     4.653000  0.3566000     3.542000  0.4460000     1.111000       0.5710000 
1 1 1 4  42 6  o 8.089000  0.1907000     8.065000  0.2710000     8.112000  0.2684000     -0.4631000E-01 0.3814000 
1 1 1 4  42 7  o 7.514000  0.2057000     7.238000  0.2934000     7.790000  0.2884000     -0.5521000     0.4114000 
1 1 1 4  42 8  o 8.954000  0.1955000     8.931000  0.2771000     8.977000  0.2760000     -0.4574000E-01 0.3911000 
1 1 1 4  42 9  o 11.69000  0.1891000     11.87000  0.2669000     11.50000  0.2681000     0.3724000      0.3783000 
1 1 1 4  42 10 o 9.585000  0.2516000     9.627000  0.4153000     9.542000  0.2842000     0.8524000E-01  0.5033000 
1 1 1 4  42 11 o 4.556000  0.6082000     4.941000  0.5861000     4.171000  1.066000      0.7704000      1.216000  
1 1 1 4  42 12 o 3.982000  0.3742000     3.627000  0.5824000     4.337000  0.4702000     -0.7101000     0.7485000 
1 1 1 4  42 13 o 3.459000  0.4458000     3.592000  0.6062000     3.327000  0.6539000     0.2657000      0.8917000 
1 1 1 4  42 14 o 5.398000  0.3004000     5.416000  0.4110000     5.381000  0.4383000     0.3408000E-01  0.6008000 
1 1 1 4  42 15 o 3.008000  0.4879000     2.624000  0.7312000     3.393000  0.6461000     -0.7699000     0.9757000 
1 1 1 4  42 16 f 1.436000  0.4682000     1.419000  0.6410000     1.453000  0.6827000     -0.3366000E-01 0.9364000 
1 1 1 4  42 17 o 2.590000  0.5238000     2.977000  0.6531000     2.203000  0.8191000     0.7740000      1.048000  
1 1 1 4  42 18 o 3.172000  0.7042000     3.172000  0.7042000     ?         ?             ?              ?         
1 1 1 4  42 19 o 1.634000  0.4656000     1.289000  0.6029000     1.978000  0.7098000     -0.6887000     0.9313000 
1 1 1 4  42 20 o 1.922000  0.5007000     2.193000  0.7437000     1.650000  0.6706000     0.5422000      1.001000  
1 1 1 4  42 21 o 2.384000  0.4689000     2.855000  0.6242000     1.914000  0.6998000     0.9414000      0.9377000 
1 1 1 4  43 0  o 1.039000  0.6485000     1.039000  0.6485000     1.039000  0.6485000     0.000000       0.000000  
1 1 1 4  43 1  o 6.773000  0.1954000     6.793000  0.2744000     6.753000  0.2782000     0.3918000E-01  0.3908000 
1 1 1 4  43 2  o 9.756000  0.1746000     9.842000  0.2476000     9.671000  0.2464000     0.1702000      0.3493000 
1 1 1 4  43 3  o 8.972000  0.1791000     8.931000  0.2542000     9.012000  0.2524000     -0.8068000E-01 0.3583000 
1 1 1 4  43 4  f 3.659000  0.3224000     4.265000  0.3804000     3.054000  0.5207000     1.212000       0.6448000 
1 1 1 4  43 5  o 4.702000  0.2597000     4.961000  0.3501000     4.443000  0.3838000     0.5177000      0.5195000 
1 1 1 4  43 6  o 9.676000  0.1854000     9.857000  0.2613000     9.496000  0.2632000     0.3616000      0.3709000 
1 1 1 4  43 7  o 14.43000  0.1848000     14.26000  0.2599000     14.61000  0.2627000     -0.3532000     0.3696000 
1 1 1 4  43 8  o 3.409000  0.3976000     3.512000  0.5345000     3.307000  0.5889000     0.2055000      0.7953000 
1 1 1 4  43 9  o 7.290000  0.2526000     6.905000  0.4023000     7.675000  0.3056000     -0.7698000     0.5052000 
1 1 1 4  43 10 o 5.520000  0.4416000     5.520000  0.4416000     ?         ?             ?              ?         
1 1 1 4  43 11 o 1.292000  0.4212000     1.161000  0.5560000     1.424000  0.6328000     -0.2630000     0.8423000 
1 1 1 4  43 12 o 6.284000  0.2590000     6.130000  0.3725000     6.438000  0.3601000     -0.3083000     0.5181000 
1 1 1 4  43 13 o 3.919000  0.3827000     3.536000  0.5893000     4.303000  0.4886000     -0.7666000     0.7655000 
1 1 1 4  43 14 o 2.891000  0.5011000     2.882000  0.7068000     2.900000  0.7105000     -0.1802000E-01 1.002000  
1 1 1 4  43 15 o 2.332000  0.5677000     2.240000  0.7400000     2.423000  0.8610000     -0.1830000     1.135000  
1 1 1 4  43 16 o 4.168000  0.4299000     4.444000  0.4742000     3.892000  0.7172000     0.5526000      0.8598000 
1 1 1 4  43 17 o 1.660000  0.4909000     1.643000  0.6855000     1.677000  0.7029000     -0.3353000E-01 0.9818000 
1 1 1 4  43 18 o 1.811000  0.5480000     1.670000  0.7499000     1.951000  0.7992000     -0.2819000     1.096000  
1 1 1 4  43 19 o 3.197000  0.4666000     3.446000  0.6418000     2.949000  0.6775000     0.4974000      0.9332000 
1 1 1 4  43 20 o 3.169000  0.4433000     3.397000  0.6220000     2.941000  0.6318000     0.4560000      0.8866000 
1 1 1 4  43 21 o 1.349000  0.4312000     1.367000  0.6148000     1.331000  0.6048000     0.3567000E-01  0.8625000 
1 1 1 4  44 0  o 10.61000  0.2446000     10.61000  0.2446000     10.61000  0.2446000     0.000000       0.000000  
1 1 1 4  44 1  o 13.75000  0.1747000     13.65000  0.2478000     13.84000  0.2463000     -0.1933000     0.3494000 
1 1 1 4  44 2  o 7.552000  0.1920000     7.462000  0.2723000     7.642000  0.2708000     -0.1800000     0.3840000 
1 1 1 4  44 3  o 11.40000  0.1888000     11.33000  0.2849000     11.47000  0.2477000     -0.1413000     0.3775000 
1 1 1 4  44 4  o 13.64000  0.1795000     13.83000  0.2533000     13.46000  0.2544000     0.3737000      0.3590000 
1 1 1 4  44 5  o 3.588000  0.3506000     3.132000  0.5583000     4.044000  0.4241000     -0.9121000     0.7011000 
1 1 1 4  44 6  o 16.32000  0.1898000     16.40000  0.2692000     16.24000  0.2678000     0.1571000      0.3797000 
1 1 1 4  44 7  f 10.25000  0.1923000     10.33000  0.2696000     10.17000  0.2744000     0.1610000      0.3847000 
1 1 1 4  44 8  o 8.741000  0.2044000     8.686000  0.2877000     8.796000  0.2905000     -0.1099000     0.4089000 
1 1 1 4  44 9  o 7.562000  0.4647000     7.562000  0.4647000     ?         ?             ?              ?         
1 1 1 4  44 10 o 2.725000  0.5486000     3.184000  0.8147000     2.266000  0.7348000     0.9180000      1.097000  
1 1 1 4  44 11 f 5.472000  0.2792000     5.377000  0.3959000     5.566000  0.3939000     -0.1887000     0.5585000 
1 1 1 4  44 12 o 4.902000  0.3076000     4.663000  0.4502000     5.141000  0.4193000     -0.4778000     0.6152000 
1 1 1 4  44 13 o 4.699000  0.3294000     5.134000  0.4234000     4.265000  0.5047000     0.8692000      0.6588000 
1 1 1 4  44 14 o 4.700000  0.3239000     4.435000  0.4817000     4.966000  0.4331000     -0.5318000     0.6478000 
1 1 1 4  44 15 o 2.081000  0.5565000     2.114000  0.7532000     2.047000  0.8194000     0.6725000E-01  1.113000  
1 1 1 4  44 16 o 1.590000  0.4917000     1.643000  0.6906000     1.538000  0.7002000     0.1044000      0.9835000 
1 1 1 4  44 17 o 3.033000  0.6471000     3.592000  0.8355000     2.473000  0.9885000     1.119000       1.294000  
1 1 1 4  44 18 o 1.727000  0.5032000     1.982000  0.7707000     1.471000  0.6471000     0.5109000      1.006000  
1 1 1 4  44 19 o 1.908000  0.5013000     1.893000  0.7269000     1.923000  0.6906000     -0.2948000E-01 1.003000  
1 1 1 4  44 20 o 1.583000  0.4529000     1.244000  0.5857000     1.922000  0.6911000     -0.6776000     0.9059000 
1 1 1 4  44 21 o 3.595000  0.7167000     4.163000  0.9923000     3.028000  1.034000      1.135000       1.433000  
1 1 1 4  45 0  o 6.362000  0.3021000     6.362000  0.3021000     6.362000  0.3021000     0.000000       0.000000  
1 1 1 4  45 1  o 4.023000  0.3066000     3.560000  0.4808000     4.485000  0.3807000     -0.9247000     0.6132000 
1 1 1 4  45 2  o 15.30000  0.1837000     15.47000  0.2613000     15.13000  0.2582000     0.3441000      0.3674000 
1 1 1 4  45 3  o 10.08000  0.1825000     10.02000  0.2591000     10.13000  0.2570000     -0.1136000     0.3650000 
1 1 1 4  45 4  o 8.795000  0.1898000     8.861000  0.2697000     8.729000  0.2671000     0.1319000      0.3796000 
1 1 1 4  45 5  o 16.33000  0.1904000     16.53000  0.2695000     16.13000  0.2691000     0.3996000      0.3809000 
1 1 1 4  45 6  f 11.77000  0.1847000     11.78000  0.2604000     11.77000  0.2621000     0.9366000E-02  0.3694000 
1 1 1 4  45 7  o 7.894000  0.2130000     7.748000  0.3030000     8.040000  0.2993000     -0.2923000     0.4259000 
1 1 1 4  45 8  o 10.64000  0.4055000     10.64000  0.4055000     ?         ?             ?              ?         
1 1 1 4  45 9  o 7.268000  0.2763000     6.910000  0.4534000     7.626000  0.3160000     -0.7161000     0.5526000 
1 1 1 4  45 10 o 3.594000  0.4104000     3.816000  0.5421000     3.372000  0.6162000     0.4443000      0.8208000 
1 1 1 4  45 11 o 7.128000  0.2382000     7.127000  0.3419000     7.129000  0.3316000     -0.2277000E-02 0.4763000 
1 1 1 4  45 12 o 3.204000  0.4446000     4.095000  0.5083000     2.314000  0.7296000     1.781000       0.8892000 
1 1 1 4  45 13 o 5.433000  0.2865000     5.366000  0.4082000     5.499000  0.4020000     -0.1338000     0.5729000 
1 1 1 4  45 14 o 2.130000  0.5256000     2.154000  0.7486000     2.105000  0.7380000     0.4867000E-01  1.051000  
1 1 1 4  45 15 o 4.133000  0.4310000     4.458000  0.4799000     3.808000  0.7160000     0.6492000      0.8620000 
1 1 1 4  45 16 o 5.388000  0.3376000     5.590000  0.4016000     5.186000  0.5429000     0.4035000      0.6753000 
1 1 1 4  45 17 o 1.222000  0.5946000     1.222000  0.5946000     ?         ?             ?              ?         
1 1 1 4  45 18 o 2.596000  0.4986000     2.284000  0.7325000     2.908000  0.6767000     -0.6236000     0.9972000 
1 1 1 4  45 19 o 2.481000  0.4016000     1.293000  0.6010000     3.669000  0.5329000     -2.376000      0.8032000 
1 1 1 4  45 20 o 1.996000  0.4782000     2.570000  0.7221000     1.422000  0.6272000     1.148000       0.9565000 
1 1 1 4  46 0  o 0.9878000 0.6440000     0.9878000 0.6440000     0.9878000 0.6440000     -0.000000      0.000000  
1 1 1 4  46 1  o 13.69000  0.1819000     13.74000  0.2574000     13.65000  0.2570000     0.8136000E-01  0.3637000 
1 1 1 4  46 2  o 3.417000  0.3594000     3.390000  0.5071000     3.444000  0.5095000     -0.5453000E-01 0.7188000 
1 1 1 4  46 3  o 8.704000  0.1915000     8.784000  0.2691000     8.625000  0.2725000     0.1589000      0.3830000 
1 1 1 4  46 4  o 12.29000  0.1833000     12.38000  0.2593000     12.20000  0.2591000     0.1816000      0.3666000 
1 1 1 4  46 5  o 1.620000  0.4383000     2.066000  0.6818000     1.174000  0.5510000     0.8922000      0.8766000 
1 1 1 4  46 6  o 10.97000  0.2084000     10.91000  0.3180000     11.04000  0.2694000     -0.1316000     0.4168000 
1 1 1 4  46 7  o 6.158000  0.5269000     6.158000  0.5269000     ?         ?             ?              ?         
1 1 1 4  46 8  o 7.833000  0.2661000     7.727000  0.4285000     7.939000  0.3157000     -0.2120000     0.5322000 
1 1 1 4  46 9  o 3.989000  0.3661000     3.948000  0.5193000     4.029000  0.5162000     -0.8030000E-01 0.7322000 
1 1 1 4  46 10 f 7.185000  0.2364000     7.242000  0.3321000     7.128000  0.3367000     0.1141000      0.4729000 
1 1 1 4  46 11 o 1.232000  0.4060000     1.448000  0.6389000     1.015000  0.5012000     0.4328000      0.8120000 
1 1 1 4  46 12 o 2.239000  0.5109000     2.648000  0.7276000     1.830000  0.7174000     0.8182000      1.022000  
1 1 1 4  46 13 f 4.340000  0.3495000     4.567000  0.4608000     4.113000  0.5255000     0.4542000      0.6989000 
1 1 1 4  46 14 o 1.663000  0.4898000     1.811000  0.7172000     1.515000  0.6672000     0.2954000      0.9796000 
1 1 1 4  46 15 o 3.142000  0.5234000     3.373000  0.6221000     2.911000  0.8418000     0.4616000      1.047000  
1 1 1 4  46 16 o 1.630000  0.5320000     1.643000  0.7538000     1.616000  0.7509000     0.2647000E-01  1.064000  
1 1 1 4  46 17 o 2.155000  0.5265000     1.742000  0.7656000     2.567000  0.7230000     -0.8252000     1.053000  
1 1 1 4  46 18 o 1.961000  0.5034000     1.795000  0.6984000     2.127000  0.7253000     -0.3321000     1.007000  
1 1 1 4  46 19 o 1.202000  0.3989000     0.9661000 0.4787000     1.438000  0.6384000     -0.4717000     0.7979000 
1 1 1 4  46 20 o 1.886000  0.4869000     1.443000  0.6488000     2.329000  0.7261000     -0.8855000     0.9738000 
1 1 1 4  47 0  o 10.26000  0.2624000     10.26000  0.2624000     10.26000  0.2624000     0.000000       0.000000  
1 1 1 4  47 1  o 4.996000  0.2814000     5.118000  0.4151000     4.874000  0.3800000     0.2443000      0.5628000 
1 1 1 4  47 2  o 12.27000  0.1838000     12.24000  0.2585000     12.29000  0.2613000     -0.5027000E-01 0.3676000 
1 1 1 4  47 3  f 12.57000  0.1844000     12.50000  0.2610000     12.64000  0.2607000     -0.1470000     0.3689000 
1 1 1 4  47 4  o 2.108000  0.4660000     1.652000  0.6573000     2.563000  0.6608000     -0.9111000     0.9320000 
1 1 1 4  47 5  o 10.44000  0.2514000     10.48000  0.3907000     10.40000  0.3164000     0.7742000E-01  0.5027000 
1 1 1 4  47 6  o 9.394000  0.5636000     9.394000  0.5636000     ?         ?             ?              ?         
1 1 1 4  47 7  o 4.479000  0.3741000     4.483000  0.5934000     4.474000  0.4558000     0.9616000E-02  0.7482000 
1 1 1 4  47 8  o 8.066000  0.2170000     8.057000  0.3045000     8.075000  0.3093000     -0.1760000E-01 0.4340000 
1 1 1 4  47 9  o 1.461000  0.4562000     1.380000  0.6253000     1.541000  0.6646000     -0.1602000     0.9125000 
1 1 1 4  47 10 o 4.407000  0.3435000     4.218000  0.5080000     4.596000  0.4625000     -0.3785000     0.6870000 
1 1 1 4  47 11 o 4.263000  0.3456000     4.282000  0.4798000     4.243000  0.4975000     0.3884000E-01  0.6912000 
1 1 1 4  47 12 o 3.282000  0.4462000     3.769000  0.5470000     2.795000  0.7050000     0.9737000      0.8924000 
1 1 1 4  47 13 o 1.639000  0.4755000     1.968000  0.7346000     1.310000  0.6040000     0.6574000      0.9510000 
1 1 1 4  47 14 o 2.407000  0.5235000     2.392000  0.7316000     2.422000  0.7490000     -0.3002000E-01 1.047000  
1 1 1 4  47 15 o 3.376000  0.5077000     3.504000  0.5955000     3.248000  0.8225000     0.2553000      1.015000  
1 1 1 4  47 16 o 2.227000  0.7807000     2.227000  0.7807000     ?         ?             ?              ?         
1 1 1 4  47 17 o 2.176000  0.5010000     2.498000  0.7019000     1.854000  0.7151000     0.6448000      1.002000  
1 1 1 4  47 18 o 1.751000  0.4916000     1.706000  0.6915000     1.796000  0.6989000     -0.8960000E-01 0.9831000 
1 1 1 4  47 19 o 1.200000  0.4142000     1.326000  0.6435000     1.074000  0.5216000     0.2517000      0.8284000 
1 1 1 4  48 0  o 1.209000  0.7260000     1.209000  0.7260000     1.209000  0.7260000     -0.000000      0.000000  
1 1 1 4  48 1  o 7.055000  0.2194000     7.153000  0.3087000     6.956000  0.3120000     0.1970000      0.4388000 
1 1 1 4  48 2  o 8.137000  0.2068000     8.165000  0.2915000     8.109000  0.2933000     0.5626000E-01  0.4135000 
1 1 1 4  48 3  o 8.046000  0.3041000     8.298000  0.4225000     7.794000  0.4375000     0.5037000      0.6082000 
1 1 1 4  48 4  o 3.410000  0.6717000     3.005000  0.8293000     3.814000  1.057000      -0.8093000     1.343000  
1 1 1 4  48 5  o 10.93000  0.3396000     11.00000  0.3778000     10.85000  0.5646000     0.1490000      0.6793000 
1 1 1 4  48 6  o 8.632000  0.2248000     8.386000  0.3443000     8.879000  0.2890000     -0.4931000     0.4495000 
1 1 1 4  48 7  o 6.547000  0.2440000     6.761000  0.3317000     6.333000  0.3578000     0.4284000      0.4879000 
1 1 1 4  48 8  o 2.529000  0.5068000     2.200000  0.7320000     2.858000  0.7010000     -0.6579000     1.014000  
1 1 1 4  48 9  o 6.639000  0.2557000     6.949000  0.3450000     6.330000  0.3775000     0.6194000      0.5114000 
1 1 1 4  48 10 f 7.896000  0.2246000     8.035000  0.3135000     7.757000  0.3218000     0.2776000      0.4493000 
1 1 1 4  48 11 o 4.068000  0.3731000     3.528000  0.5942000     4.608000  0.4512000     -1.080000      0.7461000 
1 1 1 4  48 12 o 5.783000  0.2754000     5.676000  0.3966000     5.889000  0.3821000     -0.2131000     0.5508000 
1 1 1 4  48 13 o 1.430000  0.4443000     1.732000  0.6998000     1.129000  0.5475000     0.6037000      0.8886000 
1 1 1 4  48 14 o 1.456000  0.4571000     1.593000  0.6806000     1.320000  0.6103000     0.2725000      0.9142000 
1 1 1 4  48 15 o 3.120000  0.6367000     2.400000  0.9063000     3.839000  0.8946000     -1.439000      1.273000  
1 1 1 4  48 16 o 4.620000  0.4278000     4.371000  0.6379000     4.868000  0.5702000     -0.4963000     0.8557000 
1 1 1 4  48 17 o 1.354000  0.4324000     1.576000  0.6718000     1.132000  0.5446000     0.4445000      0.8648000 
1 1 1 4  48 18 o 1.218000  0.4031000     1.174000  0.5543000     1.263000  0.5853000     -0.8870000E-01 0.8061000 
1 1 1 4  48 19 o 2.000000  0.5119000     2.152000  0.7487000     1.847000  0.6982000     0.3052000      1.024000  
1 1 1 4  49 0  o 4.355000  0.9991000     4.355000  0.9991000     4.355000  0.9991000     0.000000       0.000000  
1 1 1 4  49 1  o 7.068000  0.4875000     6.669000  0.6688000     7.467000  0.7096000     -0.7987000     0.9751000 
1 1 1 4  49 3  f 10.88000  0.2743000     11.43000  0.3775000     10.33000  0.3980000     1.093000       0.5485000 
1 1 1 4  49 4  o 1.663000  0.5013000     1.595000  0.7081000     1.730000  0.7098000     -0.1352000     1.003000  
1 1 1 4  49 5  o 7.390000  0.2219000     7.463000  0.3066000     7.318000  0.3210000     0.1449000      0.4439000 
1 1 1 4  49 6  f 1.825000  0.4954000     1.595000  0.6731000     2.054000  0.7271000     -0.4591000     0.9908000 
1 1 1 4  49 7  o 4.194000  0.3501000     4.225000  0.4738000     4.163000  0.5156000     0.6210000E-01  0.7002000 
1 1 1 4  49 8  o 6.853000  0.2484000     6.910000  0.3443000     6.796000  0.3581000     0.1139000      0.4968000 
1 1 1 4  49 9  o 8.325000  0.2238000     8.454000  0.3115000     8.195000  0.3215000     0.2592000      0.4476000 
1 1 1 4  49 10 o 1.728000  0.4919000     1.842000  0.7074000     1.614000  0.6837000     0.2278000      0.9838000 
1 1 1 4  49 11 o 3.485000  0.4247000     3.640000  0.5628000     3.330000  0.6362000     0.3101000      0.8494000 
1 1 1 4  49 12 o 3.139000  0.4631000     3.245000  0.6210000     3.034000  0.6871000     0.2111000      0.9261000 
1 1 1 4  49 13 o 1.435000  0.4553000     1.433000  0.6405000     1.437000  0.6473000     -0.3279000E-02 0.9106000 
1 1 1 4  49 14 o 1.880000  0.5544000     2.072000  0.8612000     1.688000  0.6985000     0.3840000      1.109000  
1 1 1 4  49 15 o 1.711000  0.7504000     1.711000  0.7504000     ?         ?             ?              ?         
1 1 1 4  49 16 o 3.091000  0.5284000     3.415000  0.6372000     2.767000  0.8431000     0.6486000      1.057000  
1 1 1 4  49 17 o 1.560000  0.4512000     2.001000  0.7231000     1.120000  0.5399000     0.8810000      0.9024000 
1 1 1 4  49 18 o 1.317000  0.4249000     1.168000  0.5563000     1.465000  0.6423000     -0.2964000     0.8497000 
1 1 1 4  49 19 o 1.758000  0.4956000     1.311000  0.6161000     2.206000  0.7765000     -0.8951000     0.9913000 
1 1 1 4  50 0  o 4.867000  0.4878000     4.867000  0.4878000     4.867000  0.4878000     0.000000       0.000000  
1 1 1 4  50 1  o 6.036000  0.2805000     6.404000  0.3762000     5.667000  0.4162000     0.7370000      0.5610000 
1 1 1 4  50 2  o 3.165000  0.4346000     3.504000  0.5590000     2.825000  0.6656000     0.6785000      0.8692000 
1 1 1 4  50 3  f 4.984000  0.2872000     5.081000  0.3924000     4.887000  0.4194000     0.1943000      0.5743000 
1 1 1 4  50 4  o 10.95000  0.1959000     11.12000  0.2743000     10.79000  0.2799000     0.3303000      0.3919000 
1 1 1 4  50 5  o 2.188000  0.4900000     2.560000  0.6907000     1.816000  0.6952000     0.7440000      0.9800000 
1 1 1 4  50 6  o 6.752000  0.2408000     6.906000  0.3361000     6.599000  0.3449000     0.3071000      0.4816000 
1 1 1 4  50 7  o 8.451000  0.2176000     8.154000  0.3084000     8.748000  0.3071000     -0.5938000     0.4352000 
1 1 1 4  50 8  o 3.147000  0.4543000     3.586000  0.5754000     2.708000  0.7032000     0.8781000      0.9086000 
1 1 1 4  50 9  o 7.321000  0.2345000     7.365000  0.3299000     7.277000  0.3334000     0.8755000E-01  0.4690000 
1 1 1 4  50 10 o 7.446000  0.2306000     7.711000  0.3207000     7.180000  0.3315000     0.5311000      0.4613000 
1 1 1 4  50 11 o 5.036000  0.3155000     4.940000  0.4533000     5.133000  0.4389000     -0.1936000     0.6310000 
1 1 1 4  50 12 o 4.411000  0.3384000     4.143000  0.5014000     4.680000  0.4547000     -0.5367000     0.6769000 
1 1 1 4  50 13 o 1.363000  0.4361000     1.478000  0.6476000     1.247000  0.5844000     0.2311000      0.8723000 
1 1 1 4  50 14 o 1.535000  0.7126000     1.535000  0.7126000     ?         ?             ?              ?         
1 1 1 4  50 15 o 1.949000  0.5126000     1.339000  0.6203000     2.559000  0.8163000     -1.220000      1.025000  
1 1 1 4  50 16 o 1.980000  0.5316000     1.610000  0.6765000     2.351000  0.8202000     -0.7415000     1.063000  
1 1 1 4  50 17 o 1.411000  0.4445000     1.502000  0.6485000     1.319000  0.6081000     0.1835000      0.8890000 
1 1 1 4  50 18 o 1.273000  0.4157000     1.465000  0.6455000     1.080000  0.5239000     0.3850000      0.8314000 
1 1 1 4  51 0  o 0.8656000 0.5971000     0.8656000 0.5971000     0.8656000 0.5971000     0.000000       0.000000  
1 1 1 4  51 1  o 3.622000  0.3766000     3.701000  0.5138000     3.542000  0.5508000     0.1590000      0.7532000 
1 1 1 4  51 2  o 2.293000  0.5039000     2.203000  0.7254000     2.382000  0.6997000     -0.1784000     1.008000  
1 1 1 4  51 3  o 3.022000  0.4534000     3.117000  0.6192000     2.928000  0.6625000     0.1892000      0.9068000 
1 1 1 4  51 4  o 5.837000  0.2609000     5.882000  0.3676000     5.792000  0.3704000     0.9058000E-01  0.5219000 
1 1 1 4  51 5  o 1.875000  0.4877000     2.157000  0.7098000     1.594000  0.6689000     0.5628000      0.9753000 
1 1 1 4  51 6  o 3.799000  0.3793000     4.030000  0.5003000     3.567000  0.5703000     0.4633000      0.7586000 
1 1 1 4  51 7  o 8.078000  0.2221000     7.933000  0.3142000     8.223000  0.3140000     -0.2903000     0.4442000 
1 1 1 4  51 8  o 3.344000  0.4370000     2.758000  0.6927000     3.931000  0.5329000     -1.173000      0.8740000 
1 1 1 4  51 9  o 1.429000  0.4454000     1.682000  0.6915000     1.175000  0.5615000     0.5079000      0.8908000 
1 1 1 4  51 10 o 3.869000  0.3879000     3.943000  0.5290000     3.796000  0.5675000     0.1470000      0.7758000 
1 1 1 4  51 11 o 3.055000  0.4851000     2.829000  0.7118000     3.281000  0.6593000     -0.4528000     0.9702000 
1 1 1 4  51 12 o 8.319000  0.2307000     8.590000  0.3200000     8.048000  0.3324000     0.5416000      0.4614000 
1 1 1 4  51 13 o 4.448000  0.4319000     4.481000  0.7076000     4.416000  0.4952000     0.6457000E-01  0.8637000 
1 1 1 4  51 14 o 1.298000  0.4403000     1.156000  0.5664000     1.440000  0.6743000     -0.2840000     0.8806000 
1 1 1 4  51 15 o 2.684000  0.5357000     2.907000  0.6887000     2.462000  0.8206000     0.4447000      1.071000  
1 1 1 4  51 16 o 1.585000  0.4893000     1.491000  0.6466000     1.680000  0.7344000     -0.1892000     0.9785000 
1 1 1 4  51 17 o 1.145000  0.3868000     1.133000  0.5401000     1.157000  0.5539000     -0.2447000E-01 0.7736000 
1 1 1 4  51 18 o 1.581000  0.4606000     1.269000  0.5923000     1.893000  0.7056000     -0.6235000     0.9213000 
1 1 1 4  52 0  o 0.9108000 0.6238000     0.9108000 0.6238000     0.9108000 0.6238000     0.000000       0.000000  
1 1 1 4  52 1  o 2.304000  0.5071000     2.387000  0.7183000     2.221000  0.7159000     0.1659000      1.014000  
1 1 1 4  52 2  o 4.207000  0.3409000     4.088000  0.4929000     4.326000  0.4711000     -0.2381000     0.6819000 
1 1 1 4  52 3  o 5.981000  0.2588000     5.685000  0.3777000     6.277000  0.3540000     -0.5920000     0.5177000 
1 1 1 4  52 4  o 2.414000  0.4780000     1.779000  0.7010000     3.048000  0.6501000     -1.269000      0.9560000 
1 1 1 4  52 5  o 5.693000  0.3004000     5.049000  0.4866000     6.337000  0.3525000     -1.289000      0.6009000 
1 1 1 4  52 6  o 4.461000  0.3216000     4.359000  0.4605000     4.562000  0.4490000     -0.2027000     0.6432000 
1 1 1 4  52 7  o 2.747000  0.4496000     1.828000  0.7057000     3.667000  0.5573000     -1.839000      0.8992000 
1 1 1 4  52 8  o 3.288000  0.4470000     4.098000  0.4972000     2.479000  0.7430000     1.619000       0.8940000 
1 1 1 4  52 9  o 3.902000  0.3930000     3.620000  0.5974000     4.183000  0.5107000     -0.5636000     0.7859000 
1 1 1 4  52 10 o 3.859000  0.4065000     4.303000  0.5152000     3.414000  0.6290000     0.8890000      0.8131000 
1 1 1 4  52 11 o 5.482000  0.2965000     5.756000  0.4021000     5.207000  0.4359000     0.5488000      0.5931000 
1 1 1 4  52 12 o 4.036000  0.4362000     3.887000  0.7011000     4.185000  0.5192000     -0.2985000     0.8724000 
1 1 1 4  52 13 o 2.359000  0.7731000     2.359000  0.7731000     ?         ?             ?              ?         
1 1 1 4  52 14 o 1.421000  0.4579000     1.483000  0.6511000     1.360000  0.6440000     0.1226000      0.9157000 
1 1 1 4  52 15 o 1.365000  0.4488000     1.316000  0.6085000     1.413000  0.6600000     -0.9657000E-01 0.8977000 
1 1 1 4  52 16 o 1.267000  0.4175000     1.213000  0.5693000     1.321000  0.6110000     -0.1083000     0.8351000 
1 1 1 4  52 17 o 1.764000  0.4868000     2.004000  0.7182000     1.524000  0.6574000     0.4792000      0.9736000 
1 1 1 4  53 0  o 3.735000  0.5454000     3.735000  0.5454000     3.735000  0.5454000     -0.000000      0.000000  
1 1 1 4  53 1  o 2.125000  0.5170000     2.112000  0.7316000     2.138000  0.7307000     -0.2653000E-01 1.034000  
1 1 1 4  53 2  f 5.934000  0.2612000     5.977000  0.3662000     5.891000  0.3727000     0.8593000E-01  0.5225000 
1 1 1 4  53 3  o 9.611000  0.2019000     9.938000  0.2825000     9.285000  0.2885000     0.6534000      0.4038000 
1 1 1 4  53 4  o 4.616000  0.3136000     4.899000  0.4172000     4.332000  0.4682000     0.5663000      0.6271000 
1 1 1 4  53 5  o 1.677000  0.4860000     1.711000  0.6844000     1.643000  0.6902000     0.6809000E-01  0.9720000 
1 1 1 4  53 6  o 5.771000  0.2686000     5.398000  0.3892000     6.144000  0.3703000     -0.7459000     0.5372000 
1 1 1 4  53 7  o 6.934000  0.2389000     6.802000  0.3370000     7.067000  0.3386000     -0.2650000     0.4778000 
1 1 1 4  53 8  o 4.611000  0.3322000     4.840000  0.4382000     4.383000  0.4995000     0.4562000      0.6645000 
1 1 1 4  53 9  o 3.218000  0.4780000     3.097000  0.6902000     3.340000  0.6615000     -0.2432000     0.9560000 
1 1 1 4  53 10 o 1.867000  0.5128000     1.916000  0.7352000     1.819000  0.7151000     0.9699000E-01  1.026000  
1 1 1 4  53 11 o 1.702000  0.4877000     1.529000  0.6593000     1.875000  0.7188000     -0.3466000     0.9754000 
1 1 1 4  53 12 o 2.449000  0.8896000     2.449000  0.8896000     ?         ?             ?              ?         
1 1 1 4  53 13 f 2.677000  0.5378000     2.646000  0.8011000     2.708000  0.7178000     -0.6185000E-01 1.076000  
1 1 1 4  53 14 o 1.393000  0.4479000     1.563000  0.6716000     1.222000  0.5927000     0.3408000      0.8958000 
1 1 1 4  53 15 o 1.948000  0.5033000     2.397000  0.7378000     1.499000  0.6849000     0.8980000      1.007000  
1 1 1 4  53 16 o 1.325000  0.4297000     1.267000  0.5894000     1.383000  0.6254000     -0.1160000     0.8594000 
1 1 1 4  53 17 o 1.830000  0.4816000     1.208000  0.5765000     2.452000  0.7716000     -1.245000      0.9631000 
1 1 1 4  54 0  o 2.655000  0.8221000     2.655000  0.8221000     2.655000  0.8221000     0.000000       0.000000  
1 1 1 4  54 1  o 4.779000  0.3061000     4.239000  0.4659000     5.320000  0.3970000     -1.081000      0.6121000 
1 1 1 4  54 2  o 6.154000  0.2549000     5.928000  0.3706000     6.380000  0.3501000     -0.4512000     0.5099000 
1 1 1 4  54 3  o 2.407000  0.5105000     2.302000  0.7319000     2.511000  0.7118000     -0.2094000     1.021000  
1 1 1 4  54 4  o 2.294000  0.5297000     2.391000  0.7276000     2.197000  0.7701000     0.1942000      1.059000  
1 1 1 4  54 5  o 4.729000  0.3142000     4.817000  0.4428000     4.641000  0.4460000     0.1761000      0.6285000 
1 1 1 4  54 6  o 3.882000  0.3668000     3.774000  0.5235000     3.989000  0.5140000     -0.2148000     0.7336000 
1 1 1 4  54 7  o 3.577000  0.4267000     4.219000  0.4808000     2.935000  0.7051000     1.284000       0.8534000 
1 1 1 4  54 8  o 1.966000  0.5156000     2.079000  0.7263000     1.853000  0.7321000     0.2258000      1.031000  
1 1 1 4  54 9  o 4.068000  0.3831000     3.812000  0.5664000     4.325000  0.5159000     -0.5126000     0.7662000 
1 1 1 4  54 10 o 4.403000  0.3457000     4.270000  0.5053000     4.536000  0.4719000     -0.2656000     0.6913000 
1 1 1 4  54 11 o 2.845000  0.7250000     2.266000  0.8808000     3.425000  1.152000      -1.159000      1.450000  
1 1 1 4  54 12 o 1.947000  0.5285000     1.795000  0.7605000     2.100000  0.7341000     -0.3048000     1.057000  
1 1 1 4  54 13 o 1.665000  0.4870000     1.610000  0.6789000     1.719000  0.6983000     -0.1088000     0.9740000 
1 1 1 4  54 14 o 1.719000  0.5121000     1.692000  0.6922000     1.747000  0.7549000     -0.5407000E-01 1.024000  
1 1 1 4  54 15 o 2.123000  0.5352000     2.278000  0.7248000     1.969000  0.7877000     0.3094000      1.070000  
1 1 1 4  54 16 o 1.342000  0.4279000     1.529000  0.6550000     1.156000  0.5509000     0.3732000      0.8559000 
1 1 1 4  55 0  o 6.003000  0.3638000     6.003000  0.3638000     6.003000  0.3638000     0.000000       0.000000  
1 1 1 4  55 1  o 1.606000  0.4706000     1.546000  0.6533000     1.667000  0.6775000     -0.1205000     0.9412000 
1 1 1 4  55 2  o 4.170000  0.3428000     4.552000  0.4442000     3.787000  0.5222000     0.7644000      0.6855000 
1 1 1 4  55 3  o 3.764000  0.3891000     3.388000  0.5947000     4.140000  0.5020000     -0.7528000     0.7783000 
1 1 1 4  55 4  o 7.337000  0.2344000     7.301000  0.3336000     7.373000  0.3294000     -0.7183000E-01 0.4688000 
1 1 1 4  55 5  o 6.683000  0.2484000     6.647000  0.3464000     6.719000  0.3560000     -0.7221000E-01 0.4968000 
1 1 1 4  55 6  o 5.376000  0.2930000     5.282000  0.4025000     5.471000  0.4258000     -0.1890000     0.5859000 
1 1 1 4  55 7  o 4.664000  0.3306000     4.824000  0.4437000     4.503000  0.4902000     0.3210000      0.6612000 
1 1 1 4  55 8  o 2.290000  0.5181000     2.468000  0.7212000     2.111000  0.7442000     0.3564000      1.036000  
1 1 1 4  55 9  o 1.810000  0.5032000     1.971000  0.7280000     1.649000  0.6948000     0.3225000      1.006000  
1 1 1 4  55 10 f 3.030000  0.6182000     2.313000  0.9028000     3.747000  0.8449000     -1.434000      1.236000  
1 1 1 4  55 11 o 2.013000  0.5820000     2.065000  0.8242000     1.960000  0.8220000     0.1044000      1.164000  
1 1 1 4  55 12 o 4.806000  0.3187000     4.800000  0.4479000     4.812000  0.4536000     -0.1157000E-01 0.6374000 
1 1 1 4  55 13 o 2.983000  0.4735000     3.539000  0.5881000     2.426000  0.7422000     1.113000       0.9470000 
1 1 1 4  55 14 f 2.436000  0.4916000     3.124000  0.6358000     1.748000  0.7500000     1.376000       0.9832000 
1 1 1 4  55 15 o 1.301000  0.4312000     1.296000  0.5962000     1.307000  0.6232000     -0.1108000E-01 0.8625000 
1 1 1 4  55 16 o 2.729000  0.7114000     1.735000  0.8310000     3.723000  1.155000      -1.988000      1.423000  
1 1 1 4  56 0  o 3.185000  0.6509000     3.185000  0.6509000     3.185000  0.6509000     0.000000       0.000000  
1 1 1 4  56 1  o 5.278000  0.2889000     5.130000  0.4191000     5.426000  0.3979000     -0.2957000     0.5779000 
1 1 1 4  56 2  o 1.556000  0.4678000     1.380000  0.6234000     1.733000  0.6977000     -0.3529000     0.9356000 
1 1 1 4  56 3  o 1.386000  0.4452000     1.425000  0.6397000     1.348000  0.6193000     0.7761000E-01  0.8904000 
1 1 1 4  56 4  o 5.846000  0.2943000     6.078000  0.3723000     5.613000  0.4558000     0.4651000      0.5885000 
1 1 1 4  56 5  o 1.508000  0.4512000     1.943000  0.7341000     1.074000  0.5249000     0.8683000      0.9024000 
1 1 1 4  56 6  o 3.018000  0.4858000     3.071000  0.6859000     2.966000  0.6882000     0.1054000      0.9717000 
1 1 1 4  56 7  o 2.022000  0.5196000     2.031000  0.7417000     2.012000  0.7279000     0.1882000E-01  1.039000  
1 1 1 4  56 8  o 6.775000  0.2603000     6.820000  0.3663000     6.730000  0.3700000     0.8970000E-01  0.5207000 
1 1 1 4  56 9  o 1.679000  0.5294000     2.030000  0.8348000     1.328000  0.6512000     0.7023000      1.059000  
1 1 1 4  56 10 o 2.929000  0.6969000     3.099000  0.8579000     2.759000  1.099000      0.3400000      1.394000  
1 1 1 4  56 11 o 3.014000  0.4818000     2.704000  0.7332000     3.324000  0.6252000     -0.6200000     0.9635000 
1 1 1 4  56 12 o 2.252000  0.4875000     2.857000  0.6977000     1.646000  0.6810000     1.211000       0.9750000 
1 1 1 4  56 13 f 3.442000  0.4151000     3.206000  0.6058000     3.677000  0.5676000     -0.4714000     0.8301000 
1 1 1 4  56 14 o 2.076000  0.5356000     2.120000  0.7192000     2.033000  0.7939000     0.8739000E-01  1.071000  
1 1 1 4  56 15 o 1.988000  0.4586000     2.769000  0.7027000     1.206000  0.5894000     1.562000       0.9171000 
1 1 1 4  57 0  o 1.961000  0.8839000     1.961000  0.8839000     1.961000  0.8839000     0.000000       0.000000  
1 1 1 4  57 1  o 3.283000  0.4414000     3.516000  0.5823000     3.050000  0.6635000     0.4652000      0.8828000 
1 1 1 4  57 2  o 4.885000  0.3218000     4.554000  0.4796000     5.217000  0.4294000     -0.6635000     0.6437000 
1 1 1 4  57 3  o 8.328000  0.2286000     8.443000  0.3196000     8.213000  0.3270000     0.2300000      0.4572000 
1 1 1 4  57 4  o 3.778000  0.3938000     4.341000  0.4736000     3.215000  0.6291000     1.126000       0.7875000 
1 1 1 4  57 5  o 1.848000  0.5078000     1.875000  0.7177000     1.820000  0.7185000     0.5510000E-01  1.016000  
1 1 1 4  57 6  o 1.300000  0.4262000     1.177000  0.5613000     1.423000  0.6415000     -0.2453000     0.8524000 
1 1 1 4  57 7  o 2.919000  0.4810000     2.862000  0.6957000     2.976000  0.6644000     -0.1138000     0.9620000 
1 1 1 4  57 8  o 2.235000  0.6369000     2.293000  0.9062000     2.177000  0.8953000     0.1161000      1.274000  
1 1 1 4  57 9  o 2.984000  0.5937000     2.799000  0.8548000     3.169000  0.8241000     -0.3702000     1.187000  
1 1 1 4  57 10 o 2.228000  0.5165000     2.301000  0.7402000     2.155000  0.7206000     0.1462000      1.033000  
1 1 1 4  57 11 o 4.450000  0.3531000     4.544000  0.5041000     4.356000  0.4946000     0.1885000      0.7062000 
1 1 1 4  57 12 o 1.571000  0.4776000     1.621000  0.6902000     1.521000  0.6603000     0.1004000      0.9552000 
1 1 1 4  57 13 o 1.451000  0.4454000     1.742000  0.6957000     1.160000  0.5564000     0.5819000      0.8908000 
1 1 1 4  57 14 o 1.630000  0.4901000     1.696000  0.6855000     1.564000  0.7005000     0.1321000      0.9801000 
1 1 1 4  58 0  f 1.564000  0.8509000     1.564000  0.8509000     1.564000  0.8509000     -0.000000      0.000000  
1 1 1 4  58 1  o 4.140000  0.3561000     4.255000  0.4768000     4.026000  0.5292000     0.2294000      0.7123000 
1 1 1 4  58 2  o 3.050000  0.4555000     2.743000  0.6945000     3.356000  0.5897000     -0.6136000     0.9111000 
1 1 1 4  58 3  o 6.604000  0.2536000     6.343000  0.3685000     6.865000  0.3485000     -0.5217000     0.5072000 
1 1 1 4  58 4  o 5.230000  0.2925000     5.527000  0.3971000     4.932000  0.4296000     0.5944000      0.5850000 
1 1 1 4  58 5  o 5.984000  0.2659000     5.883000  0.3809000     6.084000  0.3712000     -0.2011000     0.5319000 
1 1 1 4  58 6  o 5.807000  0.3636000     5.442000  0.6122000     6.172000  0.3925000     -0.7299000     0.7272000 
1 1 1 4  58 7  o 2.683000  0.9273000     2.683000  0.9273000     ?         ?             ?              ?         
1 1 1 4  58 8  f 1.679000  0.5250000     1.791000  0.7734000     1.567000  0.7104000     0.2244000      1.050000  
1 1 1 4  58 9  o 2.557000  0.5096000     2.161000  0.7433000     2.953000  0.6972000     -0.7917000     1.019000  
1 1 1 4  58 10 o 1.725000  0.4974000     1.760000  0.7128000     1.691000  0.6940000     0.6864000E-01  0.9949000 
1 1 1 4  58 11 o 1.470000  0.4541000     1.661000  0.6846000     1.279000  0.5967000     0.3821000      0.9081000 
1 1 1 4  58 12 o 1.629000  0.4818000     1.510000  0.6553000     1.748000  0.7065000     -0.2381000     0.9636000 
1 1 1 4  58 13 o 1.898000  0.4710000     2.543000  0.7324000     1.253000  0.5924000     1.290000       0.9420000 
1 1 1 4  58 14 o 1.863000  0.5641000     2.150000  0.8297000     1.576000  0.7645000     0.5739000      1.128000  
1 1 1 4  59 0  o 1.077000  0.7011000     1.077000  0.7011000     1.077000  0.7011000     -0.000000      0.000000  
1 1 1 4  59 1  f 6.093000  0.2722000     6.003000  0.3863000     6.183000  0.3835000     -0.1796000     0.5443000 
1 1 1 4  59 2  o 6.387000  0.2649000     6.671000  0.3628000     6.102000  0.3860000     0.5688000      0.5297000 
1 1 1 4  59 3  o 1.840000  0.5023000     1.784000  0.7084000     1.896000  0.7122000     -0.1122000     1.005000  
1 1 1 4  59 4  o 1.880000  0.5234000     1.450000  0.6882000     2.309000  0.7889000     -0.8584000     1.047000  
1 1 1 4  59 5  o 4.568000  0.5071000     4.593000  0.7000000     4.543000  0.7339000     0.4977000E-01  1.014000  
1 1 1 4  59 6  o 3.545000  0.7154000     3.548000  0.8309000     3.542000  1.165000      0.6139000E-02  1.431000  
1 1 1 4  59 7  o 3.340000  0.5235000     3.071000  0.8739000     3.608000  0.5767000     -0.5376000     1.047000  
1 1 1 4  59 8  o 1.651000  0.5024000     1.640000  0.7188000     1.662000  0.7021000     -0.2202000E-01 1.005000  
1 1 1 4  59 9  o 1.101000  0.3800000     0.9586000 0.4785000     1.244000  0.5905000     -0.2857000     0.7600000 
1 1 1 4  59 10 o 1.579000  0.4741000     1.830000  0.7224000     1.327000  0.6142000     0.5032000      0.9482000 
1 1 1 4  59 11 o 1.611000  0.4795000     1.792000  0.7145000     1.429000  0.6396000     0.3638000      0.9590000 
1 1 1 4  59 12 o 1.440000  0.4493000     1.240000  0.5807000     1.641000  0.6858000     -0.4011000     0.8986000 
1 1 1 4  59 13 o 3.285000  0.5008000     3.448000  0.6176000     3.121000  0.7886000     0.3266000      1.002000  
1 1 1 4  60 0  o 1.634000  0.9816000     1.634000  0.9816000     1.634000  0.9816000     0.000000       0.000000  
1 1 1 4  60 1  o 2.500000  0.6187000     2.891000  0.8991000     2.109000  0.8503000     0.7817000      1.237000  
1 1 1 4  60 2  o 5.629000  0.4351000     5.907000  0.5891000     5.352000  0.6405000     0.5554000      0.8702000 
1 1 1 4  60 3  o 2.884000  1.076000      2.884000  1.076000      ?         ?             ?              ?         
1 1 1 4  60 4  o 3.954000  0.6089000     5.229000  0.6137000     2.680000  1.052000      2.550000       1.218000  
1 1 1 4  60 5  o 2.635000  0.5765000     2.225000  0.8610000     3.045000  0.7668000     -0.8197000     1.153000  
1 1 1 4  60 6  o 4.000000  0.3786000     4.132000  0.5137000     3.867000  0.5562000     0.2643000      0.7572000 
1 1 1 4  60 7  f 1.923000  0.5209000     2.019000  0.7467000     1.827000  0.7264000     0.1924000      1.042000  
1 1 1 4  60 8  o 1.451000  0.4591000     1.335000  0.6181000     1.567000  0.6790000     -0.2318000     0.9182000 
1 1 1 4  60 9  o 5.631000  0.2964000     5.534000  0.4257000     5.728000  0.4125000     -0.1940000     0.5928000 
1 1 1 4  60 10 f 3.274000  0.4586000     3.266000  0.6438000     3.282000  0.6533000     -0.1669000E-01 0.9172000 
1 1 1 4  60 11 o 1.203000  0.4033000     0.9732000 0.4847000     1.433000  0.6447000     -0.4601000     0.8066000 
1 1 1 4  60 12 o 1.486000  0.4632000     1.545000  0.6706000     1.426000  0.6390000     0.1200000      0.9263000 
1 1 1 4  61 0  o 1.819000  1.019000      1.819000  1.019000      1.819000  1.019000      0.000000       0.000000  
1 1 1 4  61 1  o 2.227000  0.5885000     1.794000  0.7893000     2.660000  0.8732000     -0.8653000     1.177000  
1 1 1 4  61 2  o 3.807000  0.5617000     3.987000  0.7662000     3.627000  0.8217000     0.3596000      1.123000  
1 1 1 4  61 3  o 2.124000  0.5463000     2.284000  0.8021000     1.963000  0.7418000     0.3216000      1.093000  
1 1 1 4  61 4  o 2.380000  0.5027000     1.948000  0.7352000     2.813000  0.6857000     -0.8649000     1.005000  
1 1 1 4  61 5  o 3.138000  0.4775000     3.204000  0.6528000     3.073000  0.6972000     0.1318000      0.9551000 
1 1 1 4  61 6  o 5.373000  0.3048000     5.229000  0.4434000     5.518000  0.4183000     -0.2885000     0.6095000 
1 1 1 4  61 7  o 3.528000  0.4386000     3.804000  0.5813000     3.251000  0.6568000     0.5536000      0.8771000 
1 1 1 4  61 8  o 1.628000  0.4944000     1.457000  0.6575000     1.799000  0.7385000     -0.3422000     0.9887000 
1 1 1 4  61 9  o 2.101000  0.5329000     1.880000  0.7342000     2.321000  0.7727000     -0.4410000     1.066000  
1 1 1 4  61 10 o 1.921000  0.5161000     2.080000  0.7523000     1.762000  0.7069000     0.3188000      1.032000  
1 1 1 4  61 11 o 1.573000  0.4768000     1.456000  0.6477000     1.690000  0.7000000     -0.2339000     0.9537000 
1 1 1 4  62 0  o 0.9698000 0.6570000     0.9698000 0.6570000     0.9698000 0.6570000     -0.000000      0.000000  
1 1 1 4  62 1  o 2.583000  0.5034000     3.020000  0.6826000     2.146000  0.7401000     0.8737000      1.007000  
1 1 1 4  62 2  o 1.347000  0.4383000     1.367000  0.6257000     1.328000  0.6140000     0.3904000E-01  0.8766000 
1 1 1 4  62 3  f 3.353000  0.4479000     3.351000  0.6420000     3.354000  0.6249000     -0.2276000E-02 0.8959000 
1 1 1 4  62 4  o 4.060000  0.3776000     4.250000  0.5113000     3.870000  0.5558000     0.3793000      0.7552000 
1 1 1 4  62 5  o 5.739000  0.2958000     5.475000  0.4288000     6.002000  0.4077000     -0.5274000     0.5917000 
1 1 1 4  62 6  f 3.880000  0.4022000     3.795000  0.5902000     3.966000  0.5466000     -0.1716000     0.8044000 
1 1 1 4  62 7  f 1.295000  0.4269000     1.137000  0.5504000     1.453000  0.6528000     -0.3166000     0.8539000 
1 1 1 4  62 8  o 1.737000  0.4908000     2.020000  0.7381000     1.454000  0.6472000     0.5655000      0.9817000 
1 1 1 4  62 9  o 3.070000  0.4803000     3.189000  0.6547000     2.951000  0.7030000     0.2378000      0.9606000 
1 1 1 4  62 10 o 1.117000  0.3827000     1.188000  0.5679000     1.047000  0.5130000     0.1416000      0.7654000 
1 1 1 4  63 0  o 1.896000  0.9083000     1.896000  0.9083000     1.896000  0.9083000     0.000000       0.000000  
1 1 1 4  63 1  o 2.314000  0.4836000     1.598000  0.6825000     3.031000  0.6855000     -1.433000      0.9673000 
1 1 1 4  63 2  o 3.893000  0.4042000     4.110000  0.5383000     3.677000  0.6032000     0.4338000      0.8085000 
1 1 1 4  63 3  o 1.673000  0.4924000     1.823000  0.7226000     1.523000  0.6691000     0.3000000      0.9848000 
1 1 1 4  63 4  o 3.072000  0.4814000     2.632000  0.7429000     3.513000  0.6123000     -0.8808000     0.9627000 
1 1 1 4  63 5  o 3.460000  0.4401000     3.927000  0.5389000     2.993000  0.6960000     0.9340000      0.8803000 
1 1 1 4  63 6  f 4.174000  0.3753000     3.944000  0.5490000     4.404000  0.5120000     -0.4600000     0.7507000 
1 1 1 4  63 7  o 1.802000  0.4943000     1.512000  0.6622000     2.091000  0.7341000     -0.5795000     0.9886000 
1 1 1 4  63 8  o 2.979000  0.5019000     3.019000  0.7088000     2.939000  0.7107000     0.8041000E-01  1.004000  
1 1 1 4  63 9  o 1.495000  0.4677000     1.501000  0.6633000     1.490000  0.6597000     0.1096000E-01  0.9355000 
1 1 1 4  64 0  o 2.101000  0.9298000     2.101000  0.9298000     2.101000  0.9298000     -0.000000      0.000000  
1 1 1 4  64 1  f 4.056000  0.3832000     4.196000  0.5325000     3.915000  0.5512000     0.2809000      0.7665000 
1 1 1 4  64 2  f 6.151000  0.2838000     6.431000  0.3885000     5.871000  0.4139000     0.5606000      0.5676000 
1 1 1 4  64 3  o 1.752000  0.4765000     2.241000  0.7494000     1.263000  0.5886000     0.9779000      0.9529000 
1 1 1 4  64 4  o 1.321000  0.4346000     1.291000  0.6024000     1.352000  0.6265000     -0.6157000E-01 0.8692000 
1 1 1 4  64 5  o 1.823000  0.5051000     1.804000  0.7123000     1.842000  0.7163000     -0.3804000E-01 1.010000  
1 1 1 4  64 6  o 1.411000  0.4472000     1.549000  0.6682000     1.273000  0.5946000     0.2756000      0.8945000 
1 1 1 4  64 7  o 1.831000  0.5093000     2.053000  0.7502000     1.608000  0.6890000     0.4450000      1.019000  
1 1 1 4  64 8  o 1.702000  0.4962000     1.715000  0.7030000     1.690000  0.7004000     0.2462000E-01  0.9923000 
1 1 1 4  65 0  o 0.7056000 0.5103000     0.7056000 0.5103000     0.7056000 0.5103000     0.000000       0.000000  
1 1 1 4  65 1  o 3.272000  0.4623000     2.678000  0.7422000     3.866000  0.5513000     -1.188000      0.9246000 
1 1 1 4  65 2  o 2.071000  0.4785000     2.748000  0.7171000     1.393000  0.6337000     1.355000       0.9570000 
1 1 1 4  65 3  o 1.700000  0.4969000     1.596000  0.6874000     1.805000  0.7178000     -0.2092000     0.9938000 
1 1 1 4  65 4  o 1.590000  0.4788000     1.706000  0.6989000     1.474000  0.6548000     0.2314000      0.9577000 
1 1 1 4  65 5  o 1.986000  0.5214000     2.160000  0.7520000     1.811000  0.7224000     0.3492000      1.043000  
1 1 1 4  65 6  o 1.229000  0.4088000     1.095000  0.5310000     1.362000  0.6218000     -0.2670000     0.8177000 
1 1 1 4  65 7  o 2.313000  0.6183000     2.834000  0.9334000     1.793000  0.8113000     1.042000       1.237000  
1 1 1 4  66 0  o 1.356000  0.8323000     1.356000  0.8323000     1.356000  0.8323000     0.000000       0.000000  
1 1 1 4  66 1  o 2.065000  0.4969000     1.512000  0.6577000     2.618000  0.7450000     -1.106000      0.9938000 
1 1 1 4  66 2  o 1.500000  0.4675000     1.414000  0.6381000     1.585000  0.6833000     -0.1709000     0.9349000 
1 1 1 4  66 3  o 1.154000  0.3931000     1.038000  0.5122000     1.269000  0.5966000     -0.2318000     0.7863000 
1 1 1 4  66 4  o 2.544000  0.5029000     2.018000  0.7438000     3.070000  0.6769000     -1.052000      1.006000  
1 1 1 4  66 5  o 2.695000  0.5163000     3.052000  0.7011000     2.338000  0.7580000     0.7140000      1.033000  
1 1 1 4  67 0  o 6.303000  0.4039000     6.303000  0.4039000     6.303000  0.4039000     -0.000000      0.000000  
1 1 1 4  67 1  o 5.106000  0.3304000     4.976000  0.4636000     5.236000  0.4707000     -0.2593000     0.6607000 
1 1 1 4  67 2  o 2.342000  0.6365000     2.496000  0.9184000     2.189000  0.8814000     0.3068000      1.273000  
1 1 1 5  0  1  o 22.02000  0.2788000     22.02000  0.2788000     22.02000  0.2788000     0.000000       0.000000  
1 1 1 5  0  2  o 12.71000  0.1499000     12.71000  0.1499000     12.71000  0.1499000     -0.000000      0.000000  
1 1 1 5  0  3  o 24.29000  0.2714000     24.29000  0.2714000     24.29000  0.2714000     -0.000000      0.000000  
1 1 1 5  0  4  o 16.81000  0.2008000     16.81000  0.2008000     16.81000  0.2008000     0.000000       0.000000  
1 1 1 5  0  5  o 34.58000  0.5442000     34.58000  0.5442000     34.58000  0.5442000     -0.000000      0.000000  
1 1 1 5  0  6  o 34.83000  0.3894000     34.83000  0.3894000     34.83000  0.3894000     -0.000000      0.000000  
1 1 1 5  0  7  o 6.077000  0.1819000     6.077000  0.1819000     6.077000  0.1819000     -0.000000      0.000000  
1 1 1 5  0  8  o 7.062000  0.2207000     7.062000  0.2207000     7.062000  0.2207000     -0.000000      0.000000  
1 1 1 5  0  9  o 0.9540000 0.5826000     0.9540000 0.5826000     0.9540000 0.5826000     -0.000000      0.000000  
1 1 1 5  0  10 o 0.8130000 0.5503000     0.8130000 0.5503000     0.8130000 0.5503000     -0.000000      0.000000  
1 1 1 5  0  11 o 6.168000  0.3173000     6.168000  0.3173000     6.168000  0.3173000     0.000000       0.000000  
1 1 1 5  0  12 o 4.116000  0.5119000     4.116000  0.5119000     4.116000  0.5119000     -0.000000      0.000000  
1 1 1 5  0  13 o 5.258000  0.4326000     5.258000  0.4326000     5.258000  0.4326000     0.000000       0.000000  
1 1 1 5  0  14 o 1.055000  0.6977000     1.055000  0.6977000     1.055000  0.6977000     0.000000       0.000000  
1 1 1 5  0  15 o 1.669000  0.9528000     1.669000  0.9528000     1.669000  0.9528000     -0.000000      0.000000  
1 1 1 5  0  16 o 7.419000  0.4532000     7.419000  0.4532000     7.419000  0.4532000     0.000000       0.000000  
1 1 1 5  0  17 o 5.758000  0.5251000     5.758000  0.5251000     5.758000  0.5251000     -0.000000      0.000000  
1 1 1 5  0  18 o 1.402000  0.9058000     1.402000  0.9058000     1.402000  0.9058000     -0.000000      0.000000  
1 1 1 5  0  19 o 2.637000  1.165000      2.637000  1.165000      2.637000  1.165000      0.000000       0.000000  
1 1 1 5  0  20 o 1.123000  0.7977000     1.123000  0.7977000     1.123000  0.7977000     0.000000       0.000000  
1 1 1 5  0  21 o 2.131000  1.215000      2.131000  1.215000      2.131000  1.215000      -0.000000      0.000000  
1 1 1 5  0  22 o 5.203000  0.6630000     5.203000  0.6630000     5.203000  0.6630000     0.000000       0.000000  
1 1 1 5  0  23 o 1.620000  0.9598000     1.620000  0.9598000     1.620000  0.9598000     -0.000000      0.000000  
1 1 1 5  0  24 o 2.964000  0.8901000     2.964000  0.8901000     2.964000  0.8901000     0.000000       0.000000  
1 1 1 5  0  25 o 1.043000  0.7250000     1.043000  0.7250000     1.043000  0.7250000     -0.000000      0.000000  
1 1 1 5  0  26 o 1.299000  0.8075000     1.299000  0.8075000     1.299000  0.8075000     0.000000       0.000000  
1 1 1 5  0  27 o 0.9298000 0.6463000     0.9298000 0.6463000     0.9298000 0.6463000     0.000000       0.000000  
1 1 1 5  1  0  o 41.55000  0.6381000     41.55000  0.6381000     41.55000  0.6381000     0.000000       0.000000  
1 1 1 5  1  1  o 22.53000  0.1888000     22.52000  0.2466000     22.54000  0.2860000     -0.2017000E-01 0.3776000 
1 1 1 5  1  2  o 29.80000  0.2310000     30.02000  0.3290000     29.58000  0.3242000     0.4411000      0.4619000 
1 1 1 5  1  3  o 18.25000  0.1483000     18.19000  0.2091000     18.31000  0.2103000     -0.1202000     0.2966000 
1 1 1 5  1  4  o 22.73000  0.1834000     22.58000  0.2577000     22.88000  0.2609000     -0.3034000     0.3667000 
1 1 1 5  1  5  o 17.17000  0.2084000     17.07000  0.2933000     17.27000  0.2962000     -0.1969000     0.4168000 
1 1 1 5  1  6  o 15.97000  0.1448000     16.10000  0.2058000     15.84000  0.2037000     0.2655000      0.2896000 
1 1 1 5  1  7  o 28.34000  0.2304000     28.36000  0.3261000     28.31000  0.3257000     0.4925000E-01  0.4609000 
1 1 1 5  1  8  o 7.617000  0.1319000     7.808000  0.1864000     7.426000  0.1868000     0.3815000      0.2639000 
1 1 1 5  1  9  o 13.36000  0.1493000     13.29000  0.2108000     13.43000  0.2115000     -0.1476000     0.2986000 
1 1 1 5  1  10 o 9.365000  0.1736000     9.347000  0.2467000     9.384000  0.2444000     -0.3741000E-01 0.3473000 
1 1 1 5  1  11 o 3.469000  0.3507000     3.568000  0.4749000     3.370000  0.5160000     0.1981000      0.7013000 
1 1 1 5  1  12 o 6.689000  0.2524000     7.009000  0.3415000     6.368000  0.3717000     0.6409000      0.5047000 
1 1 1 5  1  13 f 8.352000  0.2386000     8.221000  0.3457000     8.483000  0.3289000     -0.2621000     0.4772000 
1 1 1 5  1  14 o 10.17000  0.2041000     10.36000  0.2825000     9.980000  0.2946000     0.3790000      0.4082000 
1 1 1 5  1  15 o 1.955000  0.5585000     1.708000  0.7520000     2.202000  0.8259000     -0.4948000     1.117000  
1 1 1 5  1  16 o 8.532000  0.2876000     8.657000  0.4055000     8.407000  0.4079000     0.2503000      0.5751000 
1 1 1 5  1  17 o 2.526000  0.6131000     2.812000  0.8809000     2.240000  0.8530000     0.5727000      1.226000  
1 1 1 5  1  18 o 4.799000  0.4705000     4.229000  0.7444000     5.370000  0.5756000     -1.141000      0.9410000 
1 1 1 5  1  19 o 3.356000  0.6529000     3.222000  0.9472000     3.489000  0.8988000     -0.2674000     1.306000  
1 1 1 5  1  20 o 2.031000  0.6454000     2.052000  0.9209000     2.009000  0.9046000     0.4327000E-01  1.291000  
1 1 1 5  1  21 f 2.708000  0.6653000     3.717000  1.052000      1.699000  0.8153000     2.018000       1.331000  
1 1 1 5  1  22 o 2.095000  0.6235000     2.415000  0.9466000     1.775000  0.8118000     0.6405000      1.247000  
1 1 1 5  1  23 f 2.106000  0.5977000     2.294000  0.8748000     1.919000  0.8147000     0.3747000      1.195000  
1 1 1 5  1  24 o 1.959000  0.5473000     1.785000  0.7496000     2.132000  0.7976000     -0.3465000     1.095000  
1 1 1 5  1  25 o 1.872000  0.5705000     1.863000  0.8054000     1.881000  0.8082000     -0.1839000E-01 1.141000  
1 1 1 5  1  26 o 1.711000  0.5023000     2.084000  0.7798000     1.338000  0.6334000     0.7466000      1.005000  
1 1 1 5  1  27 o 1.316000  0.4392000     1.327000  0.6258000     1.305000  0.6164000     0.2197000E-01  0.8784000 
1 1 1 5  2  0  o 39.64000  0.4964000     39.64000  0.4964000     39.64000  0.4964000     -0.000000      0.000000  
1 1 1 5  2  1  o 50.19000  0.3854000     50.41000  0.5473000     49.98000  0.5426000     0.4308000      0.7707000 
1 1 1 5  2  2  o 17.13000  0.1421000     17.16000  0.1735000     17.10000  0.2252000     0.5573000E-01  0.2843000 
1 1 1 5  2  3  o 15.88000  0.1323000     15.82000  0.1865000     15.95000  0.1877000     -0.1302000     0.2646000 
1 1 1 5  2  4  o 21.72000  0.1764000     21.48000  0.2469000     21.97000  0.2519000     -0.4917000     0.3527000 
1 1 1 5  2  5  o 9.985000  0.1534000     9.946000  0.2158000     10.02000  0.2182000     -0.7826000E-01 0.3069000 
1 1 1 5  2  6  o 21.53000  0.1806000     21.51000  0.2553000     21.55000  0.2555000     -0.4148000E-01 0.3612000 
1 1 1 5  2  7  o 24.82000  0.2059000     25.07000  0.2937000     24.56000  0.2888000     0.5054000      0.4119000 
1 1 1 5  2  8  o 6.570000  0.1397000     6.616000  0.1961000     6.524000  0.1991000     0.9165000E-01  0.2795000 
1 1 1 5  2  9  o 2.837000  0.2847000     2.955000  0.3907000     2.719000  0.4142000     0.2358000      0.5694000 
1 1 1 5  2  10 o 1.666000  0.4312000     1.458000  0.5908000     1.874000  0.6283000     -0.4163000     0.8625000 
1 1 1 5  2  11 o 7.541000  0.2072000     7.280000  0.2974000     7.802000  0.2886000     -0.5226000     0.4144000 
1 1 1 5  2  12 f 4.898000  0.3095000     4.796000  0.4435000     5.000000  0.4318000     -0.2038000     0.6190000 
1 1 1 5  2  13 o 5.827000  0.2823000     5.750000  0.4298000     5.904000  0.3661000     -0.1549000     0.5646000 
1 1 1 5  2  14 o 4.117000  0.3678000     4.024000  0.5493000     4.209000  0.4894000     -0.1857000     0.7357000 
1 1 1 5  2  15 o 16.60000  0.2375000     16.93000  0.3380000     16.28000  0.3338000     0.6449000      0.4750000 
1 1 1 5  2  16 o 1.707000  0.5300000     1.357000  0.6554000     2.057000  0.8331000     -0.7004000     1.060000  
1 1 1 5  2  17 o 6.881000  0.3179000     6.802000  0.4485000     6.960000  0.4507000     -0.1586000     0.6359000 
1 1 1 5  2  18 o 3.756000  0.5780000     3.936000  0.7895000     3.575000  0.8444000     0.3613000      1.156000  
1 1 1 5  2  19 o 2.961000  0.6658000     3.386000  0.9439000     2.536000  0.9394000     0.8509000      1.332000  
1 1 1 5  2  20 o 2.744000  0.7134000     3.308000  1.065000      2.180000  0.9492000     1.128000       1.427000  
1 1 1 5  2  21 o 7.608000  0.4335000     7.806000  0.6032000     7.411000  0.6229000     0.3944000      0.8671000 
1 1 1 5  2  22 o 2.149000  0.6245000     2.067000  0.8714000     2.230000  0.8949000     -0.1626000     1.249000  
1 1 1 5  2  23 o 2.010000  0.5880000     2.170000  0.8602000     1.851000  0.8019000     0.3190000      1.176000  
1 1 1 5  2  24 o 2.098000  0.5459000     1.732000  0.7404000     2.465000  0.8023000     -0.7332000     1.092000  
1 1 1 5  2  25 o 1.824000  0.5472000     1.372000  0.6594000     2.277000  0.8735000     -0.9051000     1.094000  
1 1 1 5  2  26 o 1.737000  0.5200000     1.569000  0.7018000     1.906000  0.7676000     -0.3376000     1.040000  
1 1 1 5  2  27 o 1.463000  0.4746000     1.388000  0.6468000     1.538000  0.6948000     -0.1504000     0.9493000 
1 1 1 5  3  0  o 37.21000  0.4039000     37.21000  0.4039000     37.21000  0.4039000     -0.000000      0.000000  
1 1 1 5  3  1  o 9.633000  0.8205000E-01 9.593000  0.1155000     9.674000  0.1165000     -0.8155000E-01 0.1641000 
1 1 1 5  3  2  o 33.41000  0.2675000     33.63000  0.4252000     33.19000  0.3247000     0.4466000      0.5350000 
1 1 1 5  3  3  f 4.038000  0.8941000E-01 3.959000  0.1295000     4.116000  0.1233000     -0.1568000     0.1788000 
1 1 1 5  3  4  o 3.008000  0.1333000     2.955000  0.1898000     3.061000  0.1872000     -0.1061000     0.2666000 
1 1 1 5  3  5  o 25.60000  0.2668000     25.75000  0.3398000     25.45000  0.4115000     0.3028000      0.5336000 
1 1 1 5  3  6  o 10.31000  0.1185000     10.29000  0.1677000     10.33000  0.1675000     -0.4331000E-01 0.2370000 
1 1 1 5  3  7  o 33.89000  0.2706000     34.15000  0.3856000     33.63000  0.3798000     0.5279000      0.5412000 
1 1 1 5  3  8  o 17.02000  0.1595000     17.03000  0.2258000     17.00000  0.2255000     0.3278000E-01  0.3191000 
1 1 1 5  3  9  o 7.265000  0.1504000     7.060000  0.2143000     7.470000  0.2111000     -0.4109000     0.3008000 
1 1 1 5  3  10 o 4.733000  0.2392000     4.685000  0.3405000     4.782000  0.3361000     -0.9644000E-01 0.4784000 
1 1 1 5  3  11 o 7.456000  0.2075000     7.429000  0.2954000     7.484000  0.2916000     -0.5561000E-01 0.4151000 
1 1 1 5  3  12 o 3.441000  0.4186000     3.280000  0.6072000     3.601000  0.5763000     -0.3207000     0.8372000 
1 1 1 5  3  13 o 6.903000  0.2528000     6.467000  0.3987000     7.339000  0.3109000     -0.8722000     0.5056000 
1 1 1 5  3  14 f 6.613000  0.2530000     6.641000  0.3588000     6.585000  0.3567000     0.5534000E-01  0.5060000 
1 1 1 5  3  15 o 4.284000  0.4409000     3.858000  0.6978000     4.710000  0.5390000     -0.8516000     0.8817000 
1 1 1 5  3  16 o 8.874000  0.2919000     8.861000  0.4094000     8.887000  0.4163000     -0.2684000E-01 0.5839000 
1 1 1 5  3  17 o 2.120000  0.5902000     2.255000  0.8436000     1.985000  0.8257000     0.2697000      1.180000  
1 1 1 5  3  18 o 2.119000  0.5880000     1.589000  0.7380000     2.649000  0.9156000     -1.061000      1.176000  
1 1 1 5  3  19 o 6.169000  0.4061000     5.889000  0.5874000     6.449000  0.5610000     -0.5595000     0.8123000 
1 1 1 5  3  20 o 2.793000  0.7313000     3.098000  1.065000      2.488000  1.002000      0.6095000      1.463000  
1 1 1 5  3  21 o 2.791000  0.7444000     2.495000  1.024000      3.086000  1.080000      -0.5909000     1.489000  
1 1 1 5  3  22 o 2.066000  0.6166000     1.889000  0.8381000     2.242000  0.9046000     -0.3528000     1.233000  
1 1 1 5  3  23 o 2.254000  0.6097000     2.508000  0.8893000     2.000000  0.8343000     0.5083000      1.219000  
1 1 1 5  3  24 o 1.715000  0.5000000     1.194000  0.5834000     2.236000  0.8121000     -1.042000      0.9999000 
1 1 1 5  3  25 o 1.778000  0.5475000     1.397000  0.6766000     2.158000  0.8610000     -0.7611000     1.095000  
1 1 1 5  3  26 o 1.450000  0.4623000     1.014000  0.5072000     1.887000  0.7731000     -0.8736000     0.9246000 
1 1 1 5  3  27 o 1.533000  0.4843000     1.420000  0.6572000     1.646000  0.7116000     -0.2266000     0.9687000 
1 1 1 5  4  0  o 5.760000  0.8587000E-01 5.760000  0.8587000E-01 5.760000  0.8587000E-01 -0.000000      0.000000  
1 1 1 5  4  1  o 14.60000  0.1179000     14.63000  0.1670000     14.57000  0.1664000     0.5710000E-01  0.2357000 
1 1 1 5  4  2  o 8.854000  0.8238000E-01 8.871000  0.1169000     8.837000  0.1161000     0.3413000E-01  0.1648000 
1 1 1 5  4  3  o 29.07000  0.2349000     28.96000  0.3706000     29.18000  0.2888000     -0.2172000     0.4698000 
1 1 1 5  4  4  o 12.83000  0.1183000     12.80000  0.1670000     12.85000  0.1675000     -0.5479000E-01 0.2365000 
1 1 1 5  4  5  o 22.02000  0.2574000     22.24000  0.3688000     21.81000  0.3593000     0.4311000      0.5149000 
1 1 1 5  4  6  f 25.83000  0.2111000     26.11000  0.3011000     25.55000  0.2959000     0.5626000      0.4222000 
1 1 1 5  4  7  o 26.76000  0.2196000     26.64000  0.3094000     26.88000  0.3118000     -0.2385000     0.4393000 
1 1 1 5  4  8  o 29.22000  0.2393000     29.46000  0.3409000     28.98000  0.3359000     0.4850000      0.4786000 
1 1 1 5  4  9  o 14.05000  0.1528000     14.19000  0.2169000     13.91000  0.2152000     0.2809000      0.3055000 
1 1 1 5  4  10 o 5.040000  0.2849000     5.054000  0.3989000     5.026000  0.4068000     0.2779000E-01  0.5698000 
1 1 1 5  4  11 o 10.84000  0.1941000     10.68000  0.2735000     11.01000  0.2753000     -0.3280000     0.3881000 
1 1 1 5  4  12 o 2.276000  0.5349000     2.330000  0.7687000     2.221000  0.7441000     0.1097000      1.070000  
1 1 1 5  4  13 o 7.780000  0.2377000     7.541000  0.3652000     8.019000  0.3044000     -0.4773000     0.4755000 
1 1 1 5  4  14 f 7.955000  0.2324000     8.088000  0.3251000     7.823000  0.3322000     0.2646000      0.4648000 
1 1 1 5  4  15 o 1.860000  0.5575000     1.988000  0.8212000     1.731000  0.7543000     0.2561000      1.115000  
1 1 1 5  4  16 o 11.31000  0.2652000     11.53000  0.3698000     11.10000  0.3802000     0.4230000      0.5304000 
1 1 1 5  4  17 f 10.76000  0.2470000     11.12000  0.3465000     10.40000  0.3519000     0.7148000      0.4939000 
1 1 1 5  4  18 o 6.711000  0.3519000     6.918000  0.4779000     6.503000  0.5166000     0.4149000      0.7038000 
1 1 1 5  4  19 o 1.900000  0.5942000     1.572000  0.7508000     2.228000  0.9210000     -0.6563000     1.188000  
1 1 1 5  4  20 o 2.499000  0.7017000     3.027000  1.066000      1.972000  0.9130000     1.055000       1.403000  
1 1 1 5  4  21 o 2.791000  0.7357000     3.308000  1.103000      2.273000  0.9738000     1.035000       1.471000  
1 1 1 5  4  22 o 5.653000  0.4393000     5.745000  0.6143000     5.561000  0.6281000     0.1834000      0.8786000 
1 1 1 5  4  23 o 1.802000  0.5469000     2.195000  0.8596000     1.409000  0.6763000     0.7860000      1.094000  
1 1 1 5  4  24 o 2.378000  0.5158000     3.218000  0.7579000     1.537000  0.6998000     1.681000       1.032000  
1 1 1 5  4  25 o 1.553000  0.5116000     1.386000  0.6675000     1.720000  0.7755000     -0.3334000     1.023000  
1 1 1 5  4  26 o 1.535000  0.4921000     1.618000  0.7204000     1.452000  0.6706000     0.1662000      0.9843000 
1 1 1 5  4  27 o 1.973000  0.5469000     2.086000  0.7871000     1.861000  0.7596000     0.2253000      1.094000  
1 1 1 5  5  0  o 16.71000  0.1889000     16.71000  0.1889000     16.71000  0.1889000     -0.000000      0.000000  
1 1 1 5  5  1  o 9.214000  0.8309000E-01 9.239000  0.1177000     9.189000  0.1173000     0.4985000E-01  0.1662000 
1 1 1 5  5  2  o 9.733000  0.8949000E-01 9.863000  0.1282000     9.602000  0.1249000     0.2607000      0.1790000 
1 1 1 5  5  3  o 26.78000  0.2110000     26.57000  0.2962000     27.00000  0.3006000     -0.4214000     0.4220000 
1 1 1 5  5  4  f 6.917000  0.9166000E-01 6.838000  0.1280000     6.996000  0.1313000     -0.1581000     0.1833000 
1 1 1 5  5  5  o 17.23000  0.1941000     17.47000  0.3036000     16.98000  0.2419000     0.4927000      0.3882000 
1 1 1 5  5  6  o 19.64000  0.1689000     19.88000  0.2414000     19.41000  0.2364000     0.4656000      0.3379000 
1 1 1 5  5  7  f 10.22000  0.1263000     10.07000  0.1781000     10.37000  0.1791000     -0.3032000     0.2526000 
1 1 1 5  5  8  o 23.74000  0.2021000     23.66000  0.2852000     23.83000  0.2865000     -0.1671000     0.4043000 
1 1 1 5  5  9  o 2.905000  0.2811000     2.864000  0.4062000     2.945000  0.3888000     -0.8165000E-01 0.5623000 
1 1 1 5  5  10 o 5.062000  0.2919000     5.398000  0.3927000     4.725000  0.4320000     0.6730000      0.5838000 
1 1 1 5  5  11 o 8.326000  0.2096000     8.277000  0.2960000     8.375000  0.2968000     -0.9822000E-01 0.4192000 
1 1 1 5  5  12 o 8.049000  0.2356000     8.239000  0.3302000     7.860000  0.3362000     0.3786000      0.4712000 
1 1 1 5  5  13 o 4.476000  0.3514000     4.555000  0.5279000     4.396000  0.4639000     0.1590000      0.7027000 
1 1 1 5  5  14 o 5.065000  0.3210000     5.181000  0.4397000     4.950000  0.4678000     0.2314000      0.6420000 
1 1 1 5  5  15 o 7.289000  0.2998000     7.025000  0.4286000     7.552000  0.4193000     -0.5272000     0.5995000 
1 1 1 5  5  16 o 3.969000  0.5626000     3.752000  0.8418000     4.187000  0.7466000     -0.4350000     1.125000  
1 1 1 5  5  17 o 2.627000  0.5219000     3.758000  0.7736000     1.496000  0.7007000     2.262000       1.044000  
1 1 1 5  5  18 o 5.626000  0.4188000     5.309000  0.6334000     5.942000  0.5481000     -0.6334000     0.8376000 
1 1 1 5  5  19 o 5.528000  0.4526000     5.666000  0.6276000     5.390000  0.6522000     0.2757000      0.9052000 
1 1 1 5  5  20 o 2.287000  0.6949000     2.366000  0.9951000     2.209000  0.9703000     0.1566000      1.390000  
1 1 1 5  5  21 o 2.245000  0.6634000     1.618000  0.7734000     2.871000  1.078000      -1.253000      1.327000  
1 1 1 5  5  22 o 2.822000  0.6662000     2.398000  0.9331000     3.246000  0.9512000     -0.8478000     1.332000  
1 1 1 5  5  23 o 2.370000  0.5797000     3.031000  0.8688000     1.709000  0.7678000     1.322000       1.159000  
1 1 1 5  5  24 o 2.768000  0.5547000     3.238000  0.7534000     2.297000  0.8144000     0.9412000      1.109000  
1 1 1 5  5  25 o 1.618000  0.5249000     1.705000  0.7692000     1.531000  0.7145000     0.1742000      1.050000  
1 1 1 5  5  26 o 1.724000  0.5168000     1.571000  0.7026000     1.878000  0.7579000     -0.3065000     1.034000  
1 1 1 5  5  27 o 1.693000  0.5122000     1.731000  0.7354000     1.656000  0.7131000     0.7592000E-01  1.024000  
1 1 1 5  6  0  o 29.35000  0.3226000     29.35000  0.3226000     29.35000  0.3226000     0.000000       0.000000  
1 1 1 5  6  1  o 27.87000  0.2172000     27.97000  0.3083000     27.77000  0.3061000     0.2003000      0.4345000 
1 1 1 5  6  2  o 19.52000  0.1690000     19.34000  0.2535000     19.69000  0.2237000     -0.3490000     0.3381000 
1 1 1 5  6  3  o 32.32000  0.2526000     32.22000  0.3561000     32.42000  0.3585000     -0.2084000     0.5053000 
1 1 1 5  6  4  o 10.65000  0.1682000     10.75000  0.2762000     10.55000  0.1921000     0.2000000      0.3364000 
1 1 1 5  6  5  o 19.22000  0.2605000     19.04000  0.4663000     19.41000  0.2325000     -0.3749000     0.5211000 
1 1 1 5  6  6  o 12.60000  0.1287000     12.61000  0.1826000     12.59000  0.1814000     0.2558000E-01  0.2574000 
1 1 1 5  6  7  o 22.91000  0.1936000     23.01000  0.2746000     22.82000  0.2729000     0.1858000      0.3871000 
1 1 1 5  6  8  o 1.743000  0.3280000     2.359000  0.4468000     1.127000  0.4804000     1.232000       0.6561000 
1 1 1 5  6  9  o 6.155000  0.1631000     5.972000  0.2369000     6.337000  0.2243000     -0.3645000     0.3262000 
1 1 1 5  6  10 o 5.810000  0.2205000     5.533000  0.3205000     6.088000  0.3030000     -0.5549000     0.4410000 
1 1 1 5  6  11 o 15.07000  0.2006000     14.95000  0.2811000     15.18000  0.2862000     -0.2295000     0.4012000 
1 1 1 5  6  12 o 10.72000  0.2108000     10.80000  0.2951000     10.64000  0.3012000     0.1579000      0.4217000 
1 1 1 5  6  13 o 5.374000  0.3026000     5.268000  0.4667000     5.479000  0.3853000     -0.2107000     0.6051000 
1 1 1 5  6  14 o 6.471000  0.2677000     6.159000  0.3867000     6.783000  0.3703000     -0.6238000     0.5354000 
1 1 1 5  6  15 o 6.085000  0.3482000     6.175000  0.4807000     5.994000  0.5039000     0.1803000      0.6964000 
1 1 1 5  6  16 o 9.915000  0.2645000     10.19000  0.3385000     9.643000  0.4066000     0.5435000      0.5291000 
1 1 1 5  6  17 o 3.566000  0.5765000     3.844000  0.7612000     3.288000  0.8660000     0.5552000      1.153000  
1 1 1 5  6  18 o 4.620000  0.5107000     4.473000  0.7382000     4.766000  0.7060000     -0.2929000     1.021000  
1 1 1 5  6  19 o 3.937000  0.6413000     4.150000  0.8617000     3.723000  0.9501000     0.4275000      1.283000  
1 1 1 5  6  20 o 3.972000  0.8070000     4.263000  1.019000      3.681000  1.252000      0.5818000      1.614000  
1 1 1 5  6  21 o 2.076000  0.6373000     1.962000  0.8719000     2.190000  0.9298000     -0.2280000     1.275000  
1 1 1 5  6  22 o 2.439000  0.6622000     2.441000  0.9397000     2.437000  0.9333000     0.4489000E-02  1.324000  
1 1 1 5  6  23 o 1.387000  0.4696000     1.538000  0.7137000     1.236000  0.6106000     0.3027000      0.9392000 
1 1 1 5  6  24 o 1.398000  0.4612000     1.420000  0.6593000     1.376000  0.6452000     0.4407000E-01  0.9225000 
1 1 1 5  6  25 o 2.022000  0.6033000     2.020000  0.8511000     2.024000  0.8553000     -0.3891000E-02 1.207000  
1 1 1 5  6  26 o 1.705000  0.5097000     2.038000  0.7918000     1.372000  0.6421000     0.6656000      1.019000  
1 1 1 5  6  27 o 1.396000  0.4558000     1.090000  0.5411000     1.702000  0.7338000     -0.6118000     0.9117000 
1 1 1 5  7  0  o 43.74000  0.4768000     43.74000  0.4768000     43.74000  0.4768000     -0.000000      0.000000  
1 1 1 5  7  1  o 22.47000  0.1780000     22.30000  0.2498000     22.64000  0.2535000     -0.3482000     0.3560000 
1 1 1 5  7  2  o 14.82000  0.1249000     14.75000  0.1761000     14.88000  0.1772000     -0.1213000     0.2499000 
1 1 1 5  7  3  o 19.43000  0.1587000     19.57000  0.2259000     19.28000  0.2230000     0.2880000      0.3175000 
1 1 1 5  7  4  o 19.67000  0.2109000     19.98000  0.3288000     19.36000  0.2642000     0.6289000      0.4218000 
1 1 1 5  7  5  o 32.08000  0.3949000     31.74000  0.7205000     32.42000  0.3235000     -0.6780000     0.7898000 
1 1 1 5  7  6  o 13.04000  0.1281000     12.97000  0.1795000     13.10000  0.1829000     -0.1319000     0.2563000 
1 1 1 5  7  7  o 16.39000  0.1528000     16.23000  0.2147000     16.55000  0.2176000     -0.3242000     0.3057000 
1 1 1 5  7  8  o 5.992000  0.1518000     5.917000  0.2163000     6.067000  0.2130000     -0.1500000     0.3035000 
1 1 1 5  7  9  o 4.415000  0.2099000     3.798000  0.3240000     5.031000  0.2670000     -1.233000      0.4198000 
1 1 1 5  7  10 o 6.596000  0.2556000     6.785000  0.3595000     6.408000  0.3634000     0.3770000      0.5112000 
1 1 1 5  7  11 o 5.113000  0.2554000     5.182000  0.3320000     5.044000  0.3880000     0.1377000      0.5107000 
1 1 1 5  7  12 o 8.535000  0.2280000     8.571000  0.3242000     8.498000  0.3207000     0.7340000E-01  0.4560000 
1 1 1 5  7  13 o 6.881000  0.2517000     6.685000  0.3851000     7.078000  0.3241000     -0.3933000     0.5034000 
1 1 1 5  7  14 o 5.014000  0.3323000     4.519000  0.5181000     5.510000  0.4162000     -0.9905000     0.6645000 
1 1 1 5  7  15 o 19.25000  0.3061000     19.43000  0.4381000     19.08000  0.4277000     0.3456000      0.6123000 
1 1 1 5  7  16 f 14.23000  0.2229000     14.26000  0.3119000     14.20000  0.3184000     0.6316000E-01  0.4457000 
1 1 1 5  7  17 o 6.735000  0.3298000     6.969000  0.4577000     6.501000  0.4750000     0.4687000      0.6596000 
1 1 1 5  7  18 o 3.979000  0.5760000     4.056000  0.7994000     3.902000  0.8294000     0.1541000      1.152000  
1 1 1 5  7  19 o 2.512000  0.6778000     2.783000  0.9892000     2.241000  0.9270000     0.5421000      1.356000  
1 1 1 5  7  20 f 3.540000  0.8383000     3.932000  1.142000      3.148000  1.227000      0.7842000      1.677000  
1 1 1 5  7  21 o 2.576000  0.7006000     2.589000  0.9961000     2.564000  0.9856000     0.2528000E-01  1.401000  
1 1 1 5  7  22 o 2.814000  0.6343000     2.130000  0.8903000     3.498000  0.9037000     -1.368000      1.269000  
1 1 1 5  7  23 o 3.280000  0.5820000     3.340000  0.8121000     3.221000  0.8338000     0.1194000      1.164000  
1 1 1 5  7  24 o 1.624000  0.5083000     1.729000  0.7411000     1.519000  0.6959000     0.2098000      1.017000  
1 1 1 5  7  25 o 1.729000  0.5627000     1.640000  0.7778000     1.818000  0.8133000     -0.1782000     1.125000  
1 1 1 5  7  26 o 1.341000  0.4452000     1.256000  0.6021000     1.427000  0.6559000     -0.1712000     0.8904000 
1 1 1 5  7  27 o 1.553000  0.4908000     1.543000  0.6899000     1.562000  0.6983000     -0.1956000E-01 0.9816000 
1 1 1 5  8  0  o 19.61000  0.2237000     19.61000  0.2237000     19.61000  0.2237000     -0.000000      0.000000  
1 1 1 5  8  1  o 5.556000  0.7829000E-01 5.665000  0.1105000     5.447000  0.1109000     0.2174000      0.1566000 
1 1 1 5  8  2  o 16.31000  0.1364000     16.41000  0.1937000     16.21000  0.1920000     0.2006000      0.2728000 
1 1 1 5  8  3  o 17.93000  0.1492000     17.93000  0.2106000     17.93000  0.2114000     0.1984000E-02  0.2984000 
1 1 1 5  8  4  o 3.965000  0.1415000     3.965000  0.1415000     ?         ?             ?              ?         
1 1 1 5  8  5  o 17.40000  0.1493000     17.39000  0.2112000     17.41000  0.2110000     -0.1316000E-01 0.2985000 
1 1 1 5  8  6  o 8.758000  0.1119000     8.789000  0.1573000     8.727000  0.1593000     0.6228000E-01  0.2239000 
1 1 1 5  8  7  o 21.55000  0.1836000     21.33000  0.2572000     21.76000  0.2622000     -0.4370000     0.3673000 
1 1 1 5  8  8  o 3.206000  0.2435000     3.630000  0.3057000     2.782000  0.3791000     0.8481000      0.4870000 
1 1 1 5  8  9  f 9.609000  0.1449000     9.656000  0.2058000     9.563000  0.2039000     0.9202000E-01  0.2898000 
1 1 1 5  8  10 f 11.99000  0.2264000     11.58000  0.3249000     12.40000  0.3153000     -0.8160000     0.4527000 
1 1 1 5  8  11 o 7.163000  0.2067000     7.187000  0.2742000     7.140000  0.3093000     0.4723000E-01  0.4133000 
1 1 1 5  8  12 o 6.723000  0.2607000     6.287000  0.3885000     7.159000  0.3478000     -0.8712000     0.5214000 
1 1 1 5  8  13 o 2.550000  0.4682000     1.727000  0.7274000     3.373000  0.5898000     -1.646000      0.9364000 
1 1 1 5  8  14 o 14.86000  0.1998000     14.98000  0.2828000     14.74000  0.2824000     0.2467000      0.3997000 
1 1 1 5  8  15 o 10.58000  0.3066000     10.39000  0.4367000     10.76000  0.4303000     -0.3706000     0.6131000 
1 1 1 5  8  16 o 6.026000  0.3369000     5.944000  0.4866000     6.107000  0.4661000     -0.1631000     0.6738000 
1 1 1 5  8  17 o 11.71000  0.2426000     11.46000  0.3434000     11.96000  0.3429000     -0.4910000     0.4853000 
1 1 1 5  8  18 o 3.009000  0.6385000     3.496000  0.8821000     2.523000  0.9232000     0.9736000      1.277000  
1 1 1 5  8  19 o 2.308000  0.6575000     2.046000  0.8927000     2.569000  0.9655000     -0.5228000     1.315000  
1 1 1 5  8  20 o 6.349000  0.6485000     5.185000  1.025000      7.512000  0.7948000     -2.326000      1.297000  
1 1 1 5  8  21 o 2.335000  0.6676000     2.152000  0.9209000     2.519000  0.9667000     -0.3671000     1.335000  
1 1 1 5  8  22 o 1.522000  0.5116000     1.296000  0.6416000     1.748000  0.7970000     -0.4524000     1.023000  
1 1 1 5  8  23 o 2.130000  0.5726000     1.698000  0.7594000     2.563000  0.8571000     -0.8648000     1.145000  
1 1 1 5  8  24 o 2.353000  0.5432000     2.982000  0.7963000     1.724000  0.7390000     1.258000       1.086000  
1 1 1 5  8  25 o 2.236000  0.6479000     2.319000  0.9320000     2.152000  0.9002000     0.1675000      1.296000  
1 1 1 5  8  26 o 1.698000  0.5149000     1.598000  0.7119000     1.798000  0.7441000     -0.2000000     1.030000  
1 1 1 5  8  27 o 1.680000  0.4906000     2.144000  0.7848000     1.216000  0.5889000     0.9274000      0.9811000 
1 1 1 5  9  0  o 18.13000  0.2107000     18.13000  0.2107000     18.13000  0.2107000     0.000000       0.000000  
1 1 1 5  9  1  o 17.96000  0.1480000     17.99000  0.2093000     17.94000  0.2092000     0.4917000E-01  0.2959000 
1 1 1 5  9  2  o 20.67000  0.1679000     20.68000  0.2376000     20.65000  0.2373000     0.2640000E-01  0.3358000 
1 1 1 5  9  3  o 18.90000  0.1923000     18.94000  0.3144000     18.86000  0.2216000     0.8338000E-01  0.3846000 
1 1 1 5  9  4  o 11.90000  0.1621000     11.81000  0.2269000     11.99000  0.2315000     -0.1739000     0.3241000 
1 1 1 5  9  5  o 16.25000  0.1429000     16.45000  0.2039000     16.04000  0.2002000     0.4053000      0.2858000 
1 1 1 5  9  6  f 15.38000  0.1405000     15.31000  0.1983000     15.45000  0.1990000     -0.1349000     0.2809000 
1 1 1 5  9  7  o 13.86000  0.1513000     13.57000  0.2293000     14.15000  0.1975000     -0.5822000     0.3026000 
1 1 1 5  9  8  o 8.303000  0.1266000     8.257000  0.1774000     8.349000  0.1807000     -0.9181000E-01 0.2532000 
1 1 1 5  9  9  o 8.513000  0.1831000     8.274000  0.2122000     8.752000  0.2985000     -0.4778000     0.3662000 
1 1 1 5  9  10 o 12.21000  0.2286000     12.16000  0.3198000     12.27000  0.3267000     -0.1082000     0.4572000 
1 1 1 5  9  11 o 6.796000  0.2256000     7.180000  0.2809000     6.412000  0.3531000     0.7682000      0.4512000 
1 1 1 5  9  12 o 7.188000  0.2529000     7.150000  0.3591000     7.227000  0.3564000     -0.7745000E-01 0.5059000 
1 1 1 5  9  13 o 8.586000  0.2282000     8.648000  0.3465000     8.523000  0.2969000     0.1249000      0.4563000 
1 1 1 5  9  14 o 12.24000  0.2024000     12.38000  0.2851000     12.11000  0.2872000     0.2692000      0.4047000 
1 1 1 5  9  15 o 2.261000  0.6239000     2.368000  0.8672000     2.154000  0.8972000     0.2138000      1.248000  
1 1 1 5  9  16 o 12.22000  0.2297000     12.41000  0.3233000     12.03000  0.3264000     0.3821000      0.4594000 
1 1 1 5  9  17 o 3.709000  0.5538000     3.358000  0.8445000     4.060000  0.7166000     -0.7019000     1.108000  
1 1 1 5  9  18 o 3.689000  0.6418000     4.747000  0.8244000     2.631000  0.9837000     2.116000       1.284000  
1 1 1 5  9  19 o 3.267000  0.6738000     2.912000  0.9867000     3.622000  0.9180000     -0.7105000     1.348000  
1 1 1 5  9  20 o 2.466000  0.7226000     2.490000  1.009000      2.441000  1.035000      0.4840000E-01  1.445000  
1 1 1 5  9  21 o 5.509000  0.4750000     5.654000  0.6554000     5.364000  0.6877000     0.2901000      0.9499000 
1 1 1 5  9  22 o 3.137000  0.6521000     2.778000  0.9327000     3.495000  0.9117000     -0.7170000     1.304000  
1 1 1 5  9  23 o 1.717000  0.5354000     1.341000  0.6410000     2.092000  0.8578000     -0.7507000     1.071000  
1 1 1 5  9  24 o 1.432000  0.4659000     1.617000  0.7123000     1.247000  0.6008000     0.3701000      0.9319000 
1 1 1 5  9  25 f 1.433000  0.4927000     1.413000  0.6916000     1.453000  0.7018000     -0.4023000E-01 0.9853000 
1 1 1 5  9  26 o 1.359000  0.4440000     1.644000  0.7121000     1.074000  0.5307000     0.5691000      0.8881000 
1 1 1 5  9  27 o 1.722000  0.5170000     1.774000  0.7476000     1.670000  0.7143000     0.1044000      1.034000  
1 1 1 5  10 0  o 39.21000  0.4315000     39.21000  0.4315000     39.21000  0.4315000     -0.000000      0.000000  
1 1 1 5  10 1  o 27.54000  0.2179000     27.73000  0.3102000     27.34000  0.3062000     0.3901000      0.4359000 
1 1 1 5  10 2  o 8.219000  0.9341000E-01 8.238000  0.1317000     8.199000  0.1326000     0.3931000E-01  0.1868000 
1 1 1 5  10 3  o 5.278000  0.1874000     5.278000  0.1874000     ?         ?             ?              ?         
1 1 1 5  10 4  o 13.55000  0.1526000     13.45000  0.2488000     13.64000  0.1767000     -0.1865000     0.3052000 
1 1 1 5  10 5  o 19.07000  0.1620000     18.78000  0.2265000     19.35000  0.2317000     -0.5658000     0.3240000 
1 1 1 5  10 6  o 18.27000  0.1697000     17.85000  0.2514000     18.69000  0.2281000     -0.8368000     0.3394000 
1 1 1 5  10 7  o 5.914000  0.1247000     5.797000  0.2007000     6.030000  0.1480000     -0.2330000     0.2494000 
1 1 1 5  10 8  o 9.042000  0.1303000     9.040000  0.1821000     9.044000  0.1864000     -0.4498000E-02 0.2606000 
1 1 1 5  10 9  o 2.512000  0.2844000     2.469000  0.4042000     2.554000  0.4003000     -0.8572000E-01 0.5688000 
1 1 1 5  10 10 o 12.61000  0.2074000     12.23000  0.3136000     12.99000  0.2715000     -0.7547000     0.4147000 
1 1 1 5  10 11 o 11.94000  0.1906000     12.05000  0.2478000     11.83000  0.2897000     0.2177000      0.3812000 
1 1 1 5  10 12 o 5.178000  0.3148000     5.589000  0.4155000     4.766000  0.4729000     0.8228000      0.6295000 
1 1 1 5  10 13 o 4.564000  0.3654000     5.139000  0.4827000     3.989000  0.5488000     1.150000       0.7308000 
1 1 1 5  10 14 f 9.651000  0.2150000     9.634000  0.3032000     9.668000  0.3048000     -0.3367000E-01 0.4300000 
1 1 1 5  10 15 o 11.57000  0.3095000     11.38000  0.4340000     11.75000  0.4412000     -0.3609000     0.6189000 
1 1 1 5  10 16 o 11.10000  0.2361000     11.03000  0.3320000     11.18000  0.3358000     -0.1452000     0.4723000 
1 1 1 5  10 17 o 12.92000  0.2369000     12.48000  0.3396000     13.37000  0.3304000     -0.8909000     0.4738000 
1 1 1 5  10 18 o 9.627000  0.2879000     9.362000  0.4139000     9.892000  0.4002000     -0.5296000     0.5758000 
1 1 1 5  10 19 o 5.522000  0.4890000     4.634000  0.7851000     6.410000  0.5833000     -1.776000      0.9780000 
1 1 1 5  10 20 o 3.930000  0.8286000     4.366000  1.085000      3.494000  1.253000      0.8720000      1.657000  
1 1 1 5  10 21 o 2.533000  0.6637000     3.030000  0.9819000     2.036000  0.8933000     0.9939000      1.327000  
1 1 1 5  10 22 o 1.691000  0.5418000     1.460000  0.6992000     1.923000  0.8278000     -0.4622000     1.084000  
1 1 1 5  10 23 o 2.361000  0.5797000     2.774000  0.8301000     1.949000  0.8094000     0.8248000      1.159000  
1 1 1 5  10 24 o 1.630000  0.4980000     1.934000  0.7702000     1.326000  0.6315000     0.6076000      0.9960000 
1 1 1 5  10 25 o 1.667000  0.5150000     2.049000  0.8211000     1.284000  0.6217000     0.7653000      1.030000  
1 1 1 5  10 26 o 1.300000  0.4340000     1.279000  0.6062000     1.321000  0.6212000     -0.4188000E-01 0.8679000 
1 1 1 5  10 27 o 1.494000  0.4753000     1.706000  0.7277000     1.282000  0.6116000     0.4234000      0.9506000 
1 1 1 5  11 0  o 24.77000  0.2807000     24.77000  0.2807000     24.77000  0.2807000     -0.000000      0.000000  
1 1 1 5  11 1  o 15.88000  0.1362000     15.92000  0.1930000     15.83000  0.1923000     0.9232000E-01  0.2725000 
1 1 1 5  11 2  o 17.43000  0.1907000     17.61000  0.2974000     17.25000  0.2387000     0.3528000      0.3813000 
1 1 1 5  11 3  o 11.80000  0.1939000     11.96000  0.2298000     11.63000  0.3123000     0.3301000      0.3878000 
1 1 1 5  11 4  o 14.83000  0.1435000     14.89000  0.2160000     14.78000  0.1889000     0.1131000      0.2870000 
1 1 1 5  11 5  o 4.477000  0.1396000     4.447000  0.1932000     4.508000  0.2017000     -0.6082000E-01 0.2793000 
1 1 1 5  11 6  o 25.77000  0.2108000     25.27000  0.2925000     26.27000  0.3035000     -1.006000      0.4216000 
1 1 1 5  11 7  o 20.89000  0.1791000     21.18000  0.2563000     20.59000  0.2504000     0.5892000      0.3583000 
1 1 1 5  11 8  o 12.54000  0.1390000     12.77000  0.1974000     12.30000  0.1956000     0.4696000      0.2779000 
1 1 1 5  11 9  o 15.87000  0.1820000     15.99000  0.2558000     15.76000  0.2589000     0.2316000      0.3639000 
1 1 1 5  11 10 f 12.41000  0.1967000     12.07000  0.3270000     12.76000  0.2185000     -0.6934000     0.3933000 
1 1 1 5  11 11 o 12.43000  0.1784000     12.63000  0.2045000     12.22000  0.2924000     0.4135000      0.3568000 
1 1 1 5  11 12 o 7.930000  0.2444000     8.129000  0.3383000     7.731000  0.3527000     0.3984000      0.4888000 
1 1 1 5  11 13 o 6.529000  0.2703000     6.771000  0.3918000     6.287000  0.3726000     0.4843000      0.5407000 
1 1 1 5  11 14 o 15.68000  0.2020000     15.46000  0.2870000     15.90000  0.2845000     -0.4461000     0.4041000 
1 1 1 5  11 15 o 13.98000  0.2483000     13.99000  0.3493000     13.97000  0.3530000     0.1436000E-01  0.4966000 
1 1 1 5  11 16 o 10.64000  0.2436000     10.73000  0.3423000     10.55000  0.3467000     0.1816000      0.4872000 
1 1 1 5  11 17 o 11.73000  0.2465000     11.98000  0.3442000     11.47000  0.3529000     0.5103000      0.4930000 
1 1 1 5  11 18 o 1.796000  0.5712000     1.572000  0.7453000     2.021000  0.8659000     -0.4492000     1.142000  
1 1 1 5  11 19 f 4.193000  0.6105000     3.904000  0.9101000     4.482000  0.8140000     -0.5782000     1.221000  
1 1 1 5  11 20 o 3.516000  0.8242000     4.217000  1.160000      2.814000  1.171000      1.403000       1.648000  
1 1 1 5  11 21 o 4.550000  0.5727000     4.772000  0.7684000     4.328000  0.8495000     0.4437000      1.145000  
1 1 1 5  11 22 o 2.497000  0.6305000     2.636000  0.9040000     2.359000  0.8793000     0.2767000      1.261000  
1 1 1 5  11 23 o 2.597000  0.5834000     2.384000  0.8265000     2.810000  0.8237000     -0.4256000     1.167000  
1 1 1 5  11 24 o 1.697000  0.5163000     1.632000  0.7161000     1.762000  0.7438000     -0.1293000     1.033000  
1 1 1 5  11 25 o 1.850000  0.5746000     1.959000  0.8587000     1.740000  0.7637000     0.2184000      1.149000  
1 1 1 5  11 26 o 1.257000  0.4244000     1.157000  0.5652000     1.356000  0.6334000     -0.1984000     0.8489000 
1 1 1 5  11 27 o 1.518000  0.4786000     1.794000  0.7477000     1.241000  0.5976000     0.5538000      0.9572000 
1 1 1 5  12 0  o 17.47000  0.2969000     17.47000  0.2969000     17.47000  0.2969000     -0.000000      0.000000  
1 1 1 5  12 1  o 20.91000  0.2985000     20.97000  0.3445000     20.86000  0.4876000     0.1045000      0.5970000 
1 1 1 5  12 2  o 14.50000  0.2583000     14.50000  0.2583000     ?         ?             ?              ?         
1 1 1 5  12 3  o 4.833000  0.1050000     4.868000  0.1502000     4.798000  0.1467000     0.7065000E-01  0.2100000 
1 1 1 5  12 4  o 13.06000  0.1249000     13.11000  0.1773000     13.00000  0.1759000     0.1100000      0.2497000 
1 1 1 5  12 5  o 29.48000  0.2364000     29.74000  0.3372000     29.21000  0.3314000     0.5304000      0.4728000 
1 1 1 5  12 6  o 24.98000  0.2056000     25.25000  0.2936000     24.70000  0.2879000     0.5543000      0.4112000 
1 1 1 5  12 7  o 15.20000  0.1446000     15.22000  0.2049000     15.19000  0.2042000     0.2712000E-01  0.2893000 
1 1 1 5  12 8  o 11.57000  0.1376000     11.80000  0.2197000     11.34000  0.1658000     0.4615000      0.2752000 
1 1 1 5  12 9  o 1.446000  0.4507000     0.9740000 0.4330000     1.917000  0.7906000     -0.9434000     0.9014000 
1 1 1 5  12 10 o 5.773000  0.1633000     5.572000  0.2348000     5.974000  0.2269000     -0.4028000     0.3265000 
1 1 1 5  12 11 o 5.296000  0.2001000     5.170000  0.2857000     5.423000  0.2802000     -0.2526000     0.4002000 
1 1 1 5  12 12 o 3.585000  0.3034000     3.447000  0.4535000     3.722000  0.4032000     -0.2756000     0.6069000 
1 1 1 5  12 13 o 8.784000  0.2358000     8.572000  0.3575000     8.997000  0.3075000     -0.4246000     0.4716000 
1 1 1 5  12 14 o 6.370000  0.2823000     6.682000  0.3876000     6.057000  0.4105000     0.6251000      0.5646000 
1 1 1 5  12 15 o 7.523000  0.3952000     7.788000  0.5466000     7.258000  0.5709000     0.5308000      0.7904000 
1 1 1 5  12 16 o 5.067000  0.4217000     6.079000  0.4759000     4.055000  0.6963000     2.024000       0.8434000 
1 1 1 5  12 17 o 4.179000  0.5227000     4.343000  0.6951000     4.015000  0.7810000     0.3280000      1.045000  
1 1 1 5  12 18 o 9.092000  0.3028000     9.167000  0.4264000     9.017000  0.4300000     0.1501000      0.6056000 
1 1 1 5  12 19 o 10.56000  0.2995000     10.61000  0.4312000     10.52000  0.4157000     0.8683000E-01  0.5989000 
1 1 1 5  12 20 o 3.164000  0.6970000     2.019000  0.9296000     4.309000  1.039000      -2.290000      1.394000  
1 1 1 5  12 21 o 2.275000  0.6059000     3.021000  0.9640000     1.528000  0.7343000     1.493000       1.212000  
1 1 1 5  12 22 o 5.734000  0.3805000     5.901000  0.5341000     5.567000  0.5420000     0.3331000      0.7609000 
1 1 1 5  12 23 o 1.734000  0.5203000     1.591000  0.7082000     1.877000  0.7624000     -0.2860000     1.041000  
1 1 1 5  12 24 o 1.774000  0.5234000     1.925000  0.7675000     1.623000  0.7120000     0.3023000      1.047000  
1 1 1 5  12 25 o 1.818000  0.5625000     2.194000  0.8866000     1.443000  0.6924000     0.7508000      1.125000  
1 1 1 5  12 26 f 1.229000  0.4191000     1.127000  0.5532000     1.331000  0.6296000     -0.2049000     0.8381000 
1 1 1 5  12 27 o 1.168000  0.4020000     1.111000  0.5450000     1.226000  0.5911000     -0.1148000     0.8040000 
1 1 1 5  13 0  o 11.21000  0.2225000     11.21000  0.2225000     11.21000  0.2225000     -0.000000      0.000000  
1 1 1 5  13 1  o 11.15000  0.1563000     11.12000  0.2208000     11.17000  0.2213000     -0.5201000E-01 0.3126000 
1 1 1 5  13 2  o 9.696000  0.1052000     9.859000  0.1496000     9.532000  0.1478000     0.3277000      0.2103000 
1 1 1 5  13 3  o 11.19000  0.1140000     11.27000  0.1620000     11.12000  0.1603000     0.1482000      0.2280000 
1 1 1 5  13 4  o 0.9742000 0.2686000     1.017000  0.3857000     0.9312000 0.3739000     0.8591000E-01  0.5371000 
1 1 1 5  13 5  f 10.03000  0.1150000     9.928000  0.1616000     10.14000  0.1635000     -0.2127000     0.2299000 
1 1 1 5  13 6  o 24.36000  0.2018000     24.36000  0.2855000     24.36000  0.2852000     -0.2611000E-02 0.4036000 
1 1 1 5  13 7  o 17.93000  0.1620000     17.89000  0.2289000     17.98000  0.2294000     -0.8546000E-01 0.3241000 
1 1 1 5  13 8  o 10.18000  0.1263000     10.25000  0.1791000     10.12000  0.1781000     0.1325000      0.2526000 
1 1 1 5  13 9  o 13.90000  0.2567000     13.85000  0.2450000     13.96000  0.4511000     -0.1153000     0.5133000 
1 1 1 5  13 10 o 6.546000  0.1633000     6.677000  0.2291000     6.416000  0.2328000     0.2608000      0.3266000 
1 1 1 5  13 11 o 3.683000  0.2740000     4.147000  0.3389000     3.218000  0.4307000     0.9285000      0.5481000 
1 1 1 5  13 12 f 1.889000  0.4387000     1.977000  0.6377000     1.800000  0.6026000     0.1770000      0.8774000 
1 1 1 5  13 13 o 10.38000  0.1934000     10.37000  0.2861000     10.39000  0.2605000     -0.2752000E-01 0.3869000 
1 1 1 5  13 14 o 1.972000  0.5279000     2.134000  0.6801000     1.811000  0.8076000     0.3232000      1.056000  
1 1 1 5  13 15 o 11.23000  0.2637000     11.43000  0.3779000     11.04000  0.3680000     0.3971000      0.5275000 
1 1 1 5  13 16 o 4.151000  0.4956000     4.384000  0.6654000     3.918000  0.7347000     0.4664000      0.9912000 
1 1 1 5  13 17 o 11.66000  0.2498000     11.93000  0.3496000     11.39000  0.3568000     0.5331000      0.4996000 
1 1 1 5  13 18 o 4.894000  0.5032000     4.242000  0.7814000     5.546000  0.6342000     -1.304000      1.006000  
1 1 1 5  13 19 o 6.663000  0.4182000     6.102000  0.6354000     7.224000  0.5440000     -1.122000      0.8364000 
1 1 1 5  13 20 o 3.888000  0.7155000     5.594000  0.9879000     2.182000  1.035000      3.413000       1.431000  
1 1 1 5  13 21 o 2.928000  0.6353000     3.644000  0.8901000     2.213000  0.9066000     1.431000       1.271000  
1 1 1 5  13 22 o 4.088000  0.5372000     4.368000  0.7077000     3.807000  0.8085000     0.5608000      1.074000  
1 1 1 5  13 23 o 3.683000  0.4800000     3.928000  0.6493000     3.439000  0.7070000     0.4884000      0.9599000 
1 1 1 5  13 24 o 1.460000  0.4801000     1.605000  0.7283000     1.315000  0.6257000     0.2893000      0.9602000 
1 1 1 5  13 25 o 1.227000  0.4277000     1.186000  0.5866000     1.268000  0.6227000     -0.8199000E-01 0.8555000 
1 1 1 5  13 26 o 1.505000  0.4746000     1.260000  0.6029000     1.751000  0.7331000     -0.4908000     0.9492000 
1 1 1 5  13 27 o 1.406000  0.4587000     1.405000  0.6483000     1.407000  0.6490000     -0.2183000E-02 0.9174000 
1 1 1 5  14 0  o 3.437000  0.1737000     3.437000  0.1737000     3.437000  0.1737000     0.000000       0.000000  
1 1 1 5  14 1  o 6.478000  0.9903000E-01 6.644000  0.1395000     6.312000  0.1406000     0.3317000      0.1981000 
1 1 1 5  14 2  o 12.28000  0.1191000     12.35000  0.1689000     12.22000  0.1679000     0.1308000      0.2382000 
1 1 1 5  14 3  o 36.27000  0.2855000     36.07000  0.4018000     36.46000  0.4057000     -0.3887000     0.5710000 
1 1 1 5  14 4  o 18.86000  0.1621000     18.65000  0.2273000     19.06000  0.2311000     -0.4073000     0.3242000 
1 1 1 5  14 5  o 14.60000  0.1371000     14.54000  0.1937000     14.67000  0.1942000     -0.1283000     0.2743000 
1 1 1 5  14 6  o 4.004000  0.1401000     4.222000  0.1913000     3.787000  0.2048000     0.4352000      0.2802000 
1 1 1 5  14 7  o 6.753000  0.1380000     6.580000  0.2143000     6.926000  0.1738000     -0.3465000     0.2759000 
1 1 1 5  14 8  o 20.85000  0.2259000     20.98000  0.3709000     20.72000  0.2580000     0.2642000      0.4518000 
1 1 1 5  14 9  o 3.674000  0.2693000     4.099000  0.3377000     3.249000  0.4197000     0.8498000      0.5387000 
1 1 1 5  14 10 o 9.994000  0.1526000     10.21000  0.2120000     9.774000  0.2195000     0.4390000      0.3051000 
1 1 1 5  14 11 o 11.33000  0.1648000     11.26000  0.2340000     11.40000  0.2321000     -0.1443000     0.3296000 
1 1 1 5  14 12 o 11.19000  0.1789000     10.85000  0.2649000     11.52000  0.2406000     -0.6732000     0.3579000 
1 1 1 5  14 13 o 14.92000  0.1978000     15.04000  0.2967000     14.81000  0.2617000     0.2301000      0.3957000 
1 1 1 5  14 14 o 2.437000  0.4999000     2.032000  0.7179000     2.841000  0.6959000     -0.8088000     0.9998000 
1 1 1 5  14 15 o 3.819000  0.5169000     3.037000  0.9292000     4.601000  0.4532000     -1.564000      1.034000  
1 1 1 5  14 16 o 5.439000  0.3945000     5.693000  0.5458000     5.184000  0.5699000     0.5091000      0.7891000 
1 1 1 5  14 17 o 5.299000  0.4328000     5.799000  0.5650000     4.800000  0.6557000     0.9990000      0.8656000 
1 1 1 5  14 18 o 7.842000  0.3361000     8.096000  0.4652000     7.588000  0.4851000     0.5084000      0.6721000 
1 1 1 5  14 19 o 6.836000  0.4466000     7.090000  0.6653000     6.582000  0.5959000     0.5079000      0.8932000 
1 1 1 5  14 20 o 5.699000  0.6519000     5.559000  1.052000      5.839000  0.7696000     -0.2794000     1.304000  
1 1 1 5  14 21 o 3.187000  0.6105000     4.002000  0.8060000     2.371000  0.9171000     1.631000       1.221000  
1 1 1 5  14 22 o 2.146000  0.5971000     2.601000  0.9117000     1.690000  0.7713000     0.9107000      1.194000  
1 1 1 5  14 23 o 1.479000  0.4780000     1.350000  0.6371000     1.608000  0.7128000     -0.2586000     0.9560000 
1 1 1 5  14 24 o 1.475000  0.4846000     1.400000  0.6586000     1.551000  0.7110000     -0.1505000     0.9692000 
1 1 1 5  14 25 o 1.345000  0.4574000     1.393000  0.6600000     1.296000  0.6334000     0.9659000E-01  0.9148000 
1 1 1 5  14 26 o 1.177000  0.4073000     1.242000  0.6039000     1.112000  0.5469000     0.1298000      0.8147000 
1 1 1 5  14 27 o 1.570000  0.4823000     1.246000  0.5975000     1.893000  0.7572000     -0.6474000     0.9646000 
1 1 1 5  15 0  o 4.818000  0.1528000     4.818000  0.1528000     4.818000  0.1528000     -0.000000      0.000000  
1 1 1 5  15 1  o 28.37000  0.2273000     28.14000  0.3192000     28.61000  0.3236000     -0.4703000     0.4546000 
1 1 1 5  15 2  o 15.65000  0.1400000     15.76000  0.1991000     15.55000  0.1970000     0.2139000      0.2801000 
1 1 1 5  15 3  o 22.37000  0.1854000     22.52000  0.2636000     22.21000  0.2607000     0.3120000      0.3708000 
1 1 1 5  15 4  o 17.37000  0.1533000     17.36000  0.2172000     17.39000  0.2165000     -0.3320000E-01 0.3067000 
1 1 1 5  15 5  o 7.729000  0.1124000     7.777000  0.1596000     7.680000  0.1582000     0.9657000E-01  0.2247000 
1 1 1 5  15 6  o 6.620000  0.1188000     6.601000  0.1671000     6.639000  0.1689000     -0.3820000E-01 0.2376000 
1 1 1 5  15 7  o 17.98000  0.1635000     17.86000  0.2302000     18.11000  0.2322000     -0.2448000     0.3270000 
1 1 1 5  15 8  o 5.130000  0.1878000     5.035000  0.2782000     5.224000  0.2523000     -0.1890000     0.3756000 
1 1 1 5  15 9  f 10.70000  0.1665000     10.97000  0.2726000     10.43000  0.1914000     0.5373000      0.3331000 
1 1 1 5  15 10 o 7.429000  0.1642000     6.993000  0.2343000     7.866000  0.2302000     -0.8725000     0.3285000 
1 1 1 5  15 11 o 8.412000  0.1712000     8.304000  0.2437000     8.520000  0.2404000     -0.2153000     0.3424000 
1 1 1 5  15 12 o 6.190000  0.2174000     6.409000  0.3170000     5.970000  0.2977000     0.4396000      0.4348000 
1 1 1 5  15 13 o 13.59000  0.2389000     13.68000  0.4046000     13.51000  0.2543000     0.1795000      0.4779000 
1 1 1 5  15 14 o 4.368000  0.5917000     5.447000  0.3740000     3.289000  1.123000      2.158000       1.183000  
1 1 1 5  15 15 o 10.28000  0.2058000     10.31000  0.2912000     10.24000  0.2908000     0.7284000E-01  0.4116000 
1 1 1 5  15 16 o 6.395000  0.2721000     6.452000  0.3734000     6.338000  0.3957000     0.1146000      0.5441000 
1 1 1 5  15 17 o 2.918000  0.5788000     1.783000  0.7354000     4.054000  0.8940000     -2.271000      1.158000  
1 1 1 5  15 18 f 2.341000  0.6337000     2.904000  0.9716000     1.778000  0.8139000     1.126000       1.267000  
1 1 1 5  15 19 o 3.799000  0.6958000     4.727000  0.9180000     2.870000  1.046000      1.857000       1.392000  
1 1 1 5  15 20 o 6.173000  0.5692000     7.440000  0.6490000     4.906000  0.9354000     2.534000       1.138000  
1 1 1 5  15 21 o 1.691000  0.5480000     1.799000  0.8046000     1.584000  0.7442000     0.2155000      1.096000  
1 1 1 5  15 22 f 2.036000  0.5943000     2.321000  0.8893000     1.752000  0.7886000     0.5683000      1.189000  
1 1 1 5  15 23 o 1.325000  0.4416000     1.112000  0.5493000     1.538000  0.6915000     -0.4254000     0.8832000 
1 1 1 5  15 24 o 1.379000  0.4633000     1.405000  0.6641000     1.353000  0.6463000     0.5151000E-01  0.9267000 
1 1 1 5  15 25 o 1.568000  0.5022000     1.604000  0.7106000     1.532000  0.7099000     0.7175000E-01  1.004000  
1 1 1 5  15 26 o 1.492000  0.4793000     1.383000  0.6435000     1.600000  0.7104000     -0.2167000     0.9585000 
1 1 1 5  15 27 f 1.884000  0.5294000     2.046000  0.7701000     1.723000  0.7266000     0.3223000      1.059000  
1 1 1 5  16 0  f 19.18000  0.2308000     19.18000  0.2308000     19.18000  0.2308000     -0.000000      0.000000  
1 1 1 5  16 1  o 22.48000  0.1858000     22.44000  0.2624000     22.52000  0.2632000     -0.7830000E-01 0.3717000 
1 1 1 5  16 2  o 16.60000  0.1473000     16.41000  0.2066000     16.79000  0.2100000     -0.3879000     0.2945000 
1 1 1 5  16 3  o 20.20000  0.1713000     20.20000  0.2424000     20.21000  0.2421000     -0.1122000E-01 0.3426000 
1 1 1 5  16 4  o 9.341000  0.1142000     9.327000  0.1622000     9.354000  0.1608000     -0.2751000E-01 0.2284000 
1 1 1 5  16 5  o 5.894000  0.1198000     6.027000  0.1691000     5.762000  0.1699000     0.2649000      0.2397000 
1 1 1 5  16 6  o 5.523000  0.1294000     5.444000  0.1828000     5.602000  0.1833000     -0.1581000     0.2589000 
1 1 1 5  16 7  o 5.037000  0.1396000     5.287000  0.1893000     4.787000  0.2052000     0.4999000      0.2792000 
1 1 1 5  16 8  o 11.28000  0.1907000     11.28000  0.1907000     ?         ?             ?              ?         
1 1 1 5  16 9  o 3.725000  0.1839000     3.908000  0.2518000     3.542000  0.2681000     0.3659000      0.3679000 
1 1 1 5  16 10 o 1.960000  0.3947000     1.976000  0.5064000     1.945000  0.6056000     0.3082000E-01  0.7895000 
1 1 1 5  16 11 o 4.805000  0.2302000     4.408000  0.3392000     5.203000  0.3114000     -0.7954000     0.4605000 
1 1 1 5  16 12 o 3.816000  0.3034000     3.728000  0.4493000     3.904000  0.4078000     -0.1760000     0.6068000 
1 1 1 5  16 13 o 15.03000  0.1994000     15.28000  0.3014000     14.79000  0.2611000     0.4922000      0.3988000 
1 1 1 5  16 14 o 11.50000  0.3622000     10.74000  0.2990000     12.25000  0.6599000     -1.509000      0.7244000 
1 1 1 5  16 15 o 2.076000  0.5302000     1.938000  0.7342000     2.214000  0.7651000     -0.2760000     1.060000  
1 1 1 5  16 16 o 8.655000  0.2305000     8.702000  0.3311000     8.608000  0.3206000     0.9437000E-01  0.4609000 
1 1 1 5  16 17 o 5.865000  0.3233000     5.866000  0.4526000     5.864000  0.4619000     0.1838000E-02  0.6467000 
1 1 1 5  16 18 o 2.233000  0.5528000     1.498000  0.6934000     2.969000  0.8612000     -1.470000      1.106000  
1 1 1 5  16 19 o 4.127000  0.6446000     5.063000  0.5934000     3.191000  1.145000      1.871000       1.289000  
1 1 1 5  16 20 o 2.931000  0.6813000     1.876000  0.8593000     3.987000  1.057000      -2.111000      1.363000  
1 1 1 5  16 21 o 3.450000  0.6350000     3.250000  0.9148000     3.650000  0.8809000     -0.4006000     1.270000  
1 1 1 5  16 22 o 1.615000  0.5272000     1.633000  0.7530000     1.597000  0.7382000     0.3589000E-01  1.054000  
1 1 1 5  16 23 o 2.203000  0.5469000     2.615000  0.8048000     1.792000  0.7407000     0.8238000      1.094000  
1 1 1 5  16 24 o 1.733000  0.5433000     1.525000  0.6997000     1.941000  0.8313000     -0.4164000     1.087000  
1 1 1 5  16 25 o 1.476000  0.4727000     1.654000  0.7169000     1.299000  0.6163000     0.3549000      0.9454000 
1 1 1 5  16 26 o 1.504000  0.4683000     1.843000  0.7448000     1.166000  0.5677000     0.6778000      0.9365000 
1 1 1 5  16 27 o 0.9342000 0.3360000     0.8976000 0.4580000     0.9708000 0.4916000     -0.7324000E-01 0.6719000 
1 1 1 5  17 0  o 18.28000  0.2239000     18.28000  0.2239000     18.28000  0.2239000     -0.000000      0.000000  
1 1 1 5  17 1  o 26.50000  0.2149000     26.05000  0.2995000     26.95000  0.3083000     -0.8959000     0.4299000 
1 1 1 5  17 2  o 20.22000  0.1716000     20.32000  0.2438000     20.12000  0.2415000     0.1950000      0.3432000 
1 1 1 5  17 3  o 1.444000  0.2868000     1.440000  0.4050000     1.449000  0.4064000     -0.9584000E-02 0.5737000 
1 1 1 5  17 4  o 12.59000  0.1284000     12.73000  0.1834000     12.45000  0.1799000     0.2830000      0.2569000 
1 1 1 5  17 5  o 9.699000  0.1199000     9.686000  0.1690000     9.712000  0.1702000     -0.2598000E-01 0.2398000 
1 1 1 5  17 6  o 16.80000  0.1560000     16.93000  0.2219000     16.66000  0.2193000     0.2733000      0.3120000 
1 1 1 5  17 7  o 9.234000  0.1553000     9.170000  0.2530000     9.299000  0.1802000     -0.1296000     0.3106000 
1 1 1 5  17 8  o 6.556000  0.1961000     6.500000  0.2715000     6.611000  0.2832000     -0.1115000     0.3923000 
1 1 1 5  17 9  o 6.269000  0.1455000     6.385000  0.2008000     6.153000  0.2106000     0.2329000      0.2910000 
1 1 1 5  17 10 o 3.740000  0.2565000     4.069000  0.2778000     3.411000  0.4312000     0.6574000      0.5130000 
1 1 1 5  17 11 o 2.185000  0.4340000     2.168000  0.6354000     2.202000  0.5914000     -0.3380000E-01 0.8680000 
1 1 1 5  17 12 o 7.232000  0.2049000     7.381000  0.2938000     7.084000  0.2857000     0.2969000      0.4098000 
1 1 1 5  17 13 o 9.495000  0.1998000     9.275000  0.2962000     9.715000  0.2682000     -0.4401000     0.3995000 
1 1 1 5  17 14 o 8.612000  0.2466000     8.596000  0.3556000     8.628000  0.3419000     -0.3187000E-01 0.4933000 
1 1 1 5  17 15 o 12.27000  0.2038000     11.99000  0.2898000     12.56000  0.2865000     -0.5698000     0.4075000 
1 1 1 5  17 16 o 4.230000  0.3805000     4.429000  0.5119000     4.032000  0.5631000     0.3970000      0.7610000 
1 1 1 5  17 17 o 9.734000  0.2861000     9.388000  0.4663000     10.08000  0.3318000     -0.6916000     0.5723000 
1 1 1 5  17 18 o 4.363000  0.4835000     3.932000  0.7414000     4.795000  0.6210000     -0.8636000     0.9671000 
1 1 1 5  17 19 o 4.295000  0.7833000     4.377000  0.7411000     4.213000  1.380000      0.1646000      1.567000  
1 1 1 5  17 20 o 3.169000  0.5416000     2.131000  0.8402000     4.208000  0.6835000     -2.076000      1.083000  
1 1 1 5  17 21 o 2.216000  0.6238000     1.743000  0.7386000     2.689000  1.005000      -0.9456000     1.248000  
1 1 1 5  17 22 o 2.256000  0.5562000     2.937000  0.8439000     1.576000  0.7247000     1.361000       1.112000  
1 1 1 5  17 23 o 1.313000  0.4392000     1.410000  0.6520000     1.215000  0.5887000     0.1951000      0.8784000 
1 1 1 5  17 24 o 2.003000  0.5641000     2.495000  0.8742000     1.512000  0.7131000     0.9828000      1.128000  
1 1 1 5  17 25 o 2.408000  0.5281000     2.989000  0.7473000     1.826000  0.7464000     1.162000       1.056000  
1 1 1 5  17 26 o 1.227000  0.4179000     1.175000  0.5717000     1.279000  0.6097000     -0.1036000     0.8359000 
1 1 1 5  18 0  o 8.477000  0.1556000     8.477000  0.1556000     8.477000  0.1556000     0.000000       0.000000  
1 1 1 5  18 1  o 11.11000  0.1190000     11.33000  0.1694000     10.90000  0.1672000     0.4220000      0.2380000 
1 1 1 5  18 2  o 14.79000  0.1384000     14.89000  0.1965000     14.68000  0.1949000     0.2089000      0.2767000 
1 1 1 5  18 3  o 7.631000  0.1128000     7.638000  0.1580000     7.624000  0.1611000     0.1348000E-01  0.2257000 
1 1 1 5  18 4  o 13.62000  0.1349000     13.63000  0.1908000     13.61000  0.1907000     0.1959000E-01  0.2697000 
1 1 1 5  18 5  o 5.635000  0.1276000     5.715000  0.1812000     5.555000  0.1797000     0.1603000      0.2552000 
1 1 1 5  18 6  o 11.88000  0.1321000     11.79000  0.1861000     11.97000  0.1876000     -0.1773000     0.2642000 
1 1 1 5  18 7  o 15.72000  0.2185000     15.65000  0.3067000     15.79000  0.3113000     -0.1318000     0.4371000 
1 1 1 5  18 8  o 6.940000  0.1687000     6.918000  0.2767000     6.962000  0.1932000     -0.4429000E-01 0.3375000 
1 1 1 5  18 9  f 11.65000  0.1439000     11.60000  0.2030000     11.70000  0.2038000     -0.1072000     0.2877000 
1 1 1 5  18 10 o 5.425000  0.1975000     5.114000  0.2536000     5.736000  0.3028000     -0.6220000     0.3950000 
1 1 1 5  18 11 o 2.756000  0.3573000     2.605000  0.4621000     2.907000  0.5452000     -0.3014000     0.7147000 
1 1 1 5  18 12 o 6.126000  0.2235000     6.067000  0.3300000     6.184000  0.3014000     -0.1166000     0.4470000 
1 1 1 5  18 13 o 5.613000  0.2825000     5.919000  0.4056000     5.307000  0.3932000     0.6118000      0.5649000 
1 1 1 5  18 14 o 11.16000  0.3283000     10.62000  0.5939000     11.70000  0.2803000     -1.083000      0.6567000 
1 1 1 5  18 15 o 2.434000  0.5442000     2.185000  0.7579000     2.682000  0.7812000     -0.4965000     1.088000  
1 1 1 5  18 16 o 8.982000  0.2291000     8.697000  0.3276000     9.266000  0.3204000     -0.5690000     0.4582000 
1 1 1 5  18 17 o 12.17000  0.2306000     12.12000  0.3239000     12.21000  0.3284000     -0.9000000E-01 0.4613000 
1 1 1 5  18 18 o 2.068000  0.5937000     1.776000  0.7850000     2.360000  0.8909000     -0.5833000     1.187000  
1 1 1 5  18 19 o 4.195000  0.7139000     5.453000  0.5589000     2.937000  1.314000      2.515000       1.428000  
1 1 1 5  18 20 o 1.621000  0.5169000     1.449000  0.6830000     1.793000  0.7760000     -0.3437000     1.034000  
1 1 1 5  18 21 o 2.462000  0.5915000     2.545000  0.8442000     2.378000  0.8286000     0.1670000      1.183000  
1 1 1 5  18 22 o 1.932000  0.5455000     1.954000  0.7761000     1.911000  0.7669000     0.4297000E-01  1.091000  
1 1 1 5  18 23 o 1.608000  0.4862000     1.464000  0.6650000     1.752000  0.7094000     -0.2877000     0.9724000 
1 1 1 5  18 24 o 1.832000  0.5989000     1.367000  0.6309000     2.298000  1.018000      -0.9318000     1.198000  
1 1 1 5  18 25 o 1.170000  0.4022000     1.080000  0.5355000     1.260000  0.6002000     -0.1797000     0.8044000 
1 1 1 5  18 26 o 1.317000  0.4390000     1.395000  0.6453000     1.238000  0.5953000     0.1572000      0.8780000 
1 1 1 5  19 0  o 12.60000  0.1800000     12.60000  0.1800000     12.60000  0.1800000     -0.000000      0.000000  
1 1 1 5  19 1  f 11.96000  0.1243000     11.99000  0.1757000     11.92000  0.1758000     0.6586000E-01  0.2485000 
1 1 1 5  19 2  o 24.16000  0.2002000     23.98000  0.2814000     24.34000  0.2849000     -0.3648000     0.4004000 
1 1 1 5  19 3  o 7.642000  0.1160000     7.576000  0.1646000     7.709000  0.1634000     -0.1337000     0.2320000 
1 1 1 5  19 4  o 6.850000  0.1199000     6.909000  0.1680000     6.791000  0.1711000     0.1179000      0.2398000 
1 1 1 5  19 5  o 16.93000  0.1567000     17.04000  0.2227000     16.82000  0.2204000     0.2182000      0.3133000 
1 1 1 5  19 6  o 8.960000  0.1396000     9.094000  0.2128000     8.827000  0.1808000     0.2669000      0.2792000 
1 1 1 5  19 7  o 8.662000  0.2046000     8.662000  0.2046000     ?         ?             ?              ?         
1 1 1 5  19 8  o 13.03000  0.1448000     13.22000  0.2055000     12.83000  0.2040000     0.3815000      0.2895000 
1 1 1 5  19 9  o 10.35000  0.1422000     10.28000  0.1999000     10.42000  0.2022000     -0.1464000     0.2844000 
1 1 1 5  19 10 o 7.104000  0.1781000     7.246000  0.2207000     6.961000  0.2797000     0.2852000      0.3563000 
1 1 1 5  19 11 o 11.69000  0.1728000     11.41000  0.2186000     11.98000  0.2676000     -0.5684000     0.3455000 
1 1 1 5  19 12 o 13.85000  0.1977000     13.81000  0.3298000     13.90000  0.2181000     -0.8432000E-01 0.3954000 
1 1 1 5  19 13 o 13.92000  0.2681000     14.08000  0.3424000     13.77000  0.4125000     0.3108000      0.5361000 
1 1 1 5  19 14 o 4.287000  0.4936000     4.472000  0.8299000     4.103000  0.5348000     0.3684000      0.9873000 
1 1 1 5  19 15 o 12.61000  0.2052000     12.77000  0.2862000     12.45000  0.2940000     0.3255000      0.4103000 
1 1 1 5  19 16 o 8.935000  0.2367000     9.078000  0.3274000     8.793000  0.3419000     0.2852000      0.4734000 
1 1 1 5  19 17 o 3.187000  0.5570000     3.557000  0.7487000     2.817000  0.8250000     0.7400000      1.114000  
1 1 1 5  19 18 o 6.869000  0.3380000     7.061000  0.4875000     6.678000  0.4682000     0.3829000      0.6759000 
1 1 1 5  19 19 o 3.801000  0.6061000     3.470000  0.8765000     4.131000  0.8372000     -0.6608000     1.212000  
1 1 1 5  19 20 o 3.980000  0.4902000     3.965000  0.6907000     3.996000  0.6958000     -0.3033000E-01 0.9804000 
1 1 1 5  19 21 o 3.369000  0.5248000     3.347000  0.7418000     3.391000  0.7426000     -0.4357000E-01 1.050000  
1 1 1 5  19 22 o 1.639000  0.4933000     1.352000  0.6322000     1.925000  0.7574000     -0.5730000     0.9866000 
1 1 1 5  19 23 o 2.948000  0.4979000     2.512000  0.7616000     3.384000  0.6417000     -0.8722000     0.9959000 
1 1 1 5  19 24 o 1.561000  0.4952000     1.512000  0.6782000     1.610000  0.7217000     -0.9748000E-01 0.9903000 
1 1 1 5  19 25 o 1.711000  0.4962000     1.640000  0.6860000     1.782000  0.7170000     -0.1413000     0.9923000 
1 1 1 5  19 26 o 1.839000  0.5075000     1.589000  0.6868000     2.089000  0.7474000     -0.4998000     1.015000  
1 1 1 5  20 0  f 3.857000  0.2017000     3.857000  0.2017000     3.857000  0.2017000     0.000000       0.000000  
1 1 1 5  20 1  o 14.76000  0.1403000     14.67000  0.1973000     14.85000  0.1996000     -0.1799000     0.2806000 
1 1 1 5  20 2  f 16.06000  0.1483000     16.13000  0.2101000     15.98000  0.2094000     0.1543000      0.2967000 
1 1 1 5  20 3  o 21.81000  0.1857000     21.78000  0.2621000     21.84000  0.2631000     -0.6600000E-01 0.3714000 
1 1 1 5  20 4  o 6.505000  0.1235000     6.449000  0.1738000     6.561000  0.1756000     -0.1119000     0.2471000 
1 1 1 5  20 5  o 6.061000  0.1308000     6.047000  0.1849000     6.075000  0.1850000     -0.2810000E-01 0.2616000 
1 1 1 5  20 6  o 8.623000  0.2118000     8.844000  0.2536000     8.402000  0.3392000     0.4421000      0.4235000 
1 1 1 5  20 7  o 4.103000  0.2086000     4.099000  0.3401000     4.106000  0.2416000     -0.7881000E-02 0.4172000 
1 1 1 5  20 8  o 9.600000  0.1378000     9.527000  0.1960000     9.674000  0.1937000     -0.1462000     0.2755000 
1 1 1 5  20 9  o 4.539000  0.1889000     4.913000  0.2475000     4.166000  0.2854000     0.7474000      0.3778000 
1 1 1 5  20 10 o 7.367000  0.1743000     7.290000  0.2195000     7.444000  0.2709000     -0.1546000     0.3487000 
1 1 1 5  20 11 o 11.38000  0.1753000     11.46000  0.2197000     11.30000  0.2731000     0.1572000      0.3505000 
1 1 1 5  20 12 f 5.008000  0.2215000     5.158000  0.3069000     4.858000  0.3193000     0.3003000      0.4429000 
1 1 1 5  20 13 o 11.74000  0.2944000     11.74000  0.2944000     ?         ?             ?              ?         
1 1 1 5  20 14 o 5.446000  0.2843000     5.499000  0.3930000     5.392000  0.4110000     0.1068000      0.5687000 
1 1 1 5  20 15 o 2.166000  0.5336000     1.778000  0.7219000     2.555000  0.7859000     -0.7775000     1.067000  
1 1 1 5  20 16 o 4.216000  0.4288000     4.737000  0.5230000     3.696000  0.6796000     1.040000       0.8576000 
1 1 1 5  20 17 o 4.600000  0.4238000     4.508000  0.6111000     4.692000  0.5872000     -0.1840000     0.8475000 
1 1 1 5  20 18 o 2.095000  0.6047000     2.009000  0.8427000     2.180000  0.8674000     -0.1709000     1.209000  
1 1 1 5  20 19 o 3.634000  0.7482000     3.170000  1.297000      4.098000  0.7466000     -0.9277000     1.496000  
1 1 1 5  20 20 f 2.061000  0.5580000     2.554000  0.8573000     1.568000  0.7145000     0.9862000      1.116000  
1 1 1 5  20 21 o 2.226000  0.5466000     2.863000  0.8260000     1.588000  0.7160000     1.275000       1.093000  
1 1 1 5  20 22 o 2.122000  0.5443000     1.991000  0.7596000     2.252000  0.7799000     -0.2609000     1.089000  
1 1 1 5  20 23 o 1.580000  0.4726000     1.202000  0.5735000     1.957000  0.7512000     -0.7543000     0.9451000 
1 1 1 5  20 24 o 1.598000  0.5315000     1.668000  0.8164000     1.528000  0.6809000     0.1402000      1.063000  
1 1 1 5  20 25 o 1.306000  0.4300000     1.241000  0.5863000     1.372000  0.6291000     -0.1308000     0.8600000 
1 1 1 5  20 26 o 1.533000  0.4711000     1.506000  0.6570000     1.559000  0.6754000     -0.5314000E-01 0.9422000 
1 1 1 5  21 0  o 4.592000  0.1888000     4.592000  0.1888000     4.592000  0.1888000     0.000000       0.000000  
1 1 1 5  21 1  o 9.129000  0.1189000     9.311000  0.1689000     8.946000  0.1673000     0.3653000      0.2377000 
1 1 1 5  21 2  o 19.79000  0.1728000     19.80000  0.2442000     19.79000  0.2445000     0.7473000E-02  0.3455000 
1 1 1 5  21 3  o 14.06000  0.1394000     14.05000  0.1967000     14.07000  0.1975000     -0.2487000E-01 0.2788000 
1 1 1 5  21 4  o 9.291000  0.1246000     9.228000  0.1760000     9.354000  0.1765000     -0.1254000     0.2492000 
1 1 1 5  21 5  o 11.35000  0.1616000     11.15000  0.2635000     11.55000  0.1872000     -0.4055000     0.3233000 
1 1 1 5  21 6  o 8.048000  0.2605000     8.048000  0.2605000     ?         ?             ?              ?         
1 1 1 5  21 7  o 2.079000  0.3042000     2.375000  0.3774000     1.783000  0.4772000     0.5913000      0.6084000 
1 1 1 5  21 8  f 8.634000  0.1408000     8.941000  0.1978000     8.328000  0.2005000     0.6124000      0.2816000 
1 1 1 5  21 9  o 10.11000  0.1448000     9.960000  0.2031000     10.25000  0.2066000     -0.2944000     0.2897000 
1 1 1 5  21 10 o 11.91000  0.1697000     11.76000  0.2155000     12.06000  0.2622000     -0.3066000     0.3394000 
1 1 1 5  21 11 o 7.993000  0.1828000     7.787000  0.2281000     8.200000  0.2857000     -0.4132000     0.3656000 
1 1 1 5  21 12 o 10.47000  0.1720000     10.45000  0.2533000     10.48000  0.2328000     -0.2611000E-01 0.3440000 
1 1 1 5  21 13 o 15.60000  0.2589000     15.61000  0.3580000     15.59000  0.3742000     0.2006000E-01  0.5178000 
1 1 1 5  21 14 o 10.06000  0.2085000     9.849000  0.2958000     10.28000  0.2939000     -0.4268000     0.4170000 
1 1 1 5  21 15 o 1.269000  0.4229000     1.303000  0.6039000     1.234000  0.5923000     0.6903000E-01  0.8459000 
1 1 1 5  21 16 o 12.85000  0.2168000     13.00000  0.3063000     12.69000  0.3069000     0.3071000      0.4336000 
1 1 1 5  21 17 o 2.605000  0.5998000     2.165000  0.8317000     3.045000  0.8644000     -0.8807000     1.200000  
1 1 1 5  21 18 o 3.160000  0.6486000     2.834000  0.9336000     3.487000  0.9007000     -0.6532000     1.297000  
1 1 1 5  21 19 o 8.714000  0.4247000     7.968000  0.7574000     9.461000  0.3845000     -1.493000      0.8494000 
1 1 1 5  21 20 o 1.773000  0.5439000     1.792000  0.7740000     1.755000  0.7644000     0.3698000E-01  1.088000  
1 1 1 5  21 21 o 1.776000  0.5286000     1.628000  0.7181000     1.925000  0.7758000     -0.2969000     1.057000  
1 1 1 5  21 22 o 1.786000  0.4946000     1.282000  0.6086000     2.290000  0.7799000     -1.008000      0.9893000 
1 1 1 5  21 23 o 3.051000  0.5066000     3.214000  0.6894000     2.887000  0.7426000     0.3270000      1.013000  
1 1 1 5  21 24 o 1.414000  0.5063000     1.802000  0.8765000     1.026000  0.5071000     0.7765000      1.013000  
1 1 1 5  21 25 o 1.720000  0.4921000     1.541000  0.6623000     1.900000  0.7279000     -0.3583000     0.9841000 
1 1 1 5  21 26 o 1.184000  0.3997000     1.060000  0.5231000     1.307000  0.6044000     -0.2463000     0.7993000 
1 1 1 5  22 0  o 11.69000  0.1810000     11.69000  0.1810000     11.69000  0.1810000     0.000000       0.000000  
1 1 1 5  22 1  o 7.899000  0.1197000     7.915000  0.1689000     7.883000  0.1697000     0.3202000E-01  0.2394000 
1 1 1 5  22 2  o 13.89000  0.1392000     13.89000  0.1971000     13.88000  0.1967000     0.1071000E-01  0.2784000 
1 1 1 5  22 3  o 6.092000  0.1292000     6.038000  0.1843000     6.147000  0.1813000     -0.1091000     0.2585000 
1 1 1 5  22 4  o 15.33000  0.1620000     15.19000  0.2452000     15.47000  0.2119000     -0.2817000     0.3241000 
1 1 1 5  22 5  o 6.609000  0.2141000     6.609000  0.2141000     ?         ?             ?              ?         
1 1 1 5  22 6  o 5.444000  0.1685000     5.581000  0.2603000     5.307000  0.2140000     0.2743000      0.3370000 
1 1 1 5  22 7  o 5.774000  0.1492000     5.655000  0.2102000     5.894000  0.2119000     -0.2382000     0.2985000 
1 1 1 5  22 8  o 5.701000  0.1607000     5.674000  0.2275000     5.727000  0.2270000     -0.5246000E-01 0.3214000 
1 1 1 5  22 9  o 4.730000  0.1862000     4.697000  0.2597000     4.763000  0.2669000     -0.6665000E-01 0.3725000 
1 1 1 5  22 10 o 6.600000  0.1900000     6.500000  0.2422000     6.700000  0.2928000     -0.2001000     0.3800000 
1 1 1 5  22 11 o 13.10000  0.1791000     12.95000  0.2275000     13.24000  0.2768000     -0.2833000     0.3583000 
1 1 1 5  22 12 o 14.58000  0.2470000     14.46000  0.4299000     14.69000  0.2434000     -0.2328000     0.4941000 
1 1 1 5  22 13 o 4.559000  0.3218000     5.267000  0.4755000     3.852000  0.4338000     1.415000       0.6436000 
1 1 1 5  22 14 o 9.513000  0.2117000     9.444000  0.2970000     9.582000  0.3018000     -0.1376000     0.4234000 
1 1 1 5  22 15 o 6.397000  0.2763000     6.328000  0.3898000     6.467000  0.3915000     -0.1388000     0.5525000 
1 1 1 5  22 16 o 4.647000  0.3954000     4.707000  0.5356000     4.587000  0.5818000     0.1197000      0.7908000 
1 1 1 5  22 17 o 1.754000  0.5428000     1.486000  0.6932000     2.022000  0.8355000     -0.5358000     1.086000  
1 1 1 5  22 18 o 2.819000  0.7472000     2.873000  0.9424000     2.766000  1.160000      0.1078000      1.494000  
1 1 1 5  22 19 o 3.100000  0.6086000     3.559000  0.8200000     2.642000  0.8997000     0.9171000      1.217000  
1 1 1 5  22 20 o 5.029000  0.3960000     5.330000  0.5254000     4.729000  0.5928000     0.6018000      0.7921000 
1 1 1 5  22 21 o 4.067000  0.4490000     4.265000  0.6106000     3.869000  0.6584000     0.3961000      0.8979000 
1 1 1 5  22 22 o 3.755000  0.4449000     4.157000  0.5643000     3.353000  0.6879000     0.8044000      0.8897000 
1 1 1 5  22 23 o 1.310000  0.4369000     1.401000  0.6457000     1.219000  0.5887000     0.1818000      0.8738000 
1 1 1 5  22 24 o 2.033000  0.5851000     2.399000  0.9463000     1.668000  0.6885000     0.7319000      1.170000  
1 1 1 5  22 25 o 1.955000  0.5165000     1.923000  0.7264000     1.987000  0.7344000     -0.6424000E-01 1.033000  
1 1 1 5  22 26 o 1.097000  0.3768000     1.046000  0.5129000     1.147000  0.5520000     -0.1009000     0.7536000 
1 1 1 5  23 0  o 9.951000  0.1768000     9.951000  0.1768000     9.951000  0.1768000     0.000000       0.000000  
1 1 1 5  23 1  o 4.243000  0.1488000     4.192000  0.2096000     4.295000  0.2112000     -0.1027000     0.2976000 
1 1 1 5  23 2  o 14.49000  0.1438000     14.54000  0.2035000     14.44000  0.2032000     0.9498000E-01  0.2876000 
1 1 1 5  23 3  o 10.15000  0.1389000     10.22000  0.2115000     10.09000  0.1801000     0.1291000      0.2778000 
1 1 1 5  23 4  o 9.225000  0.2605000     9.225000  0.2605000     ?         ?             ?              ?         
1 1 1 5  23 5  o 13.29000  0.1731000     13.10000  0.2805000     13.48000  0.2029000     -0.3748000     0.3462000 
1 1 1 5  23 6  o 3.980000  0.1820000     4.212000  0.2487000     3.749000  0.2656000     0.4637000      0.3639000 
1 1 1 5  23 7  o 7.377000  0.1445000     7.348000  0.2017000     7.406000  0.2069000     -0.5811000E-01 0.2889000 
1 1 1 5  23 8  o 1.558000  0.3417000     1.074000  0.4714000     2.041000  0.4949000     -0.9674000     0.6835000 
1 1 1 5  23 9  o 7.872000  0.1536000     7.700000  0.2144000     8.044000  0.2201000     -0.3435000     0.3073000 
1 1 1 5  23 10 f 12.73000  0.1886000     12.64000  0.2658000     12.81000  0.2676000     -0.1688000     0.3772000 
1 1 1 5  23 11 o 5.470000  0.2257000     5.022000  0.3013000     5.917000  0.3361000     -0.8952000     0.4514000 
1 1 1 5  23 12 o 14.83000  0.2824000     14.65000  0.4421000     15.01000  0.3515000     -0.3605000     0.5648000 
1 1 1 5  23 13 o 4.353000  0.2977000     3.872000  0.4726000     4.833000  0.3623000     -0.9612000     0.5954000 
1 1 1 5  23 14 o 13.00000  0.1976000     12.67000  0.3126000     13.33000  0.2417000     -0.6657000     0.3951000 
1 1 1 5  23 15 o 10.38000  0.2186000     10.74000  0.3035000     10.03000  0.3147000     0.7188000      0.4372000 
1 1 1 5  23 16 o 5.927000  0.3178000     5.920000  0.4393000     5.934000  0.4592000     -0.1415000E-01 0.6355000 
1 1 1 5  23 17 o 5.693000  0.3730000     5.310000  0.5516000     6.076000  0.5023000     -0.7654000     0.7460000 
1 1 1 5  23 18 o 5.144000  0.8737000     5.389000  0.5643000     4.900000  1.654000      0.4890000      1.747000  
1 1 1 5  23 19 o 1.665000  0.5202000     1.967000  0.8085000     1.363000  0.6548000     0.6041000      1.040000  
1 1 1 5  23 20 o 2.010000  0.5763000     1.947000  0.7984000     2.073000  0.8314000     -0.1260000     1.153000  
1 1 1 5  23 21 o 1.823000  0.5383000     1.795000  0.7552000     1.851000  0.7672000     -0.5596000E-01 1.077000  
1 1 1 5  23 22 o 2.680000  0.5595000     2.830000  0.7882000     2.530000  0.7942000     0.3007000      1.119000  
1 1 1 5  23 23 o 2.167000  0.6595000     1.532000  0.6886000     2.802000  1.125000      -1.270000      1.319000  
1 1 1 5  23 24 o 1.539000  0.4676000     1.315000  0.6079000     1.763000  0.7108000     -0.4486000     0.9353000 
1 1 1 5  23 25 o 1.495000  0.4590000     1.250000  0.5847000     1.740000  0.7077000     -0.4900000     0.9180000 
1 1 1 5  23 26 o 1.196000  0.4014000     1.150000  0.5487000     1.243000  0.5860000     -0.9300000E-01 0.8028000 
1 1 1 5  24 0  o 4.389000  0.2157000     4.389000  0.2157000     4.389000  0.2157000     0.000000       0.000000  
1 1 1 5  24 1  o 4.914000  0.1426000     4.822000  0.2033000     5.005000  0.2001000     -0.1826000     0.2852000 
1 1 1 5  24 2  o 5.928000  0.1736000     5.729000  0.2693000     6.128000  0.2190000     -0.3986000     0.3471000 
1 1 1 5  24 3  o 14.41000  0.4046000     14.41000  0.4046000     ?         ?             ?              ?         
1 1 1 5  24 4  o 5.184000  0.1833000     5.171000  0.2975000     5.198000  0.2143000     -0.2651000E-01 0.3667000 
1 1 1 5  24 5  o 7.097000  0.1377000     7.051000  0.1960000     7.144000  0.1934000     -0.9234000E-01 0.2754000 
1 1 1 5  24 6  o 9.771000  0.1368000     9.914000  0.1937000     9.628000  0.1931000     0.2854000      0.2735000 
1 1 1 5  24 7  o 14.98000  0.1574000     15.01000  0.2228000     14.95000  0.2223000     0.6569000E-01  0.3148000 
1 1 1 5  24 8  o 10.48000  0.1471000     10.21000  0.2068000     10.74000  0.2094000     -0.5325000     0.2943000 
1 1 1 5  24 9  f 3.691000  0.2626000     3.452000  0.3596000     3.931000  0.3829000     -0.4790000     0.5252000 
1 1 1 5  24 10 o 6.162000  0.2010000     5.959000  0.2544000     6.366000  0.3112000     -0.4074000     0.4020000 
1 1 1 5  24 11 o 5.772000  0.2207000     5.802000  0.2762000     5.741000  0.3444000     0.6080000E-01  0.4415000 
1 1 1 5  24 12 o 7.129000  0.2910000     7.129000  0.2910000     ?         ?             ?              ?         
1 1 1 5  24 13 o 9.480000  0.1881000     9.563000  0.2763000     9.396000  0.2553000     0.1672000      0.3762000 
1 1 1 5  24 14 o 1.769000  0.4767000     1.792000  0.6715000     1.746000  0.6768000     0.4639000E-01  0.9534000 
1 1 1 5  24 15 o 8.665000  0.2399000     8.821000  0.3325000     8.510000  0.3460000     0.3109000      0.4799000 
1 1 1 5  24 16 o 2.258000  0.5666000     2.537000  0.8015000     1.978000  0.8009000     0.5585000      1.133000  
1 1 1 5  24 17 o 7.105000  0.3223000     6.357000  0.4882000     7.853000  0.4208000     -1.496000      0.6445000 
1 1 1 5  24 18 o 2.581000  0.6252000     1.867000  0.8113000     3.294000  0.9515000     -1.427000      1.250000  
1 1 1 5  24 19 o 3.333000  0.5535000     4.013000  0.6932000     2.653000  0.8630000     1.360000       1.107000  
1 1 1 5  24 20 o 2.550000  0.5829000     2.231000  0.8307000     2.870000  0.8180000     -0.6388000     1.166000  
1 1 1 5  24 21 o 1.680000  0.5069000     1.401000  0.6528000     1.958000  0.7756000     -0.5577000     1.014000  
1 1 1 5  24 22 o 1.445000  0.4663000     1.655000  0.7186000     1.236000  0.5944000     0.4188000      0.9325000 
1 1 1 5  24 23 o 1.509000  0.4994000     1.562000  0.6825000     1.456000  0.7292000     0.1061000      0.9988000 
1 1 1 5  24 24 o 1.184000  0.3998000     1.268000  0.5942000     1.099000  0.5349000     0.1694000      0.7996000 
1 1 1 5  24 25 o 1.678000  0.4882000     1.756000  0.7050000     1.601000  0.6756000     0.1558000      0.9764000 
1 1 1 5  25 0  o 3.661000  0.5614000     3.661000  0.5614000     3.661000  0.5614000     0.000000       0.000000  
1 1 1 5  25 2  o 9.497000  0.2280000     9.500000  0.2582000     9.495000  0.3760000     0.5295000E-02  0.4561000 
1 1 1 5  25 3  o 7.215000  0.1616000     7.208000  0.2635000     7.221000  0.1873000     -0.1295000E-01 0.3232000 
1 1 1 5  25 4  o 8.872000  0.1329000     8.754000  0.1876000     8.991000  0.1884000     -0.2368000     0.2659000 
1 1 1 5  25 5  o 10.31000  0.1377000     10.38000  0.1941000     10.24000  0.1952000     0.1383000      0.2753000 
1 1 1 5  25 6  o 4.671000  0.1743000     4.639000  0.2503000     4.703000  0.2428000     -0.6440000E-01 0.3487000 
1 1 1 5  25 7  o 2.609000  0.2915000     2.319000  0.4574000     2.900000  0.3616000     -0.5820000     0.5831000 
1 1 1 5  25 8  o 7.833000  0.1520000     7.873000  0.2122000     7.793000  0.2178000     0.8012000E-01  0.3040000 
1 1 1 5  25 9  o 12.66000  0.1724000     12.26000  0.2180000     13.05000  0.2671000     -0.7859000     0.3448000 
1 1 1 5  25 10 o 8.083000  0.1812000     7.852000  0.2287000     8.315000  0.2812000     -0.4630000     0.3624000 
1 1 1 5  25 11 o 3.760000  0.3653000     3.558000  0.5787000     3.962000  0.4459000     -0.4039000     0.7306000 
1 1 1 5  25 12 o 15.57000  0.2203000     15.98000  0.3615000     15.17000  0.2521000     0.8118000      0.4407000 
1 1 1 5  25 13 o 12.13000  0.1850000     12.17000  0.2738000     12.09000  0.2489000     0.7699000E-01  0.3700000 
1 1 1 5  25 14 o 6.209000  0.2285000     6.252000  0.3216000     6.165000  0.3247000     0.8710000E-01  0.4570000 
1 1 1 5  25 15 o 5.558000  0.2928000     5.569000  0.4631000     5.546000  0.3584000     0.2292000E-01  0.5856000 
1 1 1 5  25 16 o 5.157000  0.3757000     5.058000  0.5316000     5.256000  0.5309000     -0.1976000     0.7513000 
1 1 1 5  25 17 o 6.588000  0.3435000     7.030000  0.4723000     6.146000  0.4988000     0.8838000      0.6869000 
1 1 1 5  25 18 o 2.755000  0.7633000     3.065000  1.244000      2.445000  0.8848000     0.6193000      1.527000  
1 1 1 5  25 19 f 1.796000  0.5424000     1.557000  0.7144000     2.035000  0.8164000     -0.4781000     1.085000  
1 1 1 5  25 20 o 3.371000  0.5159000     3.341000  0.7389000     3.400000  0.7202000     -0.5964000E-01 1.032000  
1 1 1 5  25 21 o 1.908000  0.5446000     1.786000  0.7526000     2.030000  0.7873000     -0.2436000     1.089000  
1 1 1 5  25 22 o 1.899000  0.5237000     1.526000  0.6863000     2.272000  0.7912000     -0.7461000     1.047000  
1 1 1 5  25 23 o 2.529000  0.6340000     2.841000  0.8009000     2.218000  0.9831000     0.6233000      1.268000  
1 1 1 5  25 24 o 1.162000  0.3956000     0.9885000 0.4933000     1.335000  0.6185000     -0.3464000     0.7912000 
1 1 1 5  25 25 o 2.159000  0.5269000     2.399000  0.7633000     1.918000  0.7265000     0.4805000      1.054000  
1 1 1 5  26 0  o 0.8071000 0.5121000     0.8071000 0.5121000     0.8071000 0.5121000     0.000000       0.000000  
1 1 1 5  26 1  f 16.95000  0.1970000     17.24000  0.3233000     16.65000  0.2252000     0.5933000      0.3940000 
1 1 1 5  26 2  f 15.25000  0.1522000     15.29000  0.2157000     15.21000  0.2148000     0.7808000E-01  0.3044000 
1 1 1 5  26 3  o 7.280000  0.1346000     7.433000  0.1896000     7.126000  0.1912000     0.3066000      0.2693000 
1 1 1 5  26 4  o 1.249000  0.3411000     1.147000  0.4727000     1.350000  0.4918000     -0.2027000     0.6822000 
1 1 1 5  26 5  o 14.04000  0.1513000     14.20000  0.2148000     13.88000  0.2132000     0.3231000      0.3027000 
1 1 1 5  26 6  o 9.962000  0.1426000     9.822000  0.2019000     10.10000  0.2014000     -0.2806000     0.2852000 
1 1 1 5  26 7  o 9.126000  0.1548000     9.025000  0.2331000     9.228000  0.2038000     -0.2032000     0.3096000 
1 1 1 5  26 8  o 13.93000  0.1581000     13.69000  0.2218000     14.17000  0.2254000     -0.4829000     0.3162000 
1 1 1 5  26 9  o 9.853000  0.1709000     9.819000  0.2175000     9.888000  0.2637000     -0.6972000E-01 0.3418000 
1 1 1 5  26 10 o 15.62000  0.1884000     15.42000  0.2413000     15.82000  0.2893000     -0.4013000     0.3767000 
1 1 1 5  26 11 o 19.06000  0.3097000     19.06000  0.3097000     ?         ?             ?              ?         
1 1 1 5  26 12 o 3.832000  0.3085000     3.898000  0.4502000     3.767000  0.4220000     0.1307000      0.6171000 
1 1 1 5  26 13 o 9.438000  0.1900000     9.643000  0.2745000     9.233000  0.2626000     0.4101000      0.3799000 
1 1 1 5  26 14 o 1.631000  0.4600000     1.847000  0.6842000     1.415000  0.6151000     0.4320000      0.9201000 
1 1 1 5  26 15 o 10.88000  0.1943000     10.64000  0.2767000     11.11000  0.2728000     -0.4733000     0.3885000 
1 1 1 5  26 16 o 7.422000  0.2871000     7.743000  0.3836000     7.100000  0.4273000     0.6433000      0.5743000 
1 1 1 5  26 17 o 3.443000  0.7084000     2.941000  0.8910000     3.945000  1.102000      -1.004000      1.417000  
1 1 1 5  26 18 o 7.214000  0.3881000     7.759000  0.6210000     6.670000  0.4658000     1.090000       0.7763000 
1 1 1 5  26 19 o 2.209000  0.5788000     2.596000  0.8545000     1.821000  0.7810000     0.7756000      1.158000  
1 1 1 5  26 20 o 3.821000  0.4511000     3.880000  0.6442000     3.761000  0.6316000     0.1194000      0.9021000 
1 1 1 5  26 21 o 4.957000  0.3533000     4.786000  0.5006000     5.128000  0.4987000     -0.3423000     0.7066000 
1 1 1 5  26 22 o 1.754000  0.4901000     1.220000  0.5868000     2.289000  0.7851000     -1.069000      0.9802000 
1 1 1 5  26 23 o 1.837000  0.5926000     1.933000  0.9166000     1.742000  0.7513000     0.1911000      1.185000  
1 1 1 5  26 24 o 1.247000  0.4169000     1.231000  0.5852000     1.263000  0.5941000     -0.3184000E-01 0.8339000 
1 1 1 5  26 25 o 1.538000  0.4713000     1.292000  0.6065000     1.784000  0.7217000     -0.4917000     0.9427000 
1 1 1 5  27 0  o 2.408000  0.3965000     2.408000  0.3965000     2.408000  0.3965000     0.000000       0.000000  
1 1 1 5  27 1  o 8.216000  0.1326000     8.018000  0.1869000     8.414000  0.1882000     -0.3961000     0.2652000 
1 1 1 5  27 2  o 0.8428000 0.2800000     0.8156000 0.3882000     0.8700000 0.4035000     -0.5434000E-01 0.5599000 
1 1 1 5  27 3  o 9.659000  0.1365000     9.372000  0.1930000     9.947000  0.1931000     -0.5755000     0.2730000 
1 1 1 5  27 4  o 9.151000  0.1384000     9.000000  0.1951000     9.301000  0.1964000     -0.3015000     0.2768000 
1 1 1 5  27 5  o 12.04000  0.1457000     11.94000  0.2045000     12.14000  0.2077000     -0.1970000     0.2914000 
1 1 1 5  27 6  o 8.456000  0.1467000     8.344000  0.2105000     8.568000  0.2043000     -0.2248000     0.2934000 
1 1 1 5  27 7  o 14.81000  0.1604000     14.76000  0.2273000     14.87000  0.2262000     -0.1100000     0.3207000 
1 1 1 5  27 8  o 3.330000  0.2681000     3.050000  0.4020000     3.611000  0.3547000     -0.5608000     0.5361000 
1 1 1 5  27 9  o 5.562000  0.2160000     5.753000  0.2604000     5.372000  0.3448000     0.3818000      0.4320000 
1 1 1 5  27 10 o 2.606000  0.4623000     2.566000  0.6892000     2.647000  0.6163000     -0.8097000E-01 0.9246000 
1 1 1 5  27 11 o 8.808000  0.2533000     8.037000  0.3534000     9.579000  0.3631000     -1.542000      0.5066000 
1 1 1 5  27 12 o 3.642000  0.3283000     3.823000  0.4660000     3.460000  0.4624000     0.3627000      0.6565000 
1 1 1 5  27 13 o 8.939000  0.1933000     8.703000  0.2839000     9.176000  0.2625000     -0.4725000     0.3867000 
1 1 1 5  27 14 o 3.529000  0.3801000     3.703000  0.5123000     3.356000  0.5617000     0.3470000      0.7602000 
1 1 1 5  27 15 o 6.735000  0.2438000     6.961000  0.3376000     6.510000  0.3519000     0.4510000      0.4877000 
1 1 1 5  27 16 o 1.825000  0.5504000     1.996000  0.8110000     1.655000  0.7445000     0.3405000      1.101000  
1 1 1 5  27 17 o 4.833000  0.9109000     3.920000  0.7183000     5.745000  1.674000      -1.824000      1.822000  
1 1 1 5  27 18 o 2.213000  0.5959000     2.132000  0.8254000     2.294000  0.8597000     -0.1618000     1.192000  
1 1 1 5  27 19 o 2.239000  0.5687000     2.664000  0.8340000     1.813000  0.7732000     0.8509000      1.137000  
1 1 1 5  27 20 o 2.683000  0.5445000     2.416000  0.7958000     2.950000  0.7434000     -0.5342000     1.089000  
1 1 1 5  27 21 o 1.389000  0.4494000     0.9970000 0.4990000     1.781000  0.7476000     -0.7843000     0.8988000 
1 1 1 5  27 22 o 2.091000  0.5582000     2.468000  0.8274000     1.714000  0.7496000     0.7542000      1.116000  
1 1 1 5  27 23 o 1.476000  0.4842000     1.373000  0.6794000     1.579000  0.6902000     -0.2056000     0.9685000 
1 1 1 5  27 24 o 1.784000  0.5025000     1.555000  0.6763000     2.013000  0.7432000     -0.4581000     1.005000  
1 1 1 5  27 25 o 1.122000  0.3849000     1.083000  0.5303000     1.160000  0.5579000     -0.7758000E-01 0.7697000 
1 1 1 5  28 0  o 3.475000  0.2901000     3.475000  0.2901000     3.475000  0.2901000     0.000000       0.000000  
1 1 1 5  28 1  o 5.550000  0.1539000     5.654000  0.2151000     5.445000  0.2201000     0.2091000      0.3077000 
1 1 1 5  28 2  o 5.794000  0.1543000     6.204000  0.2102000     5.385000  0.2261000     0.8186000      0.3087000 
1 1 1 5  28 3  o 5.375000  0.1614000     5.389000  0.2300000     5.361000  0.2265000     0.2865000E-01  0.3228000 
1 1 1 5  28 4  f 9.818000  0.1532000     9.703000  0.2006000     9.934000  0.2317000     -0.2318000     0.3065000 
1 1 1 5  28 5  o 4.095000  0.2050000     3.961000  0.2954000     4.230000  0.2843000     -0.2694000     0.4100000 
1 1 1 5  28 6  o 2.488000  0.3169000     2.337000  0.4836000     2.639000  0.4097000     -0.3028000     0.6338000 
1 1 1 5  28 7  o 4.131000  0.2094000     4.294000  0.2905000     3.967000  0.3016000     0.3279000      0.4188000 
1 1 1 5  28 8  o 12.22000  0.1561000     12.07000  0.2193000     12.37000  0.2223000     -0.3019000     0.3123000 
1 1 1 5  28 9  o 6.151000  0.2068000     6.279000  0.2567000     6.023000  0.3243000     0.2557000      0.4136000 
1 1 1 5  28 10 o 19.63000  0.3879000     19.63000  0.3879000     ?         ?             ?              ?         
1 1 1 5  28 11 o 17.54000  0.2280000     17.56000  0.3702000     17.52000  0.2660000     0.3794000E-01  0.4559000 
1 1 1 5  28 12 o 8.444000  0.1931000     8.356000  0.2828000     8.531000  0.2629000     -0.1754000     0.3862000 
1 1 1 5  28 13 f 11.37000  0.1878000     11.70000  0.2748000     11.05000  0.2561000     0.6523000      0.3756000 
1 1 1 5  28 14 o 10.82000  0.1895000     10.37000  0.2700000     11.26000  0.2660000     -0.8890000     0.3790000 
1 1 1 5  28 15 o 10.11000  0.2026000     10.27000  0.2832000     9.960000  0.2898000     0.3103000      0.4052000 
1 1 1 5  28 16 o 9.396000  0.2210000     9.201000  0.3133000     9.591000  0.3119000     -0.3899000     0.4421000 
1 1 1 5  28 17 o 6.903000  0.3757000     7.286000  0.5182000     6.521000  0.5442000     0.7641000      0.7515000 
1 1 1 5  28 18 o 4.059000  0.4698000     4.041000  0.6548000     4.078000  0.6739000     -0.3746000E-01 0.9396000 
1 1 1 5  28 19 o 1.955000  0.5564000     2.085000  0.8088000     1.826000  0.7643000     0.2589000      1.113000  
1 1 1 5  28 20 o 1.515000  0.4771000     1.289000  0.6104000     1.740000  0.7335000     -0.4506000     0.9543000 
1 1 1 5  28 21 f 1.554000  0.4842000     1.377000  0.6401000     1.731000  0.7267000     -0.3540000     0.9685000 
1 1 1 5  28 22 o 1.588000  0.5527000     1.192000  0.5824000     1.983000  0.9396000     -0.7909000     1.105000  
1 1 1 5  28 23 f 2.165000  0.5299000     1.894000  0.7447000     2.436000  0.7541000     -0.5428000     1.060000  
1 1 1 5  28 24 o 1.412000  0.4494000     1.394000  0.6274000     1.431000  0.6437000     -0.3721000E-01 0.8989000 
1 1 1 5  28 25 o 1.215000  0.4089000     1.352000  0.6230000     1.078000  0.5298000     0.2741000      0.8178000 
1 1 1 5  29 0  o 16.48000  0.2297000     16.48000  0.2297000     16.48000  0.2297000     -0.000000      0.000000  
1 1 1 5  29 1  o 1.997000  0.3405000     2.352000  0.4449000     1.642000  0.5157000     0.7109000      0.6811000 
1 1 1 5  29 2  o 6.243000  0.1541000     6.018000  0.2214000     6.468000  0.2144000     -0.4505000     0.3081000 
1 1 1 5  29 3  o 13.63000  0.1507000     13.61000  0.2128000     13.65000  0.2135000     -0.4440000E-01 0.3014000 
1 1 1 5  29 4  o 12.19000  0.1467000     12.01000  0.2068000     12.37000  0.2082000     -0.3594000     0.2934000 
1 1 1 5  29 5  o 18.84000  0.1784000     18.73000  0.2514000     18.96000  0.2531000     -0.2272000     0.3567000 
1 1 1 5  29 6  o 16.48000  0.1682000     16.29000  0.2369000     16.67000  0.2389000     -0.3764000     0.3364000 
1 1 1 5  29 7  o 17.50000  0.1748000     17.45000  0.2467000     17.56000  0.2478000     -0.1113000     0.3497000 
1 1 1 5  29 8  o 8.798000  0.1571000     8.544000  0.2232000     9.052000  0.2212000     -0.5078000     0.3142000 
1 1 1 5  29 9  o 4.276000  0.3222000     3.926000  0.5140000     4.626000  0.3886000     -0.6999000     0.6444000 
1 1 1 5  29 10 o 20.38000  0.3924000     20.38000  0.3924000     ?         ?             ?              ?         
1 1 1 5  29 11 o 11.37000  0.1731000     11.45000  0.2427000     11.29000  0.2469000     0.1671000      0.3462000 
1 1 1 5  29 12 o 7.134000  0.2109000     7.150000  0.3074000     7.118000  0.2887000     0.3157000E-01  0.4218000 
1 1 1 5  29 13 o 12.29000  0.1882000     12.12000  0.2775000     12.46000  0.2544000     -0.3406000     0.3764000 
1 1 1 5  29 14 o 9.615000  0.1986000     9.866000  0.2808000     9.365000  0.2810000     0.5011000      0.3972000 
1 1 1 5  29 15 o 5.030000  0.3174000     4.953000  0.4622000     5.106000  0.4350000     -0.1521000     0.6347000 
1 1 1 5  29 16 o 3.224000  0.5701000     2.803000  0.9531000     3.644000  0.6260000     -0.8403000     1.140000  
1 1 1 5  29 17 o 4.275000  0.6671000     5.035000  1.077000      3.515000  0.7878000     1.520000       1.334000  
1 1 1 5  29 18 o 4.390000  0.4332000     4.683000  0.5694000     4.098000  0.6530000     0.5851000      0.8664000 
1 1 1 5  29 19 o 4.152000  0.4387000     3.998000  0.6573000     4.306000  0.5812000     -0.3076000     0.8774000 
1 1 1 5  29 20 o 2.274000  0.5448000     2.535000  0.7750000     2.014000  0.7659000     0.5212000      1.090000  
1 1 1 5  29 21 o 1.845000  0.5269000     1.788000  0.7320000     1.902000  0.7579000     -0.1141000     1.054000  
1 1 1 5  29 22 o 1.653000  0.5449000     1.556000  0.6858000     1.749000  0.8471000     -0.1924000     1.090000  
1 1 1 5  29 23 f 2.306000  0.5319000     1.856000  0.7492000     2.757000  0.7551000     -0.9010000     1.064000  
1 1 1 5  29 24 o 1.277000  0.4226000     1.328000  0.6099000     1.225000  0.5851000     0.1025000      0.8452000 
1 1 1 5  29 25 o 1.477000  0.4697000     1.250000  0.5986000     1.703000  0.7240000     -0.4527000     0.9394000 
1 1 1 5  30 0  o 13.49000  0.2130000     13.49000  0.2130000     13.49000  0.2130000     -0.000000      0.000000  
1 1 1 5  30 1  o 16.94000  0.1663000     16.98000  0.2358000     16.90000  0.2347000     0.7961000E-01  0.3327000 
1 1 1 5  30 2  o 1.913000  0.3602000     1.911000  0.5130000     1.914000  0.5057000     -0.2185000E-02 0.7204000 
1 1 1 5  30 3  o 9.663000  0.1439000     9.455000  0.2041000     9.871000  0.2028000     -0.4151000     0.2877000 
1 1 1 5  30 4  o 23.50000  0.2068000     23.45000  0.2923000     23.55000  0.2928000     -0.9329000E-01 0.4137000 
1 1 1 5  30 5  o 4.904000  0.1874000     5.386000  0.2451000     4.421000  0.2836000     0.9648000      0.3749000 
1 1 1 5  30 6  o 13.95000  0.1584000     13.83000  0.2226000     14.06000  0.2255000     -0.2300000     0.3168000 
1 1 1 5  30 7  o 13.43000  0.1592000     13.56000  0.2249000     13.31000  0.2254000     0.2463000      0.3184000 
1 1 1 5  30 8  o 7.048000  0.1707000     7.083000  0.2409000     7.014000  0.2418000     0.6880000E-01  0.3413000 
1 1 1 5  30 9  o 13.93000  0.3367000     13.93000  0.3367000     ?         ?             ?              ?         
1 1 1 5  30 10 o 17.37000  0.2398000     17.48000  0.3672000     17.26000  0.3085000     0.2176000      0.4796000 
1 1 1 5  30 11 o 2.654000  0.4224000     2.535000  0.6264000     2.773000  0.5667000     -0.2381000     0.8447000 
1 1 1 5  30 12 o 14.01000  0.1890000     13.80000  0.2787000     14.22000  0.2553000     -0.4217000     0.3780000 
1 1 1 5  30 13 o 8.969000  0.2032000     8.870000  0.3034000     9.069000  0.2705000     -0.1991000     0.4065000 
1 1 1 5  30 14 o 12.40000  0.1931000     12.54000  0.2705000     12.26000  0.2756000     0.2839000      0.3862000 
1 1 1 5  30 15 o 5.502000  0.2967000     5.527000  0.4197000     5.478000  0.4196000     0.4961000E-01  0.5935000 
1 1 1 5  30 16 o 1.827000  0.5775000     1.526000  0.7215000     2.127000  0.9019000     -0.6007000     1.155000  
1 1 1 5  30 17 o 1.429000  0.4619000     1.260000  0.6024000     1.598000  0.7002000     -0.3387000     0.9237000 
1 1 1 5  30 18 o 1.980000  0.5621000     2.040000  0.8035000     1.920000  0.7863000     0.1204000      1.124000  
1 1 1 5  30 19 o 2.011000  0.5490000     1.739000  0.7440000     2.283000  0.8076000     -0.5441000     1.098000  
1 1 1 5  30 20 o 2.759000  0.4837000     3.712000  0.6146000     1.806000  0.7472000     1.907000       0.9675000 
1 1 1 5  30 21 o 1.935000  0.5365000     1.958000  0.7575000     1.913000  0.7599000     0.4560000E-01  1.073000  
1 1 1 5  30 22 o 3.096000  0.5855000     3.425000  0.8127000     2.768000  0.8430000     0.6574000      1.171000  
1 1 1 5  30 23 o 1.209000  0.4078000     1.190000  0.5682000     1.227000  0.5851000     -0.3696000E-01 0.8156000 
1 1 1 5  30 24 o 2.243000  0.5229000     1.940000  0.7357000     2.546000  0.7432000     -0.6057000     1.046000  
1 1 1 5  31 0  o 12.94000  0.2115000     12.94000  0.2115000     12.94000  0.2115000     0.000000       0.000000  
1 1 1 5  31 1  o 16.04000  0.1627000     15.90000  0.2292000     16.18000  0.2309000     -0.2757000     0.3253000 
1 1 1 5  31 2  o 17.88000  0.1731000     17.85000  0.2447000     17.90000  0.2450000     -0.5058000E-01 0.3462000 
1 1 1 5  31 3  o 7.307000  0.1520000     7.138000  0.2169000     7.476000  0.2130000     -0.3382000     0.3040000 
1 1 1 5  31 4  o 9.557000  0.1474000     9.604000  0.2082000     9.510000  0.2086000     0.9373000E-01  0.2947000 
1 1 1 5  31 5  o 3.171000  0.2664000     2.930000  0.3999000     3.411000  0.3521000     -0.4810000     0.5328000 
1 1 1 5  31 6  o 12.29000  0.1552000     12.29000  0.2180000     12.29000  0.2209000     -0.2501000E-02 0.3103000 
1 1 1 5  31 7  o 7.552000  0.1636000     7.674000  0.2290000     7.430000  0.2337000     0.2441000      0.3272000 
1 1 1 5  31 8  o 1.750000  0.4247000     1.396000  0.6193000     2.105000  0.5813000     -0.7085000     0.8494000 
1 1 1 5  31 9  o 22.03000  0.4093000     22.03000  0.4093000     ?         ?             ?              ?         
1 1 1 5  31 10 f 5.695000  0.2402000     5.835000  0.2931000     5.555000  0.3806000     0.2795000      0.4804000 
1 1 1 5  31 11 o 16.54000  0.1854000     16.33000  0.2613000     16.74000  0.2630000     -0.4026000     0.3707000 
1 1 1 5  31 12 o 8.035000  0.2010000     7.827000  0.2956000     8.242000  0.2725000     -0.4149000     0.4020000 
1 1 1 5  31 13 o 3.188000  0.4340000     2.789000  0.6973000     3.587000  0.5169000     -0.7976000     0.8680000 
1 1 1 5  31 14 o 6.707000  0.2464000     6.331000  0.3653000     7.084000  0.3306000     -0.7535000     0.4927000 
1 1 1 5  31 15 o 3.976000  0.3975000     4.416000  0.4961000     3.536000  0.6211000     0.8799000      0.7950000 
1 1 1 5  31 16 o 6.392000  0.4068000     6.392000  0.4068000     ?         ?             ?              ?         
1 1 1 5  31 17 o 5.214000  0.3174000     5.061000  0.4591000     5.367000  0.4383000     -0.3057000     0.6347000 
1 1 1 5  31 18 o 1.694000  0.5209000     1.596000  0.7106000     1.791000  0.7619000     -0.1948000     1.042000  
1 1 1 5  31 19 o 4.034000  0.4533000     4.661000  0.5521000     3.408000  0.7190000     1.253000       0.9065000 
1 1 1 5  31 20 f 1.803000  0.5227000     1.732000  0.7203000     1.874000  0.7575000     -0.1417000     1.045000  
1 1 1 5  31 21 o 1.735000  0.5161000     1.552000  0.7051000     1.919000  0.7539000     -0.3666000     1.032000  
1 1 1 5  31 22 o 1.961000  0.6355000     2.493000  1.091000      1.429000  0.6528000     1.064000       1.271000  
1 1 1 5  31 23 o 1.807000  0.5123000     1.820000  0.7345000     1.793000  0.7144000     0.2679000E-01  1.025000  
1 1 1 5  31 24 o 1.347000  0.4368000     1.581000  0.6849000     1.113000  0.5423000     0.4672000      0.8736000 
1 1 1 5  32 0  o 12.64000  0.2135000     12.64000  0.2135000     12.64000  0.2135000     -0.000000      0.000000  
1 1 1 5  32 1  o 16.31000  0.1653000     16.44000  0.2349000     16.18000  0.2326000     0.2562000      0.3306000 
1 1 1 5  32 2  o 5.298000  0.1782000     5.299000  0.2511000     5.297000  0.2530000     0.1990000E-02  0.3564000 
1 1 1 5  32 3  o 7.330000  0.1542000     7.034000  0.2203000     7.625000  0.2158000     -0.5908000     0.3084000 
1 1 1 5  32 4  f 28.27000  0.2401000     28.10000  0.3381000     28.43000  0.3410000     -0.3266000     0.4802000 
1 1 1 5  32 5  f 9.136000  0.1545000     9.013000  0.2171000     9.258000  0.2199000     -0.2459000     0.3090000 
1 1 1 5  32 6  o 22.40000  0.2040000     22.56000  0.2894000     22.25000  0.2877000     0.3123000      0.4081000 
1 1 1 5  32 7  o 6.747000  0.1767000     6.826000  0.2501000     6.668000  0.2497000     0.1572000      0.3534000 
1 1 1 5  32 8  o 10.84000  0.2285000     10.84000  0.2285000     ?         ?             ?              ?         
1 1 1 5  32 9  o 9.216000  0.2017000     9.305000  0.2849000     9.127000  0.2858000     0.1778000      0.4035000 
1 1 1 5  32 10 o 11.79000  0.1888000     11.66000  0.2398000     11.92000  0.2918000     -0.2546000     0.3777000 
1 1 1 5  32 11 o 3.432000  0.3538000     3.454000  0.4935000     3.410000  0.5070000     0.4437000E-01  0.7075000 
1 1 1 5  32 12 o 5.588000  0.2547000     5.081000  0.3941000     6.095000  0.3227000     -1.014000      0.5094000 
1 1 1 5  32 13 o 6.360000  0.2488000     6.598000  0.3594000     6.122000  0.3443000     0.4752000      0.4977000 
1 1 1 5  32 14 o 4.831000  0.3182000     4.504000  0.4748000     5.157000  0.4239000     -0.6536000     0.6365000 
1 1 1 5  32 15 o 2.569000  0.5886000     2.729000  0.9001000     2.409000  0.7585000     0.3201000      1.177000  
1 1 1 5  32 16 o 5.982000  0.3441000     6.266000  0.5485000     5.699000  0.4158000     0.5673000      0.6883000 
1 1 1 5  32 17 o 3.629000  0.4505000     2.947000  0.7380000     4.311000  0.5168000     -1.363000      0.9010000 
1 1 1 5  32 18 o 6.320000  0.3074000     6.062000  0.5033000     6.578000  0.3531000     -0.5159000     0.6148000 
1 1 1 5  32 19 o 2.343000  0.5555000     1.943000  0.7697000     2.742000  0.8012000     -0.7991000     1.111000  
1 1 1 5  32 20 o 2.520000  0.5493000     2.528000  0.7740000     2.512000  0.7797000     0.1589000E-01  1.099000  
1 1 1 5  32 21 o 3.688000  0.6053000     3.677000  0.6721000     3.699000  1.007000      -0.2202000E-01 1.211000  
1 1 1 5  32 22 o 2.211000  0.5770000     2.714000  0.9130000     1.707000  0.7058000     1.007000       1.154000  
1 1 1 5  32 23 o 1.351000  0.4403000     1.490000  0.6611000     1.212000  0.5817000     0.2775000      0.8806000 
1 1 1 5  32 24 o 1.589000  0.4814000     1.496000  0.6585000     1.681000  0.7025000     -0.1843000     0.9629000 
1 1 1 5  33 0  o 1.432000  0.6779000     1.432000  0.6779000     1.432000  0.6779000     -0.000000      0.000000  
1 1 1 5  33 1  o 14.49000  0.1591000     14.61000  0.2249000     14.36000  0.2250000     0.2499000      0.3182000 
1 1 1 5  33 2  o 12.90000  0.1541000     12.98000  0.2187000     12.82000  0.2172000     0.1582000      0.3083000 
1 1 1 5  33 3  o 19.22000  0.1974000     18.88000  0.2950000     19.55000  0.2623000     -0.6753000     0.3948000 
1 1 1 5  33 4  o 12.46000  0.1547000     12.20000  0.2181000     12.72000  0.2195000     -0.5214000     0.3095000 
1 1 1 5  33 5  o 17.68000  0.1771000     17.64000  0.2499000     17.73000  0.2510000     -0.9227000E-01 0.3542000 
1 1 1 5  33 6  o 21.67000  0.2005000     21.61000  0.2829000     21.74000  0.2843000     -0.1281000     0.4011000 
1 1 1 5  33 7  o 11.98000  0.3256000     11.98000  0.3256000     ?         ?             ?              ?         
1 1 1 5  33 8  o 12.26000  0.1983000     11.99000  0.3190000     12.54000  0.2355000     -0.5442000     0.3965000 
1 1 1 5  33 9  o 4.811000  0.2537000     4.923000  0.3177000     4.699000  0.3957000     0.2232000      0.5075000 
1 1 1 5  33 10 o 5.656000  0.2525000     5.916000  0.3019000     5.396000  0.4049000     0.5199000      0.5051000 
1 1 1 5  33 11 o 4.623000  0.2701000     4.817000  0.3613000     4.429000  0.4015000     0.3881000      0.5401000 
1 1 1 5  33 12 o 13.65000  0.1939000     13.72000  0.2873000     13.58000  0.2604000     0.1396000      0.3877000 
1 1 1 5  33 13 o 6.801000  0.2453000     6.967000  0.3545000     6.634000  0.3393000     0.3329000      0.4907000 
1 1 1 5  33 14 o 7.307000  0.2399000     7.353000  0.3379000     7.260000  0.3405000     0.9353000E-01  0.4797000 
1 1 1 5  33 15 o 2.573000  0.5824000     3.197000  0.7491000     1.950000  0.8918000     1.247000       1.165000  
1 1 1 5  33 16 o 3.820000  0.4203000     4.222000  0.5298000     3.418000  0.6525000     0.8032000      0.8405000 
1 1 1 5  33 17 o 3.111000  0.4552000     1.935000  0.7485000     4.286000  0.5182000     -2.351000      0.9104000 
1 1 1 5  33 18 o 2.562000  0.5261000     2.839000  0.7223000     2.286000  0.7652000     0.5536000      1.052000  
1 1 1 5  33 19 o 2.535000  0.5513000     2.615000  0.7622000     2.454000  0.7967000     0.1610000      1.103000  
1 1 1 5  33 20 o 3.678000  0.4488000     3.356000  0.6941000     4.000000  0.5689000     -0.6438000     0.8975000 
1 1 1 5  33 21 o 1.629000  0.5304000     1.645000  0.6968000     1.613000  0.7999000     0.3195000E-01  1.061000  
1 1 1 5  33 22 o 1.825000  0.4985000     1.416000  0.6442000     2.234000  0.7611000     -0.8180000     0.9971000 
1 1 1 5  33 23 o 1.702000  0.4990000     1.844000  0.7312000     1.560000  0.6791000     0.2832000      0.9980000 
1 1 1 5  33 24 o 1.876000  0.5082000     2.150000  0.7505000     1.602000  0.6853000     0.5488000      1.016000  
1 1 1 5  34 0  o 3.137000  0.3857000     3.137000  0.3857000     3.137000  0.3857000     -0.000000      0.000000  
1 1 1 5  34 1  o 11.51000  0.1517000     11.49000  0.2147000     11.52000  0.2145000     -0.2953000E-01 0.3035000 
1 1 1 5  34 2  o 16.79000  0.1716000     16.92000  0.2439000     16.65000  0.2414000     0.2775000      0.3432000 
1 1 1 5  34 3  o 12.77000  0.1564000     12.84000  0.2217000     12.70000  0.2205000     0.1403000      0.3127000 
1 1 1 5  34 4  o 9.783000  0.1544000     9.953000  0.2198000     9.613000  0.2169000     0.3402000      0.3089000 
1 1 1 5  34 5  o 9.761000  0.1571000     9.810000  0.2204000     9.713000  0.2240000     0.9700000E-01  0.3142000 
1 1 1 5  34 6  o 10.91000  0.2989000     11.19000  0.3258000     10.63000  0.5012000     0.5664000      0.5978000 
1 1 1 5  34 7  o 7.159000  0.2509000     6.914000  0.3546000     7.405000  0.3550000     -0.4913000     0.5017000 
1 1 1 5  34 8  o 10.56000  0.1669000     10.34000  0.2340000     10.77000  0.2381000     -0.4301000     0.3338000 
1 1 1 5  34 9  o 14.36000  0.1907000     14.29000  0.2447000     14.42000  0.2925000     -0.1285000     0.3814000 
1 1 1 5  34 10 o 1.559000  0.4577000     1.334000  0.5805000     1.783000  0.7079000     -0.4488000     0.9155000 
1 1 1 5  34 11 o 9.727000  0.1848000     9.815000  0.2600000     9.639000  0.2627000     0.1758000      0.3697000 
1 1 1 5  34 12 o 9.499000  0.2053000     9.614000  0.3043000     9.384000  0.2758000     0.2308000      0.4107000 
1 1 1 5  34 13 o 4.745000  0.3252000     4.778000  0.4808000     4.713000  0.4381000     0.6432000E-01  0.6505000 
1 1 1 5  34 14 o 4.732000  0.3289000     4.777000  0.4670000     4.688000  0.4633000     0.8943000E-01  0.6579000 
1 1 1 5  34 15 o 7.920000  0.3500000     7.481000  0.4844000     8.359000  0.5054000     -0.8777000     0.7001000 
1 1 1 5  34 16 o 7.291000  0.2477000     7.063000  0.3509000     7.519000  0.3499000     -0.4567000     0.4955000 
1 1 1 5  34 17 o 6.329000  0.2673000     6.373000  0.3700000     6.285000  0.3858000     0.8764000E-01  0.5345000 
1 1 1 5  34 18 o 4.217000  0.3560000     4.238000  0.4975000     4.195000  0.5095000     0.4356000E-01  0.7121000 
1 1 1 5  34 19 o 1.453000  0.4650000     1.627000  0.7066000     1.278000  0.6047000     0.3491000      0.9300000 
1 1 1 5  34 20 o 1.458000  0.4655000     1.525000  0.6781000     1.391000  0.6380000     0.1349000      0.9310000 
1 1 1 5  34 21 o 2.506000  0.5812000     2.788000  0.8638000     2.224000  0.7779000     0.5635000      1.162000  
1 1 1 5  34 22 o 2.289000  0.5320000     1.929000  0.7577000     2.648000  0.7470000     -0.7188000     1.064000  
1 1 1 5  34 23 o 1.487000  0.4545000     1.122000  0.5453000     1.852000  0.7273000     -0.7296000     0.9090000 
1 1 1 5  34 24 o 1.300000  0.4684000     1.246000  0.6375000     1.353000  0.6865000     -0.1068000     0.9368000 
1 1 1 5  35 0  o 2.932000  0.4218000     2.932000  0.4218000     2.932000  0.4218000     0.000000       0.000000  
1 1 1 5  35 1  o 12.14000  0.1547000     12.36000  0.2194000     11.93000  0.2182000     0.4257000      0.3095000 
1 1 1 5  35 2  o 35.80000  0.3175000     35.13000  0.4739000     36.47000  0.4227000     -1.336000      0.6350000 
1 1 1 5  35 3  o 28.36000  0.2425000     28.30000  0.3424000     28.43000  0.3434000     -0.1322000     0.4850000 
1 1 1 5  35 4  o 7.364000  0.1680000     7.785000  0.2360000     6.942000  0.2391000     0.8437000      0.3360000 
1 1 1 5  35 5  f 9.818000  0.3024000     9.580000  0.3270000     10.06000  0.5088000     -0.4758000     0.6048000 
1 1 1 5  35 6  o 4.524000  0.4489000     4.873000  0.4258000     4.174000  0.7904000     0.6994000      0.8978000 
1 1 1 5  35 7  o 10.24000  0.1667000     10.51000  0.2326000     9.967000  0.2388000     0.5394000      0.3333000 
1 1 1 5  35 8  o 5.231000  0.2440000     5.516000  0.2919000     4.946000  0.3912000     0.5702000      0.4881000 
1 1 1 5  35 9  o 4.173000  0.3125000     4.533000  0.3498000     3.814000  0.5179000     0.7199000      0.6250000 
1 1 1 5  35 10 o 3.936000  0.3381000     4.091000  0.4013000     3.781000  0.5442000     0.3100000      0.6761000 
1 1 1 5  35 11 o 15.89000  0.1880000     15.78000  0.2652000     15.99000  0.2666000     -0.2159000     0.3761000 
1 1 1 5  35 12 o 7.224000  0.2347000     7.400000  0.3413000     7.047000  0.3224000     0.3526000      0.4695000 
1 1 1 5  35 13 o 8.376000  0.2297000     8.263000  0.3429000     8.488000  0.3059000     -0.2248000     0.4595000 
1 1 1 5  35 14 o 7.151000  0.3304000     7.314000  0.4918000     6.988000  0.4415000     0.3254000      0.6609000 
1 1 1 5  35 15 o 2.028000  0.6401000     2.596000  1.100000      1.460000  0.6557000     1.136000       1.280000  
1 1 1 5  35 16 o 7.608000  0.2404000     7.638000  0.3278000     7.578000  0.3517000     0.5984000E-01  0.4808000 
1 1 1 5  35 17 o 5.131000  0.3106000     5.141000  0.4475000     5.121000  0.4309000     0.2050000E-01  0.6212000 
1 1 1 5  35 18 o 3.265000  0.4640000     3.292000  0.6458000     3.239000  0.6666000     0.5364000E-01  0.9281000 
1 1 1 5  35 19 o 1.837000  0.4872000     1.381000  0.6219000     2.293000  0.7502000     -0.9114000     0.9745000 
1 1 1 5  35 20 o 1.525000  0.4901000     1.436000  0.6632000     1.614000  0.7217000     -0.1776000     0.9802000 
1 1 1 5  35 21 o 2.174000  0.6028000     2.013000  0.9490000     2.335000  0.7436000     -0.3224000     1.206000  
1 1 1 5  35 22 o 1.697000  0.4862000     1.319000  0.6120000     2.074000  0.7557000     -0.7558000     0.9725000 
1 1 1 5  35 23 o 1.451000  0.4635000     1.483000  0.6631000     1.418000  0.6478000     0.6408000E-01  0.9270000 
1 1 1 5  36 0  o 0.7950000 0.5296000     0.7950000 0.5296000     0.7950000 0.5296000     -0.000000      0.000000  
1 1 1 5  36 1  o 5.424000  0.2090000     5.928000  0.2564000     4.920000  0.3301000     1.008000       0.4180000 
1 1 1 5  36 2  o 14.94000  0.1672000     15.16000  0.2389000     14.72000  0.2339000     0.4355000      0.3344000 
1 1 1 5  36 3  o 6.482000  0.2367000     6.279000  0.3733000     6.684000  0.2912000     -0.4048000     0.4734000 
1 1 1 5  36 4  o 33.29000  0.7901000     33.29000  0.7901000     ?         ?             ?              ?         
1 1 1 5  36 5  o 12.91000  0.2110000     13.11000  0.3233000     12.70000  0.2711000     0.4142000      0.4219000 
1 1 1 5  36 6  o 14.00000  0.1695000     13.91000  0.2376000     14.09000  0.2419000     -0.1774000     0.3390000 
1 1 1 5  36 7  o 4.291000  0.2590000     4.692000  0.3360000     3.891000  0.3943000     0.8008000      0.5181000 
1 1 1 5  36 8  o 8.257000  0.1964000     8.437000  0.2468000     8.077000  0.3055000     0.3604000      0.3927000 
1 1 1 5  36 9  o 17.57000  0.2058000     17.56000  0.2663000     17.58000  0.3137000     -0.1908000E-01 0.4115000 
1 1 1 5  36 10 o 2.988000  0.4361000     3.088000  0.5438000     2.889000  0.6819000     0.1991000      0.8722000 
1 1 1 5  36 11 o 9.701000  0.1934000     9.558000  0.2730000     9.845000  0.2741000     -0.2872000     0.3869000 
1 1 1 5  36 12 o 8.056000  0.2260000     8.427000  0.3276000     7.685000  0.3114000     0.7422000      0.4520000 
1 1 1 5  36 13 o 3.444000  0.4457000     3.628000  0.6286000     3.259000  0.6321000     0.3689000      0.8915000 
1 1 1 5  36 14 o 4.425000  0.5021000     4.425000  0.5021000     ?         ?             ?              ?         
1 1 1 5  36 15 o 7.097000  0.2461000     7.118000  0.3401000     7.076000  0.3558000     0.4204000E-01  0.4922000 
1 1 1 5  36 16 o 7.589000  0.2447000     7.606000  0.3387000     7.572000  0.3532000     0.3328000E-01  0.4894000 
1 1 1 5  36 17 o 2.592000  0.5266000     2.753000  0.7201000     2.430000  0.7686000     0.3233000      1.053000  
1 1 1 5  36 18 o 1.631000  0.4870000     1.499000  0.6621000     1.764000  0.7144000     -0.2655000     0.9740000 
1 1 1 5  36 19 o 1.693000  0.4905000     1.836000  0.7232000     1.550000  0.6627000     0.2859000      0.9809000 
1 1 1 5  36 20 o 2.317000  0.6828000     2.070000  0.7811000     2.565000  1.120000      -0.4947000     1.366000  
1 1 1 5  36 21 o 2.582000  0.4778000     1.761000  0.7204000     3.403000  0.6279000     -1.641000      0.9556000 
1 1 1 5  36 22 o 1.686000  0.4940000     1.728000  0.7068000     1.644000  0.6904000     0.8314000E-01  0.9880000 
1 1 1 5  36 23 o 1.367000  0.4392000     1.674000  0.7080000     1.059000  0.5199000     0.6150000      0.8784000 
1 1 1 5  37 0  o 15.76000  0.3464000     15.76000  0.3464000     15.76000  0.3464000     -0.000000      0.000000  
1 1 1 5  37 1  o 5.782000  0.3512000     6.535000  0.3581000     5.029000  0.6043000     1.506000       0.7025000 
1 1 1 5  37 2  o 12.87000  0.4686000     12.87000  0.4686000     ?         ?             ?              ?         
1 1 1 5  37 3  o 7.032000  0.3151000     7.435000  0.3403000     6.629000  0.5304000     0.8068000      0.6302000 
1 1 1 5  37 4  o 4.365000  0.2832000     4.154000  0.4663000     4.577000  0.3216000     -0.4230000     0.5665000 
1 1 1 5  37 5  o 6.901000  0.1836000     7.301000  0.2511000     6.500000  0.2679000     0.8016000      0.3672000 
1 1 1 5  37 6  o 18.30000  0.1876000     18.37000  0.2643000     18.23000  0.2664000     0.1370000      0.3752000 
1 1 1 5  37 7  o 20.05000  0.1978000     19.79000  0.2769000     20.30000  0.2826000     -0.5131000     0.3956000 
1 1 1 5  37 8  o 7.952000  0.2039000     8.296000  0.2530000     7.608000  0.3198000     0.6880000      0.4078000 
1 1 1 5  37 9  o 15.40000  0.1973000     15.10000  0.2531000     15.70000  0.3028000     -0.6032000     0.3947000 
1 1 1 5  37 10 o 5.346000  0.2725000     5.616000  0.3313000     5.076000  0.4328000     0.5401000      0.5450000 
1 1 1 5  37 11 o 9.501000  0.1962000     9.406000  0.2814000     9.597000  0.2734000     -0.1909000     0.3924000 
1 1 1 5  37 12 o 7.347000  0.2404000     7.393000  0.3622000     7.300000  0.3164000     0.9271000E-01  0.4809000 
1 1 1 5  37 13 o 4.022000  0.5060000     4.198000  0.8443000     3.845000  0.5581000     0.3530000      1.012000  
1 1 1 5  37 14 o 3.643000  0.5142000     3.438000  0.8624000     3.848000  0.5603000     -0.4096000     1.028000  
1 1 1 5  37 15 o 2.696000  0.5204000     2.430000  0.7603000     2.963000  0.7107000     -0.5331000     1.041000  
1 1 1 5  37 16 f 3.491000  0.4452000     3.318000  0.6301000     3.665000  0.6291000     -0.3467000     0.8904000 
1 1 1 5  37 17 o 4.100000  0.3702000     4.091000  0.5167000     4.109000  0.5304000     -0.1826000E-01 0.7405000 
1 1 1 5  37 18 o 1.709000  0.4863000     1.913000  0.7128000     1.504000  0.6618000     0.4088000      0.9726000 
1 1 1 5  37 19 o 1.666000  0.4782000     1.568000  0.6607000     1.764000  0.6915000     -0.1954000     0.9564000 
1 1 1 5  37 20 o 1.616000  0.5300000     1.660000  0.7270000     1.572000  0.7715000     0.8764000E-01  1.060000  
1 1 1 5  37 21 o 1.595000  0.4842000     1.391000  0.6371000     1.799000  0.7292000     -0.4081000     0.9683000 
1 1 1 5  37 22 o 1.632000  0.4787000     1.980000  0.7427000     1.285000  0.6042000     0.6948000      0.9575000 
1 1 1 5  37 23 o 1.383000  0.4434000     1.473000  0.6515000     1.292000  0.6016000     0.1811000      0.8868000 
1 1 1 5  38 0  o 8.604000  0.3253000     8.604000  0.3253000     8.604000  0.3253000     -0.000000      0.000000  
1 1 1 5  38 1  o 8.910000  0.2278000     8.616000  0.3220000     9.204000  0.3223000     -0.5873000     0.4556000 
1 1 1 5  38 2  o 12.60000  0.1769000     12.69000  0.2683000     12.51000  0.2307000     0.1841000      0.3538000 
1 1 1 5  38 3  o 8.176000  0.1693000     8.247000  0.2379000     8.105000  0.2410000     0.1412000      0.3387000 
1 1 1 5  38 4  o 14.73000  0.1705000     14.63000  0.2397000     14.84000  0.2424000     -0.2121000     0.3409000 
1 1 1 5  38 5  o 21.23000  0.2021000     21.61000  0.2884000     20.85000  0.2832000     0.7627000      0.4043000 
1 1 1 5  38 6  o 23.02000  0.2141000     23.28000  0.3038000     22.76000  0.3018000     0.5283000      0.4282000 
1 1 1 5  38 7  o 12.69000  0.1734000     12.86000  0.2442000     12.52000  0.2462000     0.3317000      0.3468000 
1 1 1 5  38 8  o 2.085000  0.4446000     2.553000  0.5885000     1.616000  0.6666000     0.9374000      0.8892000 
1 1 1 5  38 9  o 7.634000  0.2109000     7.447000  0.2727000     7.821000  0.3218000     -0.3743000     0.4218000 
1 1 1 5  38 10 o 10.06000  0.1891000     9.772000  0.2631000     10.34000  0.2717000     -0.5720000     0.3782000 
1 1 1 5  38 11 o 1.583000  0.4632000     1.878000  0.7108000     1.287000  0.5942000     0.5903000      0.9264000 
1 1 1 5  38 12 o 6.169000  0.2743000     6.817000  0.3782000     5.521000  0.3975000     1.296000       0.5487000 
1 1 1 5  38 13 o 2.367000  0.8008000     2.367000  0.8008000     ?         ?             ?              ?         
1 1 1 5  38 14 o 9.290000  0.2189000     8.948000  0.3103000     9.631000  0.3087000     -0.6831000     0.4377000 
1 1 1 5  38 15 o 3.976000  0.3947000     4.028000  0.5477000     3.925000  0.5684000     0.1025000      0.7894000 
1 1 1 5  38 16 o 1.572000  0.4819000     1.459000  0.6587000     1.685000  0.7036000     -0.2260000     0.9638000 
1 1 1 5  38 17 o 1.989000  0.5273000     1.910000  0.7346000     2.068000  0.7566000     -0.1583000     1.055000  
1 1 1 5  38 18 o 1.973000  0.5128000     1.809000  0.7048000     2.136000  0.7450000     -0.3268000     1.026000  
1 1 1 5  38 19 o 2.699000  0.5748000     2.997000  0.9078000     2.402000  0.7054000     0.5948000      1.150000  
1 1 1 5  38 20 o 1.332000  0.4403000     1.429000  0.6682000     1.235000  0.5736000     0.1935000      0.8806000 
1 1 1 5  38 21 o 1.630000  0.4762000     1.295000  0.6028000     1.965000  0.7374000     -0.6694000     0.9524000 
1 1 1 5  38 22 o 1.680000  0.4932000     1.972000  0.7523000     1.389000  0.6379000     0.5827000      0.9863000 
1 1 1 5  39 0  o 0.7948000 0.5393000     0.7948000 0.5393000     0.7948000 0.5393000     -0.000000      0.000000  
1 1 1 5  39 1  o 10.02000  0.1638000     10.21000  0.2292000     9.822000  0.2340000     0.3886000      0.3276000 
1 1 1 5  39 2  o 10.89000  0.1638000     11.16000  0.2318000     10.61000  0.2316000     0.5492000      0.3277000 
1 1 1 5  39 3  o 22.05000  0.2068000     22.26000  0.2942000     21.84000  0.2907000     0.4183000      0.4136000 
1 1 1 5  39 4  o 21.24000  0.2025000     21.08000  0.2851000     21.40000  0.2878000     -0.3235000     0.4051000 
1 1 1 5  39 5  o 6.446000  0.1943000     6.607000  0.2678000     6.286000  0.2817000     0.3214000      0.3887000 
1 1 1 5  39 6  o 15.80000  0.1798000     15.83000  0.2525000     15.78000  0.2560000     0.4533000E-01  0.3595000 
1 1 1 5  39 7  o 6.275000  0.2119000     6.763000  0.2810000     5.787000  0.3172000     0.9766000      0.4238000 
1 1 1 5  39 8  o 12.62000  0.2163000     12.60000  0.2472000     12.64000  0.3550000     -0.3850000E-01 0.4326000 
1 1 1 5  39 9  o 2.919000  0.4608000     2.537000  0.6479000     3.300000  0.6553000     -0.7636000     0.9215000 
1 1 1 5  39 10 o 6.122000  0.2389000     6.208000  0.3282000     6.035000  0.3472000     0.1728000      0.4778000 
1 1 1 5  39 11 o 4.084000  0.3455000     3.913000  0.5078000     4.254000  0.4687000     -0.3414000     0.6910000 
1 1 1 5  39 12 o 2.398000  0.6039000     2.851000  0.9629000     1.945000  0.7292000     0.9059000      1.208000  
1 1 1 5  39 13 o 9.338000  0.2660000     9.450000  0.4328000     9.227000  0.3093000     0.2229000      0.5320000 
1 1 1 5  39 14 o 9.955000  0.2142000     9.848000  0.3044000     10.06000  0.3014000     -0.2128000     0.4283000 
1 1 1 5  39 15 o 7.448000  0.2422000     7.262000  0.3442000     7.634000  0.3409000     -0.3715000     0.4845000 
1 1 1 5  39 16 o 2.948000  0.5006000     2.949000  0.7141000     2.947000  0.7017000     0.1691000E-02  1.001000  
1 1 1 5  39 17 o 3.419000  0.4535000     3.051000  0.6931000     3.787000  0.5849000     -0.7363000     0.9069000 
1 1 1 5  39 18 o 3.540000  0.4245000     2.852000  0.6818000     4.227000  0.5058000     -1.376000      0.8490000 
1 1 1 5  39 19 o 1.060000  0.3779000     1.075000  0.5407000     1.045000  0.5281000     0.2976000E-01  0.7558000 
1 1 1 5  39 20 o 2.089000  0.4587000     1.436000  0.6350000     2.741000  0.6623000     -1.305000      0.9175000 
1 1 1 5  39 21 o 1.529000  0.4715000     1.621000  0.6866000     1.436000  0.6463000     0.1854000      0.9430000 
1 1 1 5  39 22 o 1.936000  0.4962000     1.457000  0.6478000     2.415000  0.7518000     -0.9577000     0.9924000 
1 1 1 5  40 0  o 8.518000  0.2425000     8.518000  0.2425000     8.518000  0.2425000     0.000000       0.000000  
1 1 1 5  40 1  f 19.77000  0.1945000     19.57000  0.2745000     19.96000  0.2756000     -0.3905000     0.3890000 
1 1 1 5  40 2  o 7.656000  0.1795000     7.661000  0.2562000     7.651000  0.2514000     0.1070000E-01  0.3589000 
1 1 1 5  40 3  o 20.37000  0.1983000     20.11000  0.2779000     20.64000  0.2829000     -0.5265000     0.3965000 
1 1 1 5  40 4  o 16.26000  0.1797000     16.36000  0.2546000     16.15000  0.2535000     0.2105000      0.3593000 
1 1 1 5  40 5  o 8.728000  0.1742000     8.731000  0.2426000     8.726000  0.2500000     0.5158000E-02  0.3483000 
1 1 1 5  40 6  o 7.401000  0.1879000     7.617000  0.2616000     7.185000  0.2697000     0.4323000      0.3757000 
1 1 1 5  40 7  o 8.962000  0.1829000     9.280000  0.2541000     8.644000  0.2633000     0.6357000      0.3659000 
1 1 1 5  40 8  o 6.922000  0.2273000     6.846000  0.2946000     6.999000  0.3462000     -0.1530000     0.4546000 
1 1 1 5  40 9  o 3.860000  0.3617000     3.754000  0.4729000     3.967000  0.5475000     -0.2131000     0.7234000 
1 1 1 5  40 10 f 7.229000  0.2207000     7.196000  0.3090000     7.263000  0.3152000     -0.6708000E-01 0.4414000 
1 1 1 5  40 11 o 11.63000  0.1954000     11.32000  0.2787000     11.94000  0.2741000     -0.6207000     0.3909000 
1 1 1 5  40 12 o 9.837000  0.3259000     9.837000  0.3259000     ?         ?             ?              ?         
1 1 1 5  40 13 o 6.860000  0.2644000     6.443000  0.4018000     7.278000  0.3438000     -0.8353000     0.5288000 
1 1 1 5  40 14 o 3.235000  0.4656000     2.767000  0.7264000     3.703000  0.5826000     -0.9360000     0.9312000 
1 1 1 5  40 15 o 2.982000  0.4871000     2.448000  0.7564000     3.516000  0.6141000     -1.068000      0.9743000 
1 1 1 5  40 16 o 2.312000  0.5312000     2.113000  0.7536000     2.511000  0.7489000     -0.3977000     1.062000  
1 1 1 5  40 17 o 1.791000  0.5089000     1.671000  0.6960000     1.910000  0.7426000     -0.2390000     1.018000  
1 1 1 5  40 18 o 1.745000  0.4635000     1.201000  0.5644000     2.290000  0.7353000     -1.089000      0.9270000 
1 1 1 5  40 19 o 1.516000  0.6588000     1.516000  0.6588000     ?         ?             ?              ?         
1 1 1 5  40 20 o 1.102000  0.3744000     1.133000  0.5418000     1.070000  0.5170000     0.6352000E-01  0.7489000 
1 1 1 5  40 21 o 1.521000  0.4659000     1.885000  0.7604000     1.157000  0.5386000     0.7278000      0.9318000 
1 1 1 5  40 22 o 1.299000  0.4274000     1.388000  0.6285000     1.211000  0.5793000     0.1777000      0.8548000 
1 1 1 5  41 0  f 5.841000  0.2881000     5.841000  0.2881000     5.841000  0.2881000     -0.000000      0.000000  
1 1 1 5  41 1  o 20.35000  0.1988000     20.31000  0.2808000     20.39000  0.2814000     -0.8513000E-01 0.3976000 
1 1 1 5  41 2  o 9.099000  0.1732000     8.988000  0.2454000     9.209000  0.2444000     -0.2203000     0.3464000 
1 1 1 5  41 3  o 8.229000  0.1773000     8.125000  0.2486000     8.332000  0.2527000     -0.2066000     0.3545000 
1 1 1 5  41 4  o 2.385000  0.4069000     1.895000  0.6322000     2.875000  0.5125000     -0.9803000     0.8138000 
1 1 1 5  41 5  o 4.004000  0.2792000     3.988000  0.3899000     4.020000  0.3997000     -0.3119000E-01 0.5584000 
1 1 1 5  41 6  f 7.741000  0.1926000     7.824000  0.2693000     7.658000  0.2754000     0.1660000      0.3852000 
1 1 1 5  41 7  f 6.427000  0.2181000     6.857000  0.2921000     5.996000  0.3241000     0.8611000      0.4362000 
1 1 1 5  41 8  o 12.37000  0.1986000     12.68000  0.2556000     12.05000  0.3040000     0.6286000      0.3972000 
1 1 1 5  41 9  f 9.152000  0.2136000     9.122000  0.2775000     9.182000  0.3247000     -0.6007000E-01 0.4271000 
1 1 1 5  41 10 o 8.882000  0.2061000     9.368000  0.2837000     8.396000  0.2992000     0.9715000      0.4123000 
1 1 1 5  41 11 o 10.75000  0.3349000     10.61000  0.4122000     10.88000  0.5279000     -0.2631000     0.6698000 
1 1 1 5  41 12 o 5.153000  0.3733000     5.259000  0.6109000     5.047000  0.4291000     0.2115000      0.7465000 
1 1 1 5  41 13 o 2.166000  0.5063000     1.566000  0.6915000     2.766000  0.7398000     -1.200000      1.013000  
1 1 1 5  41 14 o 1.774000  0.5081000     1.873000  0.7302000     1.675000  0.7067000     0.1979000      1.016000  
1 1 1 5  41 15 o 2.819000  0.4873000     3.465000  0.6040000     2.173000  0.7649000     1.292000       0.9746000 
1 1 1 5  41 16 o 2.484000  0.5219000     2.331000  0.7449000     2.637000  0.7310000     -0.3058000     1.044000  
1 1 1 5  41 17 o 1.626000  0.4790000     1.413000  0.6330000     1.840000  0.7190000     -0.4271000     0.9580000 
1 1 1 5  41 18 o 4.227000  0.4293000     4.828000  0.6518000     3.626000  0.5589000     1.202000       0.8586000 
1 1 1 5  41 19 o 1.367000  0.4425000     1.340000  0.6340000     1.394000  0.6175000     -0.5354000E-01 0.8851000 
1 1 1 5  41 20 o 1.576000  0.4628000     1.421000  0.6269000     1.731000  0.6808000     -0.3100000     0.9255000 
1 1 1 5  41 21 o 1.443000  0.4408000     1.602000  0.6593000     1.284000  0.5853000     0.3183000      0.8816000 
1 1 1 5  41 22 f 0.9392000 0.3433000     0.9782000 0.5040000     0.9001000 0.4662000     0.7813000E-01  0.6866000 
1 1 1 5  42 0  o 14.78000  0.2469000     14.78000  0.2469000     14.78000  0.2469000     -0.000000      0.000000  
1 1 1 5  42 1  o 5.526000  0.2178000     5.397000  0.3142000     5.654000  0.3018000     -0.2569000     0.4356000 
1 1 1 5  42 2  o 20.96000  0.2031000     21.13000  0.2890000     20.79000  0.2855000     0.3436000      0.4062000 
1 1 1 5  42 3  o 1.593000  0.4340000     1.454000  0.5965000     1.733000  0.6305000     -0.2790000     0.8680000 
1 1 1 5  42 4  o 1.469000  0.4007000     1.892000  0.6278000     1.047000  0.4980000     0.8444000      0.8014000 
1 1 1 5  42 5  f 13.85000  0.1763000     13.75000  0.2488000     13.95000  0.2498000     -0.2000000     0.3526000 
1 1 1 5  42 6  o 10.20000  0.1780000     10.19000  0.2523000     10.22000  0.2511000     -0.2648000E-01 0.3560000 
1 1 1 5  42 7  o 14.74000  0.1853000     15.26000  0.2617000     14.21000  0.2624000     1.047000       0.3706000 
1 1 1 5  42 8  f 3.224000  0.4353000     3.636000  0.4839000     2.812000  0.7236000     0.8238000      0.8705000 
1 1 1 5  42 9  o 10.62000  0.2085000     10.04000  0.2722000     11.19000  0.3158000     -1.147000      0.4169000 
1 1 1 5  42 10 o 2.635000  0.5236000     2.109000  0.8453000     3.161000  0.6182000     -1.053000      1.047000  
1 1 1 5  42 11 o 4.113000  0.5391000     4.742000  0.6008000     3.483000  0.8953000     1.258000       1.078000  
1 1 1 5  42 12 o 1.722000  0.4991000     1.664000  0.7053000     1.779000  0.7063000     -0.1150000     0.9982000 
1 1 1 5  42 13 o 6.139000  0.2795000     5.995000  0.4196000     6.283000  0.3693000     -0.2882000     0.5590000 
1 1 1 5  42 14 o 2.846000  0.5066000     2.423000  0.7621000     3.269000  0.6676000     -0.8466000     1.013000  
1 1 1 5  42 15 o 4.459000  0.3381000     4.461000  0.4774000     4.457000  0.4790000     0.3397000E-02  0.6763000 
1 1 1 5  42 16 o 5.418000  0.3028000     5.051000  0.4430000     5.785000  0.4128000     -0.7342000     0.6055000 
1 1 1 5  42 17 o 2.553000  0.4946000     2.999000  0.6638000     2.107000  0.7334000     0.8917000      0.9892000 
1 1 1 5  42 18 o 2.235000  0.7340000     2.235000  0.7340000     ?         ?             ?              ?         
1 1 1 5  42 19 o 2.459000  0.4927000     2.087000  0.7273000     2.830000  0.6648000     -0.7431000     0.9854000 
1 1 1 5  42 20 f 2.790000  0.4602000     2.879000  0.6385000     2.702000  0.6629000     0.1772000      0.9204000 
1 1 1 5  42 21 o 1.502000  0.4523000     1.470000  0.6340000     1.533000  0.6452000     -0.6357000E-01 0.9046000 
1 1 1 5  43 0  o 1.949000  0.7794000     1.949000  0.7794000     1.949000  0.7794000     0.000000       0.000000  
1 1 1 5  43 1  o 9.490000  0.1748000     9.421000  0.2475000     9.558000  0.2470000     -0.1365000     0.3497000 
1 1 1 5  43 2  o 10.49000  0.1725000     10.80000  0.2441000     10.17000  0.2439000     0.6315000      0.3451000 
1 1 1 5  43 3  o 11.15000  0.1740000     11.35000  0.2453000     10.95000  0.2467000     0.4042000      0.3479000 
1 1 1 5  43 4  o 6.299000  0.2087000     6.429000  0.2921000     6.169000  0.2982000     0.2606000      0.4174000 
1 1 1 5  43 5  o 1.798000  0.4613000     1.761000  0.6472000     1.835000  0.6574000     -0.7425000E-01 0.9225000 
1 1 1 5  43 6  o 4.545000  0.2756000     4.798000  0.3718000     4.292000  0.4070000     0.5062000      0.5512000 
1 1 1 5  43 7  o 2.586000  0.4720000     2.733000  0.6361000     2.438000  0.6975000     0.2944000      0.9440000 
1 1 1 5  43 8  o 4.477000  0.3527000     4.912000  0.3996000     4.043000  0.5814000     0.8693000      0.7055000 
1 1 1 5  43 9  o 11.77000  0.2554000     11.58000  0.3984000     11.97000  0.3196000     -0.3942000     0.5108000 
1 1 1 5  43 10 o 8.939000  0.3217000     8.939000  0.3217000     ?         ?             ?              ?         
1 1 1 5  43 11 o 8.463000  0.2201000     8.727000  0.3065000     8.200000  0.3161000     0.5263000      0.4402000 
1 1 1 5  43 12 f 1.575000  0.4773000     1.433000  0.6494000     1.717000  0.6997000     -0.2839000     0.9546000 
1 1 1 5  43 13 o 6.850000  0.3093000     6.265000  0.5216000     7.435000  0.3327000     -1.170000      0.6187000 
1 1 1 5  43 14 o 4.275000  0.3587000     4.076000  0.5250000     4.473000  0.4890000     -0.3969000     0.7174000 
1 1 1 5  43 15 o 2.558000  0.5264000     2.362000  0.7548000     2.754000  0.7341000     -0.3924000     1.053000  
1 1 1 5  43 16 o 3.741000  0.4131000     3.600000  0.5845000     3.881000  0.5839000     -0.2805000     0.8262000 
1 1 1 5  43 17 o 5.570000  0.3537000     5.562000  0.5905000     5.578000  0.3895000     -0.1625000E-01 0.7074000 
1 1 1 5  43 18 o 1.327000  0.4511000     1.125000  0.5582000     1.528000  0.7089000     -0.4030000     0.9023000 
1 1 1 5  43 19 o 3.824000  0.3641000     3.940000  0.5040000     3.707000  0.5255000     0.2333000      0.7281000 
1 1 1 5  43 20 o 1.414000  0.4397000     1.376000  0.6076000     1.451000  0.6358000     -0.7458000E-01 0.8794000 
1 1 1 5  43 21 o 1.621000  0.4697000     1.353000  0.6123000     1.888000  0.7126000     -0.5345000     0.9395000 
1 1 1 5  44 0  o 6.713000  0.2884000     6.713000  0.2884000     6.713000  0.2884000     0.000000       0.000000  
1 1 1 5  44 1  o 17.36000  0.1879000     16.98000  0.2639000     17.73000  0.2677000     -0.7492000     0.3759000 
1 1 1 5  44 2  o 11.70000  0.1750000     11.74000  0.2482000     11.67000  0.2468000     0.7199000E-01  0.3500000 
1 1 1 5  44 3  o 13.34000  0.1782000     13.42000  0.2528000     13.26000  0.2513000     0.1581000      0.3565000 
1 1 1 5  44 4  o 5.019000  0.2597000     4.548000  0.3913000     5.490000  0.3414000     -0.9417000     0.5193000 
1 1 1 5  44 5  o 9.003000  0.1887000     8.941000  0.2639000     9.066000  0.2699000     -0.1255000     0.3775000 
1 1 1 5  44 6  o 6.357000  0.2236000     6.088000  0.3260000     6.627000  0.3060000     -0.5389000     0.4471000 
1 1 1 5  44 7  o 2.656000  0.4967000     2.298000  0.6989000     3.014000  0.7059000     -0.7165000     0.9933000 
1 1 1 5  44 8  o 4.076000  0.3916000     4.239000  0.4720000     3.912000  0.6250000     0.3277000      0.7833000 
1 1 1 5  44 9  f 4.878000  0.5946000     4.878000  0.5946000     ?         ?             ?              ?         
1 1 1 5  44 10 o 3.402000  0.4981000     3.021000  0.8315000     3.782000  0.5487000     -0.7602000     0.9962000 
1 1 1 5  44 11 o 7.408000  0.2337000     7.370000  0.3300000     7.446000  0.3312000     -0.7569000E-01 0.4675000 
1 1 1 5  44 12 f 5.972000  0.2829000     6.076000  0.4230000     5.868000  0.3757000     0.2088000      0.5658000 
1 1 1 5  44 13 o 1.716000  0.4963000     1.580000  0.6886000     1.852000  0.7148000     -0.2721000     0.9926000 
1 1 1 5  44 14 o 1.420000  0.4497000     1.242000  0.5873000     1.598000  0.6811000     -0.3560000     0.8994000 
1 1 1 5  44 15 o 3.511000  0.4467000     2.983000  0.7075000     4.039000  0.5455000     -1.056000      0.8934000 
1 1 1 5  44 16 f 1.634000  0.4781000     1.344000  0.6157000     1.925000  0.7316000     -0.5810000     0.9562000 
1 1 1 5  44 17 o 1.403000  0.4775000     1.541000  0.7205000     1.265000  0.6267000     0.2759000      0.9549000 
1 1 1 5  44 18 o 1.333000  0.4357000     1.445000  0.6605000     1.220000  0.5686000     0.2250000      0.8715000 
1 1 1 5  44 19 o 1.520000  0.4470000     1.196000  0.5633000     1.843000  0.6941000     -0.6473000     0.8939000 
1 1 1 5  44 20 o 1.414000  0.4380000     1.477000  0.6323000     1.350000  0.6064000     0.1266000      0.8761000 
1 1 1 5  45 0  o 8.172000  0.2688000     8.172000  0.2688000     8.172000  0.2688000     -0.000000      0.000000  
1 1 1 5  45 1  o 16.91000  0.1892000     17.13000  0.2686000     16.70000  0.2664000     0.4320000      0.3783000 
1 1 1 5  45 2  o 19.10000  0.1997000     18.99000  0.2827000     19.21000  0.2821000     -0.2211000     0.3993000 
1 1 1 5  45 3  o 11.86000  0.1795000     12.07000  0.2546000     11.66000  0.2532000     0.4123000      0.3590000 
1 1 1 5  45 4  o 12.09000  0.1813000     11.92000  0.2557000     12.26000  0.2571000     -0.3469000     0.3626000 
1 1 1 5  45 5  o 7.531000  0.2057000     7.481000  0.2909000     7.582000  0.2909000     -0.1007000     0.4113000 
1 1 1 5  45 6  o 8.991000  0.1959000     8.944000  0.2747000     9.038000  0.2795000     -0.9457000E-01 0.3919000 
1 1 1 5  45 7  o 7.252000  0.2454000     7.260000  0.3153000     7.244000  0.3762000     0.1656000E-01  0.4908000 
1 1 1 5  45 8  o 9.177000  0.4279000     9.177000  0.4279000     ?         ?             ?              ?         
1 1 1 5  45 9  o 3.632000  0.5004000     3.670000  0.7209000     3.593000  0.6942000     0.7677000E-01  1.001000  
1 1 1 5  45 10 o 6.405000  0.2522000     6.470000  0.3513000     6.341000  0.3618000     0.1287000      0.5043000 
1 1 1 5  45 11 o 7.440000  0.2356000     7.210000  0.3420000     7.670000  0.3242000     -0.4607000     0.4712000 
1 1 1 5  45 12 o 2.012000  0.5015000     2.523000  0.7606000     1.501000  0.6538000     1.022000       1.003000  
1 1 1 5  45 13 o 4.349000  0.3704000     3.746000  0.5990000     4.952000  0.4360000     -1.206000      0.7409000 
1 1 1 5  45 14 f 4.055000  0.3723000     3.726000  0.5653000     4.385000  0.4847000     -0.6587000     0.7446000 
1 1 1 5  45 15 o 1.415000  0.4526000     1.406000  0.6395000     1.424000  0.6406000     -0.1789000E-01 0.9052000 
1 1 1 5  45 16 o 4.485000  0.3473000     4.683000  0.4755000     4.287000  0.5065000     0.3962000      0.6947000 
1 1 1 5  45 17 o 2.997000  0.7312000     2.997000  0.7312000     ?         ?             ?              ?         
1 1 1 5  45 18 o 1.407000  0.4374000     1.158000  0.5500000     1.656000  0.6802000     -0.4977000     0.8748000 
1 1 1 5  45 19 o 1.382000  0.4219000     1.003000  0.4923000     1.761000  0.6853000     -0.7577000     0.8438000 
1 1 1 5  45 20 o 1.050000  0.3605000     1.200000  0.5635000     0.8988000 0.4499000     0.3015000      0.7210000 
1 1 1 5  46 0  o 2.082000  0.8127000     2.082000  0.8127000     2.082000  0.8127000     -0.000000      0.000000  
1 1 1 5  46 1  o 6.359000  0.2160000     6.408000  0.3050000     6.309000  0.3058000     0.9901000E-01  0.4319000 
1 1 1 5  46 2  o 10.22000  0.1856000     10.08000  0.2644000     10.36000  0.2606000     -0.2854000     0.3712000 
1 1 1 5  46 3  o 5.311000  0.2544000     5.062000  0.3734000     5.559000  0.3456000     -0.4970000     0.5087000 
1 1 1 5  46 4  o 9.921000  0.1889000     9.971000  0.2652000     9.872000  0.2690000     0.9904000E-01  0.3778000 
1 1 1 5  46 5  o 8.688000  0.1988000     8.717000  0.2793000     8.658000  0.2830000     0.5820000E-01  0.3976000 
1 1 1 5  46 6  o 6.622000  0.2566000     6.914000  0.3846000     6.331000  0.3397000     0.5836000      0.5131000 
1 1 1 5  46 7  o 4.726000  0.6347000     4.726000  0.6347000     ?         ?             ?              ?         
1 1 1 5  46 8  o 8.157000  0.2833000     8.470000  0.4066000     7.844000  0.3945000     0.6265000      0.5665000 
1 1 1 5  46 9  o 7.585000  0.2489000     7.375000  0.3275000     7.795000  0.3748000     -0.4205000     0.4977000 
1 1 1 5  46 10 o 5.569000  0.2849000     6.026000  0.3741000     5.113000  0.4298000     0.9136000      0.5698000 
1 1 1 5  46 11 o 1.984000  0.5093000     2.263000  0.7423000     1.706000  0.6977000     0.5574000      1.019000  
1 1 1 5  46 12 o 1.917000  0.4799000     1.383000  0.6382000     2.451000  0.7168000     -1.068000      0.9598000 
1 1 1 5  46 13 o 3.734000  0.4145000     4.035000  0.5811000     3.433000  0.5912000     0.6012000      0.8290000 
1 1 1 5  46 14 o 3.100000  0.4718000     3.086000  0.6590000     3.114000  0.6754000     -0.2816000E-01 0.9437000 
1 1 1 5  46 15 o 4.814000  0.3246000     4.668000  0.4658000     4.959000  0.4521000     -0.2911000     0.6492000 
1 1 1 5  46 16 o 3.544000  0.5886000     3.531000  0.8769000     3.556000  0.7853000     -0.2568000E-01 1.177000  
1 1 1 5  46 17 o 1.504000  0.4637000     1.287000  0.6188000     1.722000  0.6907000     -0.4349000     0.9274000 
1 1 1 5  46 18 o 1.634000  0.4739000     1.806000  0.6974000     1.463000  0.6419000     0.3436000      0.9478000 
1 1 1 5  46 19 o 1.530000  0.4505000     1.299000  0.5937000     1.761000  0.6778000     -0.4623000     0.9010000 
1 1 1 5  46 20 o 1.201000  0.3976000     0.9727000 0.4798000     1.428000  0.6342000     -0.4555000     0.7952000 
1 1 1 5  47 0  o 11.39000  0.2635000     11.39000  0.2635000     11.39000  0.2635000     0.000000       0.000000  
1 1 1 5  47 1  o 9.245000  0.1907000     9.108000  0.2728000     9.383000  0.2665000     -0.2750000     0.3814000 
1 1 1 5  47 2  o 14.04000  0.1858000     14.00000  0.2639000     14.07000  0.2617000     -0.6834000E-01 0.3716000 
1 1 1 5  47 3  o 9.285000  0.1939000     9.285000  0.2722000     9.285000  0.2761000     -0.1469000E-03 0.3878000 
1 1 1 5  47 4  o 4.739000  0.2797000     4.824000  0.3882000     4.654000  0.4027000     0.1701000      0.5594000 
1 1 1 5  47 5  o 4.623000  0.3929000     5.146000  0.5609000     4.100000  0.5502000     1.046000       0.7857000 
1 1 1 5  47 6  o 2.097000  0.8147000     2.097000  0.8147000     ?         ?             ?              ?         
1 1 1 5  47 7  o 7.742000  0.2883000     8.076000  0.4130000     7.407000  0.4023000     0.6687000      0.5765000 
1 1 1 5  47 8  o 6.587000  0.2737000     6.621000  0.3415000     6.553000  0.4280000     0.6851000E-01  0.5475000 
1 1 1 5  47 9  o 4.280000  0.3477000     4.182000  0.4883000     4.377000  0.4952000     -0.1946000     0.6955000 
1 1 1 5  47 10 o 3.674000  0.4066000     3.900000  0.5460000     3.449000  0.6028000     0.4513000      0.8133000 
1 1 1 5  47 11 o 3.525000  0.4226000     3.563000  0.6070000     3.488000  0.5881000     0.7515000E-01  0.8451000 
1 1 1 5  47 12 o 1.967000  0.5094000     1.686000  0.7124000     2.249000  0.7284000     -0.5628000     1.019000  
1 1 1 5  47 13 o 1.532000  0.4759000     1.713000  0.7231000     1.350000  0.6189000     0.3632000      0.9518000 
1 1 1 5  47 14 o 2.643000  0.5128000     2.823000  0.7125000     2.462000  0.7378000     0.3608000      1.026000  
1 1 1 5  47 15 o 2.714000  0.5144000     2.599000  0.7468000     2.829000  0.7076000     -0.2306000     1.029000  
1 1 1 5  47 16 o 2.110000  0.7508000     2.110000  0.7508000     ?         ?             ?              ?         
1 1 1 5  47 17 o 2.613000  0.4938000     3.005000  0.6659000     2.221000  0.7295000     0.7842000      0.9877000 
1 1 1 5  47 18 o 1.519000  0.4586000     1.459000  0.6346000     1.579000  0.6622000     -0.1198000     0.9172000 
1 1 1 5  47 19 o 1.521000  0.4551000     1.718000  0.6798000     1.323000  0.6053000     0.3954000      0.9102000 
1 1 1 5  48 0  o 0.9015000 0.6133000     0.9015000 0.6133000     0.9015000 0.6133000     0.000000       0.000000  
1 1 1 5  48 1  o 5.279000  0.2597000     5.054000  0.3759000     5.505000  0.3583000     -0.4508000     0.5193000 
1 1 1 5  48 2  f 2.784000  0.4474000     2.343000  0.6953000     3.226000  0.5631000     -0.8831000     0.8948000 
1 1 1 5  48 3  o 10.07000  0.2544000     9.798000  0.3961000     10.34000  0.3194000     -0.5415000     0.5088000 
1 1 1 5  48 4  o 2.180000  0.8367000     2.180000  0.8367000     ?         ?             ?              ?         
1 1 1 5  48 5  o 6.500000  0.4220000     6.650000  0.4457000     6.350000  0.7168000     0.3002000      0.8441000 
1 1 1 5  48 6  o 6.647000  0.2609000     6.740000  0.3913000     6.554000  0.3452000     0.1866000      0.5218000 
1 1 1 5  48 7  f 14.68000  0.2148000     14.64000  0.2730000     14.72000  0.3316000     -0.8093000E-01 0.4295000 
1 1 1 5  48 8  o 6.903000  0.2688000     6.870000  0.3386000     6.936000  0.4177000     -0.6586000E-01 0.5376000 
1 1 1 5  48 9  o 15.16000  0.2010000     15.22000  0.2846000     15.09000  0.2839000     0.1339000      0.4020000 
1 1 1 5  48 10 o 11.88000  0.2023000     12.02000  0.2905000     11.74000  0.2815000     0.2802000      0.4045000 
1 1 1 5  48 11 o 7.454000  0.2480000     7.325000  0.3704000     7.582000  0.3299000     -0.2563000     0.4960000 
1 1 1 5  48 12 o 3.834000  0.4164000     4.035000  0.5954000     3.632000  0.5823000     0.4023000      0.8329000 
1 1 1 5  48 13 o 5.508000  0.3021000     5.603000  0.4408000     5.414000  0.4134000     0.1885000      0.6043000 
1 1 1 5  48 14 o 2.848000  0.4895000     2.439000  0.7317000     3.257000  0.6503000     -0.8173000     0.9789000 
1 1 1 5  48 15 o 1.507000  0.5015000     1.535000  0.7174000     1.480000  0.7009000     0.5527000E-01  1.003000  
1 1 1 5  48 16 o 2.530000  0.4705000     1.636000  0.7368000     3.424000  0.5852000     -1.788000      0.9409000 
1 1 1 5  48 17 o 2.395000  0.5126000     2.313000  0.7363000     2.476000  0.7134000     -0.1629000     1.025000  
1 1 1 5  48 18 o 1.802000  0.4985000     1.813000  0.7070000     1.790000  0.7031000     0.2322000E-01  0.9971000 
1 1 1 5  48 19 o 1.297000  0.4191000     1.446000  0.6383000     1.148000  0.5433000     0.2981000      0.8382000 
1 1 1 5  49 0  o 8.355000  0.6038000     8.355000  0.6038000     8.355000  0.6038000     0.000000       0.000000  
1 1 1 5  49 1  o 7.276000  0.4779000     7.333000  0.6332000     7.220000  0.7158000     0.1131000      0.9557000 
1 1 1 5  49 3  o 2.354000  0.6346000     2.205000  0.8120000     2.503000  0.9755000     -0.2983000     1.269000  
1 1 1 5  49 4  f 11.40000  0.2431000     11.81000  0.3705000     10.99000  0.3149000     0.8191000      0.4863000 
1 1 1 5  49 5  o 3.780000  0.3588000     3.664000  0.5229000     3.895000  0.4916000     -0.2307000     0.7177000 
1 1 1 5  49 6  o 8.657000  0.2086000     8.511000  0.2959000     8.803000  0.2940000     -0.2911000     0.4171000 
1 1 1 5  49 7  o 4.746000  0.3432000     4.485000  0.4494000     5.006000  0.5189000     -0.5203000     0.6864000 
1 1 1 5  49 8  o 5.878000  0.2965000     5.700000  0.3860000     6.056000  0.4503000     -0.3565000     0.5930000 
1 1 1 5  49 9  o 2.904000  0.4874000     2.589000  0.7295000     3.220000  0.6466000     -0.6309000     0.9748000 
1 1 1 5  49 10 o 4.862000  0.3196000     4.478000  0.4761000     5.245000  0.4263000     -0.7674000     0.6391000 
1 1 1 5  49 11 o 1.658000  0.4890000     1.457000  0.6599000     1.860000  0.7219000     -0.4031000     0.9780000 
1 1 1 5  49 12 o 3.704000  0.4454000     3.134000  0.7322000     4.274000  0.5075000     -1.140000      0.8908000 
1 1 1 5  49 13 o 2.706000  0.5206000     2.486000  0.7763000     2.925000  0.6940000     -0.4395000     1.041000  
1 1 1 5  49 14 o 3.219000  0.5340000     2.545000  0.9184000     3.894000  0.5452000     -1.349000      1.068000  
1 1 1 5  49 15 o 2.120000  0.8170000     2.120000  0.8170000     ?         ?             ?              ?         
1 1 1 5  49 16 o 2.044000  0.4971000     2.422000  0.7210000     1.666000  0.6846000     0.7551000      0.9943000 
1 1 1 5  49 17 o 1.480000  0.4531000     1.417000  0.6266000     1.544000  0.6547000     -0.1269000     0.9062000 
1 1 1 5  49 18 o 1.930000  0.4987000     1.595000  0.6759000     2.265000  0.7334000     -0.6697000     0.9974000 
1 1 1 5  50 0  o 4.009000  0.5835000     4.009000  0.5835000     4.009000  0.5835000     -0.000000      0.000000  
1 1 1 5  50 1  o 8.950000  0.2353000     8.734000  0.3335000     9.167000  0.3321000     -0.4331000     0.4706000 
1 1 1 5  50 2  o 6.424000  0.2406000     6.527000  0.3412000     6.321000  0.3394000     0.2062000      0.4812000 
1 1 1 5  50 3  f 5.838000  0.2543000     5.728000  0.3575000     5.947000  0.3618000     -0.2195000     0.5086000 
1 1 1 5  50 4  o 3.745000  0.3750000     3.498000  0.5714000     3.991000  0.4858000     -0.4933000     0.7500000 
1 1 1 5  50 5  o 7.639000  0.2212000     7.861000  0.3050000     7.418000  0.3205000     0.4427000      0.4424000 
1 1 1 5  50 6  o 4.980000  0.3032000     4.806000  0.4368000     5.153000  0.4208000     -0.3464000     0.6065000 
1 1 1 5  50 7  o 3.110000  0.4921000     2.627000  0.7048000     3.592000  0.6870000     -0.9651000     0.9842000 
1 1 1 5  50 8  o 1.587000  0.4914000     1.481000  0.6589000     1.694000  0.7292000     -0.2129000     0.9828000 
1 1 1 5  50 9  o 3.210000  0.4541000     2.922000  0.6978000     3.499000  0.5814000     -0.5777000     0.9082000 
1 1 1 5  50 10 f 1.599000  0.4684000     1.321000  0.6090000     1.876000  0.7118000     -0.5550000     0.9368000 
1 1 1 5  50 11 o 4.971000  0.3371000     5.018000  0.4996000     4.925000  0.4528000     0.9242000E-01  0.6743000 
1 1 1 5  50 12 o 1.804000  0.5087000     1.865000  0.7385000     1.742000  0.6997000     0.1227000      1.017000  
1 1 1 5  50 13 o 3.283000  0.4566000     3.662000  0.6082000     2.904000  0.6811000     0.7576000      0.9131000 
1 1 1 5  50 14 o 1.704000  0.7671000     1.704000  0.7671000     ?         ?             ?              ?         
1 1 1 5  50 15 o 1.509000  0.4603000     1.272000  0.6030000     1.746000  0.6957000     -0.4736000     0.9206000 
1 1 1 5  50 16 o 2.656000  0.4963000     2.333000  0.7264000     2.979000  0.6766000     -0.6458000     0.9927000 
1 1 1 5  50 17 o 1.636000  0.4802000     1.747000  0.6963000     1.525000  0.6616000     0.2220000      0.9605000 
1 1 1 5  50 18 o 1.388000  0.4406000     1.392000  0.6225000     1.384000  0.6238000     0.7986000E-02  0.8813000 
1 1 1 5  51 0  o 19.00000  0.2923000     19.00000  0.2923000     19.00000  0.2923000     0.000000       0.000000  
1 1 1 5  51 1  o 2.164000  0.4981000     2.387000  0.6996000     1.942000  0.7092000     0.4455000      0.9962000 
1 1 1 5  51 2  o 1.570000  0.4680000     1.447000  0.6387000     1.692000  0.6842000     -0.2447000     0.9360000 
1 1 1 5  51 3  o 1.913000  0.4947000     2.088000  0.7117000     1.737000  0.6873000     0.3502000      0.9894000 
1 1 1 5  51 4  o 1.983000  0.4923000     1.696000  0.6823000     2.269000  0.7100000     -0.5726000     0.9847000 
1 1 1 5  51 5  o 9.906000  0.2028000     9.960000  0.2820000     9.853000  0.2916000     0.1071000      0.4056000 
1 1 1 5  51 6  f 6.234000  0.2618000     6.397000  0.3526000     6.070000  0.3871000     0.3267000      0.5237000 
1 1 1 5  51 7  o 1.697000  0.5050000     1.727000  0.6975000     1.668000  0.7303000     0.5841000E-01  1.010000  
1 1 1 5  51 8  o 6.132000  0.2844000     5.919000  0.3824000     6.344000  0.4211000     -0.4248000     0.5688000 
1 1 1 5  51 9  o 2.458000  0.5189000     2.322000  0.7481000     2.594000  0.7192000     -0.2726000     1.038000  
1 1 1 5  51 10 o 3.226000  0.4693000     4.079000  0.5444000     2.374000  0.7646000     1.705000       0.9386000 
1 1 1 5  51 11 o 3.271000  0.4735000     2.646000  0.7813000     3.897000  0.5351000     -1.251000      0.9470000 
1 1 1 5  51 12 o 2.838000  0.5068000     2.842000  0.7350000     2.834000  0.6980000     0.7929000E-02  1.014000  
1 1 1 5  51 13 o 2.294000  0.6186000     2.676000  1.004000      1.913000  0.7231000     0.7634000      1.237000  
1 1 1 5  51 14 o 1.315000  0.4364000     1.382000  0.6452000     1.247000  0.5877000     0.1346000      0.8728000 
1 1 1 5  51 15 o 1.368000  0.4360000     1.586000  0.6743000     1.151000  0.5529000     0.4351000      0.8720000 
1 1 1 5  51 16 o 2.006000  0.5077000     2.191000  0.7186000     1.820000  0.7172000     0.3711000      1.015000  
1 1 1 5  51 17 o 1.447000  0.4514000     1.440000  0.6354000     1.453000  0.6413000     -0.1257000E-01 0.9028000 
1 1 1 5  51 18 o 1.425000  0.4978000     1.446000  0.7110000     1.403000  0.6970000     0.4317000E-01  0.9957000 
1 1 1 5  52 0  o 10.02000  0.2849000     10.02000  0.2849000     10.02000  0.2849000     0.000000       0.000000  
1 1 1 5  52 1  o 2.851000  0.4706000     2.919000  0.6563000     2.783000  0.6746000     0.1357000      0.9411000 
1 1 1 5  52 2  o 3.097000  0.4377000     3.552000  0.5571000     2.642000  0.6753000     0.9098000      0.8754000 
1 1 1 5  52 3  f 6.105000  0.2513000     5.935000  0.3658000     6.276000  0.3448000     -0.3414000     0.5027000 
1 1 1 5  52 4  o 3.824000  0.3610000     4.144000  0.4689000     3.503000  0.5492000     0.6413000      0.7221000 
1 1 1 5  52 5  o 7.476000  0.2255000     7.524000  0.3161000     7.428000  0.3218000     0.9528000E-01  0.4511000 
1 1 1 5  52 6  o 5.118000  0.3129000     4.811000  0.4308000     5.424000  0.4538000     -0.6138000     0.6257000 
1 1 1 5  52 7  o 4.180000  0.3905000     4.413000  0.4558000     3.948000  0.6342000     0.4654000      0.7810000 
1 1 1 5  52 8  f 1.546000  0.4834000     1.412000  0.6363000     1.681000  0.7279000     -0.2692000     0.9668000 
1 1 1 5  52 9  o 3.051000  0.4722000     3.643000  0.5747000     2.459000  0.7494000     1.184000       0.9444000 
1 1 1 5  52 10 o 2.608000  0.5171000     2.710000  0.7324000     2.506000  0.7303000     0.2040000      1.034000  
1 1 1 5  52 11 o 2.301000  0.5255000     2.792000  0.7626000     1.811000  0.7233000     0.9811000      1.051000  
1 1 1 5  52 12 o 1.994000  0.5644000     1.904000  0.8559000     2.085000  0.7361000     -0.1813000     1.129000  
1 1 1 5  52 13 o 2.712000  0.7548000     2.712000  0.7548000     ?         ?             ?              ?         
1 1 1 5  52 14 o 4.836000  0.3191000     4.865000  0.4470000     4.806000  0.4554000     0.5867000E-01  0.6381000 
1 1 1 5  52 15 o 1.732000  0.4983000     1.634000  0.6878000     1.830000  0.7213000     -0.1954000     0.9967000 
1 1 1 5  52 16 o 1.569000  0.4636000     1.770000  0.6887000     1.369000  0.6207000     0.4010000      0.9271000 
1 1 1 5  52 17 o 1.816000  0.4924000     1.529000  0.6613000     2.103000  0.7297000     -0.5739000     0.9848000 
1 1 1 5  53 0  o 1.481000  0.8192000     1.481000  0.8192000     1.481000  0.8192000     -0.000000      0.000000  
1 1 1 5  53 1  o 7.950000  0.2185000     7.541000  0.3178000     8.360000  0.2999000     -0.8195000     0.4370000 
1 1 1 5  53 2  o 3.879000  0.3641000     4.066000  0.4923000     3.692000  0.5367000     0.3740000      0.7283000 
1 1 1 5  53 3  f 3.221000  0.4296000     3.556000  0.5616000     2.886000  0.6501000     0.6705000      0.8591000 
1 1 1 5  53 4  o 1.385000  0.4389000     1.506000  0.6541000     1.264000  0.5854000     0.2420000      0.8778000 
1 1 1 5  53 5  o 1.952000  0.5048000     2.176000  0.7282000     1.729000  0.6993000     0.4477000      1.010000  
1 1 1 5  53 6  o 1.476000  0.4543000     1.704000  0.6850000     1.249000  0.5969000     0.4549000      0.9086000 
1 1 1 5  53 7  o 3.512000  0.4504000     3.206000  0.6156000     3.817000  0.6576000     -0.6112000     0.9008000 
1 1 1 5  53 8  o 5.051000  0.3469000     4.653000  0.4735000     5.450000  0.5070000     -0.7964000     0.6937000 
1 1 1 5  53 9  o 4.948000  0.3291000     4.389000  0.5067000     5.507000  0.4200000     -1.118000      0.6582000 
1 1 1 5  53 10 o 1.450000  0.4493000     1.139000  0.5485000     1.760000  0.7119000     -0.6207000     0.8987000 
1 1 1 5  53 11 o 2.273000  0.4583000     1.391000  0.6387000     3.155000  0.6573000     -1.764000      0.9165000 
1 1 1 5  53 12 o 2.146000  0.8369000     2.146000  0.8369000     ?         ?             ?              ?         
1 1 1 5  53 13 o 1.419000  0.4549000     1.327000  0.6338000     1.511000  0.6527000     -0.1835000     0.9098000 
1 1 1 5  53 14 o 1.657000  0.4856000     1.594000  0.6784000     1.720000  0.6949000     -0.1259000     0.9712000 
1 1 1 5  53 15 o 2.033000  0.5164000     2.141000  0.7390000     1.925000  0.7215000     0.2163000      1.033000  
1 1 1 5  53 16 o 2.183000  0.5133000     2.000000  0.7115000     2.365000  0.7401000     -0.3652000     1.027000  
1 1 1 5  53 17 o 1.437000  0.5027000     1.426000  0.7087000     1.447000  0.7130000     -0.2130000E-01 1.005000  
1 1 1 5  54 0  o 1.101000  0.7080000     1.101000  0.7080000     1.101000  0.7080000     -0.000000      0.000000  
1 1 1 5  54 1  o 4.651000  0.3162000     5.298000  0.3977000     4.005000  0.4918000     1.293000       0.6325000 
1 1 1 5  54 2  o 7.262000  0.2299000     7.324000  0.3196000     7.199000  0.3306000     0.1244000      0.4598000 
1 1 1 5  54 3  o 4.743000  0.3094000     5.090000  0.4159000     4.396000  0.4582000     0.6939000      0.6188000 
1 1 1 5  54 4  o 4.161000  0.3498000     4.263000  0.4779000     4.059000  0.5108000     0.2040000      0.6995000 
1 1 1 5  54 5  o 2.884000  0.4650000     3.050000  0.6303000     2.719000  0.6839000     0.3311000      0.9301000 
1 1 1 5  54 6  o 2.685000  0.5304000     2.372000  0.7395000     2.998000  0.7605000     -0.6259000     1.061000  
1 1 1 5  54 7  f 3.206000  0.4857000     2.809000  0.6921000     3.603000  0.6816000     -0.7938000     0.9714000 
1 1 1 5  54 8  o 2.593000  0.5178000     2.910000  0.6936000     2.277000  0.7689000     0.6333000      1.036000  
1 1 1 5  54 9  o 2.825000  0.4985000     3.145000  0.6670000     2.504000  0.7410000     0.6412000      0.9970000 
1 1 1 5  54 10 o 1.245000  0.4094000     1.440000  0.6348000     1.051000  0.5171000     0.3889000      0.8187000 
1 1 1 5  54 11 o 2.046000  0.9069000     2.046000  0.9069000     ?         ?             ?              ?         
1 1 1 5  54 12 o 1.501000  0.4756000     1.422000  0.6703000     1.579000  0.6748000     -0.1575000     0.9511000 
1 1 1 5  54 13 o 3.930000  0.3734000     4.022000  0.5311000     3.837000  0.5249000     0.1844000      0.7467000 
1 1 1 5  54 14 o 1.555000  0.4692000     1.474000  0.6493000     1.636000  0.6776000     -0.1621000     0.9385000 
1 1 1 5  54 15 o 2.187000  0.5207000     2.136000  0.7328000     2.238000  0.7401000     -0.1027000     1.041000  
1 1 1 5  54 16 o 2.210000  0.5132000     2.118000  0.7250000     2.302000  0.7266000     -0.1847000     1.026000  
1 1 1 5  55 0  o 7.514000  0.3137000     7.514000  0.3137000     7.514000  0.3137000     0.000000       0.000000  
1 1 1 5  55 1  o 5.444000  0.2758000     5.143000  0.4050000     5.745000  0.3746000     -0.6025000     0.5516000 
1 1 1 5  55 2  o 5.467000  0.2744000     5.588000  0.3868000     5.346000  0.3895000     0.2421000      0.5489000 
1 1 1 5  55 3  o 4.000000  0.3557000     3.722000  0.5276000     4.279000  0.4772000     -0.5567000     0.7114000 
1 1 1 5  55 4  o 3.765000  0.3978000     3.106000  0.6424000     4.425000  0.4692000     -1.319000      0.7955000 
1 1 1 5  55 5  o 1.975000  0.4910000     2.479000  0.7368000     1.472000  0.6493000     1.007000       0.9821000 
1 1 1 5  55 6  o 2.881000  0.5283000     3.059000  0.6706000     2.704000  0.8165000     0.3546000      1.057000  
1 1 1 5  55 7  o 1.026000  0.3623000     0.8978000 0.4514000     1.154000  0.5669000     -0.2566000     0.7246000 
1 1 1 5  55 8  o 3.783000  0.4140000     4.144000  0.5116000     3.423000  0.6510000     0.7209000      0.8280000 
1 1 1 5  55 9  o 1.711000  0.4883000     1.438000  0.6425000     1.983000  0.7355000     -0.5458000     0.9766000 
1 1 1 5  55 10 o 1.750000  0.5373000     2.192000  0.8775000     1.308000  0.6203000     0.8843000      1.075000  
1 1 1 5  55 11 o 1.503000  0.4805000     1.241000  0.6041000     1.766000  0.7473000     -0.5252000     0.9609000 
1 1 1 5  55 12 o 2.092000  0.5251000     1.862000  0.7501000     2.323000  0.7350000     -0.4608000     1.050000  
1 1 1 5  55 13 o 1.362000  0.4359000     1.586000  0.6785000     1.137000  0.5476000     0.4487000      0.8719000 
1 1 1 5  55 14 o 1.189000  0.3992000     1.048000  0.5141000     1.331000  0.6109000     -0.2827000     0.7984000 
1 1 1 5  55 15 o 1.475000  0.4545000     1.348000  0.6118000     1.601000  0.6724000     -0.2530000     0.9090000 
1 1 1 5  56 0  o 2.672000  0.8194000     2.672000  0.8194000     2.672000  0.8194000     -0.000000      0.000000  
1 1 1 5  56 1  o 1.245000  0.4093000     1.410000  0.6288000     1.080000  0.5241000     0.3305000      0.8186000 
1 1 1 5  56 2  o 3.216000  0.4590000     3.361000  0.6331000     3.072000  0.6647000     0.2894000      0.9179000 
1 1 1 5  56 3  o 7.717000  0.2373000     7.927000  0.3293000     7.507000  0.3418000     0.4196000      0.4746000 
1 1 1 5  56 4  o 1.996000  0.5043000     2.367000  0.7397000     1.624000  0.6857000     0.7432000      1.009000  
1 1 1 5  56 5  f 1.186000  0.3987000     1.342000  0.6140000     1.031000  0.5089000     0.3109000      0.7974000 
1 1 1 5  56 6  o 1.779000  0.5101000     1.922000  0.7215000     1.636000  0.7212000     0.2858000      1.020000  
1 1 1 5  56 7  o 4.409000  0.3825000     4.615000  0.4606000     4.204000  0.6107000     0.4109000      0.7650000 
1 1 1 5  56 8  o 1.448000  0.4550000     1.545000  0.6636000     1.351000  0.6226000     0.1938000      0.9100000 
1 1 1 5  56 9  o 2.118000  0.5567000     1.612000  0.7494000     2.625000  0.8235000     -1.013000      1.113000  
1 1 1 5  56 10 o 2.029000  0.6153000     2.036000  0.8185000     2.022000  0.9189000     0.1381000E-01  1.231000  
1 1 1 5  56 11 o 1.448000  0.4526000     1.159000  0.5661000     1.738000  0.7064000     -0.5799000     0.9052000 
1 1 1 5  56 12 o 1.885000  0.4880000     1.372000  0.6391000     2.398000  0.7377000     -1.026000      0.9760000 
1 1 1 5  56 13 o 3.752000  0.3986000     4.103000  0.5075000     3.402000  0.6149000     0.7014000      0.7973000 
1 1 1 5  56 14 o 1.322000  0.4264000     1.479000  0.6461000     1.164000  0.5567000     0.3151000      0.8528000 
1 1 1 5  56 15 o 1.065000  0.3657000     1.263000  0.5858000     0.8672000 0.4378000     0.3962000      0.7313000 
1 1 1 5  57 0  o 1.339000  0.7930000     1.339000  0.7930000     1.339000  0.7930000     -0.000000      0.000000  
1 1 1 5  57 1  o 6.043000  0.2678000     5.755000  0.3901000     6.330000  0.3670000     -0.5747000     0.5356000 
1 1 1 5  57 2  o 4.367000  0.3611000     5.053000  0.4414000     3.681000  0.5716000     1.372000       0.7222000 
1 1 1 5  57 3  o 3.215000  0.4911000     3.765000  0.5691000     2.665000  0.8005000     1.100000       0.9822000 
1 1 1 5  57 4  o 3.434000  0.4363000     3.043000  0.6852000     3.825000  0.5403000     -0.7818000     0.8727000 
1 1 1 5  57 5  f 7.365000  0.2427000     7.533000  0.3380000     7.198000  0.3485000     0.3350000      0.4855000 
1 1 1 5  57 6  o 2.033000  0.5418000     1.800000  0.7152000     2.267000  0.8140000     -0.4671000     1.084000  
1 1 1 5  57 7  o 2.138000  0.5130000     2.537000  0.7123000     1.739000  0.7384000     0.7977000      1.026000  
1 1 1 5  57 8  o 2.064000  0.6416000     1.999000  0.8460000     2.130000  0.9648000     -0.1307000     1.283000  
1 1 1 5  57 9  o 1.970000  0.6043000     1.530000  0.7071000     2.410000  0.9801000     -0.8793000     1.209000  
1 1 1 5  57 10 o 4.957000  0.3243000     4.949000  0.4646000     4.966000  0.4526000     -0.1668000E-01 0.6487000 
1 1 1 5  57 11 o 4.568000  0.3593000     4.743000  0.5254000     4.393000  0.4902000     0.3501000      0.7186000 
1 1 1 5  57 12 o 3.344000  0.4789000     2.711000  0.7995000     3.977000  0.5272000     -1.267000      0.9577000 
1 1 1 5  57 13 o 1.090000  0.3742000     1.188000  0.5650000     0.9910000 0.4907000     0.1971000      0.7484000 
1 1 1 5  57 14 o 2.313000  0.4692000     3.102000  0.6647000     1.524000  0.6624000     1.579000       0.9384000 
1 1 1 5  58 0  o 6.478000  0.3645000     6.478000  0.3645000     6.478000  0.3645000     -0.000000      0.000000  
1 1 1 5  58 1  o 1.731000  0.4923000     1.950000  0.7291000     1.511000  0.6616000     0.4390000      0.9845000 
1 1 1 5  58 2  o 5.113000  0.3060000     4.897000  0.4442000     5.328000  0.4211000     -0.4317000     0.6121000 
1 1 1 5  58 3  o 4.383000  0.3410000     4.669000  0.4534000     4.096000  0.5095000     0.5726000      0.6820000 
1 1 1 5  58 4  o 3.495000  0.4164000     4.066000  0.5141000     2.923000  0.6552000     1.143000       0.8329000 
1 1 1 5  58 5  o 4.767000  0.3213000     4.743000  0.4430000     4.792000  0.4656000     -0.4893000E-01 0.6427000 
1 1 1 5  58 6  o 4.248000  0.5045000     4.139000  0.7718000     4.358000  0.6499000     -0.2191000     1.009000  
1 1 1 5  58 7  o 1.547000  0.7169000     1.547000  0.7169000     ?         ?             ?              ?         
1 1 1 5  58 8  o 1.790000  0.5381000     2.020000  0.8191000     1.561000  0.6980000     0.4593000      1.076000  
1 1 1 5  58 9  o 2.403000  0.5181000     2.136000  0.7432000     2.670000  0.7220000     -0.5338000     1.036000  
1 1 1 5  58 10 o 4.109000  0.3825000     3.835000  0.5808000     4.384000  0.4979000     -0.5483000     0.7650000 
1 1 1 5  58 11 o 1.373000  0.4429000     1.233000  0.5937000     1.512000  0.6574000     -0.2784000     0.8858000 
1 1 1 5  58 12 o 1.260000  0.4204000     1.390000  0.6395000     1.131000  0.5458000     0.2592000      0.8408000 
1 1 1 5  58 13 o 1.260000  0.4172000     1.259000  0.5912000     1.261000  0.5887000     -0.1621000E-02 0.8344000 
1 1 1 5  59 0  o 1.172000  0.7442000     1.172000  0.7442000     1.172000  0.7442000     0.000000       0.000000  
1 1 1 5  59 1  o 1.917000  0.5072000     2.051000  0.7269000     1.784000  0.7076000     0.2670000      1.014000  
1 1 1 5  59 2  o 1.605000  0.4539000     1.087000  0.5289000     2.124000  0.7379000     -1.036000      0.9079000 
1 1 1 5  59 3  o 1.518000  0.4677000     1.476000  0.6472000     1.559000  0.6755000     -0.8281000E-01 0.9355000 
1 1 1 5  59 4  o 3.084000  0.5708000     2.529000  0.9055000     3.639000  0.6952000     -1.109000      1.142000  
1 1 1 5  59 5  o 4.433000  0.6393000     5.366000  0.6077000     3.499000  1.125000      1.867000       1.279000  
1 1 1 5  59 6  o 2.199000  0.6346000     1.191000  0.5890000     3.207000  1.124000      -2.016000      1.269000  
1 1 1 5  59 7  o 3.936000  0.5090000     4.526000  0.6757000     3.347000  0.7615000     1.179000       1.018000  
1 1 1 5  59 8  o 4.546000  0.3497000     4.258000  0.5075000     4.834000  0.4813000     -0.5760000     0.6994000 
1 1 1 5  59 9  o 3.302000  0.4674000     3.546000  0.6113000     3.057000  0.7074000     0.4890000      0.9349000 
1 1 1 5  59 10 o 3.372000  0.4574000     3.504000  0.6382000     3.240000  0.6555000     0.2640000      0.9149000 
1 1 1 5  59 11 o 1.638000  0.4840000     1.408000  0.6492000     1.867000  0.7181000     -0.4589000     0.9680000 
1 1 1 5  59 12 o 1.611000  0.4882000     1.579000  0.6948000     1.643000  0.6861000     -0.6457000E-01 0.9765000 
1 1 1 5  59 13 o 1.477000  0.4597000     1.383000  0.6252000     1.570000  0.6740000     -0.1864000     0.9193000 
1 1 1 5  60 0  o 2.472000  1.099000      2.472000  1.099000      2.472000  1.099000      0.000000       0.000000  
1 1 1 5  60 1  o 4.366000  0.5564000     4.683000  0.7125000     4.048000  0.8548000     0.6346000      1.113000  
1 1 1 5  60 2  o 6.194000  0.4212000     5.825000  0.6155000     6.563000  0.5750000     -0.7380000     0.8423000 
1 1 1 5  60 3  o 4.904000  1.042000      4.904000  1.042000      ?         ?             ?              ?         
1 1 1 5  60 4  o 3.781000  0.6370000     4.462000  0.6861000     3.099000  1.073000      1.363000       1.274000  
1 1 1 5  60 5  o 2.221000  0.5908000     2.626000  0.8763000     1.816000  0.7925000     0.8100000      1.182000  
1 1 1 5  60 6  o 1.601000  0.4830000     1.771000  0.7030000     1.430000  0.6626000     0.3417000      0.9660000 
1 1 1 5  60 7  o 2.799000  0.5508000     2.352000  0.7515000     3.247000  0.8056000     -0.8948000     1.102000  
1 1 1 5  60 8  o 3.761000  0.4298000     4.353000  0.5229000     3.169000  0.6823000     1.184000       0.8596000 
1 1 1 5  60 9  o 1.779000  0.5084000     1.596000  0.6878000     1.962000  0.7489000     -0.3659000     1.017000  
1 1 1 5  60 10 o 1.968000  0.5203000     2.050000  0.7479000     1.886000  0.7234000     0.1644000      1.041000  
1 1 1 5  60 11 o 1.289000  0.4289000     1.327000  0.6243000     1.251000  0.5883000     0.7594000E-01  0.8578000 
1 1 1 5  60 12 o 1.286000  0.4266000     1.145000  0.5597000     1.426000  0.6441000     -0.2810000     0.8533000 
1 1 1 5  61 0  o 3.976000  0.7917000     3.976000  0.7917000     3.976000  0.7917000     -0.000000      0.000000  
1 1 1 5  61 1  o 1.605000  0.5178000     1.395000  0.6691000     1.815000  0.7906000     -0.4203000     1.036000  
1 1 1 5  61 2  o 3.119000  0.6033000     3.091000  0.8570000     3.148000  0.8493000     -0.5677000E-01 1.207000  
1 1 1 5  61 3  o 2.128000  0.5379000     2.406000  0.8003000     1.849000  0.7190000     0.5576000      1.076000  
1 1 1 5  61 4  o 2.540000  0.4960000     3.120000  0.6634000     1.961000  0.7377000     1.158000       0.9921000 
1 1 1 5  61 5  o 1.286000  0.4275000     1.443000  0.6489000     1.129000  0.5568000     0.3143000      0.8551000 
1 1 1 5  61 6  o 2.439000  0.5285000     1.694000  0.7030000     3.185000  0.7893000     -1.490000      1.057000  
1 1 1 5  61 7  o 2.523000  0.5368000     2.669000  0.7355000     2.377000  0.7822000     0.2918000      1.074000  
1 1 1 5  61 8  o 3.797000  0.4186000     3.481000  0.6380000     4.113000  0.5422000     -0.6322000     0.8373000 
1 1 1 5  61 9  o 4.124000  0.3998000     3.659000  0.6332000     4.589000  0.4885000     -0.9307000     0.7997000 
1 1 1 5  61 10 o 1.503000  0.4675000     1.407000  0.6379000     1.599000  0.6837000     -0.1922000     0.9351000 
1 1 1 5  61 11 o 2.674000  0.5308000     2.611000  0.7980000     2.736000  0.7002000     -0.1251000     1.062000  
1 1 1 5  62 0  o 1.183000  0.7550000     1.183000  0.7550000     1.183000  0.7550000     0.000000       0.000000  
1 1 1 5  62 1  o 3.271000  0.4603000     2.687000  0.7328000     3.855000  0.5572000     -1.168000      0.9206000 
1 1 1 5  62 2  o 5.055000  0.3212000     4.989000  0.4554000     5.120000  0.4532000     -0.1306000     0.6424000 
1 1 1 5  62 3  o 3.057000  0.4781000     2.818000  0.7085000     3.296000  0.6422000     -0.4772000     0.9562000 
1 1 1 5  62 4  o 1.605000  0.4734000     1.954000  0.7397000     1.256000  0.5910000     0.6982000      0.9468000 
1 1 1 5  62 5  o 4.046000  0.4411000     3.291000  0.6838000     4.801000  0.5572000     -1.511000      0.8821000 
1 1 1 5  62 6  o 4.920000  0.3570000     4.536000  0.4846000     5.304000  0.5243000     -0.7679000     0.7140000 
1 1 1 5  62 7  o 2.114000  0.4948000     1.491000  0.6607000     2.737000  0.7367000     -1.246000      0.9896000 
1 1 1 5  62 8  o 1.365000  0.4428000     1.341000  0.6179000     1.389000  0.6346000     -0.4832000E-01 0.8857000 
1 1 1 5  62 9  o 2.464000  0.5334000     2.553000  0.7447000     2.375000  0.7640000     0.1785000      1.067000  
1 1 1 5  62 10 o 2.410000  0.5153000     1.997000  0.7472000     2.822000  0.7098000     -0.8245000     1.031000  
1 1 1 5  63 0  o 4.876000  0.4641000     4.876000  0.4641000     4.876000  0.4641000     -0.000000      0.000000  
1 1 1 5  63 1  o 7.648000  0.2560000     7.610000  0.3666000     7.685000  0.3573000     -0.7527000E-01 0.5119000 
1 1 1 5  63 2  o 5.238000  0.3129000     5.565000  0.4234000     4.912000  0.4607000     0.6527000      0.6257000 
1 1 1 5  63 3  o 2.114000  0.4760000     1.389000  0.6360000     2.839000  0.7085000     -1.450000      0.9520000 
1 1 1 5  63 4  o 1.788000  0.4649000     1.115000  0.5432000     2.460000  0.7545000     -1.344000      0.9297000 
1 1 1 5  63 5  o 1.599000  0.4836000     1.870000  0.7346000     1.328000  0.6290000     0.5422000      0.9671000 
1 1 1 5  63 6  o 2.129000  0.5128000     2.572000  0.7265000     1.685000  0.7238000     0.8876000      1.026000  
1 1 1 5  63 7  o 1.338000  0.4312000     1.097000  0.5344000     1.580000  0.6768000     -0.4825000     0.8623000 
1 1 1 5  63 8  o 3.359000  0.4621000     2.899000  0.7191000     3.820000  0.5806000     -0.9205000     0.9242000 
1 1 1 5  63 9  o 3.022000  0.4954000     2.997000  0.7058000     3.048000  0.6953000     -0.5083000E-01 0.9908000 
1 1 1 5  64 0  o 7.505000  0.3603000     7.505000  0.3603000     7.505000  0.3603000     0.000000       0.000000  
1 1 1 5  64 1  o 3.655000  0.4399000     3.199000  0.6822000     4.111000  0.5555000     -0.9121000     0.8798000 
1 1 1 5  64 2  o 2.611000  0.5168000     2.292000  0.7612000     2.929000  0.6993000     -0.6377000     1.034000  
1 1 1 5  64 3  o 2.886000  0.5058000     2.805000  0.7234000     2.968000  0.7070000     -0.1632000     1.012000  
1 1 1 5  64 4  o 2.266000  0.5274000     2.509000  0.7492000     2.024000  0.7426000     0.4850000      1.055000  
1 1 1 5  64 5  o 1.286000  0.4255000     1.422000  0.6398000     1.150000  0.5612000     0.2719000      0.8510000 
1 1 1 5  64 6  o 2.242000  0.5369000     2.467000  0.7322000     2.017000  0.7855000     0.4505000      1.074000  
1 1 1 5  64 7  o 3.135000  0.4847000     2.837000  0.7229000     3.434000  0.6458000     -0.5972000     0.9694000 
1 1 1 5  64 8  o 1.838000  0.5143000     1.919000  0.7354000     1.758000  0.7191000     0.1610000      1.029000  
1 1 1 5  65 0  o 2.103000  0.9135000     2.103000  0.9135000     2.103000  0.9135000     -0.000000      0.000000  
1 1 1 5  65 1  o 1.787000  0.5032000     1.479000  0.6579000     2.094000  0.7618000     -0.6153000     1.006000  
1 1 1 5  65 2  o 1.663000  0.4947000     1.674000  0.7069000     1.653000  0.6924000     0.2143000E-01  0.9895000 
1 1 1 5  65 3  o 1.883000  0.5017000     2.324000  0.7629000     1.441000  0.6518000     0.8827000      1.003000  
1 1 1 5  65 4  o 4.127000  0.4375000     5.001000  0.4490000     3.253000  0.7511000     1.748000       0.8751000 
1 1 1 5  65 5  o 1.619000  0.4963000     1.358000  0.6214000     1.881000  0.7742000     -0.5232000     0.9927000 
1 1 1 5  65 6  o 3.247000  0.5071000     3.525000  0.6148000     2.968000  0.8066000     0.5573000      1.014000  
1 1 1 5  66 0  o 8.429000  0.3444000     8.429000  0.3444000     8.429000  0.3444000     -0.000000      0.000000  
1 1 1 5  66 1  o 3.049000  0.5065000     2.751000  0.7595000     3.348000  0.6701000     -0.5966000     1.013000  
1 1 1 5  66 2  o 2.809000  0.5113000     2.739000  0.7436000     2.879000  0.7020000     -0.1394000     1.023000  
1 1 1 5  66 3  o 1.657000  0.4718000     2.136000  0.7561000     1.179000  0.5645000     0.9569000      0.9436000 
1 1 1 5  66 4  o 2.003000  0.5133000     2.420000  0.7425000     1.585000  0.7090000     0.8355000      1.027000  
1 1 1 5  67 0  o 1.287000  0.8605000     1.287000  0.8605000     1.287000  0.8605000     0.000000       0.000000  
1 1 1 5  67 1  o 1.054000  0.3819000     1.040000  0.5364000     1.068000  0.5436000     -0.2746000E-01 0.7637000 
1 1 1 6  0  1  o 6.021000  0.9758000E-01 6.021000  0.9758000E-01 6.021000  0.9758000E-01 0.000000       0.000000  
1 1 1 6  0  2  o 6.049000  0.9990000E-01 6.049000  0.9990000E-01 6.049000  0.9990000E-01 -0.000000      0.000000  
1 1 1 6  0  3  o 2.347000  0.2142000     2.347000  0.2142000     2.347000  0.2142000     0.000000       0.000000  
1 1 1 6  0  4  o 9.972000  0.1683000     9.972000  0.1683000     9.972000  0.1683000     0.000000       0.000000  
1 1 1 6  0  5  o 8.861000  0.2161000     8.861000  0.2161000     8.861000  0.2161000     -0.000000      0.000000  
1 1 1 6  0  6  o 13.63000  0.1865000     13.63000  0.1865000     13.63000  0.1865000     -0.000000      0.000000  
1 1 1 6  0  7  o 39.87000  0.4443000     39.87000  0.4443000     39.87000  0.4443000     -0.000000      0.000000  
1 1 1 6  0  8  o 19.70000  0.2484000     19.70000  0.2484000     19.70000  0.2484000     -0.000000      0.000000  
1 1 1 6  0  9  o 10.40000  0.2026000     10.40000  0.2026000     10.40000  0.2026000     -0.000000      0.000000  
1 1 1 6  0  10 o 3.214000  0.5002000     3.214000  0.5002000     3.214000  0.5002000     -0.000000      0.000000  
1 1 1 6  0  11 o 12.97000  0.2753000     12.97000  0.2753000     12.97000  0.2753000     0.000000       0.000000  
1 1 1 6  0  12 o 8.682000  0.2643000     8.682000  0.2643000     8.682000  0.2643000     -0.000000      0.000000  
1 1 1 6  0  13 o 1.405000  0.8079000     1.405000  0.8079000     1.405000  0.8079000     -0.000000      0.000000  
1 1 1 6  0  14 o 11.50000  0.2840000     11.50000  0.2840000     11.50000  0.2840000     -0.000000      0.000000  
1 1 1 6  0  15 o 2.263000  1.006000      2.263000  1.006000      2.263000  1.006000      0.000000       0.000000  
1 1 1 6  0  16 o 11.52000  0.3662000     11.52000  0.3662000     11.52000  0.3662000     0.000000       0.000000  
1 1 1 6  0  17 f 5.705000  0.5096000     5.705000  0.5096000     5.705000  0.5096000     0.000000       0.000000  
1 1 1 6  0  18 o 6.301000  0.5101000     6.301000  0.5101000     6.301000  0.5101000     -0.000000      0.000000  
1 1 1 6  0  19 o 5.763000  0.6057000     5.763000  0.6057000     5.763000  0.6057000     0.000000       0.000000  
1 1 1 6  0  20 o 1.784000  1.104000      1.784000  1.104000      1.784000  1.104000      0.000000       0.000000  
1 1 1 6  0  21 o 1.790000  1.112000      1.790000  1.112000      1.790000  1.112000      -0.000000      0.000000  
1 1 1 6  0  22 o 5.344000  0.6483000     5.344000  0.6483000     5.344000  0.6483000     0.000000       0.000000  
1 1 1 6  0  23 o 2.055000  1.042000      2.055000  1.042000      2.055000  1.042000      0.000000       0.000000  
1 1 1 6  0  24 o 2.293000  0.9981000     2.293000  0.9981000     2.293000  0.9981000     -0.000000      0.000000  
1 1 1 6  0  25 o 1.860000  1.029000      1.860000  1.029000      1.860000  1.029000      0.000000       0.000000  
1 1 1 6  0  26 o 1.133000  0.7552000     1.133000  0.7552000     1.133000  0.7552000     0.000000       0.000000  
1 1 1 6  0  27 o 1.009000  0.6921000     1.009000  0.6921000     1.009000  0.6921000     0.000000       0.000000  
1 1 1 6  1  1  o 27.78000  0.2318000     27.81000  0.3031000     27.76000  0.3509000     0.5138000E-01  0.4637000 
1 1 1 6  1  2  o 13.11000  0.1093000     13.10000  0.1546000     13.12000  0.1545000     -0.1172000E-01 0.2185000 
1 1 1 6  1  3  o 13.48000  0.1347000     13.61000  0.1917000     13.34000  0.1893000     0.2785000      0.2694000 
1 1 1 6  1  4  o 27.45000  0.2518000     27.74000  0.3595000     27.15000  0.3526000     0.5951000      0.5036000 
1 1 1 6  1  5  o 11.11000  0.1954000     10.85000  0.3141000     11.37000  0.2326000     -0.5121000     0.3908000 
1 1 1 6  1  6  o 21.72000  0.1820000     21.78000  0.2581000     21.65000  0.2568000     0.1262000      0.3640000 
1 1 1 6  1  7  o 11.85000  0.1296000     11.95000  0.1829000     11.76000  0.1835000     0.1861000      0.2591000 
1 1 1 6  1  8  o 10.19000  0.1328000     10.40000  0.1878000     9.969000  0.1878000     0.4337000      0.2656000 
1 1 1 6  1  9  o 14.43000  0.1532000     14.44000  0.2168000     14.42000  0.2166000     0.1835000E-01  0.3065000 
1 1 1 6  1  10 o 13.53000  0.1810000     13.57000  0.2554000     13.49000  0.2565000     0.8425000E-01  0.3619000 
1 1 1 6  1  11 o 12.82000  0.1940000     12.72000  0.2728000     12.93000  0.2760000     -0.2096000     0.3881000 
1 1 1 6  1  12 o 10.85000  0.1802000     10.81000  0.2571000     10.90000  0.2525000     -0.9545000E-01 0.3603000 
1 1 1 6  1  13 f 6.027000  0.2487000     6.186000  0.3454000     5.868000  0.3580000     0.3186000      0.4975000 
1 1 1 6  1  14 o 7.296000  0.2378000     7.478000  0.3296000     7.114000  0.3427000     0.3635000      0.4755000 
1 1 1 6  1  15 o 6.793000  0.3070000     6.737000  0.4341000     6.850000  0.4343000     -0.1131000     0.6141000 
1 1 1 6  1  16 o 3.591000  0.5502000     2.435000  0.9022000     4.747000  0.6300000     -2.313000      1.100000  
1 1 1 6  1  17 o 9.628000  0.2501000     9.493000  0.3573000     9.763000  0.3500000     -0.2702000     0.5001000 
1 1 1 6  1  18 o 5.241000  0.4232000     4.951000  0.6302000     5.530000  0.5650000     -0.5784000     0.8464000 
1 1 1 6  1  19 o 4.717000  0.5187000     4.892000  0.7093000     4.541000  0.7570000     0.3511000      1.037000  
1 1 1 6  1  20 o 2.365000  0.6842000     1.914000  0.8769000     2.816000  1.051000      -0.9023000     1.368000  
1 1 1 6  1  21 o 4.594000  0.6638000     4.642000  0.9256000     4.546000  0.9517000     0.9574000E-01  1.328000  
1 1 1 6  1  22 o 3.177000  0.6222000     2.602000  0.9291000     3.752000  0.8278000     -1.149000      1.244000  
1 1 1 6  1  23 o 3.237000  0.5852000     3.602000  0.7937000     2.872000  0.8603000     0.7297000      1.170000  
1 1 1 6  1  24 o 2.439000  0.5422000     3.097000  0.7788000     1.782000  0.7546000     1.315000       1.084000  
1 1 1 6  1  25 o 1.383000  0.4695000     1.481000  0.6995000     1.286000  0.6264000     0.1949000      0.9390000 
1 1 1 6  1  26 o 1.970000  0.5184000     2.443000  0.7887000     1.497000  0.6730000     0.9460000      1.037000  
1 1 1 6  1  27 o 1.405000  0.4563000     1.168000  0.5684000     1.643000  0.7140000     -0.4751000     0.9127000 
1 1 1 6  2  0  o 49.43000  0.6191000     49.43000  0.6191000     49.43000  0.6191000     -0.000000      0.000000  
1 1 1 6  2  1  o 20.47000  0.1722000     20.28000  0.2240000     20.66000  0.2616000     -0.3786000     0.3444000 
1 1 1 6  2  2  o 11.56000  0.1031000     11.59000  0.1248000     11.53000  0.1641000     0.5417000E-01  0.2062000 
1 1 1 6  2  3  o 13.17000  0.1334000     13.11000  0.1875000     13.23000  0.1897000     -0.1230000     0.2667000 
1 1 1 6  2  4  o 19.88000  0.1896000     20.01000  0.2693000     19.74000  0.2669000     0.2739000      0.3792000 
1 1 1 6  2  5  o 21.06000  0.2260000     20.83000  0.3474000     21.29000  0.2890000     -0.4644000     0.4519000 
1 1 1 6  2  6  o 10.47000  0.1185000     10.51000  0.1674000     10.42000  0.1679000     0.8488000E-01  0.2371000 
1 1 1 6  2  7  o 18.86000  0.1665000     18.87000  0.2355000     18.84000  0.2353000     0.2633000E-01  0.3329000 
1 1 1 6  2  8  o 8.297000  0.1324000     8.288000  0.1873000     8.306000  0.1873000     -0.1808000E-01 0.2648000 
1 1 1 6  2  9  o 7.569000  0.1476000     7.564000  0.2066000     7.575000  0.2108000     -0.1127000E-01 0.2952000 
1 1 1 6  2  10 f 4.951000  0.2336000     4.502000  0.3482000     5.400000  0.3113000     -0.8982000     0.4671000 
1 1 1 6  2  11 o 11.34000  0.1908000     11.37000  0.2700000     11.32000  0.2695000     0.5274000E-01  0.3815000 
1 1 1 6  2  12 o 4.990000  0.2618000     4.649000  0.3858000     5.332000  0.3542000     -0.6832000     0.5237000 
1 1 1 6  2  13 o 5.232000  0.2738000     5.062000  0.3947000     5.402000  0.3796000     -0.3400000     0.5476000 
1 1 1 6  2  14 o 4.565000  0.3345000     4.381000  0.4881000     4.750000  0.4575000     -0.3695000     0.6690000 
1 1 1 6  2  15 o 7.389000  0.2933000     6.992000  0.4284000     7.785000  0.4008000     -0.7929000     0.5867000 
1 1 1 6  2  16 o 10.03000  0.2772000     9.829000  0.4024000     10.22000  0.3812000     -0.3948000     0.5543000 
1 1 1 6  2  17 o 8.614000  0.2676000     8.625000  0.3755000     8.604000  0.3813000     0.2110000E-01  0.5352000 
1 1 1 6  2  18 o 5.327000  0.4209000     5.364000  0.5921000     5.291000  0.5985000     0.7298000E-01  0.8418000 
1 1 1 6  2  19 o 6.831000  0.3678000     6.831000  0.5090000     6.831000  0.5311000     -0.4859000E-03 0.7356000 
1 1 1 6  2  20 o 1.935000  0.6111000     2.502000  1.013000      1.368000  0.6833000     1.133000       1.222000  
1 1 1 6  2  21 o 3.863000  0.7494000     3.516000  1.074000      4.209000  1.045000      -0.6926000     1.499000  
1 1 1 6  2  22 o 4.065000  0.5798000     4.091000  0.8030000     4.039000  0.8365000     0.5117000E-01  1.160000  
1 1 1 6  2  23 o 4.674000  0.4404000     4.966000  0.5873000     4.381000  0.6565000     0.5853000      0.8809000 
1 1 1 6  2  24 o 1.481000  0.4806000     1.562000  0.7042000     1.401000  0.6541000     0.1614000      0.9612000 
1 1 1 6  2  25 o 1.820000  0.5541000     1.902000  0.8052000     1.738000  0.7614000     0.1648000      1.108000  
1 1 1 6  2  26 o 2.039000  0.5459000     1.711000  0.7284000     2.368000  0.8133000     -0.6570000     1.092000  
1 1 1 6  2  27 o 1.185000  0.4073000     1.046000  0.5206000     1.325000  0.6266000     -0.2792000     0.8146000 
1 1 1 6  3  0  o 19.28000  0.2128000     19.28000  0.2128000     19.28000  0.2128000     -0.000000      0.000000  
1 1 1 6  3  1  f 32.50000  0.2711000     32.20000  0.3519000     32.80000  0.4124000     -0.6060000     0.5421000 
1 1 1 6  3  2  o 8.429000  0.8279000E-01 8.512000  0.1321000     8.346000  0.9979000E-01 0.1661000      0.1656000 
1 1 1 6  3  3  o 29.00000  0.2456000     29.21000  0.3232000     28.80000  0.3700000     0.4103000      0.4912000 
1 1 1 6  3  4  o 1.273000  0.2747000     1.568000  0.3796000     0.9786000 0.3971000     0.5894000      0.5494000 
1 1 1 6  3  5  o 17.16000  0.1925000     16.68000  0.2933000     17.64000  0.2495000     -0.9529000     0.3850000 
1 1 1 6  3  6  o 10.92000  0.1208000     10.91000  0.1710000     10.94000  0.1707000     -0.2639000E-01 0.2417000 
1 1 1 6  3  7  o 14.37000  0.1415000     14.47000  0.2006000     14.27000  0.1996000     0.1938000      0.2829000 
1 1 1 6  3  8  o 15.53000  0.1525000     15.59000  0.2159000     15.47000  0.2155000     0.1283000      0.3050000 
1 1 1 6  3  9  o 15.09000  0.1563000     14.65000  0.2180000     15.53000  0.2241000     -0.8794000     0.3126000 
1 1 1 6  3  10 o 10.42000  0.2161000     10.11000  0.3057000     10.73000  0.3055000     -0.6255000     0.4322000 
1 1 1 6  3  11 o 10.68000  0.1930000     10.54000  0.2733000     10.81000  0.2726000     -0.2693000     0.3860000 
1 1 1 6  3  12 o 11.86000  0.1775000     11.97000  0.2523000     11.74000  0.2498000     0.2359000      0.3551000 
1 1 1 6  3  13 o 5.016000  0.2866000     5.202000  0.4002000     4.831000  0.4105000     0.3714000      0.5733000 
1 1 1 6  3  14 o 7.119000  0.2429000     7.006000  0.3494000     7.231000  0.3376000     -0.2257000     0.4859000 
1 1 1 6  3  15 o 4.040000  0.4884000     3.013000  0.8213000     5.067000  0.5286000     -2.054000      0.9767000 
1 1 1 6  3  16 o 7.259000  0.3332000     7.096000  0.4750000     7.422000  0.4674000     -0.3262000     0.6664000 
1 1 1 6  3  17 o 1.710000  0.5347000     1.890000  0.7990000     1.531000  0.7108000     0.3586000      1.069000  
1 1 1 6  3  18 o 3.664000  0.5785000     3.160000  0.8778000     4.168000  0.7536000     -1.007000      1.157000  
1 1 1 6  3  19 o 4.567000  0.5396000     3.931000  0.8609000     5.203000  0.6508000     -1.271000      1.079000  
1 1 1 6  3  20 o 2.111000  0.6580000     2.349000  0.9930000     1.874000  0.8637000     0.4749000      1.316000  
1 1 1 6  3  21 o 2.654000  0.7359000     2.656000  1.050000      2.651000  1.031000      0.5299000E-02  1.472000  
1 1 1 6  3  22 o 2.327000  0.6401000     1.956000  0.8499000     2.697000  0.9574000     -0.7409000     1.280000  
1 1 1 6  3  23 o 2.288000  0.6093000     2.307000  0.8657000     2.269000  0.8576000     0.3791000E-01  1.219000  
1 1 1 6  3  24 o 1.357000  0.4567000     1.369000  0.6505000     1.345000  0.6412000     0.2367000E-01  0.9134000 
1 1 1 6  3  25 o 1.956000  0.5700000     1.587000  0.7301000     2.325000  0.8756000     -0.7388000     1.140000  
1 1 1 6  3  26 f 1.818000  0.5085000     1.283000  0.6119000     2.354000  0.8122000     -1.072000      1.017000  
1 1 1 6  3  27 o 1.504000  0.4813000     1.605000  0.7062000     1.404000  0.6540000     0.2009000      0.9626000 
1 1 1 6  4  0  o 22.62000  0.2493000     22.62000  0.2493000     22.62000  0.2493000     0.000000       0.000000  
1 1 1 6  4  1  o 9.589000  0.8397000E-01 9.487000  0.1177000     9.691000  0.1197000     -0.2040000     0.1679000 
1 1 1 6  4  2  o 4.852000  0.7103000E-01 4.829000  0.1046000     4.876000  0.9611000E-01 -0.4706000E-01 0.1421000 
1 1 1 6  4  3  o 22.08000  0.2166000     22.26000  0.3548000     21.90000  0.2484000     0.3556000      0.4331000 
1 1 1 6  4  4  o 22.68000  0.2128000     23.07000  0.3048000     22.29000  0.2971000     0.7787000      0.4257000 
1 1 1 6  4  5  o 20.84000  0.3034000     20.65000  0.4953000     21.04000  0.3506000     -0.3940000     0.6069000 
1 1 1 6  4  6  o 21.48000  0.1809000     21.42000  0.2553000     21.55000  0.2565000     -0.1261000     0.3619000 
1 1 1 6  4  7  o 13.08000  0.1356000     12.98000  0.1914000     13.18000  0.1922000     -0.2017000     0.2713000 
1 1 1 6  4  8  o 10.54000  0.1350000     10.46000  0.1908000     10.63000  0.1910000     -0.1738000     0.2700000 
1 1 1 6  4  9  o 11.09000  0.1439000     10.93000  0.2038000     11.25000  0.2033000     -0.3264000     0.2879000 
1 1 1 6  4  10 o 4.387000  0.3221000     4.580000  0.4327000     4.194000  0.4772000     0.3857000      0.6442000 
1 1 1 6  4  11 o 10.07000  0.1972000     9.893000  0.2796000     10.24000  0.2783000     -0.3510000     0.3945000 
1 1 1 6  4  12 o 5.723000  0.2522000     5.388000  0.3755000     6.058000  0.3369000     -0.6705000     0.5045000 
1 1 1 6  4  13 o 3.997000  0.3610000     4.264000  0.4846000     3.730000  0.5352000     0.5333000      0.7220000 
1 1 1 6  4  14 o 2.554000  0.5025000     1.921000  0.7407000     3.186000  0.6793000     -1.265000      1.005000  
1 1 1 6  4  15 o 1.600000  0.5070000     1.937000  0.8060000     1.264000  0.6154000     0.6728000      1.014000  
1 1 1 6  4  16 o 13.63000  0.2537000     13.82000  0.3612000     13.44000  0.3564000     0.3754000      0.5074000 
1 1 1 6  4  17 o 4.486000  0.4692000     4.893000  0.5861000     4.079000  0.7327000     0.8132000      0.9383000 
1 1 1 6  4  18 o 2.756000  0.6471000     2.603000  0.9210000     2.908000  0.9091000     -0.3046000     1.294000  
1 1 1 6  4  19 o 5.793000  0.4548000     4.989000  0.7137000     6.597000  0.5638000     -1.608000      0.9096000 
1 1 1 6  4  20 o 3.147000  0.7746000     3.224000  1.090000      3.070000  1.101000      0.1545000      1.549000  
1 1 1 6  4  21 o 2.389000  0.6786000     1.688000  0.8143000     3.089000  1.086000      -1.402000      1.357000  
1 1 1 6  4  22 o 2.953000  0.6709000     2.713000  0.9395000     3.193000  0.9579000     -0.4803000     1.342000  
1 1 1 6  4  23 o 2.275000  0.6038000     2.209000  0.8400000     2.341000  0.8676000     -0.1317000     1.208000  
1 1 1 6  4  24 o 1.182000  0.4092000     1.264000  0.6101000     1.100000  0.5454000     0.1647000      0.8184000 
1 1 1 6  4  25 o 1.569000  0.5121000     1.532000  0.7130000     1.607000  0.7352000     -0.7478000E-01 1.024000  
1 1 1 6  4  26 o 1.289000  0.4341000     1.425000  0.6602000     1.153000  0.5639000     0.2720000      0.8682000 
1 1 1 6  4  27 o 1.671000  0.5194000     1.916000  0.7849000     1.427000  0.6804000     0.4887000      1.039000  
1 1 1 6  5  0  o 33.51000  0.3660000     33.51000  0.3660000     33.51000  0.3660000     -0.000000      0.000000  
1 1 1 6  5  1  o 5.913000  0.6792000E-01 5.867000  0.9611000E-01 5.958000  0.9601000E-01 -0.9099000E-01 0.1358000 
1 1 1 6  5  2  o 9.790000  0.9022000E-01 9.717000  0.1271000     9.864000  0.1281000     -0.1470000     0.1804000 
1 1 1 6  5  3  o 15.66000  0.1516000     15.84000  0.2149000     15.47000  0.2140000     0.3699000      0.3033000 
1 1 1 6  5  4  o 34.68000  0.2930000     34.66000  0.4423000     34.71000  0.3844000     -0.5133000E-01 0.5860000 
1 1 1 6  5  5  o 18.81000  0.2080000     18.64000  0.3199000     18.97000  0.2660000     -0.3368000     0.4160000 
1 1 1 6  5  6  o 16.44000  0.1490000     16.34000  0.2098000     16.55000  0.2116000     -0.2010000     0.2980000 
1 1 1 6  5  7  f 7.059000  0.1297000     7.091000  0.1857000     7.027000  0.1812000     0.6403000E-01  0.2595000 
1 1 1 6  5  8  o 11.17000  0.1368000     11.01000  0.1927000     11.33000  0.1943000     -0.3186000     0.2736000 
1 1 1 6  5  9  o 2.636000  0.3200000     3.126000  0.3701000     2.146000  0.5223000     0.9805000      0.6401000 
1 1 1 6  5  10 o 15.76000  0.2366000     15.51000  0.3338000     16.01000  0.3352000     -0.4953000     0.4731000 
1 1 1 6  5  11 o 4.653000  0.2596000     4.173000  0.3945000     5.132000  0.3376000     -0.9589000     0.5192000 
1 1 1 6  5  12 o 13.36000  0.1800000     13.29000  0.2546000     13.42000  0.2546000     -0.1230000     0.3601000 
1 1 1 6  5  13 o 9.657000  0.1997000     9.646000  0.2814000     9.668000  0.2834000     -0.2272000E-01 0.3994000 
1 1 1 6  5  14 f 8.372000  0.2282000     8.449000  0.3197000     8.295000  0.3257000     0.1540000      0.4564000 
1 1 1 6  5  15 o 6.382000  0.3284000     6.479000  0.4642000     6.285000  0.4646000     0.1947000      0.6568000 
1 1 1 6  5  16 o 4.931000  0.4688000     4.520000  0.7177000     5.341000  0.6034000     -0.8210000     0.9376000 
1 1 1 6  5  17 o 12.35000  0.2345000     12.44000  0.3313000     12.27000  0.3320000     0.1668000      0.4690000 
1 1 1 6  5  18 o 7.153000  0.3355000     6.989000  0.4824000     7.318000  0.4663000     -0.3292000     0.6709000 
1 1 1 6  5  19 f 3.267000  0.6738000     2.810000  0.9802000     3.725000  0.9248000     -0.9154000     1.348000  
1 1 1 6  5  20 o 5.401000  0.7318000     6.229000  0.8656000     4.573000  1.180000      1.657000       1.464000  
1 1 1 6  5  21 o 2.515000  0.7044000     3.088000  1.086000      1.942000  0.8975000     1.146000       1.409000  
1 1 1 6  5  22 o 3.317000  0.6447000     3.790000  0.8832000     2.845000  0.9394000     0.9447000      1.289000  
1 1 1 6  5  23 o 2.355000  0.6071000     2.547000  0.8801000     2.163000  0.8365000     0.3840000      1.214000  
1 1 1 6  5  24 o 3.068000  0.5554000     3.043000  0.7968000     3.093000  0.7740000     -0.5047000E-01 1.111000  
1 1 1 6  5  25 o 1.411000  0.4784000     1.524000  0.7173000     1.298000  0.6332000     0.2259000      0.9568000 
1 1 1 6  5  26 o 1.456000  0.4717000     1.293000  0.6178000     1.619000  0.7128000     -0.3254000     0.9433000 
1 1 1 6  5  27 o 1.317000  0.4408000     1.379000  0.6434000     1.256000  0.6027000     0.1233000      0.8815000 
1 1 1 6  6  0  o 21.50000  0.2403000     21.50000  0.2403000     21.50000  0.2403000     0.000000       0.000000  
1 1 1 6  6  1  o 17.07000  0.1380000     17.23000  0.1967000     16.91000  0.1935000     0.3247000      0.2760000 
1 1 1 6  6  2  o 11.12000  0.1001000     11.04000  0.1404000     11.19000  0.1428000     -0.1480000     0.2002000 
1 1 1 6  6  3  o 38.88000  0.3491000     38.78000  0.4919000     38.98000  0.4956000     -0.2056000     0.6983000 
1 1 1 6  6  4  o 20.92000  0.2774000     21.37000  0.4818000     20.46000  0.2749000     0.9073000      0.5547000 
1 1 1 6  6  5  o 34.35000  0.4450000     34.19000  0.7715000     34.50000  0.4438000     -0.3075000     0.8901000 
1 1 1 6  6  6  o 28.44000  0.2301000     28.28000  0.3234000     28.60000  0.3273000     -0.3198000     0.4601000 
1 1 1 6  6  7  o 7.344000  0.1287000     7.470000  0.1823000     7.219000  0.1818000     0.2504000      0.2574000 
1 1 1 6  6  8  o 13.80000  0.1463000     13.88000  0.2070000     13.72000  0.2069000     0.1600000      0.2927000 
1 1 1 6  6  9  o 6.763000  0.1558000     6.944000  0.2144000     6.581000  0.2261000     0.3629000      0.3116000 
1 1 1 6  6  10 o 12.79000  0.1846000     12.80000  0.2617000     12.78000  0.2604000     0.2454000E-01  0.3692000 
1 1 1 6  6  11 o 7.926000  0.1835000     7.763000  0.2650000     8.090000  0.2539000     -0.3261000     0.3670000 
1 1 1 6  6  12 o 6.440000  0.2278000     6.267000  0.3298000     6.614000  0.3142000     -0.3464000     0.4556000 
1 1 1 6  6  13 o 10.19000  0.1946000     9.915000  0.2814000     10.47000  0.2687000     -0.5500000     0.3891000 
1 1 1 6  6  14 o 17.09000  0.2038000     17.31000  0.2887000     16.88000  0.2877000     0.4362000      0.4076000 
1 1 1 6  6  15 o 6.533000  0.3952000     6.526000  0.5603000     6.541000  0.5576000     -0.1507000E-01 0.7905000 
1 1 1 6  6  16 o 5.001000  0.4592000     4.817000  0.6824000     5.185000  0.6145000     -0.3679000     0.9183000 
1 1 1 6  6  17 o 18.47000  0.2302000     18.82000  0.3256000     18.13000  0.3254000     0.6893000      0.4604000 
1 1 1 6  6  18 o 2.318000  0.6419000     2.236000  0.8980000     2.401000  0.9174000     -0.1649000     1.284000  
1 1 1 6  6  19 o 2.209000  0.6014000     2.988000  0.9788000     1.431000  0.6992000     1.557000       1.203000  
1 1 1 6  6  20 o 4.103000  0.8329000     4.276000  1.135000      3.930000  1.220000      0.3458000      1.666000  
1 1 1 6  6  21 o 2.948000  0.7375000     3.140000  1.020000      2.755000  1.066000      0.3848000      1.475000  
1 1 1 6  6  22 o 2.289000  0.6343000     1.959000  0.8513000     2.618000  0.9404000     -0.6595000     1.269000  
1 1 1 6  6  23 o 2.309000  0.5793000     2.899000  0.8780000     1.719000  0.7558000     1.180000       1.159000  
1 1 1 6  6  24 o 1.353000  0.4514000     1.224000  0.5918000     1.481000  0.6817000     -0.2574000     0.9028000 
1 1 1 6  6  25 o 1.718000  0.5367000     2.121000  0.8592000     1.315000  0.6434000     0.8068000      1.073000  
1 1 1 6  6  26 o 2.081000  0.5588000     2.136000  0.7931000     2.026000  0.7873000     0.1098000      1.118000  
1 1 1 6  6  27 o 1.092000  0.3824000     1.170000  0.5724000     1.014000  0.5071000     0.1565000      0.7648000 
1 1 1 6  7  0  o 29.63000  0.3268000     29.63000  0.3268000     29.63000  0.3268000     -0.000000      0.000000  
1 1 1 6  7  1  o 18.75000  0.1512000     18.66000  0.2127000     18.85000  0.2149000     -0.1932000     0.3024000 
1 1 1 6  7  2  o 8.286000  0.1160000     8.113000  0.1427000     8.459000  0.1829000     -0.3459000     0.2319000 
1 1 1 6  7  3  o 24.27000  0.2239000     24.31000  0.3160000     24.23000  0.3174000     0.8463000E-01  0.4479000 
1 1 1 6  7  4  o 23.18000  0.3739000     23.47000  0.5272000     22.90000  0.5304000     0.5748000      0.7478000 
1 1 1 6  7  5  o 25.03000  0.3171000     24.77000  0.5793000     25.28000  0.2583000     -0.5118000     0.6342000 
1 1 1 6  7  6  o 4.446000  0.1235000     4.560000  0.1679000     4.332000  0.1812000     0.2283000      0.2471000 
1 1 1 6  7  7  o 10.17000  0.1287000     10.07000  0.1801000     10.27000  0.1840000     -0.2015000     0.2575000 
1 1 1 6  7  8  o 12.41000  0.1412000     12.42000  0.2005000     12.40000  0.1989000     0.1639000E-01  0.2824000 
1 1 1 6  7  9  o 4.686000  0.1960000     4.976000  0.2650000     4.396000  0.2888000     0.5803000      0.3920000 
1 1 1 6  7  10 o 15.26000  0.2163000     15.07000  0.2755000     15.45000  0.3336000     -0.3787000     0.4326000 
1 1 1 6  7  11 o 4.229000  0.2688000     4.076000  0.3985000     4.383000  0.3608000     -0.3068000     0.5376000 
1 1 1 6  7  12 o 11.04000  0.1835000     11.19000  0.2605000     10.89000  0.2586000     0.3043000      0.3671000 
1 1 1 6  7  13 o 16.91000  0.1949000     16.98000  0.2758000     16.84000  0.2756000     0.1485000      0.3899000 
1 1 1 6  7  14 o 11.37000  0.2061000     11.19000  0.2937000     11.55000  0.2891000     -0.3546000     0.4121000 
1 1 1 6  7  15 o 3.078000  0.6546000     3.202000  0.9139000     2.954000  0.9374000     0.2473000      1.309000  
1 1 1 6  7  16 o 3.885000  0.4936000     3.681000  0.7248000     4.090000  0.6703000     -0.4087000     0.9872000 
1 1 1 6  7  17 o 9.896000  0.2608000     9.687000  0.3711000     10.11000  0.3664000     -0.4187000     0.5215000 
1 1 1 6  7  18 o 5.584000  0.4156000     5.935000  0.5514000     5.233000  0.6219000     0.7026000      0.8311000 
1 1 1 6  7  19 o 9.924000  0.2978000     9.500000  0.4241000     10.35000  0.4181000     -0.8475000     0.5956000 
1 1 1 6  7  20 o 6.792000  0.5776000     7.105000  0.7214000     6.479000  0.9022000     0.6263000      1.155000  
1 1 1 6  7  21 o 4.036000  0.6406000     3.979000  0.9146000     4.093000  0.8971000     -0.1143000     1.281000  
1 1 1 6  7  22 o 1.977000  0.5835000     1.476000  0.7062000     2.477000  0.9292000     -1.001000      1.167000  
1 1 1 6  7  23 o 2.035000  0.5660000     2.419000  0.8609000     1.652000  0.7351000     0.7672000      1.132000  
1 1 1 6  7  24 o 1.421000  0.4663000     1.598000  0.7134000     1.244000  0.6007000     0.3538000      0.9326000 
1 1 1 6  7  25 o 2.435000  0.6305000     2.019000  0.8433000     2.851000  0.9375000     -0.8327000     1.261000  
1 1 1 6  7  26 o 1.203000  0.4125000     1.335000  0.6297000     1.072000  0.5330000     0.2629000      0.8250000 
1 1 1 6  7  27 o 1.367000  0.4466000     1.072000  0.5329000     1.662000  0.7168000     -0.5897000     0.8932000 
1 1 1 6  8  0  o 10.04000  0.1341000     10.04000  0.1341000     10.04000  0.1341000     0.000000       0.000000  
1 1 1 6  8  1  o 14.96000  0.1261000     15.05000  0.1791000     14.88000  0.1775000     0.1685000      0.2521000 
1 1 1 6  8  2  o 27.84000  0.2374000     27.65000  0.3083000     28.02000  0.3611000     -0.3726000     0.4748000 
1 1 1 6  8  3  o 33.36000  0.3020000     33.75000  0.4311000     32.97000  0.4230000     0.7860000      0.6040000 
1 1 1 6  8  4  f 36.02000  0.4600000     36.02000  0.4600000     ?         ?             ?              ?         
1 1 1 6  8  5  o 20.91000  0.1866000     21.00000  0.2820000     20.83000  0.2442000     0.1644000      0.3731000 
1 1 1 6  8  6  o 14.41000  0.1359000     14.55000  0.1929000     14.27000  0.1915000     0.2829000      0.2718000 
1 1 1 6  8  7  o 7.799000  0.1178000     7.667000  0.1638000     7.931000  0.1692000     -0.2642000     0.2355000 
1 1 1 6  8  8  o 8.432000  0.1394000     8.251000  0.1597000     8.612000  0.2286000     -0.3612000     0.2789000 
1 1 1 6  8  9  o 17.27000  0.1683000     17.13000  0.2368000     17.42000  0.2391000     -0.2917000     0.3365000 
1 1 1 6  8  10 o 5.555000  0.2427000     5.335000  0.3555000     5.776000  0.3306000     -0.4407000     0.4854000 
1 1 1 6  8  11 o 2.777000  0.4084000     2.613000  0.6189000     2.941000  0.5330000     -0.3285000     0.8168000 
1 1 1 6  8  12 o 11.18000  0.1824000     11.13000  0.2564000     11.23000  0.2595000     -0.1008000     0.3649000 
1 1 1 6  8  13 o 1.730000  0.4823000     2.017000  0.7221000     1.442000  0.6396000     0.5758000      0.9647000 
1 1 1 6  8  14 o 21.35000  0.2198000     21.45000  0.3114000     21.26000  0.3101000     0.1882000      0.4395000 
1 1 1 6  8  15 o 15.98000  0.2434000     16.01000  0.3455000     15.95000  0.3430000     0.6513000E-01  0.4868000 
1 1 1 6  8  16 o 10.74000  0.2314000     10.50000  0.3311000     10.98000  0.3234000     -0.4787000     0.4628000 
1 1 1 6  8  17 o 13.52000  0.2314000     14.00000  0.3258000     13.04000  0.3288000     0.9642000      0.4629000 
1 1 1 6  8  18 o 6.581000  0.3686000     6.549000  0.5350000     6.613000  0.5072000     -0.6384000E-01 0.7372000 
1 1 1 6  8  19 o 5.378000  0.4797000     6.083000  0.5822000     4.672000  0.7626000     1.411000       0.9595000 
1 1 1 6  8  20 o 3.138000  0.7483000     2.570000  1.041000      3.705000  1.076000      -1.135000      1.497000  
1 1 1 6  8  21 f 2.464000  0.6767000     2.783000  1.003000      2.146000  0.9093000     0.6377000      1.353000  
1 1 1 6  8  22 o 1.852000  0.5643000     1.378000  0.6739000     2.325000  0.9054000     -0.9475000     1.129000  
1 1 1 6  8  23 o 1.861000  0.5458000     2.200000  0.8373000     1.522000  0.7005000     0.6779000      1.092000  
1 1 1 6  8  24 o 1.502000  0.4781000     1.782000  0.7507000     1.222000  0.5923000     0.5594000      0.9563000 
1 1 1 6  8  25 o 1.720000  0.5578000     1.951000  0.8563000     1.489000  0.7149000     0.4623000      1.116000  
1 1 1 6  8  26 f 1.343000  0.4456000     1.340000  0.6296000     1.346000  0.6308000     -0.5594000E-02 0.8912000 
1 1 1 6  8  27 o 1.541000  0.4878000     1.406000  0.6533000     1.675000  0.7246000     -0.2692000     0.9757000 
1 1 1 6  9  0  o 0.8981000 0.3896000     0.8981000 0.3896000     0.8981000 0.3896000     -0.000000      0.000000  
1 1 1 6  9  1  o 15.50000  0.1311000     15.30000  0.1835000     15.70000  0.1874000     -0.4031000     0.2623000 
1 1 1 6  9  2  o 10.28000  0.1096000     10.29000  0.1431000     10.27000  0.1662000     0.1613000E-01  0.2193000 
1 1 1 6  9  3  o 18.11000  0.2458000     18.33000  0.4250000     17.89000  0.2470000     0.4376000      0.4916000 
1 1 1 6  9  4  o 14.83000  0.1875000     14.76000  0.2633000     14.90000  0.2670000     -0.1362000     0.3750000 
1 1 1 6  9  5  o 17.20000  0.1704000     17.25000  0.2409000     17.16000  0.2410000     0.8222000E-01  0.3408000 
1 1 1 6  9  6  o 37.08000  0.3024000     36.97000  0.4774000     37.20000  0.3715000     -0.2361000     0.6049000 
1 1 1 6  9  7  o 18.78000  0.1663000     18.89000  0.2360000     18.67000  0.2343000     0.2218000      0.3326000 
1 1 1 6  9  8  o 19.82000  0.1765000     19.72000  0.2477000     19.93000  0.2513000     -0.2124000     0.3529000 
1 1 1 6  9  9  o 10.64000  0.1620000     10.57000  0.2079000     10.70000  0.2485000     -0.1301000     0.3240000 
1 1 1 6  9  10 o 8.232000  0.2146000     8.192000  0.3273000     8.271000  0.2778000     -0.7892000E-01 0.4293000 
1 1 1 6  9  11 o 11.92000  0.1707000     12.09000  0.2420000     11.75000  0.2408000     0.3388000      0.3414000 
1 1 1 6  9  12 o 7.684000  0.2072000     7.739000  0.2930000     7.628000  0.2931000     0.1106000      0.4144000 
1 1 1 6  9  13 o 5.347000  0.2784000     5.423000  0.3949000     5.272000  0.3925000     0.1514000      0.5568000 
1 1 1 6  9  14 o 5.823000  0.2854000     5.877000  0.4041000     5.768000  0.4030000     0.1090000      0.5707000 
1 1 1 6  9  15 o 13.37000  0.2447000     13.34000  0.3456000     13.41000  0.3467000     -0.6421000E-01 0.4895000 
1 1 1 6  9  16 o 10.20000  0.2408000     10.01000  0.3432000     10.39000  0.3378000     -0.3842000     0.4815000 
1 1 1 6  9  17 o 5.522000  0.3846000     5.286000  0.5627000     5.758000  0.5245000     -0.4720000     0.7693000 
1 1 1 6  9  18 o 1.928000  0.5900000     1.818000  0.8078000     2.037000  0.8601000     -0.2187000     1.180000  
1 1 1 6  9  19 o 3.393000  0.6738000     3.272000  0.9624000     3.514000  0.9432000     -0.2423000     1.348000  
1 1 1 6  9  20 o 3.663000  0.7510000     3.736000  1.039000      3.589000  1.085000      0.1477000      1.502000  
1 1 1 6  9  21 o 1.692000  0.5607000     1.668000  0.7848000     1.715000  0.8009000     -0.4653000E-01 1.121000  
1 1 1 6  9  22 o 2.797000  0.5934000     3.663000  0.8490000     1.931000  0.8294000     1.733000       1.187000  
1 1 1 6  9  23 o 2.028000  0.5618000     2.273000  0.8258000     1.782000  0.7621000     0.4916000      1.124000  
1 1 1 6  9  24 o 1.578000  0.4990000     1.579000  0.7072000     1.578000  0.7041000     0.1129000E-02  0.9979000 
1 1 1 6  9  25 o 1.215000  0.4210000     1.129000  0.5611000     1.302000  0.6278000     -0.1737000     0.8420000 
1 1 1 6  9  26 o 1.433000  0.4651000     1.269000  0.6082000     1.597000  0.7038000     -0.3273000     0.9302000 
1 1 1 6  9  27 o 1.255000  0.4241000     1.395000  0.6473000     1.116000  0.5481000     0.2794000      0.8482000 
1 1 1 6  10 0  o 9.128000  0.1349000     9.128000  0.1349000     9.128000  0.1349000     -0.000000      0.000000  
1 1 1 6  10 1  o 4.933000  0.8937000E-01 4.741000  0.1275000     5.126000  0.1252000     -0.3850000     0.1787000 
1 1 1 6  10 2  o 11.65000  0.1194000     11.57000  0.1545000     11.72000  0.1821000     -0.1547000     0.2388000 
1 1 1 6  10 4  o 16.58000  0.1874000     16.90000  0.2930000     16.26000  0.2338000     0.6418000      0.3748000 
1 1 1 6  10 5  o 38.90000  0.3300000     39.49000  0.5044000     38.32000  0.4255000     1.176000       0.6599000 
1 1 1 6  10 6  o 24.05000  0.1984000     23.84000  0.2790000     24.27000  0.2821000     -0.4302000     0.3968000 
1 1 1 6  10 7  o 18.55000  0.1790000     18.69000  0.2714000     18.40000  0.2336000     0.2950000      0.3581000 
1 1 1 6  10 8  o 15.38000  0.1510000     15.50000  0.2144000     15.26000  0.2128000     0.2393000      0.3021000 
1 1 1 6  10 9  o 4.404000  0.1911000     4.591000  0.2519000     4.218000  0.2876000     0.3731000      0.3823000 
1 1 1 6  10 10 o 5.097000  0.2869000     5.346000  0.4148000     4.848000  0.3965000     0.4979000      0.5738000 
1 1 1 6  10 11 o 10.88000  0.1722000     10.56000  0.2459000     11.20000  0.2411000     -0.6335000     0.3444000 
1 1 1 6  10 12 o 9.829000  0.1924000     9.946000  0.2717000     9.712000  0.2724000     0.2342000      0.3848000 
1 1 1 6  10 13 o 3.046000  0.4546000     3.502000  0.5813000     2.589000  0.6992000     0.9139000      0.9092000 
1 1 1 6  10 14 o 9.015000  0.2214000     9.068000  0.3102000     8.962000  0.3159000     0.1063000      0.4428000 
1 1 1 6  10 15 o 12.97000  0.3029000     12.78000  0.4283000     13.16000  0.4285000     -0.3832000     0.6058000 
1 1 1 6  10 16 o 6.052000  0.3394000     5.841000  0.4909000     6.263000  0.4687000     -0.4225000     0.6787000 
1 1 1 6  10 17 o 5.782000  0.3677000     5.729000  0.5139000     5.835000  0.5261000     -0.1068000     0.7355000 
1 1 1 6  10 18 o 9.336000  0.2878000     9.129000  0.4113000     9.543000  0.4026000     -0.4137000     0.5755000 
1 1 1 6  10 19 o 3.111000  0.6883000     2.884000  0.9782000     3.337000  0.9685000     -0.4529000     1.377000  
1 1 1 6  10 20 o 3.873000  0.7746000     4.439000  0.9437000     3.306000  1.229000      1.134000       1.549000  
1 1 1 6  10 21 o 3.221000  0.6752000     3.550000  0.9267000     2.892000  0.9822000     0.6583000      1.350000  
1 1 1 6  10 22 o 2.065000  0.5949000     2.395000  0.8921000     1.736000  0.7873000     0.6594000      1.190000  
1 1 1 6  10 23 o 2.737000  0.5688000     2.387000  0.8289000     3.087000  0.7792000     -0.6993000     1.138000  
1 1 1 6  10 24 o 1.725000  0.5061000     2.147000  0.7996000     1.304000  0.6207000     0.8428000      1.012000  
1 1 1 6  10 25 o 1.968000  0.5633000     2.197000  0.8385000     1.739000  0.7525000     0.4580000      1.127000  
1 1 1 6  10 26 o 1.721000  0.5052000     1.371000  0.6419000     2.071000  0.7804000     -0.6993000     1.010000  
1 1 1 6  10 27 o 1.312000  0.4369000     1.180000  0.5728000     1.445000  0.6598000     -0.2649000     0.8738000 
1 1 1 6  11 0  o 2.533000  0.1862000     2.533000  0.1862000     2.533000  0.1862000     -0.000000      0.000000  
1 1 1 6  11 1  o 12.20000  0.1136000     12.30000  0.1615000     12.10000  0.1598000     0.1972000      0.2272000 
1 1 1 6  11 2  o 16.25000  0.1992000     15.98000  0.2752000     16.53000  0.2879000     -0.5490000     0.3983000 
1 1 1 6  11 3  o 10.78000  0.1563000     10.54000  0.2159000     11.03000  0.2261000     -0.4899000     0.3126000 
1 1 1 6  11 4  f 18.48000  0.1815000     18.45000  0.2543000     18.50000  0.2591000     -0.4584000E-01 0.3630000 
1 1 1 6  11 5  o 16.47000  0.1575000     16.61000  0.2376000     16.34000  0.2067000     0.2756000      0.3149000 
1 1 1 6  11 6  o 17.53000  0.1548000     17.42000  0.2180000     17.65000  0.2198000     -0.2244000     0.3096000 
1 1 1 6  11 7  o 20.96000  0.1795000     20.86000  0.2535000     21.06000  0.2543000     -0.1970000     0.3591000 
1 1 1 6  11 8  o 5.957000  0.1404000     5.873000  0.1982000     6.040000  0.1990000     -0.1673000     0.2809000 
1 1 1 6  11 9  o 8.341000  0.2395000     8.052000  0.2173000     8.630000  0.4268000     -0.5780000     0.4790000 
1 1 1 6  11 10 o 4.570000  0.2952000     4.276000  0.5294000     4.864000  0.2613000     -0.5881000     0.5903000 
1 1 1 6  11 11 o 7.655000  0.1978000     7.705000  0.2119000     7.606000  0.3340000     0.9886000E-01  0.3955000 
1 1 1 6  11 12 o 6.331000  0.2394000     6.203000  0.3386000     6.459000  0.3386000     -0.2551000     0.4788000 
1 1 1 6  11 13 o 7.905000  0.2288000     7.990000  0.3223000     7.820000  0.3248000     0.1708000      0.4576000 
1 1 1 6  11 14 o 7.525000  0.2478000     7.453000  0.3511000     7.596000  0.3498000     -0.1431000     0.4956000 
1 1 1 6  11 15 o 10.09000  0.2634000     10.27000  0.3683000     9.918000  0.3768000     0.3474000      0.5269000 
1 1 1 6  11 16 o 12.84000  0.2270000     12.94000  0.3252000     12.73000  0.3167000     0.2091000      0.4540000 
1 1 1 6  11 17 o 4.936000  0.4339000     4.829000  0.6301000     5.043000  0.5966000     -0.2135000     0.8677000 
1 1 1 6  11 18 o 4.233000  0.5486000     4.068000  0.7915000     4.398000  0.7598000     -0.3304000     1.097000  
1 1 1 6  11 19 o 4.829000  0.5416000     5.520000  0.6739000     4.138000  0.8479000     1.382000       1.083000  
1 1 1 6  11 20 o 3.558000  0.7897000     4.136000  1.147000      2.980000  1.086000      1.156000       1.579000  
1 1 1 6  11 21 o 2.477000  0.6608000     2.803000  0.9725000     2.151000  0.8951000     0.6520000      1.322000  
1 1 1 6  11 22 o 1.967000  0.5756000     2.190000  0.8508000     1.743000  0.7754000     0.4469000      1.151000  
1 1 1 6  11 23 o 2.167000  0.5698000     2.500000  0.8386000     1.834000  0.7718000     0.6663000      1.140000  
1 1 1 6  11 24 o 1.937000  0.5319000     1.562000  0.6953000     2.313000  0.8052000     -0.7515000     1.064000  
1 1 1 6  11 25 o 1.199000  0.4174000     1.258000  0.6156000     1.139000  0.5638000     0.1188000      0.8348000 
1 1 1 6  11 26 o 1.659000  0.5076000     1.731000  0.7331000     1.586000  0.7024000     0.1451000      1.015000  
1 1 1 6  11 27 f 1.136000  0.3934000     1.013000  0.5065000     1.259000  0.6020000     -0.2461000     0.7868000 
1 1 1 6  12 0  o 26.45000  0.4232000     26.45000  0.4232000     26.45000  0.4232000     -0.000000      0.000000  
1 1 1 6  12 1  o 17.52000  0.2585000     17.49000  0.2965000     17.55000  0.4236000     -0.6578000E-01 0.5170000 
1 1 1 6  12 2  o 14.72000  0.2620000     14.72000  0.2620000     ?         ?             ?              ?         
1 1 1 6  12 3  o 15.98000  0.1820000     16.11000  0.2823000     15.85000  0.2297000     0.2606000      0.3639000 
1 1 1 6  12 4  o 27.81000  0.2579000     27.76000  0.3629000     27.86000  0.3665000     -0.9798000E-01 0.5158000 
1 1 1 6  12 5  o 18.28000  0.1703000     18.26000  0.2556000     18.31000  0.2250000     -0.5580000E-01 0.3405000 
1 1 1 6  12 6  o 28.21000  0.2285000     28.34000  0.3247000     28.08000  0.3215000     0.2664000      0.4569000 
1 1 1 6  12 7  o 8.475000  0.1312000     8.532000  0.2035000     8.418000  0.1656000     0.1145000      0.2624000 
1 1 1 6  12 8  o 9.606000  0.1424000     9.420000  0.2142000     9.792000  0.1876000     -0.3726000     0.2847000 
1 1 1 6  12 9  o 8.823000  0.1898000     8.803000  0.1978000     8.842000  0.3239000     -0.3899000E-01 0.3795000 
1 1 1 6  12 10 o 6.512000  0.1623000     6.616000  0.2238000     6.409000  0.2353000     0.2074000      0.3247000 
1 1 1 6  12 11 o 8.798000  0.1649000     8.940000  0.2318000     8.657000  0.2346000     0.2833000      0.3298000 
1 1 1 6  12 12 o 2.032000  0.4271000     1.750000  0.6201000     2.314000  0.5874000     -0.5647000     0.8541000 
1 1 1 6  12 13 o 10.68000  0.2208000     10.46000  0.2887000     10.89000  0.3341000     -0.4360000     0.4416000 
1 1 1 6  12 14 o 9.211000  0.2260000     9.050000  0.3209000     9.371000  0.3183000     -0.3208000     0.4520000 
1 1 1 6  12 15 o 4.143000  0.5870000     3.344000  0.9932000     4.941000  0.6260000     -1.597000      1.174000  
1 1 1 6  12 16 o 5.373000  0.3799000     5.170000  0.5582000     5.576000  0.5154000     -0.4062000     0.7597000 
1 1 1 6  12 17 o 13.69000  0.2351000     13.57000  0.3340000     13.81000  0.3311000     -0.2389000     0.4703000 
1 1 1 6  12 18 o 3.663000  0.6013000     4.401000  0.7648000     2.925000  0.9280000     1.476000       1.203000  
1 1 1 6  12 19 o 2.998000  0.6999000     3.058000  0.9959000     2.938000  0.9836000     0.1197000      1.400000  
1 1 1 6  12 20 o 2.977000  0.7597000     2.728000  1.053000      3.226000  1.095000      -0.4982000     1.519000  
1 1 1 6  12 21 o 3.673000  0.6487000     4.003000  0.8711000     3.342000  0.9614000     0.6605000      1.297000  
1 1 1 6  12 22 o 1.841000  0.5657000     1.683000  0.7574000     1.999000  0.8404000     -0.3158000     1.131000  
1 1 1 6  12 23 o 2.208000  0.5249000     1.478000  0.6801000     2.938000  0.7997000     -1.460000      1.050000  
1 1 1 6  12 24 o 1.417000  0.4651000     1.442000  0.6690000     1.391000  0.6464000     0.5104000E-01  0.9303000 
1 1 1 6  12 25 o 2.612000  0.6681000     2.951000  0.9627000     2.273000  0.9265000     0.6785000      1.336000  
1 1 1 6  12 26 o 1.248000  0.4238000     1.235000  0.5949000     1.261000  0.6037000     -0.2594000E-01 0.8476000 
1 1 1 6  12 27 o 1.161000  0.4008000     1.259000  0.6037000     1.063000  0.5272000     0.1964000      0.8015000 
1 1 1 6  13 0  o 2.190000  0.3527000     2.190000  0.3527000     2.190000  0.3527000     0.000000       0.000000  
1 1 1 6  13 1  o 14.81000  0.1861000     14.77000  0.2631000     14.85000  0.2634000     -0.7678000E-01 0.3723000 
1 1 1 6  13 2  o 4.627000  0.1236000     4.447000  0.1780000     4.806000  0.1717000     -0.3585000     0.2473000 
1 1 1 6  13 3  o 10.21000  0.1265000     10.20000  0.1766000     10.21000  0.1813000     -0.1555000E-01 0.2531000 
1 1 1 6  13 4  o 27.34000  0.2550000     27.57000  0.3616000     27.10000  0.3597000     0.4741000      0.5101000 
1 1 1 6  13 5  o 11.16000  0.1268000     11.25000  0.1903000     11.07000  0.1676000     0.1749000      0.2536000 
1 1 1 6  13 6  o 10.50000  0.1194000     10.40000  0.1685000     10.61000  0.1694000     -0.2153000     0.2389000 
1 1 1 6  13 7  o 17.72000  0.1609000     17.70000  0.2276000     17.74000  0.2276000     -0.3718000E-01 0.3219000 
1 1 1 6  13 8  o 12.21000  0.1341000     12.39000  0.1915000     12.02000  0.1878000     0.3684000      0.2682000 
1 1 1 6  13 9  o 12.02000  0.2504000     11.96000  0.2345000     12.08000  0.4425000     -0.1140000     0.5008000 
1 1 1 6  13 10 o 2.338000  0.3365000     1.978000  0.5188000     2.697000  0.4287000     -0.7193000     0.6730000 
1 1 1 6  13 11 o 2.581000  0.3529000     3.109000  0.4092000     2.052000  0.5751000     1.057000       0.7058000 
1 1 1 6  13 12 o 1.343000  0.4000000     1.355000  0.5645000     1.331000  0.5668000     0.2357000E-01  0.7999000 
1 1 1 6  13 13 o 6.596000  0.2083000     6.732000  0.2924000     6.459000  0.2968000     0.2725000      0.4167000 
1 1 1 6  13 14 f 12.50000  0.2475000     12.38000  0.2618000     12.63000  0.4200000     -0.2520000     0.4949000 
1 1 1 6  13 15 o 8.013000  0.3362000     7.869000  0.5220000     8.156000  0.4238000     -0.2874000     0.6724000 
1 1 1 6  13 16 o 8.869000  0.2615000     8.748000  0.3727000     8.990000  0.3668000     -0.2422000     0.5230000 
1 1 1 6  13 17 o 3.757000  0.5705000     3.050000  0.8985000     4.463000  0.7033000     -1.413000      1.141000  
1 1 1 6  13 18 o 6.385000  0.3983000     5.875000  0.6027000     6.895000  0.5210000     -1.020000      0.7966000 
1 1 1 6  13 19 o 2.178000  0.6466000     2.246000  0.9266000     2.111000  0.9021000     0.1349000      1.293000  
1 1 1 6  13 20 o 2.710000  0.7713000     3.297000  1.213000      2.123000  0.9533000     1.173000       1.543000  
1 1 1 6  13 21 o 2.493000  0.6519000     2.668000  0.9361000     2.317000  0.9076000     0.3511000      1.304000  
1 1 1 6  13 22 o 2.074000  0.6028000     2.063000  0.8500000     2.086000  0.8550000     -0.2298000E-01 1.206000  
1 1 1 6  13 23 o 2.557000  0.5729000     2.660000  0.8056000     2.455000  0.8149000     0.2056000      1.146000  
1 1 1 6  13 24 o 1.484000  0.4901000     1.577000  0.7244000     1.391000  0.6604000     0.1861000      0.9803000 
1 1 1 6  13 25 o 1.954000  0.5784000     1.644000  0.7619000     2.263000  0.8704000     -0.6187000     1.157000  
1 1 1 6  13 26 o 1.784000  0.5187000     1.649000  0.7079000     1.919000  0.7582000     -0.2702000     1.037000  
1 1 1 6  13 27 o 1.306000  0.4370000     1.180000  0.5733000     1.432000  0.6596000     -0.2519000     0.8740000 
1 1 1 6  14 0  o 15.93000  0.1978000     15.93000  0.1978000     15.93000  0.1978000     -0.000000      0.000000  
1 1 1 6  14 1  o 18.82000  0.1592000     18.81000  0.2253000     18.82000  0.2249000     -0.4951000E-02 0.3184000 
1 1 1 6  14 2  o 17.81000  0.1659000     17.44000  0.2129000     18.17000  0.2545000     -0.7368000     0.3318000 
1 1 1 6  14 3  o 3.308000  0.1586000     2.989000  0.2287000     3.627000  0.2197000     -0.6382000     0.3172000 
1 1 1 6  14 4  o 12.14000  0.1412000     12.08000  0.1953000     12.20000  0.2041000     -0.1228000     0.2825000 
1 1 1 6  14 5  o 27.20000  0.2378000     26.87000  0.3555000     27.54000  0.3160000     -0.6731000     0.4756000 
1 1 1 6  14 6  o 7.664000  0.1157000     7.640000  0.1626000     7.688000  0.1647000     -0.4846000E-01 0.2315000 
1 1 1 6  14 7  o 9.343000  0.1224000     9.553000  0.1746000     9.134000  0.1716000     0.4185000      0.2448000 
1 1 1 6  14 8  o 6.738000  0.1573000     6.703000  0.2576000     6.774000  0.1808000     -0.7127000E-01 0.3147000 
1 1 1 6  14 9  o 3.804000  0.2620000     3.879000  0.4102000     3.730000  0.3261000     0.1489000      0.5240000 
1 1 1 6  14 10 o 8.738000  0.1568000     8.720000  0.2182000     8.756000  0.2252000     -0.3623000E-01 0.3136000 
1 1 1 6  14 11 o 3.377000  0.2955000     3.503000  0.4005000     3.252000  0.4347000     0.2512000      0.5911000 
1 1 1 6  14 12 o 12.52000  0.1818000     12.26000  0.2684000     12.79000  0.2454000     -0.5312000     0.3637000 
1 1 1 6  14 13 o 18.77000  0.1971000     18.94000  0.2789000     18.59000  0.2785000     0.3414000      0.3941000 
1 1 1 6  14 14 o 7.564000  0.3151000     7.408000  0.3414000     7.719000  0.5297000     -0.3119000     0.6302000 
1 1 1 6  14 15 o 4.298000  0.5147000     4.621000  0.8964000     3.975000  0.5062000     0.6459000      1.029000  
1 1 1 6  14 16 o 6.145000  0.3389000     6.308000  0.3554000     5.982000  0.5772000     0.3258000      0.6778000 
1 1 1 6  14 17 o 6.919000  0.3397000     7.533000  0.4490000     6.305000  0.5100000     1.228000       0.6795000 
1 1 1 6  14 18 o 2.683000  0.6010000     1.782000  0.8070000     3.584000  0.8908000     -1.802000      1.202000  
1 1 1 6  14 19 o 6.717000  0.4663000     6.561000  0.6885000     6.873000  0.6291000     -0.3117000     0.9326000 
1 1 1 6  14 20 o 3.527000  0.8174000     3.329000  1.213000      3.725000  1.095000      -0.3960000     1.635000  
1 1 1 6  14 21 o 1.454000  0.4940000     1.512000  0.7192000     1.395000  0.6775000     0.1168000      0.9881000 
1 1 1 6  14 22 o 3.579000  0.5899000     2.943000  0.9182000     4.215000  0.7409000     -1.272000      1.180000  
1 1 1 6  14 23 o 1.489000  0.4801000     1.407000  0.6561000     1.571000  0.7012000     -0.1638000     0.9603000 
1 1 1 6  14 24 o 1.727000  0.5337000     1.647000  0.7352000     1.807000  0.7740000     -0.1594000     1.067000  
1 1 1 6  14 25 o 1.973000  0.5756000     1.862000  0.7800000     2.083000  0.8467000     -0.2211000     1.151000  
1 1 1 6  14 26 o 1.416000  0.4600000     1.294000  0.6131000     1.538000  0.6859000     -0.2446000     0.9200000 
1 1 1 6  14 27 o 1.204000  0.4119000     1.106000  0.5446000     1.303000  0.6181000     -0.1976000     0.8238000 
1 1 1 6  15 0  o 16.74000  0.2069000     16.74000  0.2069000     16.74000  0.2069000     0.000000       0.000000  
1 1 1 6  15 1  o 17.29000  0.1500000     17.41000  0.2134000     17.16000  0.2109000     0.2545000      0.3001000 
1 1 1 6  15 2  o 8.587000  0.1152000     8.526000  0.1506000     8.648000  0.1745000     -0.1222000     0.2305000 
1 1 1 6  15 3  o 16.61000  0.1702000     16.68000  0.2395000     16.54000  0.2419000     0.1358000      0.3403000 
1 1 1 6  15 4  o 13.27000  0.1392000     13.24000  0.2085000     13.29000  0.1844000     -0.4646000E-01 0.2783000 
1 1 1 6  15 5  o 22.94000  0.2066000     23.13000  0.3135000     22.76000  0.2693000     0.3679000      0.4133000 
1 1 1 6  15 6  f 21.79000  0.1860000     21.61000  0.2615000     21.96000  0.2645000     -0.3506000     0.3719000 
1 1 1 6  15 7  o 4.013000  0.1535000     4.164000  0.2102000     3.862000  0.2237000     0.3017000      0.3069000 
1 1 1 6  15 8  o 10.24000  0.1816000     10.15000  0.2570000     10.34000  0.2566000     -0.1910000     0.3632000 
1 1 1 6  15 9  o 9.099000  0.1648000     8.770000  0.2695000     9.427000  0.1896000     -0.6565000     0.3295000 
1 1 1 6  15 10 o 8.176000  0.1582000     8.270000  0.2193000     8.083000  0.2279000     0.1867000      0.3163000 
1 1 1 6  15 11 o 10.35000  0.1895000     10.03000  0.2345000     10.67000  0.2979000     -0.6351000     0.3791000 
1 1 1 6  15 12 o 5.980000  0.2113000     6.093000  0.2900000     5.867000  0.3073000     0.2258000      0.4225000 
1 1 1 6  15 13 o 5.977000  0.2284000     5.983000  0.3201000     5.971000  0.3257000     0.1259000E-01  0.4567000 
1 1 1 6  15 14 o 6.212000  0.4726000     6.259000  0.3589000     6.165000  0.8744000     0.9362000E-01  0.9452000 
1 1 1 6  15 15 o 4.528000  0.3327000     4.815000  0.4577000     4.241000  0.4830000     0.5743000      0.6654000 
1 1 1 6  15 16 o 2.621000  0.5345000     2.412000  0.7587000     2.830000  0.7531000     -0.4180000     1.069000  
1 1 1 6  15 17 o 14.90000  0.2384000     14.86000  0.2779000     14.94000  0.3874000     -0.8583000E-01 0.4768000 
1 1 1 6  15 18 o 11.62000  0.2667000     10.90000  0.3895000     12.35000  0.3644000     -1.451000      0.5333000 
1 1 1 6  15 19 o 4.220000  0.7192000     4.008000  1.085000      4.432000  0.9450000     -0.4240000     1.438000  
1 1 1 6  15 20 o 2.327000  0.7006000     2.374000  1.012000      2.279000  0.9687000     0.9582000E-01  1.401000  
1 1 1 6  15 21 o 2.168000  0.6252000     2.064000  0.8715000     2.273000  0.8966000     -0.2084000     1.250000  
1 1 1 6  15 22 o 2.169000  0.5998000     2.544000  0.9052000     1.793000  0.7872000     0.7510000      1.200000  
1 1 1 6  15 23 o 2.026000  0.5529000     2.035000  0.7919000     2.017000  0.7718000     0.1875000E-01  1.106000  
1 1 1 6  15 24 o 1.340000  0.4526000     1.263000  0.6132000     1.417000  0.6657000     -0.1533000     0.9051000 
1 1 1 6  15 25 o 2.119000  0.5792000     1.687000  0.7424000     2.550000  0.8892000     -0.8627000     1.158000  
1 1 1 6  15 26 o 1.682000  0.4972000     1.957000  0.7545000     1.407000  0.6476000     0.5498000      0.9943000 
1 1 1 6  15 27 o 1.345000  0.4562000     1.168000  0.5761000     1.522000  0.7076000     -0.3543000     0.9124000 
1 1 1 6  16 0  o 0.9726000 0.4704000     0.9726000 0.4704000     0.9726000 0.4704000     -0.000000      0.000000  
1 1 1 6  16 1  o 17.60000  0.1535000     17.52000  0.2163000     17.69000  0.2178000     -0.1718000     0.3070000 
1 1 1 6  16 2  o 34.88000  0.2974000     35.53000  0.3966000     34.23000  0.4434000     1.305000       0.5949000 
1 1 1 6  16 3  o 17.84000  0.1694000     17.96000  0.2235000     17.72000  0.2547000     0.2414000      0.3389000 
1 1 1 6  16 4  o 5.407000  0.1263000     5.530000  0.1851000     5.284000  0.1719000     0.2463000      0.2526000 
1 1 1 6  16 5  o 9.882000  0.1268000     9.860000  0.1895000     9.904000  0.1686000     -0.4389000E-01 0.2536000 
1 1 1 6  16 6  o 11.44000  0.1280000     11.39000  0.1805000     11.50000  0.1815000     -0.1069000     0.2559000 
1 1 1 6  16 7  o 10.80000  0.1300000     11.00000  0.1849000     10.61000  0.1828000     0.3935000      0.2600000 
1 1 1 6  16 8  o 13.84000  0.2053000     13.84000  0.2053000     ?         ?             ?              ?         
1 1 1 6  16 9  f 7.683000  0.1376000     7.933000  0.1933000     7.433000  0.1959000     0.4998000      0.2752000 
1 1 1 6  16 10 o 5.586000  0.1621000     5.542000  0.2259000     5.630000  0.2325000     -0.8791000E-01 0.3242000 
1 1 1 6  16 11 o 10.03000  0.1659000     10.09000  0.2351000     9.971000  0.2340000     0.1192000      0.3317000 
1 1 1 6  16 12 o 10.08000  0.1748000     9.891000  0.2457000     10.27000  0.2489000     -0.3822000     0.3497000 
1 1 1 6  16 13 o 13.79000  0.1830000     13.95000  0.2601000     13.64000  0.2574000     0.3064000      0.3659000 
1 1 1 6  16 14 o 19.43000  0.3641000     19.69000  0.3384000     19.18000  0.6448000     0.5055000      0.7281000 
1 1 1 6  16 15 o 9.850000  0.2087000     9.937000  0.2950000     9.764000  0.2954000     0.1739000      0.4174000 
1 1 1 6  16 16 o 9.571000  0.2251000     9.673000  0.3155000     9.470000  0.3212000     0.2029000      0.4502000 
1 1 1 6  16 17 o 2.727000  0.4924000     1.663000  0.7309000     3.791000  0.6599000     -2.128000      0.9847000 
1 1 1 6  16 18 o 2.218000  0.5821000     1.998000  0.7982000     2.439000  0.8475000     -0.4409000     1.164000  
1 1 1 6  16 19 o 3.889000  0.7889000     3.738000  0.8080000     4.041000  1.355000      -0.3026000     1.578000  
1 1 1 6  16 20 o 2.957000  0.7532000     3.033000  1.074000      2.881000  1.056000      0.1519000      1.506000  
1 1 1 6  16 21 o 2.874000  0.6321000     2.362000  0.9145000     3.385000  0.8729000     -1.023000      1.264000  
1 1 1 6  16 22 o 3.088000  0.6055000     3.061000  0.8513000     3.115000  0.8611000     -0.5326000E-01 1.211000  
1 1 1 6  16 23 o 1.838000  0.5336000     1.780000  0.7473000     1.896000  0.7620000     -0.1166000     1.067000  
1 1 1 6  16 24 o 1.454000  0.4937000     1.399000  0.6810000     1.509000  0.7151000     -0.1107000     0.9875000 
1 1 1 6  16 25 o 1.301000  0.4392000     1.428000  0.6569000     1.174000  0.5832000     0.2538000      0.8785000 
1 1 1 6  16 26 o 1.409000  0.4557000     1.632000  0.7068000     1.186000  0.5753000     0.4457000      0.9114000 
1 1 1 6  17 0  o 25.49000  0.2939000     25.49000  0.2939000     25.49000  0.2939000     -0.000000      0.000000  
1 1 1 6  17 1  o 9.214000  0.1109000     9.298000  0.1567000     9.129000  0.1570000     0.1694000      0.2219000 
1 1 1 6  17 2  o 25.26000  0.2239000     24.94000  0.2893000     25.58000  0.3417000     -0.6344000     0.4477000 
1 1 1 6  17 3  o 19.69000  0.1837000     19.51000  0.2386000     19.87000  0.2792000     -0.3658000     0.3673000 
1 1 1 6  17 4  o 4.519000  0.1388000     4.542000  0.2060000     4.497000  0.1860000     0.4519000E-01  0.2776000 
1 1 1 6  17 5  o 14.76000  0.1526000     14.78000  0.2290000     14.74000  0.2017000     0.4233000E-01  0.3052000 
1 1 1 6  17 6  o 21.40000  0.1851000     21.31000  0.2612000     21.49000  0.2622000     -0.1750000     0.3701000 
1 1 1 6  17 7  o 13.47000  0.1742000     13.52000  0.2849000     13.43000  0.2003000     0.9476000E-01  0.3483000 
1 1 1 6  17 8  o 10.85000  0.1935000     10.65000  0.2708000     11.05000  0.2765000     -0.4059000     0.3870000 
1 1 1 6  17 9  o 1.570000  0.3465000     1.721000  0.4805000     1.420000  0.4992000     0.3006000      0.6929000 
1 1 1 6  17 10 o 10.89000  0.1477000     10.86000  0.2063000     10.93000  0.2113000     -0.7078000E-01 0.2953000 
1 1 1 6  17 11 o 6.757000  0.1946000     6.563000  0.3268000     6.950000  0.2113000     -0.3869000     0.3891000 
1 1 1 6  17 12 f 2.959000  0.3794000     2.449000  0.5980000     3.468000  0.4669000     -1.020000      0.7587000 
1 1 1 6  17 13 o 1.956000  0.4733000     1.747000  0.6668000     2.166000  0.6720000     -0.4185000     0.9467000 
1 1 1 6  17 14 o 6.613000  0.2630000     6.997000  0.3481000     6.229000  0.3943000     0.7688000      0.5259000 
1 1 1 6  17 15 o 3.512000  0.4396000     4.014000  0.5373000     3.010000  0.6958000     1.003000       0.8791000 
1 1 1 6  17 16 o 7.810000  0.2415000     7.964000  0.3315000     7.656000  0.3513000     0.3073000      0.4830000 
1 1 1 6  17 17 o 5.857000  0.3249000     5.923000  0.4571000     5.791000  0.4619000     0.1320000      0.6498000 
1 1 1 6  17 18 o 1.422000  0.4695000     1.042000  0.5233000     1.802000  0.7797000     -0.7596000     0.9390000 
1 1 1 6  17 19 o 4.148000  0.7311000     4.802000  0.5938000     3.493000  1.336000      1.309000       1.462000  
1 1 1 6  17 20 o 4.733000  0.4308000     5.227000  0.5264000     4.239000  0.6821000     0.9871000      0.8616000 
1 1 1 6  17 21 o 2.614000  0.6209000     2.649000  0.7637000     2.578000  0.9793000     0.7064000E-01  1.242000  
1 1 1 6  17 22 o 1.955000  0.5658000     1.846000  0.7187000     2.064000  0.8741000     -0.2181000     1.132000  
1 1 1 6  17 23 o 2.168000  0.5153000     1.481000  0.6786000     2.855000  0.7756000     -1.374000      1.031000  
1 1 1 6  17 24 o 1.802000  0.5495000     1.777000  0.7756000     1.826000  0.7785000     -0.4940000E-01 1.099000  
1 1 1 6  17 25 o 1.273000  0.4271000     1.114000  0.5469000     1.432000  0.6561000     -0.3172000     0.8542000 
1 1 1 6  17 26 o 1.222000  0.4164000     1.230000  0.5916000     1.214000  0.5862000     0.1595000E-01  0.8329000 
1 1 1 6  18 0  o 26.02000  0.3000000     26.02000  0.3000000     26.02000  0.3000000     -0.000000      0.000000  
1 1 1 6  18 1  o 9.053000  0.1130000     8.831000  0.1584000     9.275000  0.1613000     -0.4440000     0.2260000 
1 1 1 6  18 2  o 16.58000  0.1617000     16.61000  0.2115000     16.54000  0.2448000     0.7674000E-01  0.3235000 
1 1 1 6  18 3  o 4.445000  0.1457000     4.459000  0.1874000     4.432000  0.2231000     0.2746000E-01  0.2914000 
1 1 1 6  18 4  o 14.07000  0.1480000     14.17000  0.2230000     13.98000  0.1948000     0.1979000      0.2961000 
1 1 1 6  18 5  o 7.868000  0.1280000     7.913000  0.1891000     7.822000  0.1726000     0.9103000E-01  0.2560000 
1 1 1 6  18 6  o 11.24000  0.1301000     11.32000  0.1849000     11.15000  0.1830000     0.1718000      0.2602000 
1 1 1 6  18 7  o 11.39000  0.1898000     11.19000  0.2699000     11.58000  0.2670000     -0.3925000     0.3796000 
1 1 1 6  18 8  o 5.801000  0.1771000     5.878000  0.2864000     5.724000  0.2083000     0.1539000      0.3541000 
1 1 1 6  18 9  o 10.60000  0.1427000     10.66000  0.2014000     10.55000  0.2023000     0.1025000      0.2855000 
1 1 1 6  18 10 o 8.474000  0.1480000     8.525000  0.2083000     8.423000  0.2102000     0.1023000      0.2960000 
1 1 1 6  18 11 o 5.180000  0.1834000     5.398000  0.2521000     4.961000  0.2664000     0.4375000      0.3667000 
1 1 1 6  18 12 o 3.980000  0.2908000     4.164000  0.3926000     3.796000  0.4291000     0.3682000      0.5816000 
1 1 1 6  18 13 o 8.066000  0.2216000     7.966000  0.3154000     8.166000  0.3114000     -0.1991000     0.4433000 
1 1 1 6  18 14 o 5.013000  0.4601000     ?         ?             5.013000  0.4601000     ?              ?         
1 1 1 6  18 15 o 2.143000  0.4910000     1.466000  0.6616000     2.819000  0.7258000     -1.352000      0.9820000 
1 1 1 6  18 16 o 3.396000  0.4778000     3.134000  0.7171000     3.658000  0.6317000     -0.5245000     0.9557000 
1 1 1 6  18 17 o 3.612000  0.5046000     3.143000  0.7750000     4.080000  0.6464000     -0.9369000     1.009000  
1 1 1 6  18 18 o 3.754000  0.5374000     3.584000  0.7722000     3.924000  0.7476000     -0.3403000     1.075000  
1 1 1 6  18 19 o 3.380000  0.8540000     2.923000  0.8648000     3.838000  1.473000      -0.9145000     1.708000  
1 1 1 6  18 20 o 2.873000  0.5613000     2.282000  0.8394000     3.464000  0.7454000     -1.182000      1.123000  
1 1 1 6  18 21 o 3.126000  0.5467000     3.399000  0.7391000     2.854000  0.8058000     0.5451000      1.093000  
1 1 1 6  18 22 o 2.253000  0.5143000     1.551000  0.6841000     2.956000  0.7683000     -1.405000      1.029000  
1 1 1 6  18 23 o 1.711000  0.5055000     1.644000  0.6990000     1.778000  0.7305000     -0.1338000     1.011000  
1 1 1 6  18 24 o 1.888000  0.5834000     1.761000  0.7119000     2.015000  0.9245000     -0.2539000     1.167000  
1 1 1 6  18 25 o 1.858000  0.5105000     1.189000  0.5501000     2.527000  0.8603000     -1.338000      1.021000  
1 1 1 6  18 26 o 1.741000  0.5146000     1.757000  0.7327000     1.725000  0.7226000     0.3106000E-01  1.029000  
1 1 1 6  19 0  o 5.573000  0.1660000     5.573000  0.1660000     5.573000  0.1660000     -0.000000      0.000000  
1 1 1 6  19 1  o 13.30000  0.1314000     13.25000  0.1851000     13.35000  0.1867000     -0.1071000     0.2629000 
1 1 1 6  19 2  o 20.08000  0.1865000     20.43000  0.2475000     19.73000  0.2792000     0.6968000      0.3731000 
1 1 1 6  19 3  o 4.132000  0.1704000     4.388000  0.2362000     3.876000  0.2456000     0.5115000      0.3408000 
1 1 1 6  19 4  o 17.10000  0.1681000     17.09000  0.2533000     17.10000  0.2210000     -0.7378000E-02 0.3362000 
1 1 1 6  19 5  o 10.76000  0.1555000     10.91000  0.2542000     10.61000  0.1791000     0.3002000      0.3110000 
1 1 1 6  19 6  f 9.191000  0.1557000     9.308000  0.2550000     9.073000  0.1787000     0.2354000      0.3114000 
1 1 1 6  19 7  o 7.496000  0.2076000     7.496000  0.2076000     ?         ?             ?              ?         
1 1 1 6  19 8  o 6.457000  0.1442000     6.870000  0.1979000     6.044000  0.2098000     0.8262000      0.2885000 
1 1 1 6  19 9  o 6.013000  0.1561000     6.125000  0.2160000     5.901000  0.2255000     0.2245000      0.3123000 
1 1 1 6  19 10 o 4.629000  0.1885000     4.517000  0.2680000     4.741000  0.2650000     -0.2247000     0.3769000 
1 1 1 6  19 11 o 9.327000  0.1536000     9.278000  0.2161000     9.375000  0.2185000     -0.9614000E-01 0.3073000 
1 1 1 6  19 12 o 10.46000  0.1752000     10.59000  0.2770000     10.32000  0.2144000     0.2664000      0.3503000 
1 1 1 6  19 13 o 2.104000  0.6055000     1.874000  0.6995000     2.334000  0.9887000     -0.4598000     1.211000  
1 1 1 6  19 14 o 12.43000  0.2569000     12.84000  0.4313000     12.02000  0.2795000     0.8182000      0.5139000 
1 1 1 6  19 15 o 2.332000  0.5240000     1.831000  0.7383000     2.833000  0.7437000     -1.002000      1.048000  
1 1 1 6  19 16 o 14.24000  0.2113000     14.53000  0.2984000     13.94000  0.2991000     0.5922000      0.4225000 
1 1 1 6  19 17 o 6.259000  0.3193000     6.426000  0.4298000     6.091000  0.4725000     0.3353000      0.6387000 
1 1 1 6  19 18 o 5.815000  0.3640000     5.638000  0.5207000     5.992000  0.5087000     -0.3545000     0.7279000 
1 1 1 6  19 19 o 1.636000  0.5309000     1.879000  0.8185000     1.393000  0.6766000     0.4864000      1.062000  
1 1 1 6  19 20 o 2.258000  0.5874000     2.421000  0.8319000     2.094000  0.8296000     0.3267000      1.175000  
1 1 1 6  19 21 f 1.318000  0.4465000     1.349000  0.6386000     1.286000  0.6241000     0.6278000E-01  0.8929000 
1 1 1 6  19 22 o 2.409000  0.5546000     2.357000  0.7688000     2.460000  0.7996000     -0.1029000     1.109000  
1 1 1 6  19 23 o 1.759000  0.5012000     1.536000  0.6679000     1.982000  0.7475000     -0.4457000     1.002000  
1 1 1 6  19 24 o 1.450000  0.4647000     1.299000  0.6084000     1.600000  0.7025000     -0.3012000     0.9293000 
1 1 1 6  19 25 o 1.427000  0.4503000     1.487000  0.6529000     1.367000  0.6202000     0.1200000      0.9005000 
1 1 1 6  19 26 o 1.229000  0.4090000     1.155000  0.5514000     1.304000  0.6042000     -0.1487000     0.8180000 
1 1 1 6  20 0  f 0.7507000 0.4573000     0.7507000 0.4573000     0.7507000 0.4573000     -0.000000      0.000000  
1 1 1 6  20 1  o 8.361000  0.1166000     8.501000  0.1636000     8.220000  0.1661000     0.2803000      0.2331000 
1 1 1 6  20 2  o 13.96000  0.1481000     14.00000  0.1940000     13.93000  0.2239000     0.7196000E-01  0.2962000 
1 1 1 6  20 3  o 6.827000  0.1319000     6.797000  0.1715000     6.856000  0.2004000     -0.5954000E-01 0.2638000 
1 1 1 6  20 4  o 11.90000  0.1395000     12.16000  0.2102000     11.63000  0.1833000     0.5307000      0.2789000 
1 1 1 6  20 5  o 5.615000  0.1426000     5.631000  0.2117000     5.600000  0.1912000     0.3055000E-01  0.2852000 
1 1 1 6  20 6  o 5.707000  0.2255000     5.662000  0.2831000     5.753000  0.3512000     -0.9117000E-01 0.4511000 
1 1 1 6  20 7  o 5.473000  0.1769000     5.388000  0.2874000     5.559000  0.2063000     -0.1706000     0.3538000 
1 1 1 6  20 8  o 6.414000  0.1468000     6.305000  0.2065000     6.524000  0.2087000     -0.2190000     0.2936000 
1 1 1 6  20 9  o 5.776000  0.1652000     5.812000  0.2340000     5.740000  0.2333000     0.7189000E-01  0.3304000 
1 1 1 6  20 10 o 13.32000  0.1562000     13.26000  0.2202000     13.39000  0.2215000     -0.1288000     0.3123000 
1 1 1 6  20 11 o 18.01000  0.1807000     17.90000  0.2535000     18.12000  0.2577000     -0.2191000     0.3615000 
1 1 1 6  20 12 o 8.386000  0.1655000     8.246000  0.2344000     8.525000  0.2338000     -0.2796000     0.3310000 
1 1 1 6  20 13 o 10.43000  0.3541000     10.50000  0.2650000     10.36000  0.6566000     0.1366000      0.7081000 
1 1 1 6  20 14 o 5.561000  0.2752000     5.399000  0.3921000     5.723000  0.3862000     -0.3235000     0.5503000 
1 1 1 6  20 15 o 16.28000  0.2081000     16.46000  0.2925000     16.09000  0.2961000     0.3761000      0.4162000 
1 1 1 6  20 16 o 6.436000  0.2862000     6.505000  0.4006000     6.368000  0.4089000     0.1374000      0.5724000 
1 1 1 6  20 17 o 3.883000  0.4955000     4.256000  0.6311000     3.509000  0.7640000     0.7470000      0.9909000 
1 1 1 6  20 18 o 2.249000  0.5804000     1.648000  0.7638000     2.850000  0.8741000     -1.202000      1.161000  
1 1 1 6  20 19 o 4.337000  0.7052000     3.298000  1.277000      5.375000  0.5994000     -2.078000      1.410000  
1 1 1 6  20 20 o 4.818000  0.4370000     5.818000  0.4855000     3.819000  0.7267000     1.999000       0.8739000 
1 1 1 6  20 21 o 1.723000  0.5182000     1.843000  0.7573000     1.602000  0.7077000     0.2414000      1.036000  
1 1 1 6  20 22 o 2.611000  0.5457000     2.687000  0.7624000     2.535000  0.7809000     0.1522000      1.091000  
1 1 1 6  20 23 o 1.869000  0.4901000     1.425000  0.6406000     2.313000  0.7419000     -0.8878000     0.9802000 
1 1 1 6  20 24 o 1.758000  0.5727000     1.873000  0.8979000     1.643000  0.7111000     0.2304000      1.145000  
1 1 1 6  20 25 o 1.672000  0.4858000     1.907000  0.7249000     1.437000  0.6471000     0.4702000      0.9717000 
1 1 1 6  20 26 o 1.389000  0.4394000     1.185000  0.5652000     1.594000  0.6729000     -0.4090000     0.8788000 
1 1 1 6  21 0  o 18.18000  0.2291000     18.18000  0.2291000     18.18000  0.2291000     -0.000000      0.000000  
1 1 1 6  21 1  o 15.60000  0.1586000     15.66000  0.2082000     15.54000  0.2393000     0.1261000      0.3172000 
1 1 1 6  21 2  o 14.25000  0.1512000     14.47000  0.1998000     14.04000  0.2270000     0.4355000      0.3024000 
1 1 1 6  21 3  o 7.432000  0.1331000     7.205000  0.1758000     7.659000  0.1999000     -0.4544000     0.2662000 
1 1 1 6  21 4  o 5.648000  0.1422000     5.676000  0.2112000     5.619000  0.1906000     0.5651000E-01  0.2845000 
1 1 1 6  21 5  o 8.176000  0.1939000     8.174000  0.3314000     8.179000  0.2014000     -0.5244000E-02 0.3878000 
1 1 1 6  21 6  o 5.071000  0.3076000     5.071000  0.3076000     ?         ?             ?              ?         
1 1 1 6  21 7  o 8.872000  0.1362000     8.912000  0.1908000     8.831000  0.1944000     0.8073000E-01  0.2724000 
1 1 1 6  21 8  o 8.679000  0.1412000     9.008000  0.1998000     8.350000  0.1996000     0.6584000      0.2824000 
1 1 1 6  21 9  o 4.885000  0.1850000     5.153000  0.2489000     4.618000  0.2738000     0.5354000      0.3700000 
1 1 1 6  21 10 o 5.123000  0.1854000     4.981000  0.2638000     5.264000  0.2605000     -0.2836000     0.3708000 
1 1 1 6  21 11 o 19.78000  0.1902000     19.71000  0.2677000     19.84000  0.2703000     -0.1382000     0.3804000 
1 1 1 6  21 12 o 8.577000  0.1656000     8.569000  0.2354000     8.584000  0.2329000     -0.1482000E-01 0.3312000 
1 1 1 6  21 13 o 13.94000  0.2163000     13.64000  0.3012000     14.25000  0.3104000     -0.6085000     0.4325000 
1 1 1 6  21 14 o 11.87000  0.1971000     11.77000  0.2791000     11.97000  0.2784000     -0.2030000     0.3942000 
1 1 1 6  21 15 o 6.259000  0.2745000     5.834000  0.3918000     6.684000  0.3848000     -0.8497000     0.5491000 
1 1 1 6  21 16 f 4.434000  0.4019000     4.185000  0.5842000     4.683000  0.5521000     -0.4978000     0.8038000 
1 1 1 6  21 17 o 3.827000  0.5146000     4.123000  0.6727000     3.530000  0.7789000     0.5928000      1.029000  
1 1 1 6  21 18 o 5.228000  0.4466000     5.359000  0.6182000     5.096000  0.6445000     0.2632000      0.8931000 
1 1 1 6  21 19 o 4.692000  0.6406000     3.480000  1.178000      5.904000  0.5025000     -2.425000      1.281000  
1 1 1 6  21 20 o 5.640000  0.3398000     5.587000  0.4897000     5.693000  0.4711000     -0.1060000     0.6795000 
1 1 1 6  21 21 o 1.771000  0.5295000     1.825000  0.7588000     1.718000  0.7387000     0.1071000      1.059000  
1 1 1 6  21 22 o 2.056000  0.5429000     2.137000  0.7822000     1.974000  0.7532000     0.1627000      1.086000  
1 1 1 6  21 23 o 1.626000  0.4995000     1.550000  0.6859000     1.702000  0.7265000     -0.1522000     0.9991000 
1 1 1 6  21 24 o 1.915000  0.5800000     1.857000  0.8987000     1.973000  0.7334000     -0.1154000     1.160000  
1 1 1 6  21 25 o 1.984000  0.5131000     1.761000  0.7071000     2.207000  0.7438000     -0.4466000     1.026000  
1 1 1 6  21 26 o 1.467000  0.4596000     1.369000  0.6219000     1.566000  0.6768000     -0.1971000     0.9191000 
1 1 1 6  22 0  o 7.116000  0.1719000     7.116000  0.1719000     7.116000  0.1719000     -0.000000      0.000000  
1 1 1 6  22 1  o 12.35000  0.1427000     12.45000  0.1871000     12.25000  0.2154000     0.1984000      0.2853000 
1 1 1 6  22 2  o 1.440000  0.3304000     1.213000  0.4488000     1.666000  0.4850000     -0.4532000     0.6608000 
1 1 1 6  22 3  o 4.482000  0.1603000     4.319000  0.2150000     4.644000  0.2379000     -0.3247000     0.3207000 
1 1 1 6  22 4  o 3.018000  0.2437000     3.325000  0.3736000     2.712000  0.3131000     0.6128000      0.4875000 
1 1 1 6  22 5  o 8.113000  0.2045000     8.113000  0.2045000     ?         ?             ?              ?         
1 1 1 6  22 6  o 8.155000  0.1643000     8.180000  0.2693000     8.129000  0.1882000     0.5088000E-01  0.3286000 
1 1 1 6  22 7  o 3.822000  0.1949000     3.604000  0.2863000     4.040000  0.2646000     -0.4352000     0.3899000 
1 1 1 6  22 8  o 6.136000  0.1557000     6.126000  0.2218000     6.146000  0.2186000     -0.2005000E-01 0.3114000 
1 1 1 6  22 9  o 8.814000  0.1472000     8.532000  0.2067000     9.097000  0.2097000     -0.5644000     0.2944000 
1 1 1 6  22 10 o 11.54000  0.1538000     11.57000  0.2176000     11.50000  0.2173000     0.6991000E-01  0.3076000 
1 1 1 6  22 11 o 7.959000  0.1644000     8.212000  0.2304000     7.706000  0.2345000     0.5058000      0.3288000 
1 1 1 6  22 12 o 4.737000  0.2786000     4.518000  0.4660000     4.955000  0.3055000     -0.4373000     0.5572000 
1 1 1 6  22 13 o 4.416000  0.3694000     4.089000  0.5952000     4.743000  0.4377000     -0.6542000     0.7388000 
1 1 1 6  22 14 o 3.585000  0.4098000     3.471000  0.5890000     3.700000  0.5700000     -0.2293000     0.8197000 
1 1 1 6  22 15 o 11.58000  0.2085000     11.73000  0.2925000     11.43000  0.2973000     0.3054000      0.4171000 
1 1 1 6  22 16 o 8.070000  0.2590000     8.370000  0.3498000     7.770000  0.3822000     0.5992000      0.5181000 
1 1 1 6  22 17 o 2.696000  0.6059000     2.664000  0.8503000     2.728000  0.8635000     -0.6357000E-01 1.212000  
1 1 1 6  22 18 o 7.811000  0.5052000     7.132000  0.4859000     8.489000  0.8859000     -1.357000      1.010000  
1 1 1 6  22 19 o 5.982000  0.4822000     5.396000  0.8439000     6.569000  0.4669000     -1.174000      0.9644000 
1 1 1 6  22 20 o 2.188000  0.5886000     2.237000  0.8293000     2.139000  0.8355000     0.9842000E-01  1.177000  
1 1 1 6  22 21 o 2.518000  0.5723000     2.676000  0.8138000     2.360000  0.8050000     0.3155000      1.145000  
1 1 1 6  22 22 o 2.297000  0.5448000     2.663000  0.7865000     1.932000  0.7541000     0.7310000      1.090000  
1 1 1 6  22 23 o 1.865000  0.5331000     1.879000  0.7480000     1.851000  0.7599000     0.2775000E-01  1.066000  
1 1 1 6  22 24 o 2.196000  0.5331000     1.663000  0.7794000     2.729000  0.7276000     -1.066000      1.066000  
1 1 1 6  22 25 o 1.449000  0.4423000     1.802000  0.7048000     1.095000  0.5344000     0.7069000      0.8845000 
1 1 1 6  22 26 o 1.310000  0.4302000     1.288000  0.6006000     1.332000  0.6162000     -0.4433000E-01 0.8604000 
1 1 1 6  23 0  o 0.5959000 0.4035000     0.5959000 0.4035000     0.5959000 0.4035000     0.000000       0.000000  
1 1 1 6  23 1  o 21.06000  0.1982000     20.67000  0.2552000     21.45000  0.3033000     -0.7784000     0.3964000 
1 1 1 6  23 2  o 10.31000  0.1377000     10.34000  0.1795000     10.29000  0.2087000     0.5080000E-01  0.2753000 
1 1 1 6  23 3  o 9.780000  0.1508000     9.958000  0.2165000     9.602000  0.2100000     0.3564000      0.3016000 
1 1 1 6  23 4  o 7.194000  0.3384000     7.194000  0.3384000     ?         ?             ?              ?         
1 1 1 6  23 5  o 7.227000  0.1662000     7.417000  0.2710000     7.037000  0.1925000     0.3799000      0.3324000 
1 1 1 6  23 6  o 8.661000  0.1373000     8.474000  0.1943000     8.848000  0.1939000     -0.3742000     0.2745000 
1 1 1 6  23 7  o 3.654000  0.2109000     3.706000  0.2864000     3.603000  0.3096000     0.1031000      0.4217000 
1 1 1 6  23 8  f 14.61000  0.1571000     14.59000  0.2225000     14.62000  0.2219000     -0.3378000E-01 0.3143000 
1 1 1 6  23 9  o 4.150000  0.2122000     4.101000  0.3011000     4.200000  0.2992000     -0.9834000E-01 0.4245000 
1 1 1 6  23 10 o 7.777000  0.1602000     7.859000  0.2220000     7.695000  0.2311000     0.1643000      0.3204000 
1 1 1 6  23 11 o 15.41000  0.1719000     15.50000  0.2447000     15.32000  0.2416000     0.1816000      0.3439000 
1 1 1 6  23 12 o 4.230000  0.3607000     4.449000  0.4882000     4.011000  0.5312000     0.4381000      0.7214000 
1 1 1 6  23 13 o 11.19000  0.1959000     11.16000  0.3054000     11.23000  0.2455000     -0.7788000E-01 0.3918000 
1 1 1 6  23 14 o 8.459000  0.2136000     8.272000  0.3417000     8.646000  0.2563000     -0.3735000     0.4271000 
1 1 1 6  23 15 o 1.632000  0.4971000     1.615000  0.7003000     1.649000  0.7058000     -0.3398000E-01 0.9942000 
1 1 1 6  23 16 o 1.925000  0.5327000     1.439000  0.6632000     2.412000  0.8339000     -0.9728000     1.065000  
1 1 1 6  23 17 o 3.093000  0.5949000     3.149000  0.8333000     3.037000  0.8493000     0.1118000      1.190000  
1 1 1 6  23 18 o 3.827000  0.7760000     4.515000  0.6394000     3.139000  1.414000      1.376000       1.552000  
1 1 1 6  23 19 o 2.478000  0.5967000     2.788000  0.8391000     2.168000  0.8487000     0.6197000      1.193000  
1 1 1 6  23 20 o 2.391000  0.5978000     2.309000  0.8414000     2.473000  0.8495000     -0.1635000     1.196000  
1 1 1 6  23 21 o 4.486000  0.4001000     4.999000  0.4955000     3.974000  0.6285000     1.025000       0.8003000 
1 1 1 6  23 22 o 1.837000  0.5011000     1.295000  0.6141000     2.379000  0.7921000     -1.084000      1.002000  
1 1 1 6  23 23 o 1.819000  0.5926000     1.668000  0.7228000     1.970000  0.9394000     -0.3015000     1.185000  
1 1 1 6  23 24 o 1.724000  0.5008000     1.825000  0.7276000     1.623000  0.6883000     0.2022000      1.002000  
1 1 1 6  23 25 o 1.245000  0.4112000     1.039000  0.5108000     1.451000  0.6446000     -0.4119000     0.8225000 
1 1 1 6  23 26 o 1.523000  0.5169000     1.549000  0.7401000     1.497000  0.7219000     0.5128000E-01  1.034000  
1 1 1 6  24 0  o 11.76000  0.1873000     11.76000  0.1873000     11.76000  0.1873000     -0.000000      0.000000  
1 1 1 6  24 1  o 3.116000  0.2099000     2.864000  0.3004000     3.369000  0.2931000     -0.5048000     0.4197000 
1 1 1 6  24 2  o 7.772000  0.1815000     7.570000  0.2577000     7.975000  0.2555000     -0.4057000     0.3629000 
1 1 1 6  24 3  o 11.13000  0.2652000     11.13000  0.2652000     ?         ?             ?              ?         
1 1 1 6  24 4  o 5.327000  0.1808000     5.303000  0.2951000     5.352000  0.2091000     -0.4925000E-01 0.3617000 
1 1 1 6  24 5  o 12.33000  0.1506000     12.23000  0.2246000     12.42000  0.2007000     -0.1923000     0.3012000 
1 1 1 6  24 6  o 5.788000  0.1545000     5.746000  0.2176000     5.830000  0.2192000     -0.8376000E-01 0.3089000 
1 1 1 6  24 7  o 3.623000  0.2171000     3.700000  0.2995000     3.546000  0.3143000     0.1539000      0.4341000 
1 1 1 6  24 8  o 4.396000  0.1990000     4.701000  0.2652000     4.092000  0.2967000     0.6093000      0.3979000 
1 1 1 6  24 9  o 9.636000  0.1519000     9.701000  0.2154000     9.572000  0.2142000     0.1285000      0.3038000 
1 1 1 6  24 10 o 10.85000  0.1557000     10.95000  0.2196000     10.75000  0.2209000     0.2005000      0.3115000 
1 1 1 6  24 11 o 9.091000  0.1637000     8.936000  0.2335000     9.247000  0.2293000     -0.3106000     0.3273000 
1 1 1 6  24 12 o 5.835000  0.2917000     5.835000  0.2917000     ?         ?             ?              ?         
1 1 1 6  24 13 o 8.927000  0.1811000     8.808000  0.2553000     9.046000  0.2569000     -0.2370000     0.3621000 
1 1 1 6  24 14 o 8.284000  0.1943000     8.394000  0.2721000     8.175000  0.2776000     0.2197000      0.3887000 
1 1 1 6  24 15 o 7.471000  0.2517000     7.545000  0.3490000     7.397000  0.3628000     0.1484000      0.5034000 
1 1 1 6  24 16 f 5.023000  0.3657000     4.313000  0.5622000     5.734000  0.4678000     -1.421000      0.7314000 
1 1 1 6  24 17 f 4.537000  0.4850000     3.397000  0.8234000     5.678000  0.5126000     -2.281000      0.9699000 
1 1 1 6  24 18 o 6.037000  0.3872000     6.215000  0.4977000     5.858000  0.5934000     0.3566000      0.7745000 
1 1 1 6  24 19 o 4.863000  0.4077000     4.834000  0.5767000     4.891000  0.5764000     -0.5689000E-01 0.8153000 
1 1 1 6  24 20 o 1.512000  0.4902000     1.465000  0.6793000     1.559000  0.7069000     -0.9346000E-01 0.9803000 
1 1 1 6  24 21 o 1.694000  0.5135000     1.750000  0.7358000     1.639000  0.7164000     0.1104000      1.027000  
1 1 1 6  24 22 o 1.861000  0.5195000     1.518000  0.6770000     2.205000  0.7882000     -0.6867000     1.039000  
1 1 1 6  24 23 o 1.507000  0.5322000     0.9886000 0.4942000     2.025000  0.9427000     -1.036000      1.064000  
1 1 1 6  24 24 f 1.401000  0.4412000     1.133000  0.5491000     1.670000  0.6908000     -0.5362000     0.8824000 
1 1 1 6  24 25 f 1.031000  0.3590000     0.9198000 0.4608000     1.142000  0.5506000     -0.2223000     0.7180000 
1 1 1 6  25 0  o 10.23000  0.3749000     10.23000  0.3749000     10.23000  0.3749000     -0.000000      0.000000  
1 1 1 6  25 2  o 4.215000  0.2928000     3.721000  0.3643000     4.708000  0.4585000     -0.9871000     0.5856000 
1 1 1 6  25 3  o 7.354000  0.1740000     7.463000  0.2677000     7.245000  0.2223000     0.2186000      0.3479000 
1 1 1 6  25 4  o 5.865000  0.1553000     5.701000  0.2327000     6.030000  0.2058000     -0.3297000     0.3107000 
1 1 1 6  25 5  o 4.655000  0.1803000     4.590000  0.2646000     4.720000  0.2451000     -0.1301000     0.3607000 
1 1 1 6  25 6  o 1.507000  0.3555000     1.201000  0.4955000     1.813000  0.5097000     -0.6124000     0.7109000 
1 1 1 6  25 7  o 10.68000  0.1449000     10.72000  0.2053000     10.65000  0.2046000     0.7179000E-01  0.2899000 
1 1 1 6  25 8  o 9.085000  0.1499000     9.015000  0.2112000     9.155000  0.2127000     -0.1397000     0.2998000 
1 1 1 6  25 9  o 15.17000  0.1651000     15.33000  0.2340000     15.00000  0.2329000     0.3274000      0.3301000 
1 1 1 6  25 10 o 24.00000  0.2160000     23.78000  0.3031000     24.21000  0.3077000     -0.4311000     0.4319000 
1 1 1 6  25 11 o 10.91000  0.2003000     11.52000  0.3275000     10.31000  0.2308000     1.207000       0.4006000 
1 1 1 6  25 12 o 12.56000  0.2253000     12.53000  0.3422000     12.60000  0.2931000     -0.6827000E-01 0.4506000 
1 1 1 6  25 13 o 10.49000  0.1781000     10.02000  0.2542000     10.96000  0.2494000     -0.9453000     0.3562000 
1 1 1 6  25 14 f 7.945000  0.1973000     7.771000  0.2799000     8.118000  0.2780000     -0.3473000     0.3945000 
1 1 1 6  25 15 o 4.938000  0.3348000     4.847000  0.5341000     5.030000  0.4038000     -0.1829000     0.6696000 
1 1 1 6  25 16 o 6.984000  0.2934000     6.412000  0.4390000     7.556000  0.3895000     -1.144000      0.5869000 
1 1 1 6  25 17 o 5.758000  0.3820000     5.109000  0.5909000     6.407000  0.4843000     -1.298000      0.7640000 
1 1 1 6  25 18 o 3.504000  0.7392000     3.248000  1.258000      3.760000  0.7772000     -0.5129000     1.478000  
1 1 1 6  25 19 o 4.453000  0.4294000     4.491000  0.5839000     4.415000  0.6297000     0.7616000E-01  0.8587000 
1 1 1 6  25 20 o 3.054000  0.5586000     3.177000  0.7502000     2.930000  0.8280000     0.2473000      1.117000  
1 1 1 6  25 21 o 2.316000  0.5430000     1.809000  0.7558000     2.822000  0.7798000     -1.013000      1.086000  
1 1 1 6  25 22 o 2.024000  0.5165000     1.462000  0.6614000     2.586000  0.7935000     -1.124000      1.033000  
1 1 1 6  25 23 o 1.322000  0.4473000     1.285000  0.6195000     1.359000  0.6455000     -0.7393000E-01 0.8947000 
1 1 1 6  25 24 o 2.301000  0.5266000     2.528000  0.7475000     2.075000  0.7419000     0.4527000      1.053000  
1 1 1 6  25 25 f 1.182000  0.3992000     1.261000  0.5909000     1.104000  0.5369000     0.1571000      0.7984000 
1 1 1 6  26 0  o 1.075000  0.6077000     1.075000  0.6077000     1.075000  0.6077000     0.000000       0.000000  
1 1 1 6  26 1  o 10.54000  0.1553000     10.41000  0.2186000     10.68000  0.2207000     -0.2637000     0.3107000 
1 1 1 6  26 2  f 9.327000  0.1440000     9.194000  0.1882000     9.460000  0.2180000     -0.2663000     0.2880000 
1 1 1 6  26 3  o 5.688000  0.1636000     5.619000  0.2138000     5.757000  0.2477000     -0.1380000     0.3272000 
1 1 1 6  26 4  o 3.150000  0.2361000     2.890000  0.3719000     3.410000  0.2911000     -0.5197000     0.4723000 
1 1 1 6  26 5  o 12.80000  0.1560000     12.66000  0.2328000     12.94000  0.2077000     -0.2829000     0.3120000 
1 1 1 6  26 6  o 5.571000  0.1631000     5.540000  0.2295000     5.601000  0.2318000     -0.6070000E-01 0.3262000 
1 1 1 6  26 7  o 11.54000  0.1479000     11.52000  0.2087000     11.57000  0.2097000     -0.4923000E-01 0.2958000 
1 1 1 6  26 8  o 10.39000  0.1510000     10.31000  0.2139000     10.46000  0.2133000     -0.1494000     0.3021000 
1 1 1 6  26 9  o 11.44000  0.1566000     11.80000  0.2217000     11.08000  0.2212000     0.7213000      0.3131000 
1 1 1 6  26 10 o 5.773000  0.1913000     5.609000  0.2754000     5.938000  0.2657000     -0.3296000     0.3827000 
1 1 1 6  26 11 f 6.057000  0.2758000     6.471000  0.2693000     5.643000  0.4813000     0.8273000      0.5516000 
1 1 1 6  26 12 o 15.86000  0.1992000     15.98000  0.3074000     15.73000  0.2534000     0.2534000      0.3984000 
1 1 1 6  26 13 o 7.062000  0.2019000     7.052000  0.2830000     7.072000  0.2879000     -0.1933000E-01 0.4037000 
1 1 1 6  26 14 o 10.37000  0.1945000     10.69000  0.2846000     10.06000  0.2652000     0.6296000      0.3890000 
1 1 1 6  26 15 o 2.478000  0.5048000     2.363000  0.7229000     2.592000  0.7049000     -0.2289000     1.010000  
1 1 1 6  26 16 o 4.750000  0.3927000     4.393000  0.5837000     5.106000  0.5255000     -0.7126000     0.7854000 
1 1 1 6  26 17 o 2.544000  0.7342000     2.313000  0.8828000     2.774000  1.173000      -0.4605000     1.468000  
1 1 1 6  26 18 o 6.775000  0.4511000     7.254000  0.7677000     6.295000  0.4738000     0.9586000      0.9021000 
1 1 1 6  26 19 o 2.239000  0.5791000     1.949000  0.8008000     2.529000  0.8368000     -0.5802000     1.158000  
1 1 1 6  26 20 f 2.242000  0.5585000     2.384000  0.7931000     2.099000  0.7865000     0.2856000      1.117000  
1 1 1 6  26 21 o 2.483000  0.5596000     2.548000  0.7719000     2.418000  0.8105000     0.1295000      1.119000  
1 1 1 6  26 22 o 1.841000  0.5018000     1.279000  0.6057000     2.404000  0.8003000     -1.125000      1.004000  
1 1 1 6  26 23 o 1.883000  0.5740000     1.674000  0.8248000     2.092000  0.7986000     -0.4183000     1.148000  
1 1 1 6  26 24 o 1.577000  0.4719000     1.878000  0.7293000     1.277000  0.5989000     0.6014000      0.9437000 
1 1 1 6  26 25 o 2.068000  0.5218000     2.119000  0.7452000     2.017000  0.7305000     0.1026000      1.044000  
1 1 1 6  27 0  o 0.8118000 0.5091000     0.8118000 0.5091000     0.8118000 0.5091000     0.000000       0.000000  
1 1 1 6  27 1  o 9.464000  0.1453000     9.273000  0.1897000     9.654000  0.2200000     -0.3814000     0.2905000 
1 1 1 6  27 2  o 9.385000  0.1467000     9.434000  0.1920000     9.335000  0.2218000     0.9909000E-01  0.2934000 
1 1 1 6  27 3  o 15.48000  0.1580000     15.20000  0.2211000     15.76000  0.2257000     -0.5563000     0.3159000 
1 1 1 6  27 4  o 5.295000  0.1740000     5.300000  0.2595000     5.289000  0.2319000     0.1109000E-01  0.3480000 
1 1 1 6  27 5  o 8.812000  0.1526000     8.797000  0.2273000     8.827000  0.2037000     -0.3022000E-01 0.3052000 
1 1 1 6  27 6  o 9.011000  0.1448000     8.929000  0.2055000     9.093000  0.2041000     -0.1634000     0.2896000 
1 1 1 6  27 7  o 12.04000  0.1501000     11.82000  0.2123000     12.27000  0.2123000     -0.4487000     0.3003000 
1 1 1 6  27 8  o 4.581000  0.2050000     4.675000  0.2856000     4.487000  0.2943000     0.1880000      0.4100000 
1 1 1 6  27 9  o 17.00000  0.1759000     16.70000  0.2464000     17.31000  0.2511000     -0.6076000     0.3518000 
1 1 1 6  27 10 o 17.15000  0.2213000     17.22000  0.3626000     17.08000  0.2538000     0.1355000      0.4426000 
1 1 1 6  27 11 o 14.39000  0.2457000     14.33000  0.3426000     14.45000  0.3523000     -0.1219000     0.4914000 
1 1 1 6  27 12 o 4.665000  0.2561000     4.774000  0.3563000     4.556000  0.3680000     0.2177000      0.5122000 
1 1 1 6  27 13 o 3.612000  0.3373000     3.407000  0.4928000     3.817000  0.4606000     -0.4100000     0.6746000 
1 1 1 6  27 14 o 2.196000  0.4656000     2.759000  0.6512000     1.634000  0.6658000     1.126000       0.9313000 
1 1 1 6  27 15 o 8.520000  0.2080000     8.153000  0.3007000     8.887000  0.2874000     -0.7336000     0.4160000 
1 1 1 6  27 16 o 7.780000  0.2786000     7.986000  0.3887000     7.574000  0.3994000     0.4123000      0.5573000 
1 1 1 6  27 17 o 2.710000  0.8423000     1.757000  0.7618000     3.662000  1.503000      -1.905000      1.685000  
1 1 1 6  27 18 o 7.439000  0.2940000     7.196000  0.4170000     7.682000  0.4146000     -0.4860000     0.5880000 
1 1 1 6  27 19 o 1.984000  0.5520000     2.315000  0.8295000     1.653000  0.7286000     0.6620000      1.104000  
1 1 1 6  27 20 o 2.033000  0.5416000     2.220000  0.7814000     1.846000  0.7501000     0.3739000      1.083000  
1 1 1 6  27 21 o 3.206000  0.5121000     3.182000  0.7367000     3.231000  0.7114000     -0.4908000E-01 1.024000  
1 1 1 6  27 22 o 2.643000  0.5377000     3.392000  0.7336000     1.895000  0.7863000     1.497000       1.075000  
1 1 1 6  27 23 o 1.719000  0.5757000     2.061000  0.9623000     1.377000  0.6321000     0.6834000      1.151000  
1 1 1 6  27 24 o 1.138000  0.3892000     1.033000  0.5089000     1.243000  0.5890000     -0.2101000     0.7784000 
1 1 1 6  27 25 o 1.389000  0.4383000     1.035000  0.5107000     1.742000  0.7124000     -0.7072000     0.8765000 
1 1 1 6  28 0  o 11.58000  0.2001000     11.58000  0.2001000     11.58000  0.2001000     -0.000000      0.000000  
1 1 1 6  28 1  o 17.81000  0.1829000     17.57000  0.2370000     18.04000  0.2787000     -0.4735000     0.3658000 
1 1 1 6  28 2  f 16.12000  0.1736000     16.13000  0.2268000     16.12000  0.2630000     0.1271000E-01  0.3473000 
1 1 1 6  28 3  o 6.454000  0.1537000     6.654000  0.2159000     6.254000  0.2187000     0.4000000      0.3073000 
1 1 1 6  28 4  o 9.134000  0.1519000     9.163000  0.2265000     9.106000  0.2026000     0.5654000E-01  0.3039000 
1 1 1 6  28 5  f 5.581000  0.1759000     5.830000  0.2560000     5.332000  0.2413000     0.4978000      0.3518000 
1 1 1 6  28 6  o 10.53000  0.1470000     10.55000  0.2082000     10.51000  0.2075000     0.3817000E-01  0.2939000 
1 1 1 6  28 7  o 7.088000  0.1586000     7.085000  0.2264000     7.090000  0.2222000     -0.4821000E-02 0.3173000 
1 1 1 6  28 8  o 14.21000  0.1620000     14.30000  0.2296000     14.12000  0.2286000     0.1805000      0.3240000 
1 1 1 6  28 9  o 3.237000  0.2872000     3.254000  0.4048000     3.221000  0.4075000     0.3296000E-01  0.5744000 
1 1 1 6  28 10 o 5.680000  0.2908000     5.515000  0.4228000     5.845000  0.3995000     -0.3306000     0.5817000 
1 1 1 6  28 11 o 8.570000  0.2158000     8.748000  0.3501000     8.393000  0.2523000     0.3549000      0.4316000 
1 1 1 6  28 12 o 5.236000  0.2383000     5.263000  0.3328000     5.208000  0.3412000     0.5539000E-01  0.4766000 
1 1 1 6  28 13 f 5.628000  0.2404000     5.634000  0.3434000     5.623000  0.3363000     0.1049000E-01  0.4807000 
1 1 1 6  28 14 o 9.618000  0.1934000     9.705000  0.2713000     9.532000  0.2758000     0.1731000      0.3868000 
1 1 1 6  28 15 o 4.739000  0.3179000     4.221000  0.4876000     5.257000  0.4081000     -1.036000      0.6359000 
1 1 1 6  28 16 o 1.532000  0.4752000     1.435000  0.6455000     1.629000  0.6976000     -0.1948000     0.9504000 
1 1 1 6  28 17 o 11.61000  0.3040000     11.64000  0.4188000     11.58000  0.4407000     0.5720000E-01  0.6080000 
1 1 1 6  28 18 o 4.165000  0.4598000     4.618000  0.5571000     3.711000  0.7316000     0.9075000      0.9196000 
1 1 1 6  28 19 o 4.834000  0.3723000     4.671000  0.5482000     4.997000  0.5038000     -0.3261000     0.7445000 
1 1 1 6  28 20 o 3.429000  0.4802000     3.247000  0.7024000     3.610000  0.6550000     -0.3633000     0.9605000 
1 1 1 6  28 21 o 1.606000  0.4886000     1.411000  0.6438000     1.801000  0.7351000     -0.3900000     0.9772000 
1 1 1 6  28 22 o 1.735000  0.5709000     1.610000  0.7084000     1.861000  0.8954000     -0.2506000     1.142000  
1 1 1 6  28 23 f 1.824000  0.5450000     2.007000  0.8408000     1.641000  0.6938000     0.3656000      1.090000  
1 1 1 6  28 24 o 1.564000  0.4731000     1.301000  0.6071000     1.828000  0.7258000     -0.5269000     0.9463000 
1 1 1 6  28 25 o 0.9884000 0.3481000     1.031000  0.5104000     0.9456000 0.4734000     0.8555000E-01  0.6961000 
1 1 1 6  29 0  o 19.77000  0.2585000     19.77000  0.2585000     19.77000  0.2585000     -0.000000      0.000000  
1 1 1 6  29 1  o 8.587000  0.1534000     8.563000  0.1987000     8.611000  0.2337000     -0.4779000E-01 0.3067000 
1 1 1 6  29 2  o 2.266000  0.3482000     2.553000  0.4098000     1.979000  0.5631000     0.5740000      0.6965000 
1 1 1 6  29 3  o 22.96000  0.2034000     22.73000  0.2862000     23.18000  0.2892000     -0.4463000     0.4069000 
1 1 1 6  29 4  o 12.39000  0.1589000     12.26000  0.2378000     12.52000  0.2109000     -0.2608000     0.3179000 
1 1 1 6  29 5  o 12.24000  0.1595000     12.19000  0.2393000     12.29000  0.2110000     -0.1012000     0.3190000 
1 1 1 6  29 6  o 5.177000  0.1843000     5.396000  0.2541000     4.958000  0.2669000     0.4381000      0.3685000 
1 1 1 6  29 7  o 11.18000  0.1528000     11.15000  0.2154000     11.20000  0.2167000     -0.5044000E-01 0.3055000 
1 1 1 6  29 8  o 5.824000  0.1817000     6.042000  0.2533000     5.606000  0.2606000     0.4355000      0.3634000 
1 1 1 6  29 9  o 11.55000  0.2003000     11.54000  0.3292000     11.56000  0.2283000     -0.2338000E-01 0.4006000 
1 1 1 6  29 10 o 9.536000  0.2643000     9.297000  0.2670000     9.776000  0.4562000     -0.4789000     0.5286000 
1 1 1 6  29 11 o 14.15000  0.1752000     13.88000  0.2455000     14.43000  0.2500000     -0.5457000     0.3504000 
1 1 1 6  29 12 o 7.258000  0.1972000     6.998000  0.2863000     7.519000  0.2713000     -0.5207000     0.3944000 
1 1 1 6  29 13 o 6.301000  0.2222000     6.549000  0.3111000     6.053000  0.3173000     0.4964000      0.4444000 
1 1 1 6  29 14 o 12.28000  0.1897000     12.12000  0.2690000     12.43000  0.2677000     -0.3153000     0.3795000 
1 1 1 6  29 15 o 7.159000  0.2424000     7.099000  0.3462000     7.219000  0.3395000     -0.1202000     0.4849000 
1 1 1 6  29 16 o 6.742000  0.3208000     7.149000  0.5100000     6.334000  0.3893000     0.8151000      0.6416000 
1 1 1 6  29 17 o 5.853000  0.5860000     6.401000  1.041000      5.304000  0.5385000     1.097000       1.172000  
1 1 1 6  29 18 o 3.183000  0.5421000     3.127000  0.7627000     3.240000  0.7705000     -0.1131000     1.084000  
1 1 1 6  29 19 o 1.601000  0.4992000     1.409000  0.6576000     1.793000  0.7513000     -0.3841000     0.9984000 
1 1 1 6  29 20 o 1.662000  0.5049000     1.690000  0.7186000     1.633000  0.7095000     0.5701000E-01  1.010000  
1 1 1 6  29 21 o 1.504000  0.4769000     1.386000  0.6431000     1.621000  0.7043000     -0.2342000     0.9538000 
1 1 1 6  29 22 o 1.489000  0.5045000     1.409000  0.6435000     1.568000  0.7772000     -0.1584000     1.009000  
1 1 1 6  29 23 o 1.886000  0.5145000     2.153000  0.7545000     1.620000  0.6996000     0.5331000      1.029000  
1 1 1 6  29 24 f 1.819000  0.4670000     1.201000  0.5745000     2.436000  0.7364000     -1.236000      0.9340000 
1 1 1 6  30 0  o 10.80000  0.2089000     10.80000  0.2089000     10.80000  0.2089000     0.000000       0.000000  
1 1 1 6  30 1  f 4.958000  0.1933000     5.010000  0.2508000     4.907000  0.2941000     0.1035000      0.3865000 
1 1 1 6  30 2  o 21.61000  0.2104000     21.37000  0.2729000     21.84000  0.3203000     -0.4677000     0.4208000 
1 1 1 6  30 3  o 5.865000  0.1652000     6.039000  0.2303000     5.690000  0.2370000     0.3492000      0.3305000 
1 1 1 6  30 4  o 23.56000  0.2231000     23.12000  0.3327000     24.00000  0.2973000     -0.8799000     0.4462000 
1 1 1 6  30 5  o 5.034000  0.1974000     4.973000  0.2932000     5.096000  0.2644000     -0.1237000     0.3948000 
1 1 1 6  30 6  o 8.366000  0.1537000     8.606000  0.2149000     8.127000  0.2199000     0.4790000      0.3075000 
1 1 1 6  30 7  o 10.23000  0.1525000     10.32000  0.2158000     10.15000  0.2157000     0.1735000      0.3051000 
1 1 1 6  30 8  o 12.31000  0.1585000     12.44000  0.2250000     12.19000  0.2234000     0.2523000      0.3171000 
1 1 1 6  30 9  o 12.28000  0.2671000     12.57000  0.3308000     12.00000  0.4194000     0.5666000      0.5342000 
1 1 1 6  30 10 o 21.39000  0.2511000     21.56000  0.4116000     21.23000  0.2877000     0.3318000      0.5022000 
1 1 1 6  30 11 o 9.246000  0.1781000     9.164000  0.2531000     9.329000  0.2507000     -0.1657000     0.3563000 
1 1 1 6  30 12 o 7.375000  0.1996000     7.030000  0.2843000     7.720000  0.2801000     -0.6902000     0.3991000 
1 1 1 6  30 13 o 4.881000  0.2892000     4.444000  0.4447000     5.318000  0.3698000     -0.8743000     0.5783000 
1 1 1 6  30 14 o 12.39000  0.1912000     12.57000  0.2717000     12.21000  0.2691000     0.3564000      0.3824000 
1 1 1 6  30 15 o 6.467000  0.2600000     6.759000  0.3599000     6.175000  0.3753000     0.5847000      0.5200000 
1 1 1 6  30 16 o 7.211000  0.3070000     7.154000  0.3590000     7.267000  0.4980000     -0.1125000     0.6140000 
1 1 1 6  30 17 o 2.656000  0.5591000     2.331000  0.8736000     2.980000  0.6979000     -0.6493000     1.118000  
1 1 1 6  30 18 o 2.556000  0.5679000     2.842000  0.7975000     2.269000  0.8088000     0.5724000      1.136000  
1 1 1 6  30 19 o 2.777000  0.5627000     3.016000  0.7874000     2.537000  0.8041000     0.4785000      1.125000  
1 1 1 6  30 20 o 2.688000  0.5478000     2.809000  0.7672000     2.567000  0.7823000     0.2412000      1.096000  
1 1 1 6  30 21 o 1.964000  0.5352000     1.805000  0.7363000     2.123000  0.7770000     -0.3186000     1.070000  
1 1 1 6  30 22 o 1.763000  0.5080000     1.327000  0.6322000     2.198000  0.7952000     -0.8710000     1.016000  
1 1 1 6  30 23 o 1.579000  0.4807000     1.419000  0.6408000     1.740000  0.7166000     -0.3208000     0.9613000 
1 1 1 6  30 24 o 1.262000  0.4193000     1.335000  0.6149000     1.188000  0.5703000     0.1476000      0.8387000 
1 1 1 6  31 0  o 0.5736000 0.4127000     0.5736000 0.4127000     0.5736000 0.4127000     0.000000       0.000000  
1 1 1 6  31 1  o 6.585000  0.1686000     6.543000  0.2195000     6.628000  0.2560000     -0.8484000E-01 0.3373000 
1 1 1 6  31 2  o 10.72000  0.1582000     10.95000  0.2071000     10.49000  0.2393000     0.4579000      0.3165000 
1 1 1 6  31 3  o 3.524000  0.2392000     3.384000  0.3609000     3.664000  0.3138000     -0.2805000     0.4783000 
1 1 1 6  31 4  o 6.922000  0.1682000     6.491000  0.2566000     7.352000  0.2174000     -0.8611000     0.3364000 
1 1 1 6  31 5  o 11.56000  0.1635000     11.93000  0.2441000     11.19000  0.2177000     0.7353000      0.3271000 
1 1 1 6  31 6  o 8.290000  0.1580000     8.247000  0.2224000     8.334000  0.2245000     -0.8713000E-01 0.3160000 
1 1 1 6  31 7  o 4.217000  0.2278000     4.207000  0.3223000     4.228000  0.3220000     -0.2179000E-01 0.4555000 
1 1 1 6  31 8  o 6.122000  0.2318000     6.036000  0.3831000     6.208000  0.2609000     -0.1722000     0.4635000 
1 1 1 6  31 9  o 10.40000  0.2758000     10.36000  0.3307000     10.45000  0.4415000     -0.8223000E-01 0.5516000 
1 1 1 6  31 10 o 20.05000  0.1978000     19.98000  0.2799000     20.12000  0.2796000     -0.1449000     0.3957000 
1 1 1 6  31 11 o 18.53000  0.1943000     18.15000  0.2705000     18.91000  0.2790000     -0.7616000     0.3886000 
1 1 1 6  31 12 o 9.058000  0.1860000     8.668000  0.2675000     9.448000  0.2585000     -0.7792000     0.3720000 
1 1 1 6  31 13 o 11.75000  0.1867000     11.84000  0.2658000     11.66000  0.2623000     0.1768000      0.3734000 
1 1 1 6  31 14 o 9.740000  0.2044000     9.599000  0.2893000     9.880000  0.2888000     -0.2812000     0.4088000 
1 1 1 6  31 15 o 3.981000  0.3990000     3.505000  0.6266000     4.457000  0.4943000     -0.9522000     0.7981000 
1 1 1 6  31 16 o 2.812000  0.6273000     2.896000  0.7246000     2.727000  1.024000      0.1692000      1.255000  
1 1 1 6  31 17 o 4.671000  0.3529000     4.193000  0.5472000     5.149000  0.4459000     -0.9561000     0.7059000 
1 1 1 6  31 18 o 2.543000  0.5703000     2.259000  0.8173000     2.826000  0.7957000     -0.5665000     1.141000  
1 1 1 6  31 19 o 2.673000  0.5564000     2.952000  0.7647000     2.394000  0.8084000     0.5582000      1.113000  
1 1 1 6  31 20 o 2.643000  0.5198000     3.101000  0.7078000     2.186000  0.7613000     0.9157000      1.040000  
1 1 1 6  31 21 o 1.661000  0.5084000     1.413000  0.6550000     1.910000  0.7777000     -0.4968000     1.017000  
1 1 1 6  31 22 o 1.892000  0.6044000     2.126000  0.9836000     1.659000  0.7027000     0.4677000      1.209000  
1 1 1 6  31 23 o 2.109000  0.5190000     1.809000  0.7226000     2.408000  0.7453000     -0.5997000     1.038000  
1 1 1 6  31 24 o 1.536000  0.4761000     1.604000  0.6925000     1.468000  0.6536000     0.1357000      0.9522000 
1 1 1 6  32 0  o 1.030000  0.6298000     1.030000  0.6298000     1.030000  0.6298000     -0.000000      0.000000  
1 1 1 6  32 1  o 10.96000  0.1589000     10.89000  0.2080000     11.03000  0.2403000     -0.1457000     0.3178000 
1 1 1 6  32 2  o 6.570000  0.1712000     6.452000  0.2265000     6.688000  0.2566000     -0.2363000     0.3423000 
1 1 1 6  32 3  o 15.98000  0.1667000     15.76000  0.2356000     16.21000  0.2359000     -0.4478000     0.3334000 
1 1 1 6  32 4  o 12.58000  0.1655000     12.59000  0.2485000     12.56000  0.2188000     0.2705000E-01  0.3311000 
1 1 1 6  32 5  o 12.43000  0.1661000     12.51000  0.2486000     12.35000  0.2203000     0.1549000      0.3322000 
1 1 1 6  32 6  o 3.406000  0.2709000     3.438000  0.3820000     3.374000  0.3842000     0.6393000E-01  0.5418000 
1 1 1 6  32 7  o 5.422000  0.2193000     5.332000  0.3403000     5.512000  0.2766000     -0.1801000     0.4386000 
1 1 1 6  32 8  o 14.35000  0.2384000     14.35000  0.2384000     ?         ?             ?              ?         
1 1 1 6  32 9  o 6.179000  0.2194000     6.133000  0.3456000     6.226000  0.2703000     -0.9302000E-01 0.4387000 
1 1 1 6  32 10 o 5.605000  0.2224000     5.861000  0.3086000     5.348000  0.3203000     0.5124000      0.4447000 
1 1 1 6  32 11 o 6.474000  0.2112000     6.824000  0.2820000     6.124000  0.3145000     0.7003000      0.4225000 
1 1 1 6  32 12 o 16.49000  0.1896000     16.56000  0.2677000     16.41000  0.2685000     0.1487000      0.3792000 
1 1 1 6  32 13 o 11.35000  0.1904000     11.75000  0.2717000     10.95000  0.2668000     0.8046000      0.3809000 
1 1 1 6  32 14 o 4.441000  0.3478000     3.853000  0.5482000     5.029000  0.4283000     -1.175000      0.6956000 
1 1 1 6  32 15 o 7.739000  0.2928000     7.321000  0.4864000     8.157000  0.3262000     -0.8358000     0.5857000 
1 1 1 6  32 16 o 3.133000  0.5654000     3.749000  0.8247000     2.516000  0.7736000     1.233000       1.131000  
1 1 1 6  32 17 o 1.990000  0.5228000     2.308000  0.7688000     1.673000  0.7088000     0.6343000      1.046000  
1 1 1 6  32 18 o 2.074000  0.5555000     2.304000  0.8574000     1.845000  0.7067000     0.4593000      1.111000  
1 1 1 6  32 19 o 2.661000  0.5283000     2.929000  0.7245000     2.393000  0.7693000     0.5353000      1.057000  
1 1 1 6  32 20 o 1.943000  0.5079000     2.398000  0.7658000     1.487000  0.6674000     0.9106000      1.016000  
1 1 1 6  32 21 o 2.615000  0.6147000     3.139000  0.7484000     2.091000  0.9752000     1.048000       1.229000  
1 1 1 6  32 22 o 1.353000  0.4519000     1.239000  0.6207000     1.467000  0.6570000     -0.2277000     0.9039000 
1 1 1 6  32 23 o 1.235000  0.4151000     1.291000  0.6068000     1.180000  0.5665000     0.1106000      0.8301000 
1 1 1 6  32 24 o 1.369000  0.4424000     1.467000  0.6519000     1.270000  0.5983000     0.1971000      0.8849000 
1 1 1 6  33 0  o 4.935000  0.3122000     4.935000  0.3122000     4.935000  0.3122000     -0.000000      0.000000  
1 1 1 6  33 1  f 4.054000  0.2359000     4.343000  0.2902000     3.766000  0.3720000     0.5772000      0.4718000 
1 1 1 6  33 2  o 12.03000  0.1656000     12.27000  0.2168000     11.80000  0.2504000     0.4755000      0.3312000 
1 1 1 6  33 3  o 10.62000  0.1528000     10.62000  0.2179000     10.62000  0.2144000     -0.3996000E-03 0.3057000 
1 1 1 6  33 4  o 6.005000  0.1855000     5.853000  0.2798000     6.158000  0.2435000     -0.3045000     0.3709000 
1 1 1 6  33 5  o 14.40000  0.1747000     14.39000  0.2617000     14.42000  0.2315000     -0.2807000E-01 0.3494000 
1 1 1 6  33 6  o 13.16000  0.1621000     13.24000  0.2307000     13.08000  0.2277000     0.1613000      0.3242000 
1 1 1 6  33 7  o 6.582000  0.3699000     6.582000  0.3699000     ?         ?             ?              ?         
1 1 1 6  33 8  o 7.006000  0.2185000     6.940000  0.3568000     7.072000  0.2523000     -0.1323000     0.4370000 
1 1 1 6  33 9  o 9.159000  0.1719000     9.212000  0.2433000     9.106000  0.2428000     0.1065000      0.3438000 
1 1 1 6  33 10 o 7.967000  0.1873000     8.054000  0.2623000     7.879000  0.2674000     0.1754000      0.3746000 
1 1 1 6  33 11 o 11.48000  0.1778000     11.55000  0.2538000     11.40000  0.2490000     0.1510000      0.3555000 
1 1 1 6  33 12 o 3.401000  0.3857000     3.438000  0.5327000     3.364000  0.5579000     0.7475000E-01  0.7714000 
1 1 1 6  33 13 o 6.990000  0.2293000     6.955000  0.3246000     7.024000  0.3239000     -0.6824000E-01 0.4586000 
1 1 1 6  33 14 o 5.005000  0.3038000     4.959000  0.4403000     5.051000  0.4187000     -0.9157000E-01 0.6076000 
1 1 1 6  33 15 o 5.865000  0.4143000     5.907000  0.4040000     5.823000  0.7233000     0.8385000E-01  0.8285000 
1 1 1 6  33 16 o 10.63000  0.2097000     10.77000  0.2963000     10.49000  0.2967000     0.2872000      0.4193000 
1 1 1 6  33 17 o 4.717000  0.3388000     4.384000  0.5123000     5.050000  0.4436000     -0.6662000     0.6777000 
1 1 1 6  33 18 o 2.096000  0.4677000     1.339000  0.6192000     2.854000  0.7010000     -1.515000      0.9353000 
1 1 1 6  33 19 o 1.457000  0.4676000     1.546000  0.6851000     1.368000  0.6366000     0.1778000      0.9352000 
1 1 1 6  33 20 o 1.839000  0.5173000     1.718000  0.7091000     1.960000  0.7533000     -0.2423000     1.035000  
1 1 1 6  33 21 o 1.995000  0.5241000     2.463000  0.7241000     1.528000  0.7579000     0.9346000      1.048000  
1 1 1 6  33 22 f 2.606000  0.5104000     2.105000  0.7611000     3.107000  0.6804000     -1.002000      1.021000  
1 1 1 6  33 23 o 1.660000  0.4888000     1.918000  0.7383000     1.401000  0.6407000     0.5167000      0.9775000 
1 1 1 6  33 24 o 1.679000  0.5073000     1.600000  0.7041000     1.758000  0.7305000     -0.1582000     1.015000  
1 1 1 6  34 0  o 5.355000  0.3111000     5.355000  0.3111000     5.355000  0.3111000     -0.000000      0.000000  
1 1 1 6  34 1  o 4.360000  0.2274000     4.438000  0.2935000     4.281000  0.3475000     0.1564000      0.4549000 
1 1 1 6  34 2  o 14.26000  0.1744000     14.22000  0.2271000     14.30000  0.2648000     -0.7647000E-01 0.3489000 
1 1 1 6  34 3  o 17.06000  0.1748000     16.97000  0.2478000     17.15000  0.2466000     -0.1818000     0.3496000 
1 1 1 6  34 4  o 6.656000  0.1801000     6.769000  0.2679000     6.543000  0.2408000     0.2252000      0.3603000 
1 1 1 6  34 5  o 16.64000  0.1865000     16.61000  0.2799000     16.67000  0.2466000     -0.5482000E-01 0.3730000 
1 1 1 6  34 6  o 10.71000  0.3357000     10.71000  0.3357000     ?         ?             ?              ?         
1 1 1 6  34 7  o 19.89000  0.2511000     19.43000  0.3801000     20.35000  0.3283000     -0.9160000     0.5022000 
1 1 1 6  34 8  o 18.71000  0.1890000     18.62000  0.2664000     18.80000  0.2681000     -0.1859000     0.3780000 
1 1 1 6  34 9  o 5.451000  0.2167000     5.482000  0.3017000     5.419000  0.3112000     0.6378000E-01  0.4334000 
1 1 1 6  34 10 o 12.25000  0.1742000     12.63000  0.2461000     11.86000  0.2467000     0.7742000      0.3485000 
1 1 1 6  34 11 o 3.683000  0.3387000     3.942000  0.4467000     3.424000  0.5092000     0.5184000      0.6774000 
1 1 1 6  34 12 o 4.705000  0.2962000     4.920000  0.4106000     4.489000  0.4272000     0.4315000      0.5925000 
1 1 1 6  34 13 o 7.573000  0.2235000     7.259000  0.3278000     7.887000  0.3038000     -0.6281000     0.4469000 
1 1 1 6  34 14 f 5.345000  0.3711000     5.268000  0.6155000     5.422000  0.4147000     -0.1541000     0.7422000 
1 1 1 6  34 15 o 3.078000  0.5972000     3.192000  0.7455000     2.964000  0.9331000     0.2275000      1.194000  
1 1 1 6  34 16 o 2.177000  0.5140000     2.659000  0.7396000     1.696000  0.7140000     0.9624000      1.028000  
1 1 1 6  34 17 o 2.246000  0.5285000     2.399000  0.7418000     2.093000  0.7531000     0.3059000      1.057000  
1 1 1 6  34 18 o 2.084000  0.5146000     1.734000  0.7182000     2.434000  0.7372000     -0.6997000     1.029000  
1 1 1 6  34 19 o 3.003000  0.4899000     3.825000  0.5910000     2.180000  0.7816000     1.645000       0.9799000 
1 1 1 6  34 20 o 2.501000  0.5266000     2.865000  0.7305000     2.137000  0.7586000     0.7280000      1.053000  
1 1 1 6  34 21 o 1.778000  0.5079000     1.435000  0.6695000     2.121000  0.7639000     -0.6856000     1.016000  
1 1 1 6  34 22 o 1.499000  0.4699000     1.579000  0.6832000     1.418000  0.6453000     0.1609000      0.9398000 
1 1 1 6  34 23 o 1.581000  0.5012000     1.319000  0.6201000     1.843000  0.7876000     -0.5240000     1.002000  
1 1 1 6  35 0  o 6.528000  0.2808000     6.528000  0.2808000     6.528000  0.2808000     -0.000000      0.000000  
1 1 1 6  35 1  o 7.238000  0.1775000     7.139000  0.2359000     7.337000  0.2653000     -0.1986000     0.3551000 
1 1 1 6  35 2  o 16.57000  0.1865000     16.68000  0.2441000     16.46000  0.2819000     0.2221000      0.3729000 
1 1 1 6  35 3  o 17.47000  0.1932000     17.50000  0.2543000     17.43000  0.2908000     0.7627000E-01  0.3863000 
1 1 1 6  35 4  o 16.44000  0.2117000     16.17000  0.3442000     16.71000  0.2466000     -0.5375000     0.4234000 
1 1 1 6  35 5  o 6.599000  0.4814000     6.599000  0.4814000     ?         ?             ?              ?         
1 1 1 6  35 6  o 30.59000  0.3689000     30.42000  0.5165000     30.76000  0.5269000     -0.3405000     0.7379000 
1 1 1 6  35 7  o 22.27000  0.2084000     21.83000  0.2912000     22.71000  0.2982000     -0.8813000     0.4167000 
1 1 1 6  35 8  o 8.088000  0.1781000     8.273000  0.2476000     7.902000  0.2559000     0.3712000      0.3561000 
1 1 1 6  35 9  o 9.445000  0.1730000     9.532000  0.2429000     9.359000  0.2463000     0.1732000      0.3460000 
1 1 1 6  35 10 o 20.95000  0.2056000     20.59000  0.2887000     21.31000  0.2929000     -0.7215000     0.4113000 
1 1 1 6  35 11 o 5.021000  0.2691000     4.765000  0.3966000     5.278000  0.3638000     -0.5129000     0.5382000 
1 1 1 6  35 12 o 10.15000  0.1929000     10.28000  0.2731000     10.02000  0.2724000     0.2674000      0.3857000 
1 1 1 6  35 13 o 5.631000  0.2765000     5.511000  0.4056000     5.752000  0.3759000     -0.2413000     0.5530000 
1 1 1 6  35 14 o 1.893000  0.5713000     2.057000  0.8420000     1.729000  0.7723000     0.3276000      1.143000  
1 1 1 6  35 15 o 3.738000  0.4929000     3.869000  0.7868000     3.606000  0.5939000     0.2636000      0.9857000 
1 1 1 6  35 16 o 2.810000  0.4870000     3.436000  0.6261000     2.184000  0.7462000     1.253000       0.9741000 
1 1 1 6  35 17 o 1.669000  0.4610000     1.095000  0.5362000     2.243000  0.7500000     -1.147000      0.9219000 
1 1 1 6  35 18 o 3.541000  0.4329000     2.932000  0.7022000     4.150000  0.5063000     -1.218000      0.8657000 
1 1 1 6  35 19 o 1.470000  0.4594000     1.356000  0.6429000     1.585000  0.6564000     -0.2288000     0.9188000 
1 1 1 6  35 20 o 1.624000  0.4928000     1.203000  0.5811000     2.045000  0.7961000     -0.8413000     0.9856000 
1 1 1 6  35 21 o 1.720000  0.5692000     2.009000  0.9403000     1.431000  0.6418000     0.5780000      1.138000  
1 1 1 6  35 22 o 1.404000  0.4434000     1.735000  0.7120000     1.072000  0.5288000     0.6631000      0.8869000 
1 1 1 6  35 23 o 2.036000  0.5251000     2.285000  0.7659000     1.786000  0.7186000     0.4994000      1.050000  
1 1 1 6  36 0  o 32.98000  0.4479000     32.98000  0.4479000     32.98000  0.4479000     -0.000000      0.000000  
1 1 1 6  36 1  o 9.679000  0.1705000     9.728000  0.2227000     9.629000  0.2583000     0.9919000E-01  0.3411000 
1 1 1 6  36 2  o 4.615000  0.2186000     4.222000  0.3255000     5.008000  0.2918000     -0.7867000     0.4372000 
1 1 1 6  36 3  o 15.20000  0.2230000     15.00000  0.3481000     15.40000  0.2789000     -0.3965000     0.4461000 
1 1 1 6  36 4  o 18.39000  0.5175000     18.39000  0.5175000     ?         ?             ?              ?         
1 1 1 6  36 5  o 36.93000  0.3922000     36.86000  0.6072000     37.00000  0.4966000     -0.1421000     0.7844000 
1 1 1 6  36 6  o 12.55000  0.1673000     12.72000  0.2364000     12.37000  0.2367000     0.3494000      0.3345000 
1 1 1 6  36 7  o 16.66000  0.1805000     16.56000  0.2546000     16.76000  0.2559000     -0.2037000     0.3610000 
1 1 1 6  36 8  o 17.78000  0.1873000     17.89000  0.2649000     17.67000  0.2647000     0.2204000      0.3745000 
1 1 1 6  36 9  o 2.970000  0.3732000     3.043000  0.5115000     2.896000  0.5436000     0.1464000      0.7464000 
1 1 1 6  36 10 o 8.006000  0.1909000     8.149000  0.2689000     7.864000  0.2710000     0.2852000      0.3818000 
1 1 1 6  36 11 o 10.43000  0.1895000     10.28000  0.2697000     10.58000  0.2663000     -0.2997000     0.3790000 
1 1 1 6  36 12 o 9.568000  0.1999000     9.795000  0.2834000     9.340000  0.2821000     0.4553000      0.3999000 
1 1 1 6  36 13 o 2.843000  0.4903000     3.248000  0.6472000     2.439000  0.7367000     0.8088000      0.9806000 
1 1 1 6  36 14 f 5.306000  0.4251000     5.306000  0.4251000     ?         ?             ?              ?         
1 1 1 6  36 15 o 5.134000  0.3159000     5.408000  0.4295000     4.861000  0.4634000     0.5469000      0.6318000 
1 1 1 6  36 16 o 2.497000  0.5174000     2.145000  0.7507000     2.848000  0.7123000     -0.7030000     1.035000  
1 1 1 6  36 17 o 3.724000  0.4146000     3.276000  0.6458000     4.172000  0.5199000     -0.8957000     0.8291000 
1 1 1 6  36 18 o 4.796000  0.3202000     5.012000  0.4490000     4.580000  0.4567000     0.4326000      0.6404000 
1 1 1 6  36 19 o 1.479000  0.4513000     1.258000  0.5873000     1.699000  0.6852000     -0.4415000     0.9025000 
1 1 1 6  36 20 o 1.779000  0.5900000     1.440000  0.6449000     2.117000  0.9883000     -0.6768000     1.180000  
1 1 1 6  36 21 o 1.481000  0.4582000     1.793000  0.7250000     1.169000  0.5604000     0.6238000      0.9164000 
1 1 1 6  36 22 o 1.867000  0.5109000     1.734000  0.7073000     1.999000  0.7375000     -0.2654000     1.022000  
1 1 1 6  36 23 o 1.399000  0.4419000     1.071000  0.5242000     1.727000  0.7116000     -0.6554000     0.8839000 
1 1 1 6  37 0  o 1.238000  0.7497000     1.238000  0.7497000     1.238000  0.7497000     0.000000       0.000000  
1 1 1 6  37 1  o 9.569000  0.2868000     9.425000  0.3342000     9.714000  0.4663000     -0.2889000     0.5737000 
1 1 1 6  37 2  o 23.84000  0.6128000     23.84000  0.6128000     ?         ?             ?              ?         
1 1 1 6  37 3  o 18.57000  0.3240000     18.67000  0.3720000     18.47000  0.5306000     0.2024000      0.6480000 
1 1 1 6  37 4  o 11.65000  0.1981000     11.70000  0.3221000     11.61000  0.2306000     0.9085000E-01  0.3962000 
1 1 1 6  37 5  o 10.98000  0.1756000     11.11000  0.2620000     10.86000  0.2338000     0.2472000      0.3511000 
1 1 1 6  37 6  o 9.998000  0.1683000     9.880000  0.2374000     10.12000  0.2386000     -0.2361000     0.3366000 
1 1 1 6  37 7  o 16.88000  0.1831000     16.82000  0.2583000     16.94000  0.2595000     -0.1166000     0.3661000 
1 1 1 6  37 8  o 2.165000  0.4471000     2.084000  0.6328000     2.247000  0.6318000     -0.1635000     0.8942000 
1 1 1 6  37 9  o 13.22000  0.1766000     13.45000  0.2492000     12.99000  0.2503000     0.4567000      0.3532000 
1 1 1 6  37 10 o 2.346000  0.4602000     2.128000  0.6646000     2.564000  0.6368000     -0.4364000     0.9204000 
1 1 1 6  37 11 o 5.401000  0.2644000     5.566000  0.3675000     5.235000  0.3802000     0.3303000      0.5288000 
1 1 1 6  37 12 o 6.956000  0.2703000     7.186000  0.3378000     6.727000  0.4220000     0.4590000      0.5406000 
1 1 1 6  37 13 o 3.341000  0.5246000     4.260000  0.7119000     2.422000  0.7708000     1.838000       1.049000  
1 1 1 6  37 14 o 7.468000  0.2902000     7.698000  0.4616000     7.238000  0.3517000     0.4601000      0.5803000 
1 1 1 6  37 15 o 1.535000  0.4652000     1.887000  0.7349000     1.184000  0.5704000     0.7029000      0.9303000 
1 1 1 6  37 16 o 1.663000  0.4870000     1.460000  0.6566000     1.867000  0.7194000     -0.4076000     0.9740000 
1 1 1 6  37 17 o 3.761000  0.4003000     3.893000  0.5432000     3.628000  0.5881000     0.2652000      0.8006000 
1 1 1 6  37 18 o 3.119000  0.4455000     2.262000  0.7262000     3.976000  0.5162000     -1.714000      0.8909000 
1 1 1 6  37 19 o 1.324000  0.4202000     1.523000  0.6441000     1.124000  0.5398000     0.3988000      0.8404000 
1 1 1 6  37 20 o 1.439000  0.4730000     1.352000  0.6357000     1.526000  0.7006000     -0.1742000     0.9460000 
1 1 1 6  37 21 o 1.444000  0.4552000     1.255000  0.5917000     1.632000  0.6920000     -0.3765000     0.9104000 
1 1 1 6  37 22 o 1.292000  0.4258000     1.359000  0.6210000     1.225000  0.5827000     0.1338000      0.8516000 
1 1 1 6  37 23 o 1.139000  0.3997000     1.312000  0.6348000     0.9657000 0.4859000     0.3465000      0.7995000 
1 1 1 6  38 0  o 1.378000  0.8542000     1.378000  0.8542000     1.378000  0.8542000     0.000000       0.000000  
1 1 1 6  38 1  o 7.478000  0.2499000     7.527000  0.3486000     7.428000  0.3583000     0.9902000E-01  0.4999000 
1 1 1 6  38 2  o 8.189000  0.1864000     8.265000  0.2833000     8.114000  0.2423000     0.1506000      0.3728000 
1 1 1 6  38 3  o 12.97000  0.1671000     13.11000  0.2390000     12.82000  0.2337000     0.2975000      0.3343000 
1 1 1 6  38 4  o 6.040000  0.2115000     5.903000  0.3189000     6.177000  0.2779000     -0.2743000     0.4230000 
1 1 1 6  38 5  o 13.90000  0.1821000     13.71000  0.2716000     14.10000  0.2426000     -0.3882000     0.3642000 
1 1 1 6  38 6  o 14.37000  0.1742000     14.32000  0.2466000     14.41000  0.2461000     -0.9531000E-01 0.3484000 
1 1 1 6  38 7  o 15.99000  0.1800000     16.04000  0.2540000     15.94000  0.2550000     0.1022000      0.3599000 
1 1 1 6  38 8  o 16.12000  0.1829000     16.22000  0.2590000     16.02000  0.2583000     0.2076000      0.3658000 
1 1 1 6  38 9  o 11.98000  0.1778000     11.98000  0.2514000     11.98000  0.2514000     0.5129000E-02  0.3555000 
1 1 1 6  38 10 o 11.86000  0.1825000     11.89000  0.2564000     11.83000  0.2599000     0.6581000E-01  0.3651000 
1 1 1 6  38 11 o 4.531000  0.3136000     4.052000  0.4819000     5.010000  0.4016000     -0.9586000     0.6273000 
1 1 1 6  38 12 o 8.320000  0.2176000     8.507000  0.3048000     8.133000  0.3106000     0.3741000      0.4352000 
1 1 1 6  38 13 o 7.759000  0.3328000     7.759000  0.3328000     ?         ?             ?              ?         
1 1 1 6  38 14 o 3.481000  0.4446000     3.015000  0.6975000     3.947000  0.5516000     -0.9314000     0.8893000 
1 1 1 6  38 15 o 1.619000  0.4729000     2.031000  0.7503000     1.207000  0.5758000     0.8234000      0.9458000 
1 1 1 6  38 16 o 3.267000  0.4684000     3.251000  0.6707000     3.283000  0.6541000     -0.3163000E-01 0.9368000 
1 1 1 6  38 17 o 3.620000  0.4168000     3.591000  0.5981000     3.649000  0.5807000     -0.5787000E-01 0.8336000 
1 1 1 6  38 18 o 1.840000  0.4865000     2.181000  0.7173000     1.499000  0.6573000     0.6825000      0.9729000 
1 1 1 6  38 19 o 1.989000  0.5471000     2.353000  0.8674000     1.625000  0.6670000     0.7273000      1.094000  
1 1 1 6  38 20 o 1.775000  0.5161000     1.760000  0.7578000     1.791000  0.7009000     -0.3069000E-01 1.032000  
1 1 1 6  38 21 o 1.654000  0.4868000     1.794000  0.7135000     1.514000  0.6625000     0.2799000      0.9736000 
1 1 1 6  38 22 o 1.445000  0.4578000     1.393000  0.6306000     1.497000  0.6637000     -0.1041000     0.9155000 
1 1 1 6  39 0  o 14.70000  0.2786000     14.70000  0.2786000     14.70000  0.2786000     0.000000       0.000000  
1 1 1 6  39 1  o 7.565000  0.2045000     7.785000  0.2864000     7.345000  0.2918000     0.4403000      0.4089000 
1 1 1 6  39 2  o 3.014000  0.3461000     2.672000  0.5405000     3.355000  0.4324000     -0.6835000     0.6921000 
1 1 1 6  39 3  o 6.164000  0.2097000     6.132000  0.3123000     6.196000  0.2799000     -0.6409000E-01 0.4193000 
1 1 1 6  39 4  o 10.84000  0.1781000     10.85000  0.2665000     10.83000  0.2363000     0.2638000E-01  0.3562000 
1 1 1 6  39 5  o 4.448000  0.2652000     4.794000  0.3721000     4.102000  0.3779000     0.6923000      0.5303000 
1 1 1 6  39 6  o 14.63000  0.1759000     14.52000  0.2472000     14.74000  0.2504000     -0.2229000     0.3519000 
1 1 1 6  39 7  o 3.435000  0.3557000     4.079000  0.4063000     2.791000  0.5838000     1.288000       0.7113000 
1 1 1 6  39 8  o 11.65000  0.1769000     11.66000  0.2489000     11.65000  0.2514000     0.3346000E-02  0.3538000 
1 1 1 6  39 9  o 9.503000  0.1882000     9.507000  0.2669000     9.499000  0.2654000     0.7926000E-02  0.3764000 
1 1 1 6  39 10 o 11.71000  0.1859000     11.78000  0.2625000     11.63000  0.2633000     0.1540000      0.3718000 
1 1 1 6  39 11 f 1.396000  0.4389000     1.367000  0.6131000     1.426000  0.6282000     -0.5870000E-01 0.8778000 
1 1 1 6  39 12 o 5.864000  0.3618000     5.563000  0.5723000     6.165000  0.4429000     -0.6025000     0.7237000 
1 1 1 6  39 13 o 6.448000  0.3225000     6.479000  0.5237000     6.418000  0.3764000     0.6134000E-01  0.6449000 
1 1 1 6  39 14 o 7.064000  0.2449000     7.210000  0.3377000     6.917000  0.3549000     0.2923000      0.4899000 
1 1 1 6  39 15 o 2.646000  0.5075000     3.017000  0.6714000     2.275000  0.7612000     0.7425000      1.015000  
1 1 1 6  39 16 o 4.474000  0.3411000     4.417000  0.4887000     4.531000  0.4758000     -0.1136000     0.6821000 
1 1 1 6  39 17 o 1.527000  0.4656000     1.287000  0.5993000     1.768000  0.7126000     -0.4811000     0.9311000 
1 1 1 6  39 18 o 1.365000  0.4378000     1.305000  0.6022000     1.426000  0.6355000     -0.1210000     0.8755000 
1 1 1 6  39 19 o 1.682000  0.4976000     1.348000  0.6190000     2.016000  0.7794000     -0.6683000     0.9953000 
1 1 1 6  39 20 o 1.445000  0.4539000     1.423000  0.6486000     1.467000  0.6353000     -0.4377000E-01 0.9079000 
1 1 1 6  39 21 o 1.252000  0.4142000     1.285000  0.5947000     1.220000  0.5767000     0.6505000E-01  0.8284000 
1 1 1 6  39 22 o 1.209000  0.4050000     0.9431000 0.4726000     1.476000  0.6578000     -0.5327000     0.8100000 
1 1 1 6  40 0  o 19.74000  0.3177000     19.74000  0.3177000     19.74000  0.3177000     0.000000       0.000000  
1 1 1 6  40 1  o 5.517000  0.2407000     5.443000  0.3397000     5.592000  0.3409000     -0.1494000     0.4813000 
1 1 1 6  40 2  o 12.69000  0.1692000     12.45000  0.2395000     12.92000  0.2391000     -0.4753000     0.3385000 
1 1 1 6  40 3  f 2.961000  0.3866000     2.612000  0.6243000     3.310000  0.4562000     -0.6985000     0.7732000 
1 1 1 6  40 4  o 8.928000  0.1860000     8.930000  0.2795000     8.927000  0.2456000     0.3588000E-02  0.3721000 
1 1 1 6  40 5  o 14.77000  0.1881000     14.78000  0.2810000     14.75000  0.2499000     0.3130000E-01  0.3761000 
1 1 1 6  40 6  o 6.942000  0.1966000     7.166000  0.2676000     6.719000  0.2880000     0.4471000      0.3931000 
1 1 1 6  40 7  o 13.56000  0.1785000     13.80000  0.2527000     13.32000  0.2522000     0.4850000      0.3570000 
1 1 1 6  40 8  o 18.78000  0.1977000     18.92000  0.2817000     18.64000  0.2776000     0.2786000      0.3955000 
1 1 1 6  40 9  o 3.916000  0.3241000     3.772000  0.4651000     4.060000  0.4515000     -0.2885000     0.6482000 
1 1 1 6  40 10 o 3.949000  0.3451000     4.024000  0.4867000     3.874000  0.4892000     0.1500000      0.6901000 
1 1 1 6  40 11 o 2.846000  0.5251000     3.031000  0.7859000     2.661000  0.6967000     0.3695000      1.050000  
1 1 1 6  40 12 f 4.368000  0.5373000     4.368000  0.5373000     ?         ?             ?              ?         
1 1 1 6  40 13 o 4.049000  0.3893000     3.976000  0.5576000     4.122000  0.5434000     -0.1466000     0.7786000 
1 1 1 6  40 14 o 2.992000  0.4964000     2.872000  0.7252000     3.111000  0.6779000     -0.2389000     0.9927000 
1 1 1 6  40 15 o 1.448000  0.4582000     1.481000  0.6537000     1.415000  0.6421000     0.6591000E-01  0.9163000 
1 1 1 6  40 16 o 5.204000  0.3025000     5.482000  0.4100000     4.926000  0.4448000     0.5550000      0.6049000 
1 1 1 6  40 17 o 2.157000  0.4915000     2.738000  0.7116000     1.575000  0.6782000     1.163000       0.9831000 
1 1 1 6  40 18 o 1.635000  0.4736000     1.820000  0.6988000     1.450000  0.6394000     0.3694000      0.9472000 
1 1 1 6  40 19 f 1.683000  0.5298000     1.574000  0.6611000     1.791000  0.8281000     -0.2166000     1.060000  
1 1 1 6  40 20 o 2.351000  0.4817000     1.984000  0.6987000     2.718000  0.6632000     -0.7334000     0.9634000 
1 1 1 6  40 21 o 1.358000  0.4384000     1.562000  0.6927000     1.154000  0.5375000     0.4079000      0.8767000 
1 1 1 6  40 22 f 1.907000  0.4992000     2.287000  0.7355000     1.526000  0.6750000     0.7611000      0.9983000 
1 1 1 6  41 0  o 8.806000  0.2815000     8.806000  0.2815000     8.806000  0.2815000     -0.000000      0.000000  
1 1 1 6  41 1  o 13.63000  0.1986000     13.23000  0.2788000     14.04000  0.2828000     -0.8143000     0.3971000 
1 1 1 6  41 2  f 16.57000  0.1819000     16.40000  0.2564000     16.74000  0.2581000     -0.3332000     0.3639000 
1 1 1 6  41 3  o 2.100000  0.4416000     1.680000  0.6513000     2.520000  0.5965000     -0.8393000     0.8832000 
1 1 1 6  41 4  o 18.14000  0.2027000     17.99000  0.3042000     18.28000  0.2681000     -0.2874000     0.4055000 
1 1 1 6  41 5  o 10.25000  0.1853000     10.29000  0.2765000     10.21000  0.2466000     0.7836000E-01  0.3705000 
1 1 1 6  41 6  o 11.89000  0.1749000     12.21000  0.2450000     11.56000  0.2496000     0.6533000      0.3497000 
1 1 1 6  41 7  o 6.734000  0.2112000     6.773000  0.2977000     6.696000  0.2998000     0.7653000E-01  0.4225000 
1 1 1 6  41 8  o 3.602000  0.3553000     3.264000  0.5519000     3.941000  0.4476000     -0.6776000     0.7106000 
1 1 1 6  41 9  o 17.05000  0.1945000     16.94000  0.2749000     17.16000  0.2753000     -0.2135000     0.3891000 
1 1 1 6  41 10 o 4.195000  0.3286000     4.471000  0.4386000     3.919000  0.4896000     0.5523000      0.6573000 
1 1 1 6  41 11 o 5.129000  0.4817000     5.331000  0.5794000     4.926000  0.7697000     0.4053000      0.9634000 
1 1 1 6  41 12 o 7.647000  0.2846000     7.554000  0.4694000     7.740000  0.3220000     -0.1858000     0.5692000 
1 1 1 6  41 13 o 4.046000  0.3812000     4.432000  0.4785000     3.659000  0.5934000     0.7726000      0.7623000 
1 1 1 6  41 14 o 2.189000  0.5206000     1.967000  0.7363000     2.412000  0.7362000     -0.4450000     1.041000  
1 1 1 6  41 15 o 6.704000  0.2482000     6.768000  0.3469000     6.640000  0.3550000     0.1273000      0.4964000 
1 1 1 6  41 16 o 2.131000  0.5276000     2.209000  0.7513000     2.052000  0.7410000     0.1568000      1.055000  
1 1 1 6  41 17 o 1.612000  0.4734000     1.317000  0.6072000     1.907000  0.7265000     -0.5904000     0.9468000 
1 1 1 6  41 18 o 1.601000  0.5018000     1.894000  0.8043000     1.307000  0.6001000     0.5873000      1.004000  
1 1 1 6  41 19 o 1.639000  0.4767000     1.331000  0.6374000     1.946000  0.7091000     -0.6148000     0.9535000 
1 1 1 6  41 20 o 2.759000  0.4660000     2.382000  0.7020000     3.135000  0.6129000     -0.7534000     0.9319000 
1 1 1 6  41 21 o 1.863000  0.4614000     2.341000  0.6867000     1.385000  0.6164000     0.9556000      0.9228000 
1 1 1 6  42 0  o 11.67000  0.2804000     11.67000  0.2804000     11.67000  0.2804000     0.000000       0.000000  
1 1 1 6  42 1  o 10.75000  0.1989000     10.96000  0.2797000     10.54000  0.2830000     0.4249000      0.3978000 
1 1 1 6  42 2  o 12.52000  0.1724000     12.11000  0.2444000     12.94000  0.2431000     -0.8327000     0.3448000 
1 1 1 6  42 3  o 6.312000  0.2175000     6.308000  0.3238000     6.316000  0.2906000     -0.7921000E-02 0.4350000 
1 1 1 6  42 4  o 5.709000  0.2372000     5.594000  0.3536000     5.824000  0.3162000     -0.2301000     0.4744000 
1 1 1 6  42 5  o 2.394000  0.4687000     2.433000  0.6793000     2.356000  0.6460000     0.7666000E-01  0.9374000 
1 1 1 6  42 6  o 4.537000  0.2704000     4.317000  0.3943000     4.758000  0.3703000     -0.4411000     0.5409000 
1 1 1 6  42 7  o 13.29000  0.1838000     13.56000  0.2591000     13.02000  0.2606000     0.5419000      0.3675000 
1 1 1 6  42 8  o 6.172000  0.2369000     6.051000  0.3442000     6.293000  0.3257000     -0.2420000     0.4738000 
1 1 1 6  42 9  o 9.666000  0.1950000     9.569000  0.2752000     9.764000  0.2762000     -0.1950000     0.3899000 
1 1 1 6  42 10 o 7.062000  0.2953000     6.764000  0.4993000     7.360000  0.3153000     -0.5953000     0.5905000 
1 1 1 6  42 11 o 2.484000  0.5983000     1.892000  0.7955000     3.076000  0.8940000     -1.183000      1.197000  
1 1 1 6  42 12 o 2.073000  0.5213000     2.069000  0.7400000     2.078000  0.7344000     -0.9017000E-02 1.043000  
1 1 1 6  42 13 o 2.810000  0.5000000     3.080000  0.6792000     2.541000  0.7341000     0.5390000      1.000000  
1 1 1 6  42 14 o 3.041000  0.4816000     3.081000  0.6742000     3.001000  0.6880000     0.8049000E-01  0.9633000 
1 1 1 6  42 15 o 1.861000  0.5009000     1.639000  0.6879000     2.084000  0.7282000     -0.4455000     1.002000  
1 1 1 6  42 16 o 1.790000  0.4708000     2.331000  0.7367000     1.248000  0.5865000     1.083000       0.9417000 
1 1 1 6  42 17 f 1.810000  0.4969000     1.593000  0.6723000     2.028000  0.7319000     -0.4350000     0.9939000 
1 1 1 6  42 18 o 1.718000  0.6835000     1.718000  0.6835000     ?         ?             ?              ?         
1 1 1 6  42 19 o 1.703000  0.4785000     1.699000  0.6810000     1.707000  0.6724000     -0.7183000E-02 0.9570000 
1 1 1 6  42 20 o 1.135000  0.3803000     1.269000  0.5803000     1.000000  0.4917000     0.2689000      0.7606000 
1 1 1 6  42 21 f 2.000000  0.5057000     2.056000  0.7186000     1.945000  0.7118000     0.1116000      1.011000  
1 1 1 6  43 0  o 1.347000  0.7732000     1.347000  0.7732000     1.347000  0.7732000     -0.000000      0.000000  
1 1 1 6  43 1  o 6.704000  0.2321000     6.901000  0.3224000     6.508000  0.3339000     0.3928000      0.4641000 
1 1 1 6  43 2  o 4.408000  0.2637000     4.398000  0.3737000     4.418000  0.3723000     -0.1915000E-01 0.5275000 
1 1 1 6  43 3  o 6.765000  0.2162000     6.638000  0.3256000     6.891000  0.2846000     -0.2530000     0.4325000 
1 1 1 6  43 4  o 1.866000  0.4732000     1.802000  0.6913000     1.930000  0.6465000     -0.1278000     0.9465000 
1 1 1 6  43 5  o 13.84000  0.1932000     13.70000  0.2888000     13.99000  0.2566000     -0.2906000     0.3863000 
1 1 1 6  43 6  o 11.34000  0.1810000     11.63000  0.2554000     11.04000  0.2565000     0.5908000      0.3619000 
1 1 1 6  43 7  o 4.895000  0.2781000     5.056000  0.3866000     4.733000  0.3999000     0.3235000      0.5562000 
1 1 1 6  43 8  o 4.504000  0.3058000     4.720000  0.4251000     4.288000  0.4398000     0.4322000      0.6117000 
1 1 1 6  43 9  o 8.965000  0.2547000     8.991000  0.4216000     8.940000  0.2858000     0.5052000E-01  0.5094000 
1 1 1 6  43 10 o 4.511000  0.5106000     4.511000  0.5106000     ?         ?             ?              ?         
1 1 1 6  43 11 o 1.717000  0.4705000     1.255000  0.6006000     2.179000  0.7244000     -0.9239000     0.9410000 
1 1 1 6  43 12 o 8.333000  0.2189000     8.260000  0.3119000     8.405000  0.3071000     -0.1447000     0.4377000 
1 1 1 6  43 13 o 4.086000  0.3775000     3.877000  0.5750000     4.295000  0.4892000     -0.4182000     0.7549000 
1 1 1 6  43 14 o 4.791000  0.3234000     4.755000  0.4596000     4.826000  0.4551000     -0.7150000E-01 0.6468000 
1 1 1 6  43 15 o 5.459000  0.2954000     5.419000  0.4162000     5.500000  0.4193000     -0.8064000E-01 0.5908000 
1 1 1 6  43 16 o 3.219000  0.4633000     3.473000  0.6099000     2.965000  0.6976000     0.5088000      0.9266000 
1 1 1 6  43 17 o 1.688000  0.5147000     1.925000  0.8101000     1.451000  0.6352000     0.4740000      1.029000  
1 1 1 6  43 18 f 1.828000  0.5510000     1.967000  0.7944000     1.689000  0.7638000     0.2782000      1.102000  
1 1 1 6  43 19 f 1.041000  0.3563000     1.124000  0.5317000     0.9577000 0.4743000     0.1665000      0.7125000 
1 1 1 6  43 20 o 1.130000  0.3803000     1.195000  0.5599000     1.066000  0.5148000     0.1282000      0.7606000 
1 1 1 6  43 21 o 1.168000  0.3899000     1.161000  0.5481000     1.174000  0.5547000     -0.1258000E-01 0.7798000 
1 1 1 6  44 0  o 7.149000  0.3273000     7.149000  0.3273000     7.149000  0.3273000     -0.000000      0.000000  
1 1 1 6  44 1  o 7.203000  0.2171000     7.223000  0.3239000     7.184000  0.2892000     0.3975000E-01  0.4342000 
1 1 1 6  44 2  o 6.375000  0.2170000     6.551000  0.3071000     6.200000  0.3066000     0.3516000      0.4339000 
1 1 1 6  44 3  o 4.079000  0.3390000     3.449000  0.5653000     4.708000  0.3745000     -1.259000      0.6781000 
1 1 1 6  44 4  f 15.53000  0.1990000     15.43000  0.2985000     15.64000  0.2633000     -0.2134000     0.3980000 
1 1 1 6  44 5  o 11.23000  0.1949000     10.87000  0.2923000     11.60000  0.2580000     -0.7392000     0.3899000 
1 1 1 6  44 6  f 5.979000  0.2367000     5.920000  0.3348000     6.039000  0.3346000     -0.1189000     0.4733000 
1 1 1 6  44 7  o 14.97000  0.1898000     15.23000  0.2692000     14.72000  0.2676000     0.5046000      0.3795000 
1 1 1 6  44 8  o 7.873000  0.2377000     8.058000  0.3631000     7.688000  0.3070000     0.3699000      0.4755000 
1 1 1 6  44 9  o 2.591000  0.7745000     2.591000  0.7745000     ?         ?             ?              ?         
1 1 1 6  44 10 o 5.908000  0.3141000     5.833000  0.5103000     5.983000  0.3664000     -0.1493000     0.6282000 
1 1 1 6  44 11 o 5.069000  0.2971000     5.327000  0.4026000     4.811000  0.4369000     0.5161000      0.5941000 
1 1 1 6  44 12 o 2.719000  0.5055000     3.000000  0.6975000     2.437000  0.7319000     0.5627000      1.011000  
1 1 1 6  44 13 o 4.207000  0.3493000     4.223000  0.4987000     4.192000  0.4892000     0.3089000E-01  0.6985000 
1 1 1 6  44 14 o 3.834000  0.3860000     4.152000  0.4997000     3.516000  0.5884000     0.6360000      0.7720000 
1 1 1 6  44 15 o 1.622000  0.4852000     1.551000  0.6710000     1.693000  0.7009000     -0.1418000     0.9703000 
1 1 1 6  44 16 o 1.933000  0.4698000     2.620000  0.7350000     1.245000  0.5852000     1.375000       0.9395000 
1 1 1 6  44 17 o 1.949000  0.5571000     2.539000  0.9049000     1.358000  0.6499000     1.181000       1.114000  
1 1 1 6  44 18 o 2.046000  0.5132000     1.865000  0.7416000     2.228000  0.7097000     -0.3628000     1.026000  
1 1 1 6  44 19 o 1.267000  0.4124000     1.282000  0.5874000     1.251000  0.5792000     0.3075000E-01  0.8249000 
1 1 1 6  44 20 o 1.353000  0.4247000     1.597000  0.6616000     1.110000  0.5329000     0.4875000      0.8495000 
1 1 1 6  45 0  o 14.15000  0.2990000     14.15000  0.2990000     14.15000  0.2990000     -0.000000      0.000000  
1 1 1 6  45 1  f 4.859000  0.2829000     4.768000  0.4314000     4.950000  0.3660000     -0.1812000     0.5657000 
1 1 1 6  45 2  o 6.579000  0.2199000     6.603000  0.3145000     6.554000  0.3076000     0.4850000E-01  0.4399000 
1 1 1 6  45 3  o 11.42000  0.1947000     11.51000  0.2922000     11.34000  0.2574000     0.1662000      0.3893000 
1 1 1 6  45 4  o 4.917000  0.2902000     5.034000  0.4337000     4.801000  0.3857000     0.2326000      0.5803000 
1 1 1 6  45 5  o 8.319000  0.2132000     8.635000  0.3109000     8.002000  0.2919000     0.6324000      0.4265000 
1 1 1 6  45 6  o 10.15000  0.1929000     10.32000  0.2705000     9.974000  0.2751000     0.3450000      0.3858000 
1 1 1 6  45 7  o 3.106000  0.4766000     3.427000  0.6780000     2.785000  0.6699000     0.6420000      0.9531000 
1 1 1 6  45 8  o 13.09000  0.3893000     13.09000  0.3893000     ?         ?             ?              ?         
1 1 1 6  45 9  o 8.055000  0.2615000     7.900000  0.4266000     8.209000  0.3028000     -0.3089000     0.5231000 
1 1 1 6  45 10 o 2.207000  0.5174000     2.154000  0.7299000     2.261000  0.7336000     -0.1071000     1.035000  
1 1 1 6  45 11 o 2.666000  0.5009000     2.446000  0.7417000     2.887000  0.6735000     -0.4410000     1.002000  
1 1 1 6  45 12 f 3.040000  0.4556000     3.890000  0.5421000     2.189000  0.7324000     1.700000       0.9112000 
1 1 1 6  45 13 o 2.157000  0.5192000     2.266000  0.7402000     2.048000  0.7283000     0.2182000      1.038000  
1 1 1 6  45 14 o 1.794000  0.5063000     1.751000  0.7115000     1.837000  0.7205000     -0.8602000E-01 1.013000  
1 1 1 6  45 15 o 5.151000  0.3039000     5.214000  0.4270000     5.088000  0.4324000     0.1261000      0.6077000 
1 1 1 6  45 16 o 4.586000  0.3845000     4.872000  0.5850000     4.301000  0.4991000     0.5710000      0.7690000 
1 1 1 6  45 17 o 2.035000  0.5708000     2.121000  0.7612000     1.949000  0.8508000     0.1720000      1.142000  
1 1 1 6  45 18 o 1.750000  0.4786000     1.497000  0.6462000     2.002000  0.7061000     -0.5052000     0.9572000 
1 1 1 6  45 19 o 1.874000  0.4962000     1.851000  0.6964000     1.898000  0.7070000     -0.4706000E-01 0.9924000 
1 1 1 6  45 20 o 3.278000  0.4212000     3.540000  0.5587000     3.016000  0.6304000     0.5240000      0.8423000 
1 1 1 6  46 0  f 1.245000  0.7740000     1.245000  0.7740000     1.245000  0.7740000     0.000000       0.000000  
1 1 1 6  46 1  o 6.834000  0.2371000     6.752000  0.3571000     6.916000  0.3122000     -0.1638000     0.4743000 
1 1 1 6  46 2  o 16.27000  0.1925000     16.23000  0.2748000     16.32000  0.2697000     -0.8408000E-01 0.3850000 
1 1 1 6  46 3  o 5.961000  0.2524000     6.124000  0.3705000     5.799000  0.3427000     0.3249000      0.5047000 
1 1 1 6  46 4  o 10.77000  0.2009000     10.98000  0.3019000     10.57000  0.2651000     0.4060000      0.4018000 
1 1 1 6  46 5  o 2.186000  0.5033000     2.323000  0.7282000     2.048000  0.6949000     0.2747000      1.007000  
1 1 1 6  46 6  o 7.713000  0.2717000     7.808000  0.4508000     7.617000  0.3035000     0.1911000      0.5435000 
1 1 1 6  46 7  o 2.159000  0.8459000     2.159000  0.8459000     ?         ?             ?              ?         
1 1 1 6  46 8  o 8.243000  0.2658000     7.843000  0.4329000     8.643000  0.3085000     -0.8002000     0.5316000 
1 1 1 6  46 9  o 5.886000  0.2662000     6.295000  0.3502000     5.476000  0.4010000     0.8193000      0.5324000 
1 1 1 6  46 10 o 3.584000  0.4019000     3.591000  0.5735000     3.578000  0.5632000     0.1264000E-01  0.8038000 
1 1 1 6  46 11 o 4.448000  0.3289000     4.621000  0.4523000     4.276000  0.4775000     0.3458000      0.6577000 
1 1 1 6  46 12 o 2.628000  0.4847000     3.167000  0.6431000     2.090000  0.7254000     1.076000       0.9694000 
1 1 1 6  46 13 f 1.739000  0.4821000     2.065000  0.7283000     1.414000  0.6317000     0.6510000      0.9641000 
1 1 1 6  46 14 o 1.885000  0.5117000     1.818000  0.7105000     1.953000  0.7367000     -0.1353000     1.023000  
1 1 1 6  46 15 o 1.393000  0.4414000     1.133000  0.5459000     1.654000  0.6939000     -0.5212000     0.8829000 
1 1 1 6  46 16 o 1.554000  0.5071000     1.520000  0.7127000     1.588000  0.7214000     -0.6767000E-01 1.014000  
1 1 1 6  46 17 o 1.806000  0.5124000     1.622000  0.7286000     1.989000  0.7207000     -0.3670000     1.025000  
1 1 1 6  46 18 o 1.349000  0.4328000     1.270000  0.5850000     1.427000  0.6380000     -0.1572000     0.8656000 
1 1 1 6  46 19 o 1.837000  0.4784000     1.539000  0.6474000     2.135000  0.7045000     -0.5967000     0.9568000 
1 1 1 6  46 20 o 1.328000  0.4400000     1.564000  0.7037000     1.091000  0.5285000     0.4739000      0.8801000 
1 1 1 6  47 0  f 3.843000  0.5598000     3.843000  0.5598000     3.843000  0.5598000     0.000000       0.000000  
1 1 1 6  47 1  o 11.04000  0.2024000     11.18000  0.3045000     10.89000  0.2669000     0.2926000      0.4049000 
1 1 1 6  47 2  o 9.183000  0.2110000     9.173000  0.3202000     9.192000  0.2749000     -0.1874000E-01 0.4221000 
1 1 1 6  47 3  o 4.627000  0.3190000     4.461000  0.4930000     4.792000  0.4048000     -0.3305000     0.6379000 
1 1 1 6  47 4  o 4.689000  0.3050000     4.757000  0.4498000     4.621000  0.4119000     0.1357000      0.6100000 
1 1 1 6  47 5  o 8.311000  0.3292000     8.617000  0.5633000     8.006000  0.3408000     0.6104000      0.6584000 
1 1 1 6  47 6  f 12.95000  0.3672000     12.95000  0.3672000     ?         ?             ?              ?         
1 1 1 6  47 7  o 2.055000  0.5457000     2.414000  0.8449000     1.695000  0.6910000     0.7196000      1.091000  
1 1 1 6  47 8  o 7.128000  0.2375000     7.322000  0.3302000     6.935000  0.3415000     0.3867000      0.4751000 
1 1 1 6  47 9  o 12.59000  0.1971000     12.43000  0.2789000     12.75000  0.2787000     -0.3175000     0.3943000 
1 1 1 6  47 10 o 10.33000  0.2033000     10.40000  0.2900000     10.26000  0.2851000     0.1386000      0.4067000 
1 1 1 6  47 11 o 1.767000  0.4880000     2.063000  0.7360000     1.471000  0.6410000     0.5925000      0.9760000 
1 1 1 6  47 12 o 1.709000  0.4867000     1.547000  0.6667000     1.871000  0.7093000     -0.3235000     0.9734000 
1 1 1 6  47 13 o 3.230000  0.4545000     3.245000  0.6437000     3.214000  0.6417000     0.3107000E-01  0.9090000 
1 1 1 6  47 14 o 2.482000  0.5061000     2.267000  0.7363000     2.698000  0.6945000     -0.4309000     1.012000  
1 1 1 6  47 15 f 1.547000  0.4859000     1.928000  0.7960000     1.167000  0.5574000     0.7605000      0.9718000 
1 1 1 6  47 16 o 1.521000  0.6766000     1.521000  0.6766000     ?         ?             ?              ?         
1 1 1 6  47 17 o 1.354000  0.4338000     1.247000  0.5796000     1.461000  0.6457000     -0.2144000     0.8677000 
1 1 1 6  47 18 o 1.463000  0.4408000     1.792000  0.6964000     1.133000  0.5406000     0.6585000      0.8816000 
1 1 1 6  47 19 o 1.717000  0.4814000     1.909000  0.7102000     1.526000  0.6500000     0.3830000      0.9627000 
1 1 1 6  48 0  o 6.033000  0.3939000     6.033000  0.3939000     6.033000  0.3939000     0.000000       0.000000  
1 1 1 6  48 1  o 2.120000  0.5123000     2.279000  0.7497000     1.962000  0.6983000     0.3170000      1.025000  
1 1 1 6  48 2  o 16.19000  0.2407000     16.35000  0.3971000     16.03000  0.2721000     0.3174000      0.4814000 
1 1 1 6  48 3  o 10.16000  0.3182000     10.24000  0.5477000     10.08000  0.3240000     0.1588000      0.6364000 
1 1 1 6  48 4  o 2.169000  0.9177000     2.169000  0.9177000     ?         ?             ?              ?         
1 1 1 6  48 5  o 1.693000  0.5559000     1.479000  0.6885000     1.907000  0.8729000     -0.4273000     1.112000  
1 1 1 6  48 6  o 2.083000  0.4506000     1.322000  0.6247000     2.844000  0.6495000     -1.522000      0.9012000 
1 1 1 6  48 7  o 8.610000  0.2156000     8.139000  0.3125000     9.082000  0.2970000     -0.9431000     0.4311000 
1 1 1 6  48 8  o 10.20000  0.2043000     10.10000  0.2876000     10.31000  0.2904000     -0.2125000     0.4087000 
1 1 1 6  48 9  o 3.365000  0.4351000     3.549000  0.5846000     3.180000  0.6445000     0.3695000      0.8701000 
1 1 1 6  48 10 o 5.909000  0.2662000     6.117000  0.3733000     5.701000  0.3796000     0.4156000      0.5324000 
1 1 1 6  48 11 o 3.830000  0.3772000     3.790000  0.5472000     3.870000  0.5193000     -0.7977000E-01 0.7544000 
1 1 1 6  48 12 o 3.917000  0.3745000     4.115000  0.5050000     3.718000  0.5531000     0.3964000      0.7490000 
1 1 1 6  48 13 o 4.479000  0.3387000     4.378000  0.4960000     4.580000  0.4614000     -0.2019000     0.6774000 
1 1 1 6  48 14 o 2.068000  0.5147000     1.898000  0.7183000     2.239000  0.7373000     -0.3408000     1.029000  
1 1 1 6  48 15 o 1.726000  0.5411000     1.618000  0.7379000     1.835000  0.7917000     -0.2168000     1.082000  
1 1 1 6  48 16 o 2.006000  0.5348000     1.865000  0.7865000     2.147000  0.7249000     -0.2824000     1.070000  
1 1 1 6  48 17 o 1.420000  0.4435000     1.243000  0.5793000     1.596000  0.6717000     -0.3522000     0.8870000 
1 1 1 6  48 18 o 1.503000  0.4573000     1.640000  0.6760000     1.366000  0.6162000     0.2735000      0.9147000 
1 1 1 6  48 19 o 1.663000  0.4741000     1.589000  0.6573000     1.738000  0.6833000     -0.1484000     0.9482000 
1 1 1 6  49 0  o 8.667000  0.5962000     8.667000  0.5962000     8.667000  0.5962000     0.000000       0.000000  
1 1 1 6  49 1  o 7.372000  0.4696000     7.476000  0.6323000     7.267000  0.6945000     0.2089000      0.9393000 
1 1 1 6  49 2  o 4.345000  0.9209000     4.345000  0.9209000     ?         ?             ?              ?         
1 1 1 6  49 3  o 6.159000  0.4382000     6.355000  0.4780000     5.964000  0.7345000     0.3907000      0.8763000 
1 1 1 6  49 4  o 5.649000  0.3189000     5.917000  0.5001000     5.380000  0.3959000     0.5372000      0.6379000 
1 1 1 6  49 5  o 4.569000  0.3349000     4.257000  0.5179000     4.881000  0.4247000     -0.6240000     0.6698000 
1 1 1 6  49 6  o 7.016000  0.2324000     7.408000  0.3172000     6.624000  0.3397000     0.7838000      0.4648000 
1 1 1 6  49 7  f 6.756000  0.2425000     6.808000  0.3376000     6.705000  0.3483000     0.1031000      0.4851000 
1 1 1 6  49 8  o 4.939000  0.3205000     4.101000  0.5093000     5.777000  0.3892000     -1.676000      0.6410000 
1 1 1 6  49 9  o 2.146000  0.5022000     2.610000  0.7272000     1.682000  0.6928000     0.9279000      1.004000  
1 1 1 6  49 10 o 2.824000  0.4859000     3.077000  0.6603000     2.570000  0.7130000     0.5075000      0.9718000 
1 1 1 6  49 11 o 3.589000  0.4197000     4.160000  0.5127000     3.018000  0.6645000     1.142000       0.8393000 
1 1 1 6  49 12 f 2.726000  0.5215000     2.516000  0.7226000     2.937000  0.7521000     -0.4209000     1.043000  
1 1 1 6  49 13 f 1.791000  0.4571000     1.143000  0.5505000     2.439000  0.7298000     -1.296000      0.9141000 
1 1 1 6  49 14 f 2.211000  0.4847000     1.461000  0.6985000     2.961000  0.6720000     -1.500000      0.9693000 
1 1 1 6  49 15 o 1.657000  0.5252000     1.703000  0.7069000     1.610000  0.7769000     0.9326000E-01  1.050000  
1 1 1 6  49 16 o 2.470000  0.4438000     1.560000  0.6654000     3.380000  0.5875000     -1.820000      0.8876000 
1 1 1 6  49 17 o 1.358000  0.4257000     1.723000  0.6969000     0.9924000 0.4892000     0.7307000      0.8514000 
1 1 1 6  49 18 o 2.228000  0.4849000     2.724000  0.6706000     1.732000  0.7005000     0.9920000      0.9697000 
1 1 1 6  50 0  o 6.524000  0.4875000     6.524000  0.4875000     6.524000  0.4875000     -0.000000      0.000000  
1 1 1 6  50 1  o 9.012000  0.2644000     9.015000  0.4075000     9.009000  0.3371000     0.6166000E-02  0.5289000 
1 1 1 6  50 2  f 4.439000  0.3566000     4.226000  0.5581000     4.653000  0.4440000     -0.4267000     0.7132000 
1 1 1 6  50 3  o 3.438000  0.4356000     3.862000  0.5890000     3.014000  0.6419000     0.8474000      0.8712000 
1 1 1 6  50 4  o 4.534000  0.3276000     4.568000  0.4892000     4.500000  0.4358000     0.6817000E-01  0.6552000 
1 1 1 6  50 5  o 3.927000  0.3988000     3.361000  0.6580000     4.493000  0.4506000     -1.132000      0.7975000 
1 1 1 6  50 6  o 4.651000  0.3149000     4.698000  0.4335000     4.604000  0.4568000     0.9451000E-01  0.6298000 
1 1 1 6  50 7  o 6.824000  0.2477000     6.670000  0.3531000     6.978000  0.3474000     -0.3080000     0.4953000 
1 1 1 6  50 8  o 7.122000  0.2417000     7.291000  0.3450000     6.952000  0.3386000     0.3382000      0.4834000 
1 1 1 6  50 9  o 2.077000  0.5008000     2.481000  0.7257000     1.674000  0.6903000     0.8079000      1.002000  
1 1 1 6  50 10 o 3.669000  0.4078000     3.732000  0.5827000     3.606000  0.5707000     0.1262000      0.8156000 
1 1 1 6  50 11 o 2.287000  0.5184000     2.558000  0.7262000     2.016000  0.7400000     0.5425000      1.037000  
1 1 1 6  50 12 o 3.316000  0.4390000     3.051000  0.6698000     3.582000  0.5677000     -0.5315000     0.8780000 
1 1 1 6  50 13 o 3.425000  0.4359000     3.610000  0.5946000     3.241000  0.6375000     0.3690000      0.8718000 
1 1 1 6  50 14 o 5.007000  0.4377000     5.007000  0.4377000     ?         ?             ?              ?         
1 1 1 6  50 15 o 3.623000  0.4478000     2.894000  0.7540000     4.352000  0.4832000     -1.458000      0.8955000 
1 1 1 6  50 16 o 2.326000  0.5112000     2.206000  0.7264000     2.447000  0.7195000     -0.2403000     1.022000  
1 1 1 6  50 17 o 1.509000  0.4384000     0.9811000 0.4856000     2.036000  0.7301000     -1.055000      0.8768000 
1 1 1 6  50 18 o 1.779000  0.4752000     2.188000  0.7232000     1.370000  0.6165000     0.8183000      0.9503000 
1 1 1 6  51 0  o 15.99000  0.2845000     15.99000  0.2845000     15.99000  0.2845000     0.000000       0.000000  
1 1 1 6  51 1  o 9.150000  0.2222000     8.813000  0.3390000     9.487000  0.2872000     -0.6732000     0.4443000 
1 1 1 6  51 2  o 2.260000  0.5094000     2.814000  0.7549000     1.705000  0.6841000     1.109000       1.019000  
1 1 1 6  51 3  f 5.040000  0.3164000     4.885000  0.4884000     5.196000  0.4024000     -0.3101000     0.6328000 
1 1 1 6  51 4  o 1.586000  0.4790000     1.491000  0.6673000     1.682000  0.6874000     -0.1911000     0.9580000 
1 1 1 6  51 5  o 3.353000  0.4410000     3.910000  0.5595000     2.797000  0.6818000     1.113000       0.8820000 
1 1 1 6  51 6  o 5.394000  0.2820000     5.908000  0.3670000     4.880000  0.4283000     1.028000       0.5641000 
1 1 1 6  51 7  o 6.284000  0.2541000     6.636000  0.3392000     5.931000  0.3784000     0.7047000      0.5082000 
1 1 1 6  51 8  o 3.200000  0.4440000     3.177000  0.6380000     3.224000  0.6177000     -0.4671000E-01 0.8880000 
1 1 1 6  51 9  o 5.314000  0.2889000     5.286000  0.4163000     5.343000  0.4006000     -0.5694000E-01 0.5777000 
1 1 1 6  51 10 f 2.769000  0.5063000     2.747000  0.7245000     2.790000  0.7074000     -0.4371000E-01 1.013000  
1 1 1 6  51 11 o 3.255000  0.4560000     3.101000  0.6913000     3.408000  0.5949000     -0.3073000     0.9120000 
1 1 1 6  51 12 o 4.513000  0.3288000     4.503000  0.4626000     4.523000  0.4674000     -0.2002000E-01 0.6576000 
1 1 1 6  51 13 o 1.355000  0.4528000     1.461000  0.6913000     1.250000  0.5851000     0.2112000      0.9057000 
1 1 1 6  51 14 f 1.512000  0.4879000     1.600000  0.7115000     1.424000  0.6678000     0.1759000      0.9758000 
1 1 1 6  51 15 o 1.635000  0.4813000     1.696000  0.6868000     1.575000  0.6743000     0.1212000      0.9625000 
1 1 1 6  51 16 o 1.537000  0.4655000     1.410000  0.6243000     1.665000  0.6907000     -0.2551000     0.9310000 
1 1 1 6  51 17 o 1.806000  0.4922000     1.717000  0.6879000     1.895000  0.7042000     -0.1781000     0.9844000 
1 1 1 6  52 0  o 3.110000  0.7016000     3.110000  0.7016000     3.110000  0.7016000     -0.000000      0.000000  
1 1 1 6  52 1  o 4.442000  0.3619000     4.020000  0.5823000     4.865000  0.4299000     -0.8450000     0.7238000 
1 1 1 6  52 2  f 2.203000  0.5313000     2.233000  0.7783000     2.172000  0.7235000     0.6085000E-01  1.063000  
1 1 1 6  52 3  o 2.989000  0.4813000     2.705000  0.7533000     3.273000  0.5992000     -0.5686000     0.9625000 
1 1 1 6  52 4  o 4.051000  0.3925000     3.733000  0.6323000     4.370000  0.4652000     -0.6368000     0.7850000 
1 1 1 6  52 5  o 8.315000  0.2177000     8.076000  0.3134000     8.554000  0.3022000     -0.4782000     0.4354000 
1 1 1 6  52 6  o 2.024000  0.5002000     2.305000  0.7213000     1.744000  0.6932000     0.5606000      1.000000  
1 1 1 6  52 7  o 5.060000  0.2965000     5.368000  0.3932000     4.751000  0.4440000     0.6172000      0.5931000 
1 1 1 6  52 8  o 6.990000  0.2428000     6.854000  0.3509000     7.125000  0.3357000     -0.2706000     0.4856000 
1 1 1 6  52 9  o 4.129000  0.3781000     3.749000  0.5759000     4.509000  0.4902000     -0.7601000     0.7563000 
1 1 1 6  52 10 o 6.614000  0.2604000     6.872000  0.3640000     6.356000  0.3725000     0.5158000      0.5208000 
1 1 1 6  52 11 o 2.237000  0.4883000     1.609000  0.6812000     2.865000  0.6999000     -1.257000      0.9767000 
1 1 1 6  52 12 o 1.289000  0.4361000     1.417000  0.6717000     1.162000  0.5566000     0.2549000      0.8723000 
1 1 1 6  52 13 o 6.906000  0.3896000     6.906000  0.3896000     ?         ?             ?              ?         
1 1 1 6  52 14 o 1.437000  0.4433000     1.108000  0.5360000     1.767000  0.7061000     -0.6596000     0.8865000 
1 1 1 6  52 15 o 1.448000  0.4496000     1.564000  0.6616000     1.332000  0.6090000     0.2320000      0.8992000 
1 1 1 6  52 16 f 1.357000  0.4344000     1.288000  0.5902000     1.425000  0.6376000     -0.1379000     0.8689000 
1 1 1 6  52 17 o 1.255000  0.4116000     1.311000  0.5987000     1.198000  0.5649000     0.1133000      0.8231000 
1 1 1 6  53 0  o 4.034000  0.5148000     4.034000  0.5148000     4.034000  0.5148000     0.000000       0.000000  
1 1 1 6  53 1  o 1.962000  0.5030000     2.570000  0.7954000     1.355000  0.6159000     1.215000       1.006000  
1 1 1 6  53 2  f 3.337000  0.4569000     3.278000  0.6987000     3.397000  0.5887000     -0.1192000     0.9137000 
1 1 1 6  53 3  o 3.303000  0.4542000     3.214000  0.7092000     3.392000  0.5675000     -0.1777000     0.9083000 
1 1 1 6  53 4  o 2.601000  0.5116000     2.385000  0.7712000     2.817000  0.6724000     -0.4324000     1.023000  
1 1 1 6  53 5  o 3.221000  0.4356000     3.259000  0.6097000     3.183000  0.6223000     0.7622000E-01  0.8712000 
1 1 1 6  53 6  o 7.837000  0.2205000     7.974000  0.3123000     7.700000  0.3115000     0.2745000      0.4411000 
1 1 1 6  53 7  o 3.035000  0.4536000     2.218000  0.7350000     3.852000  0.5318000     -1.634000      0.9072000 
1 1 1 6  53 8  o 6.694000  0.2562000     6.654000  0.3634000     6.734000  0.3612000     -0.7969000E-01 0.5123000 
1 1 1 6  53 9  o 2.127000  0.5288000     2.020000  0.7366000     2.234000  0.7588000     -0.2146000     1.058000  
1 1 1 6  53 10 o 4.328000  0.3485000     4.228000  0.5084000     4.427000  0.4769000     -0.1996000     0.6971000 
1 1 1 6  53 11 o 1.385000  0.4429000     1.388000  0.6307000     1.382000  0.6219000     0.6101000E-02  0.8858000 
1 1 1 6  53 12 o 1.894000  0.7228000     1.894000  0.7228000     ?         ?             ?              ?         
1 1 1 6  53 13 o 1.555000  0.4883000     1.563000  0.7125000     1.547000  0.6680000     0.1568000E-01  0.9767000 
1 1 1 6  53 14 f 1.579000  0.4725000     1.524000  0.6564000     1.633000  0.6798000     -0.1084000     0.9450000 
1 1 1 6  53 15 o 1.383000  0.4356000     1.621000  0.6768000     1.146000  0.5486000     0.4753000      0.8712000 
1 1 1 6  53 16 o 1.164000  0.3920000     1.060000  0.5162000     1.268000  0.5902000     -0.2077000     0.7841000 
1 1 1 6  54 0  o 6.702000  0.3401000     6.702000  0.3401000     6.702000  0.3401000     -0.000000      0.000000  
1 1 1 6  54 1  o 1.415000  0.4511000     1.656000  0.7100000     1.175000  0.5567000     0.4803000      0.9022000 
1 1 1 6  54 2  o 4.936000  0.3414000     4.434000  0.5614000     5.438000  0.3885000     -1.005000      0.6827000 
1 1 1 6  54 3  o 5.423000  0.3438000     4.942000  0.5853000     5.903000  0.3609000     -0.9611000     0.6876000 
1 1 1 6  54 4  o 3.837000  0.4056000     4.517000  0.5109000     3.157000  0.6302000     1.360000       0.8113000 
1 1 1 6  54 5  o 4.144000  0.3552000     4.527000  0.4622000     3.761000  0.5395000     0.7664000      0.7105000 
1 1 1 6  54 6  o 5.637000  0.2747000     5.740000  0.3915000     5.534000  0.3853000     0.2062000      0.5493000 
1 1 1 6  54 7  o 2.214000  0.5012000     1.740000  0.7013000     2.688000  0.7161000     -0.9483000     1.002000  
1 1 1 6  54 8  o 2.334000  0.5254000     2.199000  0.7429000     2.469000  0.7432000     -0.2700000     1.051000  
1 1 1 6  54 9  o 2.243000  0.5250000     2.125000  0.7455000     2.361000  0.7395000     -0.2355000     1.050000  
1 1 1 6  54 10 o 6.010000  0.2697000     5.982000  0.3810000     6.039000  0.3819000     -0.5705000E-01 0.5395000 
1 1 1 6  54 11 o 4.882000  0.5736000     5.370000  0.6268000     4.394000  0.9609000     0.9751000      1.147000  
1 1 1 6  54 12 o 1.556000  0.4863000     1.959000  0.7994000     1.153000  0.5541000     0.8059000      0.9727000 
1 1 1 6  54 13 o 2.267000  0.5051000     1.845000  0.7120000     2.688000  0.7165000     -0.8432000     1.010000  
1 1 1 6  54 14 o 1.435000  0.4485000     1.575000  0.6699000     1.295000  0.5965000     0.2807000      0.8970000 
1 1 1 6  54 15 o 2.443000  0.5064000     2.068000  0.7399000     2.817000  0.6917000     -0.7495000     1.013000  
1 1 1 6  54 16 o 1.608000  0.4658000     1.334000  0.6049000     1.883000  0.7084000     -0.5495000     0.9316000 
1 1 1 6  55 0  o 3.518000  0.5933000     3.518000  0.5933000     3.518000  0.5933000     0.000000       0.000000  
1 1 1 6  55 1  o 2.016000  0.5233000     2.074000  0.7703000     1.959000  0.7085000     0.1155000      1.047000  
1 1 1 6  55 2  o 1.835000  0.5202000     2.080000  0.7905000     1.591000  0.6765000     0.4886000      1.040000  
1 1 1 6  55 3  o 3.653000  0.4749000     4.064000  0.7161000     3.243000  0.6238000     0.8214000      0.9497000 
1 1 1 6  55 4  o 3.624000  0.4442000     3.285000  0.7162000     3.963000  0.5257000     -0.6773000     0.8884000 
1 1 1 6  55 5  o 1.255000  0.4165000     1.185000  0.5657000     1.326000  0.6115000     -0.1403000     0.8330000 
1 1 1 6  55 6  o 1.894000  0.4984000     1.508000  0.6593000     2.280000  0.7477000     -0.7719000     0.9968000 
1 1 1 6  55 7  o 1.509000  0.4624000     1.728000  0.7007000     1.290000  0.6036000     0.4382000      0.9249000 
1 1 1 6  55 8  o 4.203000  0.3599000     4.113000  0.5231000     4.294000  0.4946000     -0.1812000     0.7199000 
1 1 1 6  55 9  o 1.615000  0.4816000     1.609000  0.6774000     1.621000  0.6847000     -0.1248000E-01 0.9632000 
1 1 1 6  55 10 o 1.714000  0.5423000     2.092000  0.8721000     1.336000  0.6448000     0.7559000      1.085000  
1 1 1 6  55 11 o 2.056000  0.5036000     2.985000  0.8367000     1.126000  0.5607000     1.860000       1.007000  
1 1 1 6  55 12 o 3.022000  0.4698000     3.242000  0.6170000     2.801000  0.7085000     0.4406000      0.9395000 
1 1 1 6  55 13 o 2.348000  0.5080000     2.143000  0.7248000     2.553000  0.7119000     -0.4104000     1.016000  
1 1 1 6  55 14 o 1.790000  0.4822000     2.182000  0.7315000     1.398000  0.6285000     0.7844000      0.9645000 
1 1 1 6  55 15 o 1.092000  0.3733000     1.282000  0.5936000     0.9031000 0.4529000     0.3785000      0.7466000 
1 1 1 6  56 0  o 4.877000  0.4388000     4.877000  0.4388000     4.877000  0.4388000     0.000000       0.000000  
1 1 1 6  56 1  o 1.708000  0.4846000     1.349000  0.6354000     2.067000  0.7318000     -0.7180000     0.9692000 
1 1 1 6  56 2  o 1.479000  0.4663000     1.437000  0.6580000     1.520000  0.6607000     -0.8260000E-01 0.9325000 
1 1 1 6  56 3  o 2.647000  0.5756000     2.954000  0.8783000     2.341000  0.7442000     0.6127000      1.151000  
1 1 1 6  56 4  o 1.770000  0.5088000     1.962000  0.7612000     1.577000  0.6754000     0.3846000      1.018000  
1 1 1 6  56 5  o 1.947000  0.5151000     1.934000  0.7275000     1.961000  0.7294000     -0.2775000E-01 1.030000  
1 1 1 6  56 6  o 1.661000  0.4856000     1.427000  0.6372000     1.894000  0.7329000     -0.4671000     0.9712000 
1 1 1 6  56 7  o 5.278000  0.3064000     5.637000  0.4081000     4.919000  0.4571000     0.7188000      0.6128000 
1 1 1 6  56 8  o 2.812000  0.4961000     2.793000  0.7124000     2.832000  0.6906000     -0.3853000E-01 0.9922000 
1 1 1 6  56 9  o 3.113000  0.6121000     3.925000  0.8455000     2.302000  0.8853000     1.623000       1.224000  
1 1 1 6  56 10 o 2.418000  0.6615000     2.600000  0.8831000     2.235000  0.9851000     0.3648000      1.323000  
1 1 1 6  56 11 o 1.827000  0.5070000     1.791000  0.7148000     1.863000  0.7191000     -0.7267000E-01 1.014000  
1 1 1 6  56 12 o 1.403000  0.4438000     1.599000  0.6784000     1.207000  0.5725000     0.3924000      0.8876000 
1 1 1 6  56 13 o 1.422000  0.4456000     1.558000  0.6639000     1.286000  0.5944000     0.2717000      0.8911000 
1 1 1 6  56 14 o 1.426000  0.4417000     1.713000  0.6936000     1.140000  0.5472000     0.5726000      0.8835000 
1 1 1 6  56 15 o 1.307000  0.4392000     1.191000  0.5856000     1.423000  0.6547000     -0.2323000     0.8784000 
1 1 1 6  57 0  o 4.708000  0.4498000     4.708000  0.4498000     4.708000  0.4498000     0.000000       0.000000  
1 1 1 6  57 1  o 1.762000  0.5070000     1.684000  0.7228000     1.840000  0.7112000     -0.1555000     1.014000  
1 1 1 6  57 2  o 6.959000  0.2777000     6.519000  0.4374000     7.398000  0.3422000     -0.8786000     0.5554000 
1 1 1 6  57 3  o 6.223000  0.3317000     6.065000  0.5501000     6.380000  0.3709000     -0.3153000     0.6634000 
1 1 1 6  57 4  o 4.485000  0.3637000     4.874000  0.5041000     4.096000  0.5243000     0.7771000      0.7273000 
1 1 1 6  57 5  f 2.246000  0.4708000     1.498000  0.6581000     2.993000  0.6733000     -1.495000      0.9415000 
1 1 1 6  57 6  o 2.580000  0.5121000     2.334000  0.7355000     2.825000  0.7129000     -0.4914000     1.024000  
1 1 1 6  57 7  o 1.729000  0.5096000     1.793000  0.7501000     1.664000  0.6899000     0.1291000      1.019000  
1 1 1 6  57 8  o 5.576000  0.6429000     5.576000  0.6429000     ?         ?             ?              ?         
1 1 1 6  57 9  o 3.548000  0.6527000     4.033000  0.7299000     3.063000  1.082000      0.9693000      1.305000  
1 1 1 6  57 10 o 1.655000  0.4507000     1.073000  0.5255000     2.237000  0.7323000     -1.165000      0.9013000 
1 1 1 6  57 11 o 1.616000  0.4842000     1.636000  0.6893000     1.596000  0.6802000     0.4038000E-01  0.9685000 
1 1 1 6  57 12 o 1.611000  0.4772000     1.454000  0.6423000     1.768000  0.7060000     -0.3142000     0.9545000 
1 1 1 6  57 13 o 1.253000  0.4084000     1.540000  0.6622000     0.9654000 0.4783000     0.5743000      0.8169000 
1 1 1 6  57 14 o 1.878000  0.4950000     1.515000  0.6596000     2.241000  0.7383000     -0.7252000     0.9900000 
1 1 1 6  58 0  o 7.592000  0.3369000     7.592000  0.3369000     7.592000  0.3369000     0.000000       0.000000  
1 1 1 6  58 1  o 1.962000  0.4949000     1.470000  0.6529000     2.454000  0.7440000     -0.9848000     0.9899000 
1 1 1 6  58 2  o 3.183000  0.4951000     3.144000  0.7518000     3.222000  0.6445000     -0.7863000E-01 0.9902000 
1 1 1 6  58 3  o 3.562000  0.4984000     4.095000  0.7489000     3.028000  0.6579000     1.068000       0.9968000 
1 1 1 6  58 4  o 2.502000  0.5209000     3.000000  0.7478000     2.003000  0.7253000     0.9964000      1.042000  
1 1 1 6  58 5  o 1.927000  0.4824000     2.424000  0.7252000     1.431000  0.6365000     0.9931000      0.9649000 
1 1 1 6  58 6  o 1.658000  0.5231000     2.030000  0.8465000     1.285000  0.6148000     0.7450000      1.046000  
1 1 1 6  58 7  o 1.594000  0.7071000     1.594000  0.7071000     ?         ?             ?              ?         
1 1 1 6  58 8  o 2.603000  0.5747000     3.115000  0.8297000     2.091000  0.7953000     1.024000       1.149000  
1 1 1 6  58 9  o 1.779000  0.4893000     1.394000  0.6341000     2.163000  0.7454000     -0.7695000     0.9786000 
1 1 1 6  58 10 f 2.123000  0.5114000     1.789000  0.7156000     2.457000  0.7308000     -0.6678000     1.023000  
1 1 1 6  58 11 o 1.403000  0.4460000     1.416000  0.6330000     1.389000  0.6285000     0.2650000E-01  0.8920000 
1 1 1 6  58 12 o 1.473000  0.4593000     1.533000  0.6639000     1.413000  0.6349000     0.1206000      0.9186000 
1 1 1 6  58 13 o 1.339000  0.4308000     1.317000  0.6017000     1.362000  0.6166000     -0.4563000E-01 0.8615000 
1 1 1 6  59 0  o 1.350000  0.8046000     1.350000  0.8046000     1.350000  0.8046000     0.000000       0.000000  
1 1 1 6  59 1  o 6.087000  0.2789000     5.741000  0.4173000     6.433000  0.3700000     -0.6923000     0.5577000 
1 1 1 6  59 2  o 4.276000  0.3832000     4.541000  0.5494000     4.011000  0.5345000     0.5296000      0.7665000 
1 1 1 6  59 3  o 4.050000  0.4658000     3.758000  0.7964000     4.343000  0.4833000     -0.5847000     0.9315000 
1 1 1 6  59 4  o 1.600000  0.5206000     1.608000  0.7719000     1.593000  0.6987000     0.1519000E-01  1.041000  
1 1 1 6  59 5  o 1.447000  0.4984000     1.442000  0.6917000     1.451000  0.7178000     -0.8962000E-02 0.9968000 
1 1 1 6  59 6  o 2.573000  0.7006000     2.547000  0.8919000     2.600000  1.081000      -0.5363000E-01 1.401000  
1 1 1 6  59 7  o 4.594000  0.4089000     5.122000  0.6101000     4.066000  0.5446000     1.056000       0.8178000 
1 1 1 6  59 8  o 5.665000  0.2943000     5.734000  0.4100000     5.596000  0.4223000     0.1375000      0.5886000 
1 1 1 6  59 9  o 1.939000  0.5229000     2.101000  0.7591000     1.776000  0.7195000     0.3248000      1.046000  
1 1 1 6  59 10 o 3.420000  0.4581000     2.642000  0.7558000     4.198000  0.5179000     -1.556000      0.9162000 
1 1 1 6  59 11 f 1.582000  0.4722000     1.763000  0.7067000     1.402000  0.6264000     0.3608000      0.9444000 
1 1 1 6  59 12 o 1.418000  0.4498000     1.274000  0.5964000     1.563000  0.6736000     -0.2896000     0.8997000 
1 1 1 6  60 0  o 0.9735000 0.6873000     0.9735000 0.6873000     0.9735000 0.6873000     -0.000000      0.000000  
1 1 1 6  60 1  o 2.943000  0.6038000     2.248000  0.8726000     3.637000  0.8348000     -1.389000      1.208000  
1 1 1 6  60 2  o 3.684000  0.6270000     4.043000  0.8360000     3.325000  0.9346000     0.7186000      1.254000  
1 1 1 6  60 3  f 3.113000  1.106000      3.113000  1.106000      ?         ?             ?              ?         
1 1 1 6  60 4  o 4.776000  0.6924000     5.602000  0.8418000     3.949000  1.100000      1.653000       1.385000  
1 1 1 6  60 5  o 1.419000  0.4697000     1.427000  0.6780000     1.411000  0.6503000     0.1590000E-01  0.9395000 
1 1 1 6  60 6  o 2.425000  0.5056000     1.894000  0.7322000     2.957000  0.6974000     -1.063000      1.011000  
1 1 1 6  60 7  o 8.050000  0.2416000     8.312000  0.3324000     7.788000  0.3506000     0.5238000      0.4831000 
1 1 1 6  60 8  o 1.519000  0.4723000     1.640000  0.6960000     1.399000  0.6386000     0.2407000      0.9446000 
1 1 1 6  60 9  o 1.995000  0.5263000     2.139000  0.7556000     1.852000  0.7329000     0.2870000      1.053000  
1 1 1 6  60 10 o 2.148000  0.5287000     2.007000  0.7405000     2.289000  0.7548000     -0.2823000     1.057000  
1 1 1 6  60 11 o 2.586000  0.5160000     2.568000  0.7257000     2.603000  0.7337000     -0.3477000E-01 1.032000  
1 1 1 6  60 12 o 1.197000  0.4017000     1.393000  0.6315000     1.000000  0.4965000     0.3930000      0.8033000 
1 1 1 6  61 0  o 2.027000  1.046000      2.027000  1.046000      2.027000  1.046000      0.000000       0.000000  
1 1 1 6  61 1  o 7.839000  0.3473000     8.225000  0.4769000     7.453000  0.5051000     0.7712000      0.6947000 
1 1 1 6  61 2  o 3.502000  0.5955000     2.589000  1.029000      4.416000  0.5989000     -1.827000      1.191000  
1 1 1 6  61 3  o 2.923000  0.6103000     2.517000  1.027000      3.328000  0.6604000     -0.8110000     1.221000  
1 1 1 6  61 4  o 1.543000  0.4942000     1.644000  0.7452000     1.442000  0.6494000     0.2021000      0.9885000 
1 1 1 6  61 5  o 1.131000  0.3865000     1.081000  0.5281000     1.181000  0.5646000     -0.9970000E-01 0.7730000 
1 1 1 6  61 6  o 4.651000  0.3424000     4.605000  0.4833000     4.698000  0.4851000     -0.9390000E-01 0.6848000 
1 1 1 6  61 7  o 4.487000  0.3565000     4.122000  0.5321000     4.852000  0.4746000     -0.7305000     0.7130000 
1 1 1 6  61 8  o 4.201000  0.3816000     4.073000  0.5418000     4.329000  0.5375000     -0.2556000     0.7632000 
1 1 1 6  61 9  o 4.241000  0.3961000     4.889000  0.4739000     3.593000  0.6349000     1.296000       0.7922000 
1 1 1 6  61 10 o 3.589000  0.4271000     3.707000  0.5897000     3.471000  0.6179000     0.2357000      0.8541000 
1 1 1 6  61 11 o 1.329000  0.4210000     1.746000  0.7068000     0.9122000 0.4576000     0.8337000      0.8420000 
1 1 1 6  62 0  o 8.978000  0.3265000     8.978000  0.3265000     8.978000  0.3265000     -0.000000      0.000000  
1 1 1 6  62 1  o 2.050000  0.5165000     1.776000  0.7219000     2.325000  0.7388000     -0.5496000     1.033000  
1 1 1 6  62 2  o 1.858000  0.5349000     2.493000  0.8984000     1.223000  0.5807000     1.271000       1.070000  
1 1 1 6  62 3  o 2.527000  0.5809000     2.597000  0.8842000     2.457000  0.7538000     0.1400000      1.162000  
1 1 1 6  62 4  o 6.187000  0.3452000     6.436000  0.5552000     5.939000  0.4104000     0.4967000      0.6904000 
1 1 1 6  62 5  o 1.999000  0.5210000     1.848000  0.7284000     2.150000  0.7450000     -0.3017000     1.042000  
1 1 1 6  62 6  o 5.099000  0.3130000     5.327000  0.4326000     4.871000  0.4523000     0.4560000      0.6259000 
1 1 1 6  62 7  o 4.729000  0.3377000     4.633000  0.4813000     4.826000  0.4738000     -0.1930000     0.6754000 
1 1 1 6  62 8  o 3.188000  0.4832000     2.967000  0.7183000     3.409000  0.6464000     -0.4422000     0.9663000 
1 1 1 6  62 9  o 1.130000  0.3875000     1.173000  0.5635000     1.087000  0.5320000     0.8693000E-01  0.7749000 
1 1 1 6  62 10 o 1.612000  0.4748000     1.951000  0.7391000     1.274000  0.5962000     0.6762000      0.9496000 
1 1 1 6  63 0  o 5.104000  0.4510000     5.104000  0.4510000     5.104000  0.4510000     0.000000       0.000000  
1 1 1 6  63 1  o 1.321000  0.4314000     1.176000  0.5664000     1.466000  0.6508000     -0.2905000     0.8627000 
1 1 1 6  63 2  o 1.685000  0.5078000     1.806000  0.7551000     1.564000  0.6791000     0.2424000      1.016000  
1 1 1 6  63 3  o 5.242000  0.3997000     4.895000  0.6866000     5.588000  0.4093000     -0.6928000     0.7993000 
1 1 1 6  63 4  o 3.249000  0.5478000     2.820000  0.9198000     3.678000  0.5954000     -0.8582000     1.096000  
1 1 1 6  63 5  o 5.711000  0.2943000     5.539000  0.4264000     5.883000  0.4057000     -0.3446000     0.5886000 
1 1 1 6  63 6  o 1.948000  0.5026000     2.243000  0.7296000     1.654000  0.6914000     0.5894000      1.005000  
1 1 1 6  63 7  o 4.232000  0.3801000     4.571000  0.4932000     3.894000  0.5786000     0.6769000      0.7603000 
1 1 1 6  63 8  o 2.175000  0.4877000     1.429000  0.6460000     2.921000  0.7309000     -1.492000      0.9754000 
1 1 1 6  63 9  f 1.402000  0.4546000     1.374000  0.6367000     1.431000  0.6491000     -0.5670000E-01 0.9092000 
1 1 1 6  64 0  o 2.454000  0.9064000     2.454000  0.9064000     2.454000  0.9064000     0.000000       0.000000  
1 1 1 6  64 1  o 4.218000  0.3816000     3.998000  0.5679000     4.438000  0.5099000     -0.4403000     0.7633000 
1 1 1 6  64 2  o 1.795000  0.5177000     2.186000  0.8179000     1.403000  0.6349000     0.7831000      1.035000  
1 1 1 6  64 3  o 2.454000  0.5708000     3.147000  0.8824000     1.760000  0.7243000     1.387000       1.142000  
1 1 1 6  64 4  o 3.859000  0.5030000     3.467000  0.8682000     4.250000  0.5083000     -0.7837000     1.006000  
1 1 1 6  64 5  o 1.566000  0.4745000     1.530000  0.6613000     1.602000  0.6808000     -0.7268000E-01 0.9491000 
1 1 1 6  64 6  o 2.164000  0.5082000     1.756000  0.7047000     2.573000  0.7325000     -0.8172000     1.016000  
1 1 1 6  64 7  o 1.393000  0.4447000     1.234000  0.5837000     1.552000  0.6712000     -0.3182000     0.8894000 
1 1 1 6  65 0  o 0.8267000 0.5842000     0.8267000 0.5842000     0.8267000 0.5842000     0.000000       0.000000  
1 1 1 6  65 1  o 5.742000  0.3058000     5.651000  0.4321000     5.832000  0.4327000     -0.1806000     0.6116000 
1 1 1 6  65 2  o 2.517000  0.5816000     2.645000  0.8393000     2.389000  0.8052000     0.2562000      1.163000  
1 1 1 6  65 3  o 1.397000  0.4540000     1.218000  0.6019000     1.576000  0.6797000     -0.3584000     0.9079000 
1 1 1 6  65 4  o 1.487000  0.4774000     1.400000  0.6678000     1.574000  0.6825000     -0.1739000     0.9549000 
1 1 1 6  65 5  o 1.912000  0.5184000     1.912000  0.7388000     1.912000  0.7276000     -0.7021000E-04 1.037000  
1 1 1 6  65 6  o 2.381000  0.5260000     2.175000  0.7590000     2.587000  0.7285000     -0.4120000     1.052000  
1 1 1 6  66 0  o 1.074000  0.7052000     1.074000  0.7052000     1.074000  0.7052000     0.000000       0.000000  
1 1 1 6  66 1  o 1.581000  0.4835000     1.632000  0.6929000     1.531000  0.6745000     0.1005000      0.9670000 
1 1 1 6  66 2  o 1.609000  0.4967000     1.917000  0.7861000     1.302000  0.6074000     0.6152000      0.9934000 
1 1 1 6  66 3  o 1.512000  0.4866000     1.631000  0.7385000     1.394000  0.6337000     0.2367000      0.9731000 
1 1 1 6  66 4  o 1.996000  0.5771000     2.269000  0.8784000     1.724000  0.7488000     0.5450000      1.154000  
1 1 1 7  0  1  o 9.320000  0.1290000     9.320000  0.1290000     9.320000  0.1290000     0.000000       0.000000  
1 1 1 7  0  2  o 19.35000  0.2168000     19.35000  0.2168000     19.35000  0.2168000     0.000000       0.000000  
1 1 1 7  0  3  o 53.96000  0.5875000     53.96000  0.5875000     53.96000  0.5875000     0.000000       0.000000  
1 1 1 7  0  4  o 21.96000  0.2902000     21.96000  0.2902000     21.96000  0.2902000     -0.000000      0.000000  
1 1 1 7  0  5  o 45.98000  0.7147000     45.98000  0.7147000     45.98000  0.7147000     -0.000000      0.000000  
1 1 1 7  0  6  o 44.42000  0.6942000     44.42000  0.6942000     44.42000  0.6942000     -0.000000      0.000000  
1 1 1 7  0  7  o 28.21000  0.3252000     28.21000  0.3252000     28.21000  0.3252000     -0.000000      0.000000  
1 1 1 7  0  8  o 1.073000  0.5930000     1.073000  0.5930000     1.073000  0.5930000     -0.000000      0.000000  
1 1 1 7  0  9  f 9.869000  0.2013000     9.869000  0.2013000     9.869000  0.2013000     0.000000       0.000000  
1 1 1 7  0  10 o 10.71000  0.2571000     10.71000  0.2571000     10.71000  0.2571000     0.000000       0.000000  
1 1 1 7  0  11 o 1.302000  0.7599000     1.302000  0.7599000     1.302000  0.7599000     -0.000000      0.000000  
1 1 1 7  0  12 o 4.393000  0.4101000     4.393000  0.4101000     4.393000  0.4101000     -0.000000      0.000000  
1 1 1 7  0  13 o 5.540000  0.3747000     5.540000  0.3747000     5.540000  0.3747000     -0.000000      0.000000  
1 1 1 7  0  14 o 2.190000  0.9086000     2.190000  0.9086000     2.190000  0.9086000     -0.000000      0.000000  
1 1 1 7  0  15 o 2.093000  1.002000      2.093000  1.002000      2.093000  1.002000      0.000000       0.000000  
1 1 1 7  0  16 o 2.274000  1.196000      2.274000  1.196000      2.274000  1.196000      -0.000000      0.000000  
1 1 1 7  0  17 o 1.614000  0.9476000     1.614000  0.9476000     1.614000  0.9476000     0.000000       0.000000  
1 1 1 7  0  18 o 1.238000  0.8308000     1.238000  0.8308000     1.238000  0.8308000     0.000000       0.000000  
1 1 1 7  0  19 o 2.109000  1.120000      2.109000  1.120000      2.109000  1.120000      -0.000000      0.000000  
1 1 1 7  0  20 o 1.411000  0.9504000     1.411000  0.9504000     1.411000  0.9504000     -0.000000      0.000000  
1 1 1 7  0  21 o 2.074000  1.178000      2.074000  1.178000      2.074000  1.178000      0.000000       0.000000  
1 1 1 7  0  22 o 1.680000  1.014000      1.680000  1.014000      1.680000  1.014000      -0.000000      0.000000  
1 1 1 7  0  23 o 1.162000  0.7789000     1.162000  0.7789000     1.162000  0.7789000     0.000000       0.000000  
1 1 1 7  0  24 o 1.337000  0.8332000     1.337000  0.8332000     1.337000  0.8332000     -0.000000      0.000000  
1 1 1 7  0  25 o 1.405000  0.8759000     1.405000  0.8759000     1.405000  0.8759000     0.000000       0.000000  
1 1 1 7  0  26 o 1.193000  0.7686000     1.193000  0.7686000     1.193000  0.7686000     0.000000       0.000000  
1 1 1 7  0  27 o 0.9001000 0.6304000     0.9001000 0.6304000     0.9001000 0.6304000     -0.000000      0.000000  
1 1 1 7  1  0  o 13.74000  0.2143000     13.74000  0.2143000     13.74000  0.2143000     0.000000       0.000000  
1 1 1 7  1  1  o 23.44000  0.1965000     23.58000  0.2584000     23.31000  0.2961000     0.2628000      0.3930000 
1 1 1 7  1  2  o 13.50000  0.1119000     13.51000  0.1582000     13.49000  0.1582000     0.1705000E-01  0.2237000 
1 1 1 7  1  3  o 16.27000  0.1350000     16.16000  0.1897000     16.38000  0.1921000     -0.2240000     0.2700000 
1 1 1 7  1  4  o 47.61000  0.4258000     47.60000  0.6021000     47.62000  0.6022000     -0.1672000E-01 0.8516000 
1 1 1 7  1  5  o 26.11000  0.2968000     26.06000  0.4189000     26.17000  0.4206000     -0.1094000     0.5936000 
1 1 1 7  1  6  o 39.65000  0.4021000     40.13000  0.5161000     39.18000  0.6167000     0.9518000      0.8041000 
1 1 1 7  1  7  o 13.76000  0.1387000     13.94000  0.1971000     13.58000  0.1951000     0.3648000      0.2774000 
1 1 1 7  1  8  o 3.966000  0.1923000     3.813000  0.2794000     4.118000  0.2641000     -0.3050000     0.3845000 
1 1 1 7  1  9  o 18.32000  0.1727000     18.15000  0.2429000     18.49000  0.2457000     -0.3480000     0.3455000 
1 1 1 7  1  10 o 7.865000  0.2276000     7.724000  0.3241000     8.006000  0.3197000     -0.2817000     0.4553000 
1 1 1 7  1  11 o 8.556000  0.2046000     8.466000  0.2883000     8.647000  0.2905000     -0.1809000     0.4093000 
1 1 1 7  1  12 o 5.159000  0.2540000     5.012000  0.3665000     5.306000  0.3517000     -0.2938000     0.5080000 
1 1 1 7  1  13 o 10.61000  0.1906000     10.48000  0.2686000     10.74000  0.2707000     -0.2546000     0.3813000 
1 1 1 7  1  14 o 7.223000  0.2444000     7.278000  0.3481000     7.167000  0.3432000     0.1104000      0.4888000 
1 1 1 7  1  15 o 1.912000  0.5378000     1.435000  0.6722000     2.390000  0.8397000     -0.9549000     1.076000  
1 1 1 7  1  16 o 12.97000  0.3102000     12.60000  0.4366000     13.33000  0.4408000     -0.7272000     0.6204000 
1 1 1 7  1  17 o 11.33000  0.2389000     11.67000  0.3316000     10.98000  0.3439000     0.6920000      0.4778000 
1 1 1 7  1  18 o 8.407000  0.2987000     7.972000  0.4320000     8.842000  0.4128000     -0.8706000     0.5975000 
1 1 1 7  1  19 o 3.210000  0.6455000     3.632000  0.9024000     2.788000  0.9234000     0.8433000      1.291000  
1 1 1 7  1  20 o 3.093000  0.7525000     3.307000  1.068000      2.880000  1.060000      0.4273000      1.505000  
1 1 1 7  1  21 o 2.645000  0.7299000     2.787000  1.046000      2.502000  1.018000      0.2854000      1.460000  
1 1 1 7  1  22 o 2.576000  0.6585000     2.512000  0.9244000     2.641000  0.9381000     -0.1292000     1.317000  
1 1 1 7  1  23 o 2.400000  0.5984000     2.232000  0.8288000     2.567000  0.8633000     -0.3348000     1.197000  
1 1 1 7  1  24 o 1.729000  0.5192000     1.885000  0.7655000     1.573000  0.7016000     0.3122000      1.038000  
1 1 1 7  1  25 o 1.755000  0.5377000     1.442000  0.6950000     2.069000  0.8205000     -0.6279000     1.075000  
1 1 1 7  1  26 o 1.586000  0.4940000     1.435000  0.6614000     1.737000  0.7341000     -0.3021000     0.9881000 
1 1 1 7  1  27 o 1.194000  0.4100000     1.299000  0.6172000     1.089000  0.5398000     0.2096000      0.8199000 
1 1 1 7  2  0  o 20.68000  0.2618000     20.68000  0.2618000     20.68000  0.2618000     -0.000000      0.000000  
1 1 1 7  2  1  o 7.120000  0.7458000E-01 7.108000  0.1084000     7.132000  0.1025000     -0.2408000E-01 0.1492000 
1 1 1 7  2  2  o 22.70000  0.1843000     22.81000  0.2262000     22.60000  0.2909000     0.2085000      0.3685000 
1 1 1 7  2  3  o 17.52000  0.1440000     17.76000  0.2061000     17.29000  0.2013000     0.4670000      0.2881000 
1 1 1 7  2  4  o 12.99000  0.1364000     12.99000  0.1923000     13.00000  0.1935000     -0.7315000E-02 0.2728000 
1 1 1 7  2  5  f 21.18000  0.2473000     21.09000  0.3483000     21.28000  0.3512000     -0.1908000     0.4946000 
1 1 1 7  2  6  o 24.29000  0.2304000     24.26000  0.3254000     24.32000  0.3263000     -0.5145000E-01 0.4608000 
1 1 1 7  2  7  o 10.19000  0.1258000     10.33000  0.1782000     10.05000  0.1775000     0.2775000      0.2515000 
1 1 1 7  2  8  o 7.917000  0.1361000     8.060000  0.1927000     7.774000  0.1921000     0.2863000      0.2721000 
1 1 1 7  2  9  o 15.83000  0.1602000     15.92000  0.2275000     15.75000  0.2256000     0.1751000      0.3204000 
1 1 1 7  2  10 o 5.975000  0.2608000     5.590000  0.3903000     6.361000  0.3460000     -0.7702000     0.5216000 
1 1 1 7  2  11 o 3.627000  0.3519000     3.786000  0.4791000     3.467000  0.5156000     0.3187000      0.7039000 
1 1 1 7  2  12 o 9.096000  0.1901000     9.365000  0.2644000     8.826000  0.2731000     0.5400000      0.3801000 
1 1 1 7  2  13 o 8.809000  0.2030000     8.674000  0.2853000     8.945000  0.2890000     -0.2708000     0.4061000 
1 1 1 7  2  14 o 15.54000  0.2141000     15.37000  0.2804000     15.72000  0.3236000     -0.3514000     0.4282000 
1 1 1 7  2  15 o 7.085000  0.3000000     7.180000  0.4188000     6.990000  0.4297000     0.1899000      0.6001000 
1 1 1 7  2  16 o 4.114000  0.5179000     4.181000  0.7232000     4.048000  0.7414000     0.1325000      1.036000  
1 1 1 7  2  17 o 12.51000  0.2306000     12.36000  0.3261000     12.67000  0.3262000     -0.3168000     0.4612000 
1 1 1 7  2  18 o 3.251000  0.7003000     3.094000  0.9929000     3.408000  0.9879000     -0.3137000     1.401000  
1 1 1 7  2  19 o 3.229000  0.6073000     2.336000  0.9163000     4.122000  0.7974000     -1.785000      1.215000  
1 1 1 7  2  20 o 3.039000  0.7552000     2.740000  1.059000      3.338000  1.076000      -0.5979000     1.510000  
1 1 1 7  2  21 o 2.321000  0.6841000     2.417000  0.9844000     2.225000  0.9504000     0.1926000      1.368000  
1 1 1 7  2  22 o 1.931000  0.5633000     2.633000  0.9444000     1.230000  0.6145000     1.403000       1.127000  
1 1 1 7  2  23 o 2.268000  0.5627000     2.811000  0.8328000     1.724000  0.7569000     1.087000       1.125000  
1 1 1 7  2  24 f 1.677000  0.5154000     1.535000  0.6900000     1.820000  0.7657000     -0.2853000     1.031000  
1 1 1 7  2  25 o 1.733000  0.5340000     2.085000  0.8366000     1.381000  0.6640000     0.7038000      1.068000  
1 1 1 7  2  26 o 1.244000  0.4216000     1.030000  0.5134000     1.458000  0.6688000     -0.4275000     0.8431000 
1 1 1 7  2  27 o 1.623000  0.4993000     1.511000  0.6825000     1.735000  0.7288000     -0.2237000     0.9985000 
1 1 1 7  3  0  f 36.99000  0.4021000     36.99000  0.4021000     36.99000  0.4021000     0.000000       0.000000  
1 1 1 7  3  1  o 22.69000  0.1914000     23.00000  0.2926000     22.37000  0.2468000     0.6260000      0.3828000 
1 1 1 7  3  2  o 16.30000  0.1361000     16.30000  0.2156000     16.30000  0.1663000     0.3376000E-03  0.2723000 
1 1 1 7  3  3  o 1.334000  0.2212000     1.072000  0.2684000     1.597000  0.3516000     -0.5254000     0.4423000 
1 1 1 7  3  4  o 28.84000  0.2634000     28.69000  0.3705000     28.99000  0.3745000     -0.2989000     0.5268000 
1 1 1 7  3  5  o 25.89000  0.2948000     25.95000  0.4180000     25.82000  0.4159000     0.1267000      0.5896000 
1 1 1 7  3  6  f 19.36000  0.1918000     19.31000  0.2708000     19.40000  0.2717000     -0.8687000E-01 0.3837000 
1 1 1 7  3  7  o 15.43000  0.1479000     15.58000  0.2107000     15.28000  0.2077000     0.3016000      0.2959000 
1 1 1 7  3  8  o 7.237000  0.1406000     7.050000  0.1981000     7.424000  0.1995000     -0.3746000     0.2811000 
1 1 1 7  3  9  o 13.12000  0.1489000     13.13000  0.2100000     13.12000  0.2111000     0.1615000E-01  0.2977000 
1 1 1 7  3  10 o 19.65000  0.2624000     19.53000  0.3696000     19.78000  0.3724000     -0.2529000     0.5247000 
1 1 1 7  3  11 o 4.399000  0.2931000     4.470000  0.4031000     4.329000  0.4256000     0.1411000      0.5862000 
1 1 1 7  3  12 o 12.46000  0.1802000     12.66000  0.2565000     12.25000  0.2533000     0.4083000      0.3605000 
1 1 1 7  3  13 o 13.21000  0.1865000     13.24000  0.2643000     13.19000  0.2633000     0.4871000E-01  0.3731000 
1 1 1 7  3  14 o 10.09000  0.2078000     10.12000  0.2910000     10.06000  0.2968000     0.5807000E-01  0.4157000 
1 1 1 7  3  15 o 9.814000  0.2528000     9.939000  0.3556000     9.688000  0.3593000     0.2509000      0.5055000 
1 1 1 7  3  16 f 3.448000  0.6039000     3.920000  0.7921000     2.976000  0.9118000     0.9441000      1.208000  
1 1 1 7  3  17 o 5.908000  0.3532000     6.035000  0.4944000     5.782000  0.5044000     0.2529000      0.7063000 
1 1 1 7  3  18 o 4.069000  0.5520000     3.923000  0.8110000     4.215000  0.7491000     -0.2919000     1.104000  
1 1 1 7  3  19 o 5.659000  0.4297000     5.515000  0.6325000     5.802000  0.5819000     -0.2870000     0.8594000 
1 1 1 7  3  20 o 3.118000  0.7741000     2.238000  1.011000      3.997000  1.172000      -1.759000      1.548000  
1 1 1 7  3  21 o 3.219000  0.7180000     2.517000  1.012000      3.922000  1.019000      -1.405000      1.436000  
1 1 1 7  3  22 o 2.111000  0.6127000     2.348000  0.9034000     1.873000  0.8278000     0.4759000      1.225000  
1 1 1 7  3  23 f 2.848000  0.5617000     3.680000  0.7669000     2.017000  0.8210000     1.663000       1.123000  
1 1 1 7  3  24 o 1.478000  0.4791000     1.566000  0.7032000     1.389000  0.6509000     0.1773000      0.9582000 
1 1 1 7  3  25 o 1.892000  0.5703000     1.609000  0.7444000     2.175000  0.8641000     -0.5661000     1.141000  
1 1 1 7  3  26 o 1.944000  0.5073000     1.352000  0.6381000     2.535000  0.7890000     -1.183000      1.015000  
1 1 1 7  3  27 o 1.427000  0.4670000     1.533000  0.6923000     1.321000  0.6269000     0.2122000      0.9340000 
1 1 1 7  4  0  o 4.026000  0.8418000E-01 4.026000  0.8418000E-01 4.026000  0.8418000E-01 0.000000       0.000000  
1 1 1 7  4  1  f 6.342000  0.6650000E-01 6.285000  0.9343000E-01 6.399000  0.9466000E-01 -0.1137000     0.1330000 
1 1 1 7  4  2  o 25.81000  0.2017000     25.64000  0.2835000     25.98000  0.2870000     -0.3385000     0.4034000 
1 1 1 7  4  3  o 39.91000  0.3350000     40.18000  0.5092000     39.63000  0.4353000     0.5500000      0.6699000 
1 1 1 7  4  4  o 14.61000  0.1582000     14.71000  0.1800000     14.50000  0.2603000     0.2115000      0.3164000 
1 1 1 7  4  5  o 39.86000  0.4054000     39.37000  0.5039000     40.36000  0.6351000     -0.9861000     0.8107000 
1 1 1 7  4  6  o 40.21000  0.3645000     40.18000  0.5151000     40.23000  0.5158000     -0.4223000E-01 0.7290000 
1 1 1 7  4  7  o 32.08000  0.2580000     31.96000  0.3639000     32.20000  0.3659000     -0.2392000     0.5161000 
1 1 1 7  4  8  o 6.796000  0.1436000     6.874000  0.2014000     6.718000  0.2048000     0.1564000      0.2872000 
1 1 1 7  4  9  o 18.06000  0.1720000     18.13000  0.2441000     18.00000  0.2423000     0.1330000      0.3439000 
1 1 1 7  4  10 o 10.30000  0.2200000     10.45000  0.3091000     10.15000  0.3131000     0.3074000      0.4400000 
1 1 1 7  4  11 o 9.747000  0.1987000     9.832000  0.2804000     9.661000  0.2817000     0.1704000      0.3975000 
1 1 1 7  4  12 o 8.573000  0.1969000     8.514000  0.2840000     8.633000  0.2727000     -0.1199000     0.3937000 
1 1 1 7  4  13 o 4.117000  0.3434000     4.087000  0.4852000     4.147000  0.4862000     -0.6087000E-01 0.6868000 
1 1 1 7  4  14 o 11.34000  0.2044000     11.40000  0.2882000     11.28000  0.2899000     0.1231000      0.4088000 
1 1 1 7  4  15 o 6.177000  0.3400000     5.996000  0.4955000     6.359000  0.4658000     -0.3630000     0.6801000 
1 1 1 7  4  16 o 2.888000  0.6423000     3.390000  0.9230000     2.387000  0.8935000     1.003000       1.285000  
1 1 1 7  4  17 o 5.612000  0.3767000     5.800000  0.5074000     5.424000  0.5570000     0.3769000      0.7534000 
1 1 1 7  4  18 o 8.292000  0.3058000     8.580000  0.4198000     8.004000  0.4448000     0.5752000      0.6116000 
1 1 1 7  4  19 o 1.858000  0.5860000     2.144000  0.8999000     1.573000  0.7510000     0.5712000      1.172000  
1 1 1 7  4  20 o 2.374000  0.7292000     1.862000  0.8949000     2.886000  1.152000      -1.025000      1.458000  
1 1 1 7  4  21 o 2.968000  0.7376000     3.390000  1.070000      2.546000  1.016000      0.8443000      1.475000  
1 1 1 7  4  22 o 2.066000  0.6141000     2.303000  0.9143000     1.830000  0.8201000     0.4724000      1.228000  
1 1 1 7  4  23 o 1.967000  0.5498000     1.499000  0.6985000     2.435000  0.8492000     -0.9364000     1.100000  
1 1 1 7  4  24 o 1.900000  0.5270000     1.403000  0.6563000     2.396000  0.8249000     -0.9924000     1.054000  
1 1 1 7  4  25 o 1.664000  0.5287000     1.840000  0.7977000     1.489000  0.6940000     0.3509000      1.057000  
1 1 1 7  4  26 o 1.579000  0.4986000     1.559000  0.7009000     1.599000  0.7094000     -0.3981000E-01 0.9972000 
1 1 1 7  4  27 o 1.191000  0.4094000     1.293000  0.6168000     1.090000  0.5385000     0.2032000      0.8188000 
1 1 1 7  5  0  o 5.912000  0.9437000E-01 5.912000  0.9437000E-01 5.912000  0.9437000E-01 0.000000       0.000000  
1 1 1 7  5  1  o 14.99000  0.1221000     15.06000  0.1734000     14.92000  0.1719000     0.1428000      0.2442000 
1 1 1 7  5  2  o 8.338000  0.8222000E-01 8.321000  0.1165000     8.356000  0.1160000     -0.3538000E-01 0.1644000 
1 1 1 7  5  3  o 9.744000  0.9387000E-01 9.751000  0.1328000     9.736000  0.1327000     0.1575000E-01  0.1877000 
1 1 1 7  5  4  o 45.87000  0.4362000     46.18000  0.5069000     45.57000  0.7100000     0.6147000      0.8724000 
1 1 1 7  5  5  o 11.17000  0.1935000     11.21000  0.1810000     11.13000  0.3420000     0.8066000E-01  0.3870000 
1 1 1 7  5  6  o 29.82000  0.2766000     29.43000  0.3862000     30.22000  0.3961000     -0.7925000     0.5532000 
1 1 1 7  5  7  o 27.65000  0.2271000     27.71000  0.3223000     27.60000  0.3200000     0.1184000      0.4542000 
1 1 1 7  5  8  o 15.46000  0.1532000     15.38000  0.2160000     15.54000  0.2174000     -0.1569000     0.3065000 
1 1 1 7  5  9  o 8.456000  0.1466000     8.821000  0.2051000     8.090000  0.2095000     0.7311000      0.2932000 
1 1 1 7  5  10 o 2.012000  0.4705000     1.870000  0.6697000     2.155000  0.6609000     -0.2847000     0.9409000 
1 1 1 7  5  11 o 10.35000  0.1868000     10.60000  0.2446000     10.10000  0.2824000     0.5002000      0.3736000 
1 1 1 7  5  12 o 2.401000  0.4738000     1.976000  0.7079000     2.825000  0.6299000     -0.8489000     0.9475000 
1 1 1 7  5  13 o 5.683000  0.2746000     6.129000  0.3594000     5.238000  0.4152000     0.8913000      0.5491000 
1 1 1 7  5  14 o 18.55000  0.2075000     18.63000  0.2941000     18.48000  0.2929000     0.1509000      0.4151000 
1 1 1 7  5  15 o 10.79000  0.3010000     10.47000  0.4296000     11.11000  0.4219000     -0.6335000     0.6021000 
1 1 1 7  5  16 o 7.850000  0.3161000     7.700000  0.4448000     8.000000  0.4493000     -0.2997000     0.6322000 
1 1 1 7  5  17 o 6.472000  0.3417000     6.302000  0.4972000     6.641000  0.4689000     -0.3389000     0.6834000 
1 1 1 7  5  18 o 5.420000  0.4714000     5.261000  0.6420000     5.579000  0.6903000     -0.3180000     0.9427000 
1 1 1 7  5  19 o 3.680000  0.6049000     2.684000  0.9454000     4.676000  0.7550000     -1.992000      1.210000  
1 1 1 7  5  20 o 5.456000  0.6869000     5.279000  1.024000      5.633000  0.9157000     -0.3546000     1.374000  
1 1 1 7  5  21 o 2.382000  0.7004000     2.389000  0.9890000     2.375000  0.9921000     0.1332000E-01  1.401000  
1 1 1 7  5  22 f 3.068000  0.5830000     4.133000  0.7918000     2.004000  0.8560000     2.128000       1.166000  
1 1 1 7  5  23 o 1.603000  0.5088000     1.312000  0.6317000     1.894000  0.7977000     -0.5823000     1.018000  
1 1 1 7  5  24 o 2.046000  0.5514000     2.347000  0.8089000     1.746000  0.7494000     0.6019000      1.103000  
1 1 1 7  5  25 o 2.054000  0.5907000     2.091000  0.8437000     2.017000  0.8271000     0.7389000E-01  1.181000  
1 1 1 7  5  26 o 1.281000  0.4296000     1.491000  0.6764000     1.070000  0.5298000     0.4214000      0.8592000 
1 1 1 7  5  27 o 1.639000  0.4983000     1.848000  0.7481000     1.429000  0.6586000     0.4193000      0.9967000 
1 1 1 7  6  0  o 0.5829000 0.3188000     0.5829000 0.3188000     0.5829000 0.3188000     0.000000       0.000000  
1 1 1 7  6  1  o 6.074000  0.8450000E-01 6.186000  0.1198000     5.962000  0.1192000     0.2244000      0.1690000 
1 1 1 7  6  2  o 2.061000  0.1154000     2.254000  0.1498000     1.868000  0.1757000     0.3860000      0.2309000 
1 1 1 7  6  3  o 8.950000  0.1068000     9.167000  0.1304000     8.734000  0.1692000     0.4325000      0.2136000 
1 1 1 7  6  4  o 9.993000  0.1302000     10.13000  0.2001000     9.857000  0.1665000     0.2720000      0.2603000 
1 1 1 7  6  5  o 17.14000  0.4339000     ?         ?             17.14000  0.4339000     ?              ?         
1 1 1 7  6  6  o 12.72000  0.1605000     12.40000  0.1732000     13.03000  0.2702000     -0.6327000     0.3210000 
1 1 1 7  6  7  o 13.20000  0.1395000     13.63000  0.2019000     12.77000  0.1927000     0.8641000      0.2791000 
1 1 1 7  6  8  o 6.871000  0.1451000     6.948000  0.2078000     6.793000  0.2027000     0.1554000      0.2903000 
1 1 1 7  6  9  f 10.64000  0.1448000     10.62000  0.2049000     10.66000  0.2048000     -0.4479000E-01 0.2896000 
1 1 1 7  6  10 o 3.000000  0.3852000     3.026000  0.5544000     2.974000  0.5350000     0.5184000E-01  0.7705000 
1 1 1 7  6  11 o 17.80000  0.1848000     17.81000  0.2621000     17.79000  0.2607000     0.1994000E-01  0.3697000 
1 1 1 7  6  12 o 8.142000  0.2015000     8.091000  0.2872000     8.193000  0.2827000     -0.1013000     0.4029000 
1 1 1 7  6  13 o 7.997000  0.2309000     7.807000  0.3075000     8.188000  0.3446000     -0.3813000     0.4618000 
1 1 1 7  6  14 o 8.144000  0.2349000     8.500000  0.3267000     7.789000  0.3376000     0.7116000      0.4698000 
1 1 1 7  6  15 o 8.186000  0.3415000     7.814000  0.4926000     8.558000  0.4732000     -0.7434000     0.6831000 
1 1 1 7  6  16 o 9.612000  0.2913000     9.714000  0.4115000     9.510000  0.4124000     0.2047000      0.5826000 
1 1 1 7  6  17 o 2.925000  0.6167000     2.694000  0.8911000     3.156000  0.8529000     -0.4615000     1.233000  
1 1 1 7  6  18 f 6.179000  0.3882000     6.465000  0.5244000     5.893000  0.5726000     0.5720000      0.7764000 
1 1 1 7  6  19 o 2.727000  0.6875000     2.709000  0.9644000     2.745000  0.9801000     -0.3550000E-01 1.375000  
1 1 1 7  6  20 o 3.953000  0.8351000     4.327000  1.153000      3.579000  1.208000      0.7487000      1.670000  
1 1 1 7  6  21 o 2.983000  0.7523000     2.679000  1.055000      3.286000  1.072000      -0.6065000     1.505000  
1 1 1 7  6  22 o 2.569000  0.6062000     1.798000  0.8060000     3.341000  0.9057000     -1.543000      1.212000  
1 1 1 7  6  23 o 2.151000  0.5223000     1.367000  0.6492000     2.935000  0.8185000     -1.567000      1.045000  
1 1 1 7  6  24 o 1.219000  0.4204000     1.190000  0.5824000     1.247000  0.6064000     -0.5688000E-01 0.8408000 
1 1 1 7  6  25 o 1.592000  0.5150000     1.713000  0.7658000     1.472000  0.6886000     0.2413000      1.030000  
1 1 1 7  6  26 o 1.143000  0.3957000     1.136000  0.5573000     1.150000  0.5618000     -0.1401000E-01 0.7913000 
1 1 1 7  6  27 o 1.182000  0.4071000     1.155000  0.5659000     1.210000  0.5852000     -0.5490000E-01 0.8141000 
1 1 1 7  7  0  o 24.14000  0.2690000     24.14000  0.2690000     24.14000  0.2690000     0.000000       0.000000  
1 1 1 7  7  1  o 10.37000  0.9493000E-01 10.39000  0.1343000     10.35000  0.1342000     0.4381000E-01  0.1899000 
1 1 1 7  7  2  o 22.19000  0.1774000     22.08000  0.2497000     22.31000  0.2521000     -0.2301000     0.3548000 
1 1 1 7  7  3  o 10.60000  0.1017000     10.58000  0.1441000     10.63000  0.1436000     -0.4850000E-01 0.2034000 
1 1 1 7  7  4  o 13.05000  0.1672000     13.16000  0.2394000     12.94000  0.2336000     0.2226000      0.3344000 
1 1 1 7  7  5  o 15.45000  0.2252000     ?         ?             15.45000  0.2252000     ?              ?         
1 1 1 7  7  6  o 8.150000  0.1483000     8.120000  0.1719000     8.179000  0.2418000     -0.5953000E-01 0.2967000 
1 1 1 7  7  7  o 15.27000  0.1541000     15.07000  0.1831000     15.47000  0.2479000     -0.3988000     0.3082000 
1 1 1 7  7  8  f 18.33000  0.1696000     18.30000  0.2395000     18.37000  0.2403000     -0.6946000E-01 0.3393000 
1 1 1 7  7  9  o 3.952000  0.2244000     4.047000  0.3140000     3.858000  0.3207000     0.1881000      0.4488000 
1 1 1 7  7  10 o 7.666000  0.2009000     7.658000  0.2879000     7.673000  0.2802000     -0.1580000E-01 0.4017000 
1 1 1 7  7  11 o 3.844000  0.2995000     3.764000  0.4318000     3.924000  0.4152000     -0.1602000     0.5990000 
1 1 1 7  7  12 o 6.215000  0.2562000     6.676000  0.3146000     5.754000  0.4045000     0.9216000      0.5124000 
1 1 1 7  7  13 o 2.667000  0.4719000     3.324000  0.5986000     2.009000  0.7297000     1.316000       0.9438000 
1 1 1 7  7  14 o 8.330000  0.2300000     8.287000  0.3266000     8.373000  0.3240000     -0.8626000E-01 0.4600000 
1 1 1 7  7  15 o 6.965000  0.3263000     7.246000  0.4421000     6.684000  0.4800000     0.5622000      0.6525000 
1 1 1 7  7  16 o 3.779000  0.5358000     2.824000  0.8518000     4.735000  0.6502000     -1.911000      1.072000  
1 1 1 7  7  17 o 12.85000  0.2342000     12.62000  0.3359000     13.09000  0.3265000     -0.4713000     0.4685000 
1 1 1 7  7  18 o 9.193000  0.2927000     9.402000  0.4123000     8.985000  0.4157000     0.4173000      0.5855000 
1 1 1 7  7  19 o 6.415000  0.4097000     6.230000  0.5923000     6.599000  0.5661000     -0.3698000     0.8193000 
1 1 1 7  7  20 o 2.939000  0.7474000     2.960000  1.052000      2.917000  1.062000      0.4258000E-01  1.495000  
1 1 1 7  7  21 o 2.045000  0.6223000     2.357000  0.9396000     1.734000  0.8162000     0.6230000      1.245000  
1 1 1 7  7  22 o 1.969000  0.5807000     2.391000  0.9083000     1.547000  0.7238000     0.8435000      1.161000  
1 1 1 7  7  23 o 2.431000  0.5930000     2.398000  0.8463000     2.464000  0.8309000     -0.6559000E-01 1.186000  
1 1 1 7  7  24 o 1.652000  0.5114000     1.480000  0.6864000     1.824000  0.7583000     -0.3438000     1.023000  
1 1 1 7  7  25 o 1.632000  0.5209000     1.421000  0.6758000     1.842000  0.7929000     -0.4214000     1.042000  
1 1 1 7  7  26 o 1.578000  0.4908000     1.834000  0.7555000     1.321000  0.6266000     0.5126000      0.9815000 
1 1 1 7  7  27 o 1.212000  0.4151000     1.193000  0.5811000     1.230000  0.5928000     -0.3754000E-01 0.8302000 
1 1 1 7  8  0  o 1.641000  0.2195000     1.641000  0.2195000     1.641000  0.2195000     -0.000000      0.000000  
1 1 1 7  8  1  o 25.42000  0.2008000     25.25000  0.2821000     25.58000  0.2858000     -0.3323000     0.4016000 
1 1 1 7  8  2  o 30.51000  0.2392000     30.96000  0.3428000     30.06000  0.3336000     0.8971000      0.4783000 
1 1 1 7  8  3  o 3.852000  0.9596000E-01 3.818000  0.1362000     3.886000  0.1353000     -0.6792000E-01 0.1919000 
1 1 1 7  8  4  o 5.339000  0.1326000     5.214000  0.1343000     5.464000  0.2287000     -0.2501000     0.2653000 
1 1 1 7  8  5  o 15.95000  0.1612000     15.89000  0.2245000     16.00000  0.2313000     -0.1189000     0.3223000 
1 1 1 7  8  6  o 10.53000  0.1571000     10.40000  0.1856000     10.65000  0.2534000     -0.2564000     0.3141000 
1 1 1 7  8  7  o 18.35000  0.1765000     18.44000  0.2657000     18.25000  0.2325000     0.1942000      0.3530000 
1 1 1 7  8  8  o 11.50000  0.1443000     11.57000  0.1691000     11.43000  0.2340000     0.1360000      0.2887000 
1 1 1 7  8  9  o 4.174000  0.2244000     3.934000  0.3350000     4.414000  0.2987000     -0.4793000     0.4488000 
1 1 1 7  8  10 o 5.661000  0.2383000     5.670000  0.3392000     5.652000  0.3349000     0.1819000E-01  0.4767000 
1 1 1 7  8  11 o 4.366000  0.2705000     4.338000  0.3811000     4.394000  0.3839000     -0.5616000E-01 0.5410000 
1 1 1 7  8  12 o 11.98000  0.1820000     11.62000  0.2591000     12.33000  0.2556000     -0.7059000     0.3640000 
1 1 1 7  8  13 o 1.786000  0.5052000     1.776000  0.7117000     1.796000  0.7173000     -0.2046000E-01 1.010000  
1 1 1 7  8  14 o 14.50000  0.1985000     14.62000  0.2815000     14.39000  0.2800000     0.2230000      0.3971000 
1 1 1 7  8  15 o 11.27000  0.2544000     11.43000  0.3593000     11.10000  0.3603000     0.3333000      0.5089000 
1 1 1 7  8  16 o 2.560000  0.5910000     2.279000  0.8439000     2.842000  0.8276000     -0.5635000     1.182000  
1 1 1 7  8  17 o 10.37000  0.2496000     10.01000  0.3595000     10.74000  0.3463000     -0.7388000     0.4991000 
1 1 1 7  8  18 o 4.971000  0.4627000     5.359000  0.5899000     4.583000  0.7131000     0.7756000      0.9255000 
1 1 1 7  8  19 o 10.42000  0.2871000     10.28000  0.4198000     10.57000  0.3919000     -0.2966000     0.5742000 
1 1 1 7  8  20 o 3.790000  0.7259000     3.985000  0.9781000     3.595000  1.073000      0.3895000      1.452000  
1 1 1 7  8  21 o 2.757000  0.6883000     2.776000  0.9605000     2.738000  0.9862000     0.3830000E-01  1.377000  
1 1 1 7  8  22 o 1.926000  0.5835000     1.976000  0.8410000     1.875000  0.8090000     0.1018000      1.167000  
1 1 1 7  8  23 o 3.053000  0.5700000     2.840000  0.8320000     3.265000  0.7792000     -0.4248000     1.140000  
1 1 1 7  8  24 f 1.381000  0.4508000     1.797000  0.7578000     0.9648000 0.4886000     0.8317000      0.9017000 
1 1 1 7  8  25 o 2.521000  0.5416000     3.187000  0.7462000     1.854000  0.7853000     1.333000       1.083000  
1 1 1 7  8  26 o 1.237000  0.4204000     1.297000  0.6171000     1.178000  0.5711000     0.1195000      0.8408000 
1 1 1 7  8  27 o 1.564000  0.4905000     1.564000  0.6934000     1.565000  0.6939000     -0.6145000E-03 0.9810000 
1 1 1 7  9  0  o 1.173000  0.3574000     1.173000  0.3574000     1.173000  0.3574000     -0.000000      0.000000  
1 1 1 7  9  1  o 13.05000  0.1151000     13.07000  0.1629000     13.02000  0.1628000     0.4795000E-01  0.2303000 
1 1 1 7  9  2  o 16.93000  0.1418000     17.00000  0.2013000     16.86000  0.1999000     0.1393000      0.2837000 
1 1 1 7  9  3  o 7.852000  0.1137000     8.022000  0.1858000     7.681000  0.1312000     0.3412000      0.2274000 
1 1 1 7  9  4  o 19.39000  0.2852000     19.75000  0.3301000     19.04000  0.4652000     0.7132000      0.5705000 
1 1 1 7  9  5  o 36.34000  0.3300000     36.63000  0.4691000     36.05000  0.4644000     0.5897000      0.6601000 
1 1 1 7  9  6  o 23.01000  0.2460000     22.78000  0.3772000     23.24000  0.3160000     -0.4572000     0.4921000 
1 1 1 7  9  7  o 9.336000  0.1299000     9.614000  0.1925000     9.059000  0.1745000     0.5548000      0.2598000 
1 1 1 7  9  8  o 8.515000  0.1293000     8.376000  0.1811000     8.654000  0.1846000     -0.2783000     0.2587000 
1 1 1 7  9  9  f 7.108000  0.1644000     7.023000  0.1811000     7.193000  0.2745000     -0.1697000     0.3289000 
1 1 1 7  9  10 o 6.354000  0.2232000     6.390000  0.3172000     6.318000  0.3141000     0.7178000E-01  0.4464000 
1 1 1 7  9  11 o 11.67000  0.1729000     11.48000  0.2446000     11.86000  0.2445000     -0.3776000     0.3459000 
1 1 1 7  9  12 o 4.524000  0.3043000     5.079000  0.3859000     3.969000  0.4705000     1.109000       0.6085000 
1 1 1 7  9  13 o 2.520000  0.5063000     2.363000  0.7208000     2.677000  0.7112000     -0.3136000     1.013000  
1 1 1 7  9  14 o 7.083000  0.2515000     7.300000  0.3468000     6.866000  0.3644000     0.4340000      0.5030000 
1 1 1 7  9  15 o 7.205000  0.3127000     7.365000  0.4367000     7.046000  0.4475000     0.3195000      0.6253000 
1 1 1 7  9  16 o 9.094000  0.2554000     9.239000  0.3597000     8.949000  0.3627000     0.2899000      0.5108000 
1 1 1 7  9  17 o 12.62000  0.2364000     12.71000  0.3322000     12.54000  0.3363000     0.1711000      0.4727000 
1 1 1 7  9  18 o 5.988000  0.4076000     5.564000  0.6129000     6.412000  0.5375000     -0.8483000     0.8152000 
1 1 1 7  9  19 o 5.234000  0.5174000     5.328000  0.7052000     5.140000  0.7573000     0.1878000      1.035000  
1 1 1 7  9  20 o 3.324000  0.7275000     2.658000  1.028000      3.990000  1.030000      -1.332000      1.455000  
1 1 1 7  9  21 o 3.127000  0.6499000     2.445000  0.9374000     3.808000  0.9004000     -1.362000      1.300000  
1 1 1 7  9  22 o 2.171000  0.5944000     1.902000  0.8152000     2.439000  0.8652000     -0.5372000     1.189000  
1 1 1 7  9  23 o 2.656000  0.5846000     2.374000  0.8394000     2.937000  0.8138000     -0.5630000     1.169000  
1 1 1 7  9  24 o 1.671000  0.5144000     1.613000  0.7149000     1.728000  0.7399000     -0.1147000     1.029000  
1 1 1 7  9  25 o 1.715000  0.5253000     1.457000  0.6842000     1.973000  0.7973000     -0.5165000     1.051000  
1 1 1 7  9  26 o 1.529000  0.4721000     1.919000  0.7626000     1.138000  0.5569000     0.7816000      0.9443000 
1 1 1 7  9  27 o 1.922000  0.5411000     2.048000  0.7901000     1.797000  0.7396000     0.2507000      1.082000  
1 1 1 7  10 0  o 19.84000  0.2292000     19.84000  0.2292000     19.84000  0.2292000     0.000000       0.000000  
1 1 1 7  10 1  o 25.81000  0.2052000     25.63000  0.2883000     25.99000  0.2920000     -0.3571000     0.4103000 
1 1 1 7  10 2  o 19.86000  0.1630000     19.89000  0.2308000     19.83000  0.2302000     0.6534000E-01  0.3259000 
1 1 1 7  10 3  o 33.92000  0.4342000     33.92000  0.4346000     33.92000  0.7519000     -0.2846000E-02 0.8685000 
1 1 1 7  10 4  o 17.63000  0.1956000     17.59000  0.3026000     17.67000  0.2480000     -0.7706000E-01 0.3912000 
1 1 1 7  10 5  o 36.54000  0.3323000     36.89000  0.4730000     36.19000  0.4667000     0.7061000      0.6645000 
1 1 1 7  10 6  o 26.78000  0.2518000     26.96000  0.3567000     26.59000  0.3554000     0.3673000      0.5035000 
1 1 1 7  10 7  o 21.99000  0.2038000     22.03000  0.3078000     21.95000  0.2673000     0.8573000E-01  0.4076000 
1 1 1 7  10 8  o 19.64000  0.1767000     19.26000  0.2462000     20.03000  0.2535000     -0.7639000     0.3534000 
1 1 1 7  10 9  o 12.76000  0.1647000     12.63000  0.2306000     12.89000  0.2354000     -0.2645000     0.3295000 
1 1 1 7  10 10 o 1.905000  0.5234000     1.831000  0.7143000     1.979000  0.7653000     -0.1473000     1.047000  
1 1 1 7  10 11 o 10.61000  0.1764000     10.74000  0.2502000     10.49000  0.2488000     0.2473000      0.3529000 
1 1 1 7  10 12 o 13.17000  0.1845000     13.35000  0.2628000     12.99000  0.2590000     0.3542000      0.3690000 
1 1 1 7  10 13 o 12.25000  0.1916000     12.17000  0.2722000     12.33000  0.2696000     -0.1563000     0.3831000 
1 1 1 7  10 14 o 4.459000  0.3739000     4.824000  0.4868000     4.094000  0.5676000     0.7300000      0.7478000 
1 1 1 7  10 15 o 12.86000  0.2365000     13.06000  0.3093000     12.66000  0.3577000     0.4052000      0.4729000 
1 1 1 7  10 16 o 6.719000  0.3194000     6.532000  0.4653000     6.906000  0.4378000     -0.3735000     0.6389000 
1 1 1 7  10 17 o 15.91000  0.2294000     15.92000  0.3253000     15.89000  0.3235000     0.2787000E-01  0.4587000 
1 1 1 7  10 18 o 8.160000  0.3172000     8.013000  0.4606000     8.307000  0.4362000     -0.2943000     0.6343000 
1 1 1 7  10 19 o 2.019000  0.5904000     1.307000  0.6518000     2.732000  0.9846000     -1.425000      1.181000  
1 1 1 7  10 20 o 5.100000  0.6096000     4.750000  0.9222000     5.449000  0.7975000     -0.6992000     1.219000  
1 1 1 7  10 21 o 2.290000  0.6501000     2.178000  0.9059000     2.403000  0.9326000     -0.2252000     1.300000  
1 1 1 7  10 22 f 3.419000  0.5713000     3.875000  0.7482000     2.963000  0.8634000     0.9116000      1.143000  
1 1 1 7  10 23 o 1.668000  0.5158000     1.612000  0.7231000     1.723000  0.7359000     -0.1108000     1.032000  
1 1 1 7  10 24 o 1.622000  0.5057000     1.676000  0.7256000     1.567000  0.7047000     0.1083000      1.011000  
1 1 1 7  10 25 o 1.511000  0.4954000     1.516000  0.7009000     1.507000  0.7004000     0.9214000E-02  0.9909000 
1 1 1 7  10 26 o 1.387000  0.4572000     1.399000  0.6496000     1.376000  0.6435000     0.2243000E-01  0.9143000 
1 1 1 7  10 27 o 1.501000  0.4756000     1.339000  0.6300000     1.663000  0.7127000     -0.3236000     0.9512000 
1 1 1 7  11 0  o 13.12000  0.1676000     13.12000  0.1676000     13.12000  0.1676000     0.000000       0.000000  
1 1 1 7  11 1  o 13.06000  0.1182000     13.15000  0.1680000     12.97000  0.1664000     0.1856000      0.2365000 
1 1 1 7  11 2  o 3.035000  0.1601000     3.251000  0.2284000     2.820000  0.2244000     0.4316000      0.3202000 
1 1 1 7  11 3  o 13.74000  0.1779000     14.02000  0.2536000     13.47000  0.2495000     0.5515000      0.3557000 
1 1 1 7  11 4  o 21.38000  0.1919000     21.22000  0.2486000     21.54000  0.2923000     -0.3255000     0.3837000 
1 1 1 7  11 5  o 10.14000  0.1507000     9.875000  0.1749000     10.41000  0.2454000     -0.5347000     0.3014000 
1 1 1 7  11 6  o 21.77000  0.2112000     21.51000  0.2938000     22.03000  0.3036000     -0.5217000     0.4225000 
1 1 1 7  11 7  o 11.81000  0.1341000     11.93000  0.2007000     11.70000  0.1780000     0.2278000      0.2683000 
1 1 1 7  11 8  o 6.615000  0.1368000     6.675000  0.1898000     6.555000  0.1971000     0.1198000      0.2736000 
1 1 1 7  11 9  o 7.950000  0.2456000     7.688000  0.2211000     8.212000  0.4386000     -0.5236000     0.4912000 
1 1 1 7  11 10 o 10.26000  0.2171000     10.20000  0.3387000     10.31000  0.2716000     -0.1110000     0.4342000 
1 1 1 7  11 11 o 7.895000  0.1637000     8.043000  0.2089000     7.747000  0.2520000     0.2963000      0.3274000 
1 1 1 7  11 12 o 2.972000  0.4447000     3.168000  0.6016000     2.775000  0.6552000     0.3930000      0.8895000 
1 1 1 7  11 13 o 16.26000  0.1969000     16.27000  0.2780000     16.25000  0.2789000     0.2184000E-01  0.3938000 
1 1 1 7  11 14 o 4.907000  0.3433000     4.482000  0.5286000     5.332000  0.4382000     -0.8496000     0.6866000 
1 1 1 7  11 15 o 12.90000  0.2458000     12.99000  0.3442000     12.82000  0.3511000     0.1782000      0.4917000 
1 1 1 7  11 16 o 9.551000  0.2526000     9.583000  0.3623000     9.519000  0.3521000     0.6385000E-01  0.5052000 
1 1 1 7  11 17 o 2.469000  0.6257000     2.283000  0.8738000     2.654000  0.8957000     -0.3701000     1.251000  
1 1 1 7  11 18 f 4.155000  0.5695000     4.354000  0.7616000     3.955000  0.8469000     0.3987000      1.139000  
1 1 1 7  11 19 o 5.821000  0.4514000     5.513000  0.6676000     6.130000  0.6078000     -0.6172000     0.9028000 
1 1 1 7  11 20 o 5.221000  0.5488000     5.225000  0.7164000     5.217000  0.8314000     0.8489000E-02  1.098000  
1 1 1 7  11 21 o 4.881000  0.4978000     5.192000  0.6455000     4.569000  0.7581000     0.6229000      0.9956000 
1 1 1 7  11 22 o 2.119000  0.5965000     2.151000  0.8527000     2.088000  0.8343000     0.6308000E-01  1.193000  
1 1 1 7  11 23 o 2.476000  0.5833000     2.390000  0.8215000     2.562000  0.8283000     -0.1725000     1.167000  
1 1 1 7  11 24 o 1.794000  0.5020000     2.351000  0.8075000     1.236000  0.5965000     1.116000       1.004000  
1 1 1 7  11 25 f 1.275000  0.4372000     1.255000  0.6111000     1.296000  0.6253000     -0.4048000E-01 0.8743000 
1 1 1 7  11 26 o 1.712000  0.5088000     1.962000  0.7686000     1.462000  0.6668000     0.5009000      1.018000  
1 1 1 7  11 27 o 1.258000  0.4252000     1.256000  0.6001000     1.260000  0.6025000     -0.4856000E-02 0.8504000 
1 1 1 7  12 0  o 10.49000  0.2121000     10.49000  0.2121000     10.49000  0.2121000     -0.000000      0.000000  
1 1 1 7  12 1  o 8.253000  0.1704000     8.396000  0.1950000     8.110000  0.2795000     0.2861000      0.3408000 
1 1 1 7  12 2  o 11.64000  0.2255000     11.64000  0.2255000     ?         ?             ?              ?         
1 1 1 7  12 3  o 27.08000  0.2344000     26.83000  0.3524000     27.33000  0.3093000     -0.5001000     0.4689000 
1 1 1 7  12 4  o 24.74000  0.2175000     25.02000  0.2876000     24.45000  0.3263000     0.5715000      0.4349000 
1 1 1 7  12 5  o 13.80000  0.1511000     13.63000  0.2086000     13.96000  0.2187000     -0.3351000     0.3022000 
1 1 1 7  12 6  o 28.38000  0.2654000     28.85000  0.3791000     27.90000  0.3715000     0.9542000      0.5307000 
1 1 1 7  12 7  f 4.690000  0.1371000     4.723000  0.2001000     4.658000  0.1876000     0.6517000E-01  0.2743000 
1 1 1 7  12 8  o 5.005000  0.2222000     4.849000  0.3847000     5.161000  0.2225000     -0.3128000     0.4444000 
1 1 1 7  12 9  o 16.55000  0.2087000     16.39000  0.2331000     16.70000  0.3463000     -0.3080000     0.4174000 
1 1 1 7  12 10 o 1.467000  0.3433000     0.8806000 0.4202000     2.054000  0.5430000     -1.173000      0.6866000 
1 1 1 7  12 11 o 4.766000  0.2140000     4.158000  0.3204000     5.375000  0.2838000     -1.217000      0.4280000 
1 1 1 7  12 12 o 7.816000  0.1815000     7.728000  0.2543000     7.904000  0.2590000     -0.1759000     0.3630000 
1 1 1 7  12 13 o 3.110000  0.4629000     3.377000  0.4434000     2.844000  0.8127000     0.5334000      0.9258000 
1 1 1 7  12 14 o 7.743000  0.2876000     8.016000  0.4037000     7.471000  0.4097000     0.5443000      0.5751000 
1 1 1 7  12 15 o 16.86000  0.2766000     16.75000  0.4273000     16.97000  0.3514000     -0.2259000     0.5533000 
1 1 1 7  12 16 o 12.76000  0.2281000     12.83000  0.3216000     12.68000  0.3235000     0.1473000      0.4562000 
1 1 1 7  12 17 o 4.027000  0.5394000     4.490000  0.7012000     3.563000  0.8198000     0.9275000      1.079000  
1 1 1 7  12 18 o 5.405000  0.4492000     6.055000  0.5613000     4.755000  0.7015000     1.300000       0.8984000 
1 1 1 7  12 19 o 3.876000  0.6402000     4.556000  0.8141000     3.196000  0.9883000     1.360000       1.280000  
1 1 1 7  12 20 o 4.977000  0.6287000     4.870000  0.9132000     5.083000  0.8643000     -0.2130000     1.257000  
1 1 1 7  12 21 o 2.416000  0.6623000     2.299000  0.9252000     2.533000  0.9481000     -0.2338000     1.325000  
1 1 1 7  12 22 f 4.260000  0.4901000     4.331000  0.6924000     4.190000  0.6936000     0.1406000      0.9801000 
1 1 1 7  12 23 o 2.161000  0.5457000     2.626000  0.8058000     1.696000  0.7360000     0.9307000      1.091000  
1 1 1 7  12 24 o 1.946000  0.5674000     1.794000  0.7685000     2.098000  0.8350000     -0.3041000     1.135000  
1 1 1 7  12 25 o 1.740000  0.5514000     1.882000  0.8344000     1.598000  0.7211000     0.2840000      1.103000  
1 1 1 7  12 26 o 2.193000  0.5482000     1.924000  0.7647000     2.463000  0.7858000     -0.5384000     1.096000  
1 1 1 7  12 27 o 1.520000  0.4769000     1.302000  0.6158000     1.738000  0.7283000     -0.4361000     0.9538000 
1 1 1 7  13 0  o 5.816000  0.1968000     5.816000  0.1968000     5.816000  0.1968000     0.000000       0.000000  
1 1 1 7  13 1  o 7.798000  0.1275000     7.723000  0.1958000     7.873000  0.1634000     -0.1495000     0.2550000 
1 1 1 7  13 2  o 15.83000  0.1503000     15.78000  0.2272000     15.88000  0.1968000     -0.9572000E-01 0.3006000 
1 1 1 7  13 3  o 21.94000  0.1812000     22.10000  0.2576000     21.79000  0.2550000     0.3058000      0.3625000 
1 1 1 7  13 4  o 16.86000  0.1612000     16.82000  0.2096000     16.90000  0.2449000     -0.8441000E-01 0.3224000 
1 1 1 7  13 5  o 18.15000  0.1833000     18.44000  0.2599000     17.86000  0.2585000     0.5781000      0.3665000 
1 1 1 7  13 6  o 12.13000  0.1453000     12.15000  0.2002000     12.12000  0.2106000     0.2942000E-01  0.2906000 
1 1 1 7  13 7  o 23.27000  0.2108000     22.85000  0.3131000     23.70000  0.2824000     -0.8515000     0.4216000 
1 1 1 7  13 8  f 7.224000  0.1263000     7.221000  0.1804000     7.227000  0.1768000     -0.5721000E-02 0.2526000 
1 1 1 7  13 9  o 1.627000  0.4006000     1.573000  0.5287000     1.682000  0.6021000     -0.1093000     0.8013000 
1 1 1 7  13 10 o 4.180000  0.2120000     4.300000  0.2916000     4.061000  0.3079000     0.2383000      0.4241000 
1 1 1 7  13 11 o 8.202000  0.1695000     8.262000  0.2396000     8.143000  0.2399000     0.1192000      0.3390000 
1 1 1 7  13 12 o 5.353000  0.2110000     5.355000  0.2920000     5.351000  0.3046000     0.4426000E-02  0.4220000 
1 1 1 7  13 13 o 16.82000  0.1891000     17.07000  0.2662000     16.58000  0.2687000     0.4917000      0.3783000 
1 1 1 7  13 14 o 15.24000  0.2467000     14.95000  0.2661000     15.53000  0.4156000     -0.5781000     0.4935000 
1 1 1 7  13 15 o 9.174000  0.3532000     9.183000  0.4786000     9.164000  0.5196000     0.1881000E-01  0.7064000 
1 1 1 7  13 16 o 5.838000  0.3583000     5.778000  0.5191000     5.897000  0.4941000     -0.1194000     0.7167000 
1 1 1 7  13 17 o 7.137000  0.3291000     7.140000  0.4673000     7.135000  0.4636000     0.4370000E-02  0.6583000 
1 1 1 7  13 18 f 6.296000  0.3870000     6.466000  0.5285000     6.126000  0.5654000     0.3398000      0.7739000 
1 1 1 7  13 19 o 10.25000  0.3233000     9.782000  0.4997000     10.72000  0.4103000     -0.9369000     0.6466000 
1 1 1 7  13 20 o 2.403000  0.6808000     2.948000  1.053000      1.857000  0.8635000     1.091000       1.362000  
1 1 1 7  13 21 o 1.708000  0.5524000     1.929000  0.8449000     1.488000  0.7119000     0.4414000      1.105000  
1 1 1 7  13 22 f 2.388000  0.6350000     2.321000  0.8965000     2.455000  0.8996000     -0.1339000     1.270000  
1 1 1 7  13 23 o 1.685000  0.5182000     1.600000  0.7141000     1.770000  0.7512000     -0.1703000     1.036000  
1 1 1 7  13 24 o 1.596000  0.5090000     1.666000  0.7379000     1.527000  0.7013000     0.1395000      1.018000  
1 1 1 7  13 25 o 1.906000  0.5841000     1.907000  0.8382000     1.905000  0.8138000     0.1735000E-02  1.168000  
1 1 1 7  13 26 o 1.327000  0.4428000     1.185000  0.5765000     1.468000  0.6724000     -0.2828000     0.8857000 
1 1 1 7  13 27 o 1.285000  0.4346000     1.279000  0.6090000     1.291000  0.6201000     -0.1215000E-01 0.8692000 
1 1 1 7  14 0  o 7.389000  0.1411000     7.389000  0.1411000     7.389000  0.1411000     -0.000000      0.000000  
1 1 1 7  14 1  o 19.11000  0.1611000     19.41000  0.2306000     18.80000  0.2250000     0.6042000      0.3222000 
1 1 1 7  14 2  o 14.23000  0.1302000     14.13000  0.1834000     14.32000  0.1849000     -0.1915000     0.2604000 
1 1 1 7  14 3  o 21.39000  0.1782000     21.69000  0.2548000     21.10000  0.2494000     0.5893000      0.3565000 
1 1 1 7  14 4  o 22.54000  0.2023000     22.87000  0.2678000     22.21000  0.3034000     0.6549000      0.4046000 
1 1 1 7  14 5  o 20.82000  0.2039000     20.76000  0.2857000     20.88000  0.2909000     -0.1147000     0.4077000 
1 1 1 7  14 6  o 2.593000  0.2215000     2.663000  0.2837000     2.524000  0.3403000     0.1392000      0.4431000 
1 1 1 7  14 7  o 10.16000  0.1322000     10.26000  0.1980000     10.05000  0.1751000     0.2060000      0.2643000 
1 1 1 7  14 8  o 5.215000  0.1742000     5.279000  0.2845000     5.150000  0.2011000     0.1287000      0.3484000 
1 1 1 7  14 9  o 13.46000  0.2643000     13.19000  0.4650000     13.74000  0.2514000     -0.5425000     0.5286000 
1 1 1 7  14 10 o 5.824000  0.1793000     6.019000  0.2390000     5.630000  0.2673000     0.3893000      0.3585000 
1 1 1 7  14 11 o 11.81000  0.1745000     11.87000  0.2602000     11.74000  0.2326000     0.1361000      0.3490000 
1 1 1 7  14 12 o 11.71000  0.1698000     12.14000  0.2419000     11.27000  0.2385000     0.8753000      0.3396000 
1 1 1 7  14 13 o 21.33000  0.2273000     21.31000  0.3409000     21.35000  0.3007000     -0.4694000E-01 0.4546000 
1 1 1 7  14 14 o 15.96000  0.3268000     15.50000  0.3034000     16.41000  0.5789000     -0.9095000     0.6535000 
1 1 1 7  14 15 o 4.617000  0.5146000     4.457000  0.9183000     4.777000  0.4646000     -0.3194000     1.029000  
1 1 1 7  14 16 f 5.788000  0.3458000     5.811000  0.3803000     5.764000  0.5776000     0.4678000E-01  0.6915000 
1 1 1 7  14 17 f 4.077000  0.5442000     3.924000  0.8011000     4.230000  0.7369000     -0.3060000     1.088000  
1 1 1 7  14 18 o 4.259000  0.5663000     4.258000  0.8013000     4.260000  0.8004000     -0.1325000E-02 1.133000  
1 1 1 7  14 19 o 2.467000  0.7084000     2.258000  0.9813000     2.675000  1.022000      -0.4169000     1.417000  
1 1 1 7  14 20 o 3.354000  0.8130000     2.942000  1.135000      3.766000  1.165000      -0.8237000     1.626000  
1 1 1 7  14 21 o 2.382000  0.6460000     2.231000  0.8973000     2.532000  0.9296000     -0.3014000     1.292000  
1 1 1 7  14 22 o 1.567000  0.5157000     1.734000  0.7807000     1.401000  0.6741000     0.3330000      1.031000  
1 1 1 7  14 23 f 2.195000  0.5470000     2.718000  0.8147000     1.671000  0.7302000     1.046000       1.094000  
1 1 1 7  14 24 o 1.669000  0.5128000     2.025000  0.8097000     1.314000  0.6296000     0.7105000      1.026000  
1 1 1 7  14 25 o 1.915000  0.5423000     1.311000  0.6331000     2.519000  0.8808000     -1.209000      1.085000  
1 1 1 7  14 26 o 1.368000  0.4497000     1.368000  0.6358000     1.369000  0.6362000     -0.1177000E-02 0.8995000 
1 1 1 7  14 27 o 1.355000  0.4656000     1.194000  0.5956000     1.516000  0.7158000     -0.3220000     0.9312000 
1 1 1 7  15 0  o 7.388000  0.1453000     7.388000  0.1453000     7.388000  0.1453000     0.000000       0.000000  
1 1 1 7  15 1  o 28.20000  0.2261000     28.26000  0.3203000     28.14000  0.3191000     0.1155000      0.4521000 
1 1 1 7  15 2  o 6.957000  0.1043000     7.040000  0.1474000     6.874000  0.1475000     0.1654000      0.2086000 
1 1 1 7  15 3  o 20.97000  0.1760000     20.97000  0.2487000     20.98000  0.2491000     -0.1655000E-01 0.3520000 
1 1 1 7  15 4  o 7.042000  0.1199000     7.097000  0.1564000     6.988000  0.1817000     0.1084000      0.2398000 
1 1 1 7  15 5  o 24.19000  0.2315000     24.37000  0.3276000     24.01000  0.3271000     0.3613000      0.4630000 
1 1 1 7  15 6  o 18.61000  0.2137000     18.29000  0.2633000     18.92000  0.3366000     -0.6211000     0.4273000 
1 1 1 7  15 7  o 6.276000  0.1325000     6.324000  0.1950000     6.228000  0.1794000     0.9589000E-01  0.2650000 
1 1 1 7  15 8  o 13.31000  0.1989000     13.57000  0.2858000     13.05000  0.2766000     0.5234000      0.3977000 
1 1 1 7  15 9  o 6.308000  0.1781000     6.276000  0.2947000     6.340000  0.2000000     -0.6350000E-01 0.3562000 
1 1 1 7  15 10 o 10.31000  0.1575000     10.03000  0.2215000     10.59000  0.2239000     -0.5630000     0.3150000 
1 1 1 7  15 11 o 10.64000  0.1651000     10.73000  0.2337000     10.55000  0.2333000     0.1746000      0.3302000 
1 1 1 7  15 12 o 5.234000  0.2339000     5.316000  0.3232000     5.152000  0.3381000     0.1637000      0.4678000 
1 1 1 7  15 13 o 20.25000  0.2054000     20.54000  0.2921000     19.96000  0.2888000     0.5845000      0.4108000 
1 1 1 7  15 14 o 9.277000  0.2847000     9.175000  0.2793000     9.378000  0.4962000     -0.2031000     0.5694000 
1 1 1 7  15 15 o 7.637000  0.2887000     7.883000  0.4641000     7.391000  0.3434000     0.4919000      0.5773000 
1 1 1 7  15 16 o 7.218000  0.2561000     7.481000  0.3550000     6.954000  0.3693000     0.5264000      0.5123000 
1 1 1 7  15 17 o 4.046000  0.5277000     4.342000  0.5474000     3.750000  0.9022000     0.5916000      1.055000  
1 1 1 7  15 18 o 3.927000  0.5711000     3.332000  0.7042000     4.521000  0.8993000     -1.189000      1.142000  
1 1 1 7  15 19 o 2.311000  0.6882000     2.179000  0.9523000     2.442000  0.9937000     -0.2634000     1.376000  
1 1 1 7  15 20 o 4.645000  0.6629000     4.492000  1.004000      4.798000  0.8663000     -0.3062000     1.326000  
1 1 1 7  15 21 o 3.739000  0.6075000     4.066000  0.8190000     3.413000  0.8976000     0.6537000      1.215000  
1 1 1 7  15 22 o 2.131000  0.5970000     1.857000  0.8117000     2.404000  0.8757000     -0.5471000     1.194000  
1 1 1 7  15 23 o 2.398000  0.5438000     2.973000  0.7821000     1.824000  0.7558000     1.150000       1.088000  
1 1 1 7  15 24 o 1.852000  0.5763000     1.580000  0.7457000     2.124000  0.8790000     -0.5444000     1.153000  
1 1 1 7  15 25 o 1.899000  0.5692000     1.889000  0.8005000     1.910000  0.8096000     -0.2133000E-01 1.138000  
1 1 1 7  15 26 o 1.745000  0.5083000     1.493000  0.6706000     1.996000  0.7640000     -0.5022000     1.017000  
1 1 1 7  16 0  o 7.226000  0.1484000     7.226000  0.1484000     7.226000  0.1484000     -0.000000      0.000000  
1 1 1 7  16 1  o 11.82000  0.1199000     11.85000  0.1700000     11.79000  0.1690000     0.5536000E-01  0.2397000 
1 1 1 7  16 2  o 11.68000  0.1199000     11.50000  0.1683000     11.86000  0.1707000     -0.3549000     0.2397000 
1 1 1 7  16 3  o 22.39000  0.1864000     22.39000  0.2635000     22.40000  0.2638000     -0.2943000E-02 0.3728000 
1 1 1 7  16 4  o 7.551000  0.1218000     7.562000  0.1584000     7.541000  0.1852000     0.2121000E-01  0.2437000 
1 1 1 7  16 5  o 6.563000  0.1351000     6.612000  0.1833000     6.513000  0.1985000     0.9848000E-01  0.2702000 
1 1 1 7  16 6  o 10.78000  0.1439000     10.75000  0.1990000     10.81000  0.2079000     -0.5871000E-01 0.2877000 
1 1 1 7  16 7  o 14.20000  0.1540000     14.49000  0.2328000     13.91000  0.2015000     0.5748000      0.3079000 
1 1 1 7  16 8  o 7.894000  0.1858000     7.883000  0.1874000     7.905000  0.3208000     -0.2235000E-01 0.3716000 
1 1 1 7  16 9  o 7.948000  0.1384000     7.858000  0.1953000     8.038000  0.1961000     -0.1803000     0.2767000 
1 1 1 7  16 10 o 4.671000  0.1762000     4.768000  0.2482000     4.575000  0.2503000     0.1930000      0.3525000 
1 1 1 7  16 11 o 9.239000  0.1679000     9.572000  0.2350000     8.907000  0.2398000     0.6646000      0.3358000 
1 1 1 7  16 12 o 9.673000  0.1779000     9.757000  0.2500000     9.589000  0.2531000     0.1682000      0.3557000 
1 1 1 7  16 13 o 5.543000  0.2396000     5.796000  0.3259000     5.290000  0.3514000     0.5067000      0.4792000 
1 1 1 7  16 14 o 9.014000  0.4157000     9.139000  0.2811000     8.889000  0.7825000     0.2500000      0.8315000 
1 1 1 7  16 15 o 6.271000  0.2680000     6.396000  0.3666000     6.145000  0.3910000     0.2512000      0.5360000 
1 1 1 7  16 16 o 6.346000  0.2827000     6.667000  0.3862000     6.024000  0.4128000     0.6433000      0.5653000 
1 1 1 7  16 17 o 4.104000  0.4366000     4.249000  0.5892000     3.959000  0.6444000     0.2895000      0.8732000 
1 1 1 7  16 18 o 2.204000  0.5788000     2.499000  0.8479000     1.909000  0.7881000     0.5896000      1.158000  
1 1 1 7  16 19 o 2.640000  0.7482000     2.577000  0.9014000     2.703000  1.194000      -0.1264000     1.496000  
1 1 1 7  16 20 o 3.937000  0.6997000     4.598000  0.9261000     3.276000  1.049000      1.322000       1.399000  
1 1 1 7  16 21 o 3.485000  0.6008000     4.207000  0.7547000     2.763000  0.9351000     1.444000       1.202000  
1 1 1 7  16 22 o 1.783000  0.5422000     2.041000  0.8226000     1.525000  0.7066000     0.5160000      1.084000  
1 1 1 7  16 23 o 1.595000  0.4877000     1.276000  0.6109000     1.914000  0.7602000     -0.6382000     0.9753000 
1 1 1 7  16 24 o 1.766000  0.5506000     1.961000  0.8209000     1.571000  0.7341000     0.3899000      1.101000  
1 1 1 7  16 25 o 1.580000  0.5052000     1.355000  0.6358000     1.805000  0.7852000     -0.4501000     1.010000  
1 1 1 7  16 26 o 1.469000  0.4581000     1.057000  0.5240000     1.881000  0.7515000     -0.8243000     0.9161000 
1 1 1 7  17 0  o 10.41000  0.1618000     10.41000  0.1618000     10.41000  0.1618000     0.000000       0.000000  
1 1 1 7  17 1  o 6.524000  0.1083000     6.728000  0.1524000     6.320000  0.1540000     0.4079000      0.2166000 
1 1 1 7  17 2  o 18.82000  0.1625000     18.77000  0.2292000     18.86000  0.2303000     -0.8861000E-01 0.3249000 
1 1 1 7  17 3  o 11.39000  0.1206000     11.30000  0.1695000     11.48000  0.1717000     -0.1786000     0.2412000 
1 1 1 7  17 4  o 19.92000  0.1850000     20.20000  0.2451000     19.63000  0.2773000     0.5730000      0.3701000 
1 1 1 7  17 5  o 15.74000  0.1606000     16.08000  0.2140000     15.40000  0.2396000     0.6862000      0.3212000 
1 1 1 7  17 6  o 10.41000  0.1355000     10.71000  0.2023000     10.12000  0.1802000     0.5915000      0.2709000 
1 1 1 7  17 7  o 5.366000  0.1741000     5.172000  0.2874000     5.560000  0.1964000     -0.3882000     0.3481000 
1 1 1 7  17 8  o 9.347000  0.2567000     9.936000  0.2149000     8.758000  0.4662000     1.179000       0.5134000 
1 1 1 7  17 9  o 1.194000  0.3330000     1.420000  0.4998000     0.9679000 0.4403000     0.4517000      0.6661000 
1 1 1 7  17 10 o 5.318000  0.1741000     5.544000  0.2450000     5.093000  0.2475000     0.4514000      0.3483000 
1 1 1 7  17 11 f 12.67000  0.1793000     12.85000  0.2689000     12.49000  0.2373000     0.3632000      0.3587000 
1 1 1 7  17 12 o 12.31000  0.1756000     12.19000  0.2459000     12.42000  0.2507000     -0.2299000     0.3512000 
1 1 1 7  17 13 o 11.81000  0.1835000     12.04000  0.2572000     11.59000  0.2619000     0.4418000      0.3671000 
1 1 1 7  17 14 o 4.420000  0.3657000     4.912000  0.4409000     3.927000  0.5837000     0.9854000      0.7315000 
1 1 1 7  17 15 o 2.308000  0.5321000     2.001000  0.7455000     2.616000  0.7595000     -0.6150000     1.064000  
1 1 1 7  17 16 o 2.724000  0.4591000     3.784000  0.5850000     1.663000  0.7078000     2.121000       0.9182000 
1 1 1 7  17 17 o 9.572000  0.2430000     9.770000  0.3379000     9.375000  0.3494000     0.3944000      0.4861000 
1 1 1 7  17 18 o 6.354000  0.3302000     6.696000  0.4656000     6.013000  0.4685000     0.6835000      0.6605000 
1 1 1 7  17 19 o 4.438000  0.6574000     4.621000  0.6129000     4.255000  1.163000      0.3661000      1.315000  
1 1 1 7  17 20 o 2.275000  0.5897000     2.351000  0.8376000     2.200000  0.8302000     0.1511000      1.179000  
1 1 1 7  17 21 o 1.953000  0.4991000     1.198000  0.5798000     2.708000  0.8125000     -1.510000      0.9981000 
1 1 1 7  17 22 o 2.106000  0.5809000     1.748000  0.7077000     2.465000  0.9214000     -0.7174000     1.162000  
1 1 1 7  17 23 o 1.982000  0.5443000     1.752000  0.7444000     2.212000  0.7944000     -0.4603000     1.089000  
1 1 1 7  17 24 o 1.410000  0.4717000     1.497000  0.7018000     1.322000  0.6304000     0.1744000      0.9433000 
1 1 1 7  17 25 o 1.339000  0.4392000     1.542000  0.6813000     1.137000  0.5545000     0.4053000      0.8785000 
1 1 1 7  17 26 o 1.442000  0.4651000     1.363000  0.6374000     1.520000  0.6776000     -0.1564000     0.9303000 
1 1 1 7  18 0  o 15.39000  0.1995000     15.39000  0.1995000     15.39000  0.1995000     -0.000000      0.000000  
1 1 1 7  18 1  o 11.66000  0.1214000     11.59000  0.1713000     11.74000  0.1722000     -0.1541000     0.2429000 
1 1 1 7  18 2  o 14.44000  0.1361000     14.47000  0.1925000     14.41000  0.1923000     0.5301000E-01  0.2721000 
1 1 1 7  18 3  o 9.477000  0.1157000     9.544000  0.1626000     9.411000  0.1648000     0.1325000      0.2315000 
1 1 1 7  18 4  o 9.670000  0.1291000     9.436000  0.1673000     9.903000  0.1966000     -0.4666000     0.2581000 
1 1 1 7  18 5  o 2.956000  0.2067000     3.098000  0.2594000     2.813000  0.3219000     0.2850000      0.4134000 
1 1 1 7  18 6  o 1.146000  0.2864000     1.614000  0.4647000     0.6780000 0.3348000     0.9359000      0.5727000 
1 1 1 7  18 7  o 12.54000  0.1958000     12.34000  0.2795000     12.73000  0.2743000     -0.3894000     0.3916000 
1 1 1 7  18 8  o 10.25000  0.1689000     10.24000  0.2778000     10.27000  0.1923000     -0.2069000E-01 0.3378000 
1 1 1 7  18 9  o 4.136000  0.1896000     3.975000  0.2750000     4.297000  0.2610000     -0.3217000     0.3792000 
1 1 1 7  18 10 o 7.046000  0.1563000     7.456000  0.2156000     6.636000  0.2264000     0.8198000      0.3127000 
1 1 1 7  18 11 o 7.493000  0.1607000     7.175000  0.2297000     7.810000  0.2250000     -0.6358000     0.3215000 
1 1 1 7  18 12 o 13.22000  0.1768000     12.94000  0.2466000     13.51000  0.2534000     -0.5685000     0.3536000 
1 1 1 7  18 13 o 9.407000  0.2095000     9.544000  0.2919000     9.271000  0.3005000     0.2735000      0.4189000 
1 1 1 7  18 14 o 12.68000  0.3385000     12.79000  0.6012000     12.56000  0.3113000     0.2214000      0.6770000 
1 1 1 7  18 15 o 4.757000  0.3376000     4.678000  0.4795000     4.837000  0.4754000     -0.1591000     0.6752000 
1 1 1 7  18 16 o 8.366000  0.2382000     8.276000  0.3329000     8.456000  0.3408000     -0.1794000     0.4764000 
1 1 1 7  18 17 o 2.149000  0.5536000     1.706000  0.7407000     2.593000  0.8229000     -0.8879000     1.107000  
1 1 1 7  18 18 o 1.784000  0.5339000     2.201000  0.8418000     1.366000  0.6570000     0.8352000      1.068000  
1 1 1 7  18 19 o 2.843000  0.6614000     2.710000  0.8665000     2.977000  0.9994000     -0.2661000     1.323000  
1 1 1 7  18 20 o 2.795000  0.5597000     2.252000  0.8157000     3.338000  0.7666000     -1.085000      1.119000  
1 1 1 7  18 21 o 3.272000  0.5345000     3.542000  0.7254000     3.003000  0.7851000     0.5394000      1.069000  
1 1 1 7  18 22 o 3.063000  0.5155000     3.450000  0.6705000     2.676000  0.7832000     0.7734000      1.031000  
1 1 1 7  18 23 o 1.844000  0.4902000     2.355000  0.7584000     1.332000  0.6213000     1.023000       0.9804000 
1 1 1 7  18 24 o 1.532000  0.5005000     1.564000  0.6664000     1.499000  0.7468000     0.6544000E-01  1.001000  
1 1 1 7  18 25 o 2.244000  0.5534000     1.951000  0.6931000     2.537000  0.8630000     -0.5859000     1.107000  
1 1 1 7  18 26 o 1.649000  0.4874000     1.263000  0.6020000     2.035000  0.7666000     -0.7717000     0.9748000 
1 1 1 7  19 0  o 2.716000  0.2514000     2.716000  0.2514000     2.716000  0.2514000     0.000000       0.000000  
1 1 1 7  19 1  o 9.073000  0.1136000     8.941000  0.1600000     9.204000  0.1612000     -0.2625000     0.2271000 
1 1 1 7  19 2  o 11.07000  0.1208000     10.89000  0.1699000     11.25000  0.1718000     -0.3627000     0.2416000 
1 1 1 7  19 3  o 4.121000  0.1395000     4.145000  0.1923000     4.097000  0.2020000     0.4809000E-01  0.2789000 
1 1 1 7  19 4  o 9.332000  0.1306000     9.416000  0.1705000     9.249000  0.1979000     0.1669000      0.2613000 
1 1 1 7  19 5  o 14.93000  0.1580000     14.95000  0.2069000     14.90000  0.2389000     0.4937000E-01  0.3161000 
1 1 1 7  19 6  o 8.861000  0.1571000     8.810000  0.2545000     8.912000  0.1843000     -0.1021000     0.3143000 
1 1 1 7  19 7  o 6.753000  0.2172000     6.973000  0.2134000     6.533000  0.3783000     0.4405000      0.4344000 
1 1 1 7  19 8  o 12.17000  0.1524000     12.17000  0.2264000     12.18000  0.2042000     -0.1423000E-01 0.3049000 
1 1 1 7  19 9  o 6.150000  0.1562000     5.968000  0.2181000     6.332000  0.2236000     -0.3639000     0.3123000 
1 1 1 7  19 10 o 7.281000  0.1539000     7.296000  0.2171000     7.267000  0.2181000     0.2945000E-01  0.3077000 
1 1 1 7  19 11 f 11.83000  0.1569000     11.96000  0.2217000     11.69000  0.2222000     0.2658000      0.3139000 
1 1 1 7  19 12 o 9.779000  0.1773000     9.770000  0.2812000     9.787000  0.2161000     -0.1721000E-01 0.3546000 
1 1 1 7  19 13 o 8.650000  0.3404000     8.265000  0.3155000     9.036000  0.6033000     -0.7714000     0.6808000 
1 1 1 7  19 14 o 8.516000  0.3117000     8.186000  0.5461000     8.847000  0.3008000     -0.6604000     0.6235000 
1 1 1 7  19 15 o 1.702000  0.5070000     1.836000  0.7406000     1.567000  0.6926000     0.2684000      1.014000  
1 1 1 7  19 16 o 5.023000  0.3529000     5.089000  0.4903000     4.957000  0.5075000     0.1324000      0.7057000 
1 1 1 7  19 17 o 4.016000  0.4852000     4.141000  0.6615000     3.890000  0.7099000     0.2507000      0.9704000 
1 1 1 7  19 18 o 7.282000  0.2998000     7.305000  0.4204000     7.258000  0.4274000     0.4738000E-01  0.5996000 
1 1 1 7  19 19 o 2.477000  0.7003000     2.453000  0.8645000     2.502000  1.102000      -0.4877000E-01 1.401000  
1 1 1 7  19 20 o 4.305000  0.4456000     3.937000  0.6917000     4.674000  0.5619000     -0.7375000     0.8912000 
1 1 1 7  19 21 o 2.435000  0.5739000     2.354000  0.8273000     2.516000  0.7957000     -0.1618000     1.148000  
1 1 1 7  19 22 o 1.753000  0.5004000     1.339000  0.6218000     2.166000  0.7842000     -0.8274000     1.001000  
1 1 1 7  19 23 o 1.380000  0.4442000     1.584000  0.6836000     1.177000  0.5674000     0.4072000      0.8884000 
1 1 1 7  19 24 o 2.155000  0.5539000     2.170000  0.7812000     2.139000  0.7856000     0.3057000E-01  1.108000  
1 1 1 7  19 25 o 2.049000  0.5180000     2.264000  0.7388000     1.835000  0.7263000     0.4284000      1.036000  
1 1 1 7  19 26 o 1.370000  0.4405000     1.523000  0.6659000     1.217000  0.5767000     0.3064000      0.8809000 
1 1 1 7  20 0  o 13.62000  0.1892000     13.62000  0.1892000     13.62000  0.1892000     0.000000       0.000000  
1 1 1 7  20 1  o 4.644000  0.1301000     4.701000  0.1815000     4.586000  0.1863000     0.1151000      0.2601000 
1 1 1 7  20 2  o 12.29000  0.1283000     12.23000  0.1812000     12.34000  0.1817000     -0.1104000     0.2567000 
1 1 1 7  20 3  o 5.492000  0.1269000     5.548000  0.1779000     5.437000  0.1810000     0.1102000      0.2538000 
1 1 1 7  20 4  o 10.97000  0.1370000     11.19000  0.1798000     10.74000  0.2068000     0.4501000      0.2740000 
1 1 1 7  20 5  o 8.319000  0.1615000     8.496000  0.1786000     8.142000  0.2692000     0.3541000      0.3230000 
1 1 1 7  20 6  o 5.633000  0.2003000     6.106000  0.2730000     5.160000  0.2931000     0.9464000      0.4005000 
1 1 1 7  20 7  o 1.158000  0.3525000     1.124000  0.5166000     1.191000  0.4797000     -0.6731000E-01 0.7050000 
1 1 1 7  20 8  o 5.330000  0.1671000     5.011000  0.2498000     5.649000  0.2220000     -0.6378000     0.3342000 
1 1 1 7  20 9  o 6.400000  0.1560000     6.447000  0.2188000     6.354000  0.2224000     0.9277000E-01  0.3120000 
1 1 1 7  20 10 o 6.277000  0.1672000     5.923000  0.2376000     6.630000  0.2354000     -0.7067000     0.3345000 
1 1 1 7  20 11 o 13.32000  0.1780000     13.50000  0.2750000     13.14000  0.2260000     0.3564000      0.3559000 
1 1 1 7  20 12 o 21.59000  0.2046000     21.02000  0.2833000     22.15000  0.2952000     -1.130000      0.4091000 
1 1 1 7  20 13 o 6.972000  0.3176000     6.714000  0.3164000     7.231000  0.5508000     -0.5178000     0.6352000 
1 1 1 7  20 14 o 5.155000  0.2942000     5.162000  0.4062000     5.147000  0.4257000     0.1560000E-01  0.5884000 
1 1 1 7  20 15 o 7.293000  0.2488000     6.937000  0.3531000     7.649000  0.3507000     -0.7118000     0.4976000 
1 1 1 7  20 16 o 2.422000  0.5519000     2.912000  0.7866000     1.931000  0.7745000     0.9811000      1.104000  
1 1 1 7  20 17 o 5.586000  0.3606000     5.865000  0.4650000     5.308000  0.5514000     0.5571000      0.7213000 
1 1 1 7  20 18 o 2.221000  0.6092000     2.553000  0.9044000     1.888000  0.8164000     0.6654000      1.218000  
1 1 1 7  20 19 o 2.050000  0.6809000     2.473000  1.134000      1.627000  0.7532000     0.8464000      1.362000  
1 1 1 7  20 20 o 4.753000  0.3958000     5.099000  0.5317000     4.406000  0.5865000     0.6937000      0.7916000 
1 1 1 7  20 21 o 3.069000  0.5380000     3.206000  0.7534000     2.932000  0.7681000     0.2739000      1.076000  
1 1 1 7  20 22 o 1.408000  0.4553000     1.286000  0.6040000     1.529000  0.6815000     -0.2430000     0.9106000 
1 1 1 7  20 23 o 3.401000  0.4674000     3.829000  0.5804000     2.973000  0.7327000     0.8555000      0.9348000 
1 1 1 7  20 24 o 1.565000  0.4780000     1.203000  0.5838000     1.927000  0.7571000     -0.7245000     0.9560000 
1 1 1 7  20 25 o 1.254000  0.4166000     1.072000  0.5261000     1.436000  0.6460000     -0.3633000     0.8331000 
1 1 1 7  20 26 o 1.240000  0.4140000     1.292000  0.6014000     1.188000  0.5692000     0.1045000      0.8280000 
1 1 1 7  21 0  o 6.657000  0.1685000     6.657000  0.1685000     6.657000  0.1685000     -0.000000      0.000000  
1 1 1 7  21 1  o 13.40000  0.1349000     13.25000  0.1896000     13.56000  0.1921000     -0.3054000     0.2699000 
1 1 1 7  21 2  o 25.21000  0.2095000     25.45000  0.2987000     24.97000  0.2937000     0.4782000      0.4189000 
1 1 1 7  21 3  o 8.477000  0.1211000     8.514000  0.1700000     8.440000  0.1726000     0.7322000E-01  0.2422000 
1 1 1 7  21 4  o 4.049000  0.1708000     3.994000  0.2189000     4.105000  0.2624000     -0.1114000     0.3417000 
1 1 1 7  21 5  o 3.566000  0.2358000     3.624000  0.3651000     3.508000  0.2984000     0.1153000      0.4716000 
1 1 1 7  21 6  o 6.320000  0.2404000     6.403000  0.2447000     6.236000  0.4139000     0.1672000      0.4808000 
1 1 1 7  21 7  o 6.241000  0.1562000     6.214000  0.2314000     6.268000  0.2100000     -0.5377000E-01 0.3125000 
1 1 1 7  21 8  o 9.481000  0.1495000     9.351000  0.2211000     9.610000  0.2013000     -0.2593000     0.2990000 
1 1 1 7  21 9  o 9.396000  0.1463000     9.246000  0.2077000     9.545000  0.2062000     -0.2993000     0.2927000 
1 1 1 7  21 10 o 7.005000  0.1612000     6.682000  0.2340000     7.328000  0.2217000     -0.6464000     0.3223000 
1 1 1 7  21 11 o 15.36000  0.1695000     15.35000  0.2385000     15.37000  0.2408000     -0.1832000E-01 0.3390000 
1 1 1 7  21 12 o 13.99000  0.2052000     13.93000  0.2911000     14.04000  0.2893000     -0.1112000     0.4104000 
1 1 1 7  21 13 o 1.366000  0.4411000     1.144000  0.5465000     1.588000  0.6927000     -0.4436000     0.8823000 
1 1 1 7  21 14 o 4.202000  0.3566000     4.226000  0.4912000     4.179000  0.5172000     0.4685000E-01  0.7133000 
1 1 1 7  21 15 o 3.049000  0.4984000     3.238000  0.6766000     2.859000  0.7319000     0.3791000      0.9968000 
1 1 1 7  21 16 o 3.712000  0.4752000     3.741000  0.6582000     3.684000  0.6855000     0.5760000E-01  0.9504000 
1 1 1 7  21 17 f 2.597000  0.5956000     2.902000  0.8349000     2.293000  0.8497000     0.6096000      1.191000  
1 1 1 7  21 18 o 8.069000  0.3199000     8.179000  0.4407000     7.959000  0.4639000     0.2208000      0.6399000 
1 1 1 7  21 19 o 6.994000  0.5943000     6.976000  1.104000      7.012000  0.4410000     -0.3538000E-01 1.189000  
1 1 1 7  21 20 o 2.824000  0.5879000     2.933000  0.8377000     2.716000  0.8250000     0.2164000      1.176000  
1 1 1 7  21 21 o 1.753000  0.5273000     1.713000  0.7330000     1.792000  0.7583000     -0.7973000E-01 1.055000  
1 1 1 7  21 22 o 2.925000  0.5075000     2.479000  0.7594000     3.372000  0.6735000     -0.8928000     1.015000  
1 1 1 7  21 23 o 3.097000  0.5256000     3.375000  0.7019000     2.820000  0.7825000     0.5548000      1.051000  
1 1 1 7  21 24 o 1.746000  0.5487000     1.700000  0.8334000     1.792000  0.7140000     -0.9191000E-01 1.097000  
1 1 1 7  21 25 o 1.201000  0.4034000     1.162000  0.5572000     1.239000  0.5834000     -0.7718000E-01 0.8068000 
1 1 1 7  21 26 o 1.102000  0.3788000     1.197000  0.5697000     1.007000  0.4994000     0.1899000      0.7576000 
1 1 1 7  22 0  o 5.418000  0.1850000     5.418000  0.1850000     5.418000  0.1850000     -0.000000      0.000000  
1 1 1 7  22 1  o 21.66000  0.1861000     21.66000  0.2630000     21.66000  0.2634000     -0.1163000E-02 0.3722000 
1 1 1 7  22 2  o 10.16000  0.1246000     9.989000  0.1760000     10.33000  0.1765000     -0.3425000     0.2493000 
1 1 1 7  22 3  o 6.088000  0.1296000     5.908000  0.1846000     6.268000  0.1820000     -0.3603000     0.2592000 
1 1 1 7  22 4  o 2.502000  0.3109000     2.859000  0.4203000     2.146000  0.4583000     0.7126000      0.6218000 
1 1 1 7  22 5  o 6.954000  0.1951000     6.954000  0.1951000     ?         ?             ?              ?         
1 1 1 7  22 6  f 7.059000  0.2029000     7.106000  0.3530000     7.012000  0.2001000     0.9449000E-01  0.4058000 
1 1 1 7  22 7  o 7.795000  0.1483000     7.828000  0.2178000     7.761000  0.2012000     0.6707000E-01  0.2965000 
1 1 1 7  22 8  o 7.475000  0.1550000     7.528000  0.2306000     7.422000  0.2073000     0.1058000      0.3101000 
1 1 1 7  22 9  o 13.31000  0.1699000     13.36000  0.2182000     13.27000  0.2604000     0.9393000E-01  0.3397000 
1 1 1 7  22 10 o 3.454000  0.2592000     3.373000  0.3779000     3.536000  0.3548000     -0.1631000     0.5183000 
1 1 1 7  22 11 o 8.334000  0.1643000     8.231000  0.2297000     8.437000  0.2350000     -0.2066000     0.3286000 
1 1 1 7  22 12 o 12.99000  0.2051000     13.02000  0.3341000     12.95000  0.2380000     0.6561000E-01  0.4102000 
1 1 1 7  22 13 o 7.637000  0.2581000     7.501000  0.3809000     7.772000  0.3485000     -0.2709000     0.5162000 
1 1 1 7  22 14 o 9.478000  0.2146000     9.532000  0.3002000     9.423000  0.3067000     0.1097000      0.4292000 
1 1 1 7  22 15 o 3.311000  0.4790000     3.556000  0.6153000     3.067000  0.7342000     0.4881000      0.9579000 
1 1 1 7  22 16 o 5.785000  0.3244000     6.080000  0.4356000     5.490000  0.4808000     0.5899000      0.6488000 
1 1 1 7  22 17 o 5.000000  0.3929000     4.872000  0.5589000     5.128000  0.5524000     -0.2563000     0.7859000 
1 1 1 7  22 18 o 3.036000  0.7787000     2.780000  0.9086000     3.291000  1.265000      -0.5111000     1.557000  
1 1 1 7  22 19 o 2.889000  0.7104000     3.773000  1.165000      2.005000  0.8127000     1.768000       1.421000  
1 1 1 7  22 20 o 2.409000  0.4993000     3.448000  0.7583000     1.369000  0.6496000     2.078000       0.9985000 
1 1 1 7  22 21 o 1.555000  0.4907000     1.386000  0.6541000     1.724000  0.7316000     -0.3387000     0.9814000 
1 1 1 7  22 22 o 1.728000  0.5156000     1.750000  0.7291000     1.707000  0.7293000     0.4293000E-01  1.031000  
1 1 1 7  22 23 o 1.745000  0.5445000     1.837000  0.7478000     1.653000  0.7918000     0.1836000      1.089000  
1 1 1 7  22 24 o 1.383000  0.4729000     1.658000  0.7788000     1.107000  0.5367000     0.5512000      0.9458000 
1 1 1 7  22 25 o 1.749000  0.4996000     1.709000  0.7008000     1.790000  0.7122000     -0.8131000E-01 0.9992000 
1 1 1 7  22 26 o 1.247000  0.4186000     1.165000  0.5625000     1.329000  0.6202000     -0.1639000     0.8373000 
1 1 1 7  23 0  o 8.441000  0.1756000     8.441000  0.1756000     8.441000  0.1756000     -0.000000      0.000000  
1 1 1 7  23 1  o 8.231000  0.1237000     8.222000  0.1741000     8.241000  0.1756000     -0.1856000E-01 0.2473000 
1 1 1 7  23 2  o 5.782000  0.1336000     5.957000  0.1870000     5.607000  0.1908000     0.3502000      0.2672000 
1 1 1 7  23 3  f 10.01000  0.1589000     9.788000  0.2595000     10.23000  0.1834000     -0.4459000     0.3178000 
1 1 1 7  23 4  o 0.8994000 0.4154000     0.8994000 0.4154000     ?         ?             ?              ?         
1 1 1 7  23 5  o 9.394000  0.1718000     9.244000  0.2636000     9.543000  0.2205000     -0.2990000     0.3437000 
1 1 1 7  23 6  o 3.350000  0.2243000     3.358000  0.3260000     3.342000  0.3081000     0.1525000E-01  0.4486000 
1 1 1 7  23 7  o 9.712000  0.1492000     9.534000  0.2215000     9.890000  0.2000000     -0.3560000     0.2984000 
1 1 1 7  23 8  o 5.828000  0.1726000     6.003000  0.2527000     5.652000  0.2353000     0.3502000      0.3453000 
1 1 1 7  23 9  o 11.60000  0.1506000     11.79000  0.2136000     11.41000  0.2124000     0.3732000      0.3012000 
1 1 1 7  23 10 o 11.89000  0.1573000     11.75000  0.2235000     12.03000  0.2214000     -0.2715000     0.3146000 
1 1 1 7  23 11 o 14.62000  0.1684000     14.63000  0.2380000     14.61000  0.2383000     0.1516000E-01  0.3369000 
1 1 1 7  23 12 o 8.516000  0.2131000     8.468000  0.2459000     8.564000  0.3482000     -0.9630000E-01 0.4263000 
1 1 1 7  23 13 o 12.96000  0.2143000     12.83000  0.3493000     13.09000  0.2484000     -0.2523000     0.4286000 
1 1 1 7  23 14 o 8.435000  0.2128000     8.442000  0.3343000     8.427000  0.2633000     0.1514000E-01  0.4256000 
1 1 1 7  23 15 o 4.592000  0.3642000     4.503000  0.5142000     4.682000  0.5158000     -0.1790000     0.7283000 
1 1 1 7  23 16 o 4.953000  0.3726000     4.697000  0.5388000     5.210000  0.5148000     -0.5137000     0.7451000 
1 1 1 7  23 17 o 5.910000  0.3504000     5.016000  0.5454000     6.803000  0.4400000     -1.786000      0.7007000 
1 1 1 7  23 18 o 3.390000  0.6768000     4.001000  0.7150000     2.778000  1.149000      1.223000       1.354000  
1 1 1 7  23 19 o 3.614000  0.5274000     4.210000  0.6472000     3.018000  0.8328000     1.193000       1.055000  
1 1 1 7  23 20 o 1.551000  0.4972000     1.680000  0.7391000     1.423000  0.6653000     0.2577000      0.9944000 
1 1 1 7  23 21 o 1.533000  0.4865000     1.650000  0.7171000     1.415000  0.6576000     0.2349000      0.9730000 
1 1 1 7  23 22 o 1.535000  0.4804000     1.360000  0.6340000     1.709000  0.7218000     -0.3491000     0.9607000 
1 1 1 7  23 23 o 1.768000  0.5893000     1.471000  0.6611000     2.065000  0.9757000     -0.5939000     1.179000  
1 1 1 7  23 24 o 1.329000  0.4284000     1.648000  0.6976000     1.010000  0.4975000     0.6374000      0.8568000 
1 1 1 7  23 25 o 1.309000  0.4222000     1.094000  0.5316000     1.524000  0.6560000     -0.4292000     0.8443000 
1 1 1 7  24 0  o 6.351000  0.1877000     6.351000  0.1877000     6.351000  0.1877000     0.000000       0.000000  
1 1 1 7  24 1  o 9.939000  0.1399000     10.07000  0.2129000     9.808000  0.1816000     0.2625000      0.2799000 
1 1 1 7  24 2  o 16.60000  0.2040000     16.61000  0.3161000     16.59000  0.2580000     0.2096000E-01  0.4080000 
1 1 1 7  24 3  o 6.287000  0.2297000     6.287000  0.2297000     ?         ?             ?              ?         
1 1 1 7  24 4  o 5.770000  0.1882000     5.676000  0.2897000     5.863000  0.2402000     -0.1867000     0.3763000 
1 1 1 7  24 5  f 6.592000  0.1527000     6.899000  0.1954000     6.285000  0.2348000     0.6138000      0.3055000 
1 1 1 7  24 6  o 6.146000  0.1613000     5.737000  0.2472000     6.555000  0.2073000     -0.8182000     0.3227000 
1 1 1 7  24 7  o 4.750000  0.1933000     4.655000  0.2861000     4.844000  0.2601000     -0.1890000     0.3866000 
1 1 1 7  24 8  o 9.084000  0.1561000     9.041000  0.2319000     9.126000  0.2090000     -0.8545000E-01 0.3122000 
1 1 1 7  24 9  o 14.71000  0.1626000     14.68000  0.2320000     14.73000  0.2279000     -0.4886000E-01 0.3252000 
1 1 1 7  24 10 o 20.50000  0.1942000     20.55000  0.2744000     20.45000  0.2749000     0.1071000      0.3884000 
1 1 1 7  24 11 o 8.657000  0.1679000     8.587000  0.2385000     8.727000  0.2364000     -0.1404000     0.3358000 
1 1 1 7  24 12 o 12.35000  0.2503000     12.10000  0.2375000     12.60000  0.4407000     -0.5064000     0.5006000 
1 1 1 7  24 13 o 7.287000  0.1948000     6.869000  0.2842000     7.704000  0.2663000     -0.8354000     0.3895000 
1 1 1 7  24 14 o 4.670000  0.2869000     4.239000  0.4200000     5.101000  0.3910000     -0.8619000     0.5739000 
1 1 1 7  24 15 o 5.287000  0.3407000     5.779000  0.4262000     4.796000  0.5318000     0.9830000      0.6815000 
1 1 1 7  24 16 o 5.042000  0.3595000     4.659000  0.5323000     5.426000  0.4833000     -0.7669000     0.7189000 
1 1 1 7  24 17 o 4.881000  0.4059000     4.696000  0.5883000     5.066000  0.5595000     -0.3700000     0.8118000 
1 1 1 7  24 18 o 2.603000  0.5879000     1.789000  0.7894000     3.417000  0.8714000     -1.628000      1.176000  
1 1 1 7  24 19 o 3.494000  0.5317000     4.193000  0.6531000     2.795000  0.8391000     1.398000       1.063000  
1 1 1 7  24 20 o 1.580000  0.4935000     1.322000  0.6300000     1.839000  0.7598000     -0.5171000     0.9870000 
1 1 1 7  24 21 o 2.371000  0.4689000     3.394000  0.6902000     1.348000  0.6349000     2.046000       0.9378000 
1 1 1 7  24 22 o 1.837000  0.5001000     2.352000  0.7843000     1.323000  0.6207000     1.028000       1.000000  
1 1 1 7  24 23 o 2.526000  0.6327000     2.386000  0.7695000     2.666000  1.005000      -0.2799000     1.265000  
1 1 1 7  24 24 o 1.567000  0.4560000     2.069000  0.7470000     1.065000  0.5230000     1.004000       0.9119000 
1 1 1 7  24 25 f 1.376000  0.4450000     1.402000  0.6382000     1.350000  0.6204000     0.5231000E-01  0.8901000 
1 1 1 7  25 0  o 1.332000  0.7658000     1.332000  0.7658000     1.332000  0.7658000     0.000000       0.000000  
1 1 1 7  25 1  o 7.352000  0.3857000     7.352000  0.3857000     ?         ?             ?              ?         
1 1 1 7  25 2  o 6.656000  0.2373000     6.777000  0.2692000     6.535000  0.3908000     0.2417000      0.4746000 
1 1 1 7  25 3  o 8.089000  0.1627000     8.467000  0.2626000     7.711000  0.1921000     0.7556000      0.3254000 
1 1 1 7  25 4  o 7.357000  0.1471000     7.290000  0.1915000     7.424000  0.2234000     -0.1336000     0.2943000 
1 1 1 7  25 5  o 5.496000  0.1692000     5.326000  0.2246000     5.667000  0.2530000     -0.3415000     0.3383000 
1 1 1 7  25 6  o 3.809000  0.2201000     3.860000  0.3264000     3.758000  0.2953000     0.1021000      0.4402000 
1 1 1 7  25 7  o 8.733000  0.1673000     8.801000  0.2632000     8.664000  0.2067000     0.1368000      0.3346000 
1 1 1 7  25 8  o 13.37000  0.1649000     13.28000  0.2452000     13.46000  0.2206000     -0.1863000     0.3298000 
1 1 1 7  25 9  o 18.45000  0.1960000     18.43000  0.2577000     18.47000  0.2954000     -0.4096000E-01 0.3920000 
1 1 1 7  25 10 o 6.638000  0.1721000     6.781000  0.2433000     6.494000  0.2435000     0.2870000      0.3442000 
1 1 1 7  25 11 o 9.416000  0.2030000     9.458000  0.3286000     9.373000  0.2385000     0.8453000E-01  0.4060000 
1 1 1 7  25 12 o 5.466000  0.3020000     5.882000  0.4310000     5.050000  0.4231000     0.8324000      0.6040000 
1 1 1 7  25 13 o 6.030000  0.2190000     5.902000  0.3103000     6.158000  0.3091000     -0.2559000     0.4379000 
1 1 1 7  25 14 o 2.540000  0.4566000     2.226000  0.6742000     2.854000  0.6160000     -0.6276000     0.9133000 
1 1 1 7  25 15 o 9.504000  0.2795000     9.351000  0.3507000     9.657000  0.4354000     -0.3054000     0.5591000 
1 1 1 7  25 16 o 1.439000  0.4748000     1.514000  0.6907000     1.365000  0.6517000     0.1489000      0.9497000 
1 1 1 7  25 17 o 4.577000  0.4859000     5.468000  0.5356000     3.686000  0.8109000     1.782000       0.9718000 
1 1 1 7  25 18 o 4.844000  0.7261000     4.947000  1.272000      4.740000  0.7000000     0.2073000      1.452000  
1 1 1 7  25 19 o 3.728000  0.4930000     3.972000  0.6625000     3.484000  0.7302000     0.4883000      0.9859000 
1 1 1 7  25 20 o 3.259000  0.5061000     3.862000  0.6251000     2.655000  0.7961000     1.207000       1.012000  
1 1 1 7  25 21 o 2.429000  0.5551000     2.712000  0.7877000     2.146000  0.7822000     0.5658000      1.110000  
1 1 1 7  25 22 o 3.223000  0.5006000     3.168000  0.7194000     3.277000  0.6964000     -0.1093000     1.001000  
1 1 1 7  25 23 o 1.579000  0.4955000     1.624000  0.7026000     1.535000  0.6988000     0.8981000E-01  0.9909000 
1 1 1 7  25 24 o 1.638000  0.4886000     1.498000  0.6568000     1.779000  0.7234000     -0.2817000     0.9771000 
1 1 1 7  25 25 o 1.402000  0.4454000     1.627000  0.6889000     1.177000  0.5649000     0.4504000      0.8908000 
1 1 1 7  26 0  f 14.71000  0.2445000     14.71000  0.2445000     14.71000  0.2445000     -0.000000      0.000000  
1 1 1 7  26 1  o 7.542000  0.1451000     7.523000  0.2202000     7.561000  0.1889000     -0.3738000E-01 0.2901000 
1 1 1 7  26 2  o 8.576000  0.1339000     8.475000  0.1897000     8.676000  0.1890000     -0.2013000     0.2677000 
1 1 1 7  26 3  o 7.153000  0.1392000     7.211000  0.1940000     7.095000  0.1997000     0.1161000      0.2785000 
1 1 1 7  26 4  o 4.231000  0.1958000     4.392000  0.2477000     4.069000  0.3033000     0.3235000      0.3916000 
1 1 1 7  26 5  o 10.93000  0.1560000     11.06000  0.2020000     10.81000  0.2377000     0.2463000      0.3119000 
1 1 1 7  26 6  o 12.98000  0.1611000     13.00000  0.2408000     12.97000  0.2142000     0.2386000E-01  0.3223000 
1 1 1 7  26 7  o 6.358000  0.1683000     6.356000  0.2492000     6.360000  0.2261000     -0.4142000E-02 0.3365000 
1 1 1 7  26 8  o 9.405000  0.1594000     9.395000  0.2371000     9.416000  0.2132000     -0.2081000E-01 0.3189000 
1 1 1 7  26 9  o 2.093000  0.3924000     2.146000  0.5497000     2.039000  0.5601000     0.1077000      0.7847000 
1 1 1 7  26 10 o 12.59000  0.1629000     12.56000  0.2291000     12.61000  0.2317000     -0.5383000E-01 0.3259000 
1 1 1 7  26 11 o 3.832000  0.4071000     4.097000  0.3715000     3.566000  0.7245000     0.5304000      0.8142000 
1 1 1 7  26 12 f 6.030000  0.2421000     6.121000  0.3797000     5.938000  0.3006000     0.1835000      0.4843000 
1 1 1 7  26 13 o 2.249000  0.4594000     2.239000  0.6494000     2.259000  0.6499000     -0.2015000E-01 0.9187000 
1 1 1 7  26 14 o 2.946000  0.4342000     3.238000  0.5678000     2.655000  0.6569000     0.5835000      0.8683000 
1 1 1 7  26 15 o 7.427000  0.2148000     7.513000  0.3019000     7.340000  0.3056000     0.1727000      0.4296000 
1 1 1 7  26 16 o 3.247000  0.5681000     3.158000  0.7846000     3.336000  0.8217000     -0.1784000     1.136000  
1 1 1 7  26 17 o 5.259000  0.6472000     5.190000  0.6099000     5.328000  1.142000      -0.1378000     1.294000  
1 1 1 7  26 18 o 2.878000  0.7344000     3.321000  1.199000      2.436000  0.8480000     0.8846000      1.469000  
1 1 1 7  26 19 o 2.103000  0.5757000     2.115000  0.8214000     2.091000  0.8069000     0.2419000E-01  1.151000  
1 1 1 7  26 20 o 3.562000  0.4720000     4.289000  0.5475000     2.836000  0.7689000     1.453000       0.9439000 
1 1 1 7  26 21 o 3.612000  0.4669000     3.027000  0.7442000     4.197000  0.5641000     -1.170000      0.9338000 
1 1 1 7  26 22 o 1.511000  0.4806000     1.451000  0.6691000     1.572000  0.6902000     -0.1212000     0.9613000 
1 1 1 7  26 23 o 1.221000  0.4227000     1.282000  0.6256000     1.160000  0.5686000     0.1223000      0.8454000 
1 1 1 7  26 24 f 1.503000  0.4716000     1.615000  0.6963000     1.391000  0.6362000     0.2244000      0.9432000 
1 1 1 7  26 25 o 1.082000  0.3739000     1.059000  0.5198000     1.106000  0.5376000     -0.4770000E-01 0.7478000 
1 1 1 7  27 0  o 5.036000  0.2241000     5.036000  0.2241000     5.036000  0.2241000     -0.000000      0.000000  
1 1 1 7  27 1  o 1.365000  0.3110000     1.813000  0.4621000     0.9169000 0.4164000     0.8962000      0.6220000 
1 1 1 7  27 2  o 4.649000  0.1683000     4.866000  0.2300000     4.432000  0.2458000     0.4335000      0.3367000 
1 1 1 7  27 3  o 8.502000  0.1488000     8.586000  0.2235000     8.418000  0.1966000     0.1688000      0.2977000 
1 1 1 7  27 4  f 11.00000  0.1540000     10.89000  0.2002000     11.12000  0.2340000     -0.2322000     0.3079000 
1 1 1 7  27 5  o 9.307000  0.1563000     9.542000  0.2041000     9.073000  0.2368000     0.4683000      0.3126000 
1 1 1 7  27 6  o 7.036000  0.1641000     7.281000  0.2431000     6.791000  0.2203000     0.4903000      0.3281000 
1 1 1 7  27 7  o 15.71000  0.1753000     15.66000  0.2629000     15.75000  0.2321000     -0.9056000E-01 0.3507000 
1 1 1 7  27 8  o 19.27000  0.1984000     19.15000  0.2967000     19.39000  0.2636000     -0.2416000     0.3968000 
1 1 1 7  27 9  o 20.73000  0.1960000     20.62000  0.2770000     20.84000  0.2774000     -0.2183000     0.3920000 
1 1 1 7  27 10 o 2.074000  0.4106000     1.524000  0.6566000     2.624000  0.4932000     -1.100000      0.8212000 
1 1 1 7  27 11 o 13.71000  0.2218000     13.87000  0.2702000     13.56000  0.3519000     0.3125000      0.4436000 
1 1 1 7  27 12 o 10.06000  0.1782000     10.01000  0.2547000     10.11000  0.2494000     -0.9632000E-01 0.3565000 
1 1 1 7  27 13 o 4.723000  0.2677000     4.821000  0.3598000     4.625000  0.3966000     0.1969000      0.5355000 
1 1 1 7  27 14 o 7.859000  0.2082000     8.062000  0.2882000     7.656000  0.3007000     0.4062000      0.4165000 
1 1 1 7  27 15 o 4.745000  0.3148000     5.091000  0.4182000     4.399000  0.4707000     0.6925000      0.6296000 
1 1 1 7  27 16 o 4.920000  0.3951000     4.402000  0.5996000     5.438000  0.5148000     -1.036000      0.7903000 
1 1 1 7  27 17 o 2.719000  0.8307000     1.890000  0.7877000     3.548000  1.463000      -1.658000      1.661000  
1 1 1 7  27 18 o 2.595000  0.5389000     3.400000  0.7481000     1.790000  0.7760000     1.611000       1.078000  
1 1 1 7  27 19 o 4.148000  0.4428000     3.945000  0.6689000     4.351000  0.5805000     -0.4062000     0.8857000 
1 1 1 7  27 20 o 2.773000  0.5292000     3.201000  0.7056000     2.345000  0.7890000     0.8564000      1.058000  
1 1 1 7  27 21 o 2.609000  0.5509000     2.519000  0.7885000     2.699000  0.7697000     -0.1795000     1.102000  
1 1 1 7  27 22 o 1.520000  0.4775000     1.062000  0.5291000     1.977000  0.7951000     -0.9154000     0.9550000 
1 1 1 7  27 23 o 2.014000  0.6439000     2.552000  1.107000      1.476000  0.6576000     1.076000       1.288000  
1 1 1 7  27 24 o 1.340000  0.4374000     1.371000  0.6278000     1.310000  0.6092000     0.6145000E-01  0.8748000 
1 1 1 7  27 25 o 1.521000  0.4666000     1.702000  0.7002000     1.339000  0.6168000     0.3633000      0.9331000 
1 1 1 7  28 0  o 32.20000  0.3730000     32.20000  0.3730000     32.20000  0.3730000     -0.000000      0.000000  
1 1 1 7  28 1  o 7.568000  0.1397000     7.649000  0.1971000     7.487000  0.1981000     0.1626000      0.2794000 
1 1 1 7  28 2  o 7.799000  0.1408000     7.713000  0.1981000     7.885000  0.2002000     -0.1721000     0.2817000 
1 1 1 7  28 3  o 4.599000  0.1820000     4.706000  0.2515000     4.491000  0.2632000     0.2155000      0.3640000 
1 1 1 7  28 4  o 8.705000  0.1544000     8.742000  0.2031000     8.669000  0.2326000     0.7265000E-01  0.3088000 
1 1 1 7  28 5  o 4.755000  0.2023000     4.652000  0.2640000     4.858000  0.3064000     -0.2066000     0.4045000 
1 1 1 7  28 6  o 12.18000  0.1516000     12.08000  0.2155000     12.27000  0.2134000     -0.1894000     0.3033000 
1 1 1 7  28 7  o 12.70000  0.1645000     12.70000  0.2467000     12.71000  0.2176000     -0.1465000E-01 0.3289000 
1 1 1 7  28 8  f 18.72000  0.1951000     18.43000  0.2909000     19.01000  0.2601000     -0.5779000     0.3903000 
1 1 1 7  28 9  o 21.74000  0.2176000     22.24000  0.3310000     21.25000  0.2825000     0.9926000      0.4352000 
1 1 1 7  28 10 o 13.15000  0.2348000     13.41000  0.3368000     12.90000  0.3273000     0.5120000      0.4696000 
1 1 1 7  28 11 o 4.441000  0.3295000     4.305000  0.5597000     4.576000  0.3478000     -0.2708000     0.6590000 
1 1 1 7  28 12 o 9.911000  0.1803000     9.788000  0.2545000     10.03000  0.2554000     -0.2453000     0.3606000 
1 1 1 7  28 13 o 9.994000  0.1826000     9.810000  0.2610000     10.18000  0.2556000     -0.3679000     0.3653000 
1 1 1 7  28 14 o 7.132000  0.2216000     7.610000  0.2979000     6.655000  0.3282000     0.9553000      0.4433000 
1 1 1 7  28 15 o 8.331000  0.2161000     8.432000  0.3035000     8.229000  0.3076000     0.2024000      0.4322000 
1 1 1 7  28 16 o 3.120000  0.5270000     3.367000  0.7757000     2.872000  0.7135000     0.4944000      1.054000  
1 1 1 7  28 17 o 3.299000  0.7702000     3.089000  0.8879000     3.509000  1.259000      -0.4209000     1.540000  
1 1 1 7  28 18 o 2.953000  0.5672000     3.007000  0.7794000     2.899000  0.8243000     0.1085000      1.134000  
1 1 1 7  28 19 o 1.801000  0.5044000     1.316000  0.6254000     2.287000  0.7915000     -0.9708000     1.009000  
1 1 1 7  28 20 f 1.636000  0.4986000     1.790000  0.7386000     1.481000  0.6699000     0.3099000      0.9971000 
1 1 1 7  28 21 o 2.460000  0.5574000     2.631000  0.7391000     2.289000  0.8345000     0.3422000      1.115000  
1 1 1 7  28 22 o 1.798000  0.5888000     1.505000  0.6744000     2.092000  0.9654000     -0.5871000     1.178000  
1 1 1 7  28 23 o 1.424000  0.4726000     1.646000  0.7509000     1.203000  0.5740000     0.4435000      0.9451000 
1 1 1 7  28 24 o 1.870000  0.5122000     2.114000  0.7506000     1.625000  0.6970000     0.4889000      1.024000  
1 1 1 7  28 25 o 1.910000  0.5466000     1.406000  0.6682000     2.415000  0.8652000     -1.009000      1.093000  
1 1 1 7  29 0  o 9.600000  0.2012000     9.600000  0.2012000     9.600000  0.2012000     -0.000000      0.000000  
1 1 1 7  29 1  o 14.20000  0.1528000     14.16000  0.2160000     14.25000  0.2161000     -0.9079000E-01 0.3055000 
1 1 1 7  29 2  o 10.20000  0.1426000     10.37000  0.2020000     10.02000  0.2014000     0.3510000      0.2852000 
1 1 1 7  29 3  o 9.754000  0.1437000     9.553000  0.2017000     9.956000  0.2047000     -0.4024000     0.2874000 
1 1 1 7  29 4  o 14.23000  0.1676000     14.40000  0.2199000     14.05000  0.2531000     0.3552000      0.3353000 
1 1 1 7  29 5  o 6.709000  0.1703000     6.715000  0.2196000     6.703000  0.2604000     0.1187000E-01  0.3407000 
1 1 1 7  29 6  o 16.94000  0.1715000     17.01000  0.2430000     16.86000  0.2421000     0.1469000      0.3430000 
1 1 1 7  29 7  o 19.00000  0.1968000     19.03000  0.2965000     18.96000  0.2587000     0.6808000E-01  0.3935000 
1 1 1 7  29 8  o 8.802000  0.1674000     8.788000  0.2493000     8.816000  0.2235000     -0.2733000E-01 0.3348000 
1 1 1 7  29 9  o 2.893000  0.3980000     3.095000  0.6214000     2.691000  0.4976000     0.4039000      0.7961000 
1 1 1 7  29 10 o 15.40000  0.2750000     15.29000  0.2764000     15.51000  0.4755000     -0.2182000     0.5500000 
1 1 1 7  29 11 f 8.929000  0.1775000     9.054000  0.2516000     8.803000  0.2504000     0.2517000      0.3549000 
1 1 1 7  29 12 o 7.405000  0.1961000     7.434000  0.2772000     7.377000  0.2774000     0.5727000E-01  0.3922000 
1 1 1 7  29 13 o 4.353000  0.2980000     4.436000  0.4141000     4.270000  0.4285000     0.1661000      0.5959000 
1 1 1 7  29 14 f 10.35000  0.1942000     10.72000  0.2728000     9.982000  0.2764000     0.7366000      0.3884000 
1 1 1 7  29 15 o 5.666000  0.2775000     6.027000  0.3805000     5.306000  0.4041000     0.7219000      0.5551000 
1 1 1 7  29 16 o 3.525000  0.5346000     3.005000  0.9156000     4.044000  0.5523000     -1.039000      1.069000  
1 1 1 7  29 17 o 2.649000  0.7129000     2.590000  1.141000      2.708000  0.8546000     -0.1179000     1.426000  
1 1 1 7  29 18 o 3.868000  0.4693000     3.479000  0.7322000     4.257000  0.5871000     -0.7780000     0.9385000 
1 1 1 7  29 19 o 2.782000  0.5594000     2.644000  0.8179000     2.919000  0.7633000     -0.2748000     1.119000  
1 1 1 7  29 20 o 3.120000  0.5086000     2.378000  0.8001000     3.862000  0.6281000     -1.484000      1.017000  
1 1 1 7  29 21 f 2.455000  0.5545000     2.423000  0.7901000     2.486000  0.7782000     -0.6246000E-01 1.109000  
1 1 1 7  29 22 o 3.035000  0.6852000     2.388000  0.7612000     3.681000  1.139000      -1.293000      1.370000  
1 1 1 7  29 23 o 1.884000  0.5122000     2.116000  0.7532000     1.651000  0.6944000     0.4648000      1.024000  
1 1 1 7  29 24 o 1.853000  0.5153000     1.661000  0.7097000     2.045000  0.7474000     -0.3843000     1.031000  
1 1 1 7  30 0  o 3.596000  0.3208000     3.596000  0.3208000     3.596000  0.3208000     -0.000000      0.000000  
1 1 1 7  30 1  o 8.844000  0.1442000     8.629000  0.2044000     9.059000  0.2036000     -0.4304000     0.2885000 
1 1 1 7  30 2  o 4.883000  0.1783000     4.782000  0.2574000     4.984000  0.2468000     -0.2024000     0.3566000 
1 1 1 7  30 3  o 9.105000  0.1460000     9.218000  0.2046000     8.992000  0.2082000     0.2254000      0.2919000 
1 1 1 7  30 4  o 9.336000  0.1771000     9.130000  0.2076000     9.543000  0.2870000     -0.4131000     0.3542000 
1 1 1 7  30 5  o 9.782000  0.1599000     9.956000  0.2097000     9.609000  0.2414000     0.3473000      0.3198000 
1 1 1 7  30 6  o 15.02000  0.1645000     14.69000  0.2299000     15.35000  0.2355000     -0.6621000     0.3291000 
1 1 1 7  30 7  o 3.730000  0.2601000     3.876000  0.3788000     3.585000  0.3565000     0.2908000      0.5202000 
1 1 1 7  30 8  o 21.36000  0.2142000     21.50000  0.3236000     21.21000  0.2807000     0.2931000      0.4284000 
1 1 1 7  30 9  o 4.853000  0.3418000     5.198000  0.3424000     4.509000  0.5918000     0.6889000      0.6837000 
1 1 1 7  30 10 o 12.70000  0.2073000     12.77000  0.3377000     12.63000  0.2407000     0.1453000      0.4147000 
1 1 1 7  30 11 o 8.657000  0.1799000     8.718000  0.2551000     8.596000  0.2537000     0.1220000      0.3598000 
1 1 1 7  30 12 o 4.642000  0.2694000     4.641000  0.3745000     4.644000  0.3873000     -0.3091000E-02 0.5388000 
1 1 1 7  30 13 o 9.800000  0.1916000     10.17000  0.2710000     9.430000  0.2709000     0.7406000      0.3832000 
1 1 1 7  30 14 o 6.718000  0.2356000     6.736000  0.3324000     6.700000  0.3339000     0.3634000E-01  0.4711000 
1 1 1 7  30 15 o 4.058000  0.3756000     4.001000  0.5249000     4.115000  0.5374000     -0.1136000     0.7513000 
1 1 1 7  30 16 o 1.914000  0.5440000     2.018000  0.7513000     1.810000  0.7868000     0.2076000      1.088000  
1 1 1 7  30 17 o 1.745000  0.5568000     1.837000  0.8610000     1.652000  0.7063000     0.1851000      1.114000  
1 1 1 7  30 18 o 3.257000  0.5379000     3.453000  0.7269000     3.061000  0.7931000     0.3921000      1.076000  
1 1 1 7  30 19 o 3.026000  0.5499000     3.073000  0.7627000     2.979000  0.7922000     0.9429000E-01  1.100000  
1 1 1 7  30 20 o 3.397000  0.4968000     3.843000  0.5985000     2.950000  0.7931000     0.8924000      0.9935000 
1 1 1 7  30 21 o 1.696000  0.4985000     1.970000  0.7551000     1.421000  0.6510000     0.5496000      0.9970000 
1 1 1 7  30 22 o 1.500000  0.4785000     1.673000  0.7222000     1.327000  0.6278000     0.3452000      0.9569000 
1 1 1 7  30 23 o 2.507000  0.5401000     2.533000  0.7681000     2.482000  0.7597000     0.5105000E-01  1.080000  
1 1 1 7  30 24 o 1.541000  0.4700000     1.755000  0.7120000     1.327000  0.6137000     0.4279000      0.9400000 
1 1 1 7  31 0  o 17.79000  0.2443000     17.79000  0.2443000     17.79000  0.2443000     0.000000       0.000000  
1 1 1 7  31 1  o 13.09000  0.1511000     12.79000  0.2124000     13.38000  0.2151000     -0.5950000     0.3023000 
1 1 1 7  31 2  o 12.64000  0.1499000     12.89000  0.2129000     12.38000  0.2112000     0.5093000      0.2999000 
1 1 1 7  31 3  o 13.05000  0.1523000     12.98000  0.2146000     13.13000  0.2161000     -0.1424000     0.3046000 
1 1 1 7  31 4  o 15.77000  0.1773000     15.96000  0.2335000     15.59000  0.2668000     0.3685000      0.3545000 
1 1 1 7  31 5  o 15.11000  0.1772000     15.18000  0.2310000     15.05000  0.2687000     0.1271000      0.3544000 
1 1 1 7  31 6  o 7.025000  0.1678000     7.185000  0.2358000     6.864000  0.2388000     0.3210000      0.3357000 
1 1 1 7  31 7  o 6.080000  0.1950000     5.911000  0.2959000     6.248000  0.2542000     -0.3365000     0.3901000 
1 1 1 7  31 8  f 14.10000  0.2525000     14.39000  0.4468000     13.81000  0.2355000     0.5784000      0.5051000 
1 1 1 7  31 9  o 20.45000  0.3366000     20.67000  0.5399000     20.22000  0.4020000     0.4472000      0.6731000 
1 1 1 7  31 10 o 13.28000  0.1722000     13.15000  0.2439000     13.41000  0.2431000     -0.2649000     0.3444000 
1 1 1 7  31 11 o 2.127000  0.4559000     2.244000  0.6407000     2.011000  0.6487000     0.2331000      0.9117000 
1 1 1 7  31 12 f 7.842000  0.1993000     7.985000  0.2820000     7.699000  0.2816000     0.2856000      0.3985000 
1 1 1 7  31 13 o 3.572000  0.3965000     4.131000  0.4744000     3.013000  0.6353000     1.118000       0.7929000 
1 1 1 7  31 14 o 7.181000  0.2324000     7.117000  0.3321000     7.246000  0.3251000     -0.1292000     0.4648000 
1 1 1 7  31 15 o 7.574000  0.2363000     7.483000  0.3355000     7.665000  0.3328000     -0.1826000     0.4725000 
1 1 1 7  31 16 o 3.573000  0.5460000     3.900000  0.5729000     3.247000  0.9296000     0.6527000      1.092000  
1 1 1 7  31 17 o 7.192000  0.2485000     7.012000  0.3557000     7.373000  0.3473000     -0.3614000     0.4971000 
1 1 1 7  31 18 f 3.590000  0.4727000     3.515000  0.6861000     3.665000  0.6503000     -0.1505000     0.9453000 
1 1 1 7  31 19 o 4.128000  0.4205000     4.354000  0.5475000     3.902000  0.6384000     0.4524000      0.8410000 
1 1 1 7  31 20 o 2.051000  0.5370000     2.246000  0.7769000     1.856000  0.7416000     0.3909000      1.074000  
1 1 1 7  31 21 o 1.554000  0.4851000     1.211000  0.5830000     1.898000  0.7755000     -0.6873000     0.9702000 
1 1 1 7  31 22 o 2.302000  0.6130000     2.131000  0.9795000     2.472000  0.7372000     -0.3414000     1.226000  
1 1 1 7  31 23 o 1.327000  0.4323000     1.454000  0.6468000     1.200000  0.5738000     0.2540000      0.8647000 
1 1 1 7  31 24 o 1.192000  0.4037000     1.267000  0.5982000     1.118000  0.5422000     0.1485000      0.8074000 
1 1 1 7  32 0  o 8.356000  0.2121000     8.356000  0.2121000     8.356000  0.2121000     -0.000000      0.000000  
1 1 1 7  32 1  o 24.17000  0.2116000     24.33000  0.3004000     24.02000  0.2980000     0.3057000      0.4231000 
1 1 1 7  32 2  f 10.37000  0.1476000     10.38000  0.2095000     10.36000  0.2080000     0.2872000E-01  0.2952000 
1 1 1 7  32 3  o 4.985000  0.1847000     4.894000  0.2626000     5.076000  0.2597000     -0.1827000     0.3693000 
1 1 1 7  32 4  o 8.432000  0.1669000     8.419000  0.2181000     8.445000  0.2526000     -0.2674000E-01 0.3337000 
1 1 1 7  32 5  o 7.747000  0.1714000     7.461000  0.2266000     8.034000  0.2574000     -0.5731000     0.3429000 
1 1 1 7  32 6  o 11.45000  0.1573000     11.32000  0.2213000     11.59000  0.2236000     -0.2704000     0.3146000 
1 1 1 7  32 7  o 11.37000  0.2101000     11.16000  0.3243000     11.57000  0.2671000     -0.4092000     0.4201000 
1 1 1 7  32 8  o 13.87000  0.2674000     13.87000  0.2674000     ?         ?             ?              ?         
1 1 1 7  32 9  o 7.881000  0.2165000     8.067000  0.3544000     7.696000  0.2489000     0.3704000      0.4331000 
1 1 1 7  32 10 o 17.57000  0.1879000     17.42000  0.2657000     17.72000  0.2658000     -0.3030000     0.3758000 
1 1 1 7  32 11 o 18.64000  0.1954000     18.64000  0.2759000     18.64000  0.2767000     0.4831000E-02  0.3907000 
1 1 1 7  32 12 o 15.48000  0.1975000     15.80000  0.2941000     15.15000  0.2637000     0.6482000      0.3950000 
1 1 1 7  32 13 o 8.807000  0.2044000     8.878000  0.2919000     8.735000  0.2863000     0.1430000      0.4088000 
1 1 1 7  32 14 o 7.854000  0.2250000     7.760000  0.3180000     7.948000  0.3184000     -0.1883000     0.4500000 
1 1 1 7  32 15 o 6.787000  0.3083000     6.790000  0.4925000     6.783000  0.3712000     0.7803000E-02  0.6167000 
1 1 1 7  32 16 o 2.213000  0.6128000     2.357000  0.9017000     2.068000  0.8301000     0.2890000      1.226000  
1 1 1 7  32 17 o 3.521000  0.4355000     3.558000  0.6085000     3.484000  0.6231000     0.7351000E-01  0.8709000 
1 1 1 7  32 18 o 1.827000  0.5294000     1.884000  0.7949000     1.770000  0.6993000     0.1136000      1.059000  
1 1 1 7  32 19 o 1.380000  0.4489000     1.568000  0.6876000     1.191000  0.5774000     0.3776000      0.8978000 
1 1 1 7  32 20 o 1.754000  0.4995000     1.452000  0.6560000     2.055000  0.7535000     -0.6031000     0.9990000 
1 1 1 7  32 21 o 2.791000  0.6569000     3.086000  0.7478000     2.497000  1.080000      0.5897000      1.314000  
1 1 1 7  32 22 o 1.435000  0.4770000     1.427000  0.6977000     1.443000  0.6506000     -0.1607000E-01 0.9539000 
1 1 1 7  32 23 o 1.190000  0.4020000     1.367000  0.6266000     1.013000  0.5036000     0.3536000      0.8039000 
1 1 1 7  32 24 o 1.175000  0.3985000     1.165000  0.5582000     1.186000  0.5689000     -0.2158000E-01 0.7970000 
1 1 1 7  33 0  o 21.21000  0.2746000     21.21000  0.2746000     21.21000  0.2746000     0.000000       0.000000  
1 1 1 7  33 1  o 6.990000  0.1582000     6.848000  0.2241000     7.132000  0.2235000     -0.2843000     0.3165000 
1 1 1 7  33 2  o 3.554000  0.2441000     3.634000  0.3365000     3.474000  0.3537000     0.1597000      0.4882000 
1 1 1 7  33 3  o 15.96000  0.1675000     15.63000  0.2345000     16.30000  0.2394000     -0.6690000     0.3351000 
1 1 1 7  33 4  f 5.731000  0.1961000     5.870000  0.2508000     5.592000  0.3015000     0.2783000      0.3922000 
1 1 1 7  33 5  o 10.94000  0.1693000     11.18000  0.2196000     10.71000  0.2577000     0.4729000      0.3386000 
1 1 1 7  33 6  o 19.07000  0.1879000     19.13000  0.2656000     19.00000  0.2657000     0.1301000      0.3757000 
1 1 1 7  33 7  o 6.702000  0.3853000     6.702000  0.3853000     ?         ?             ?              ?         
1 1 1 7  33 8  o 1.627000  0.4687000     1.981000  0.7597000     1.273000  0.5493000     0.7082000      0.9375000 
1 1 1 7  33 9  o 14.80000  0.1985000     14.61000  0.2774000     15.00000  0.2838000     -0.3841000     0.3969000 
1 1 1 7  33 10 f 5.751000  0.2219000     5.897000  0.3116000     5.605000  0.3159000     0.2914000      0.4437000 
1 1 1 7  33 11 o 9.486000  0.1850000     9.408000  0.2650000     9.563000  0.2581000     -0.1545000     0.3699000 
1 1 1 7  33 12 o 4.744000  0.2814000     4.746000  0.4083000     4.742000  0.3874000     0.4046000E-02  0.5629000 
1 1 1 7  33 13 o 4.998000  0.2896000     4.479000  0.4501000     5.518000  0.3644000     -1.039000      0.5791000 
1 1 1 7  33 14 o 5.237000  0.2940000     5.347000  0.4120000     5.127000  0.4197000     0.2200000      0.5881000 
1 1 1 7  33 15 o 3.529000  0.6021000     3.645000  0.6041000     3.412000  1.042000      0.2325000      1.204000  
1 1 1 7  33 16 o 4.719000  0.3891000     4.477000  0.6313000     4.961000  0.4550000     -0.4840000     0.7782000 
1 1 1 7  33 17 o 2.264000  0.5251000     2.629000  0.7475000     1.900000  0.7378000     0.7296000      1.050000  
1 1 1 7  33 18 o 3.255000  0.4667000     3.732000  0.5690000     2.778000  0.7398000     0.9543000      0.9334000 
1 1 1 7  33 19 o 2.572000  0.5259000     3.059000  0.7115000     2.084000  0.7747000     0.9750000      1.052000  
1 1 1 7  33 20 o 1.740000  0.5068000     1.783000  0.7173000     1.697000  0.7161000     0.8538000E-01  1.014000  
1 1 1 7  33 21 o 1.973000  0.5727000     2.081000  0.7294000     1.864000  0.8833000     0.2173000      1.145000  
1 1 1 7  33 22 o 1.562000  0.4794000     1.460000  0.6594000     1.665000  0.6960000     -0.2047000     0.9588000 
1 1 1 7  33 23 o 1.237000  0.4155000     1.194000  0.5749000     1.280000  0.6001000     -0.8618000E-01 0.8310000 
1 1 1 7  33 24 o 1.243000  0.6349000     1.243000  0.6349000     ?         ?             ?              ?         
1 1 1 7  34 0  o 12.59000  0.2204000     12.59000  0.2204000     12.59000  0.2204000     -0.000000      0.000000  
1 1 1 7  34 1  o 13.66000  0.1580000     13.53000  0.2223000     13.78000  0.2246000     -0.2503000     0.3160000 
1 1 1 7  34 2  o 31.38000  0.2623000     31.55000  0.3723000     31.21000  0.3696000     0.3412000      0.5246000 
1 1 1 7  34 3  o 18.21000  0.1798000     18.25000  0.2540000     18.18000  0.2547000     0.6340000E-01  0.3597000 
1 1 1 7  34 4  o 13.68000  0.1739000     13.51000  0.2266000     13.86000  0.2638000     -0.3471000     0.3477000 
1 1 1 7  34 5  o 12.84000  0.1738000     13.07000  0.2296000     12.61000  0.2611000     0.4598000      0.3477000 
1 1 1 7  34 6  o 17.83000  0.3105000     17.91000  0.3693000     17.75000  0.4992000     0.1600000      0.6209000 
1 1 1 7  34 7  o 1.419000  0.4491000     1.855000  0.7595000     0.9826000 0.4797000     0.8728000      0.8983000 
1 1 1 7  34 8  o 16.78000  0.1931000     16.75000  0.2896000     16.80000  0.2556000     -0.5956000E-01 0.3863000 
1 1 1 7  34 9  o 16.41000  0.1940000     15.97000  0.2889000     16.84000  0.2589000     -0.8762000     0.3880000 
1 1 1 7  34 10 o 12.34000  0.1744000     12.05000  0.2477000     12.62000  0.2455000     -0.5691000     0.3487000 
1 1 1 7  34 11 o 2.999000  0.4131000     2.991000  0.5955000     3.006000  0.5728000     -0.1462000E-01 0.8262000 
1 1 1 7  34 12 o 3.395000  0.3992000     3.271000  0.5853000     3.518000  0.5429000     -0.2465000     0.7983000 
1 1 1 7  34 13 o 7.953000  0.2288000     7.419000  0.3209000     8.486000  0.3264000     -1.067000      0.4577000 
1 1 1 7  34 14 o 14.40000  0.2441000     14.51000  0.3997000     14.29000  0.2802000     0.2113000      0.4881000 
1 1 1 7  34 15 o 2.536000  0.6026000     2.510000  0.7857000     2.561000  0.9137000     -0.5083000E-01 1.205000  
1 1 1 7  34 16 o 4.406000  0.3549000     4.251000  0.5016000     4.561000  0.5022000     -0.3099000     0.7098000 
1 1 1 7  34 17 o 3.680000  0.4121000     4.102000  0.5139000     3.257000  0.6443000     0.8445000      0.8242000 
1 1 1 7  34 18 o 2.594000  0.4843000     3.339000  0.6453000     1.849000  0.7223000     1.490000       0.9685000 
1 1 1 7  34 19 o 1.844000  0.5132000     1.491000  0.6636000     2.197000  0.7831000     -0.7055000     1.026000  
1 1 1 7  34 20 o 1.296000  0.4273000     1.280000  0.6002000     1.313000  0.6083000     -0.3303000E-01 0.8546000 
1 1 1 7  34 21 o 1.875000  0.4991000     2.469000  0.7915000     1.280000  0.6083000     1.188000       0.9982000 
1 1 1 7  34 22 o 1.266000  0.4226000     1.193000  0.5743000     1.340000  0.6202000     -0.1467000     0.8452000 
1 1 1 7  34 23 o 1.293000  0.4266000     1.136000  0.5521000     1.451000  0.6506000     -0.3156000     0.8533000 
1 1 1 7  35 0  f 46.62000  0.5251000     46.62000  0.5251000     46.62000  0.5251000     -0.000000      0.000000  
1 1 1 7  35 1  o 28.03000  0.2397000     28.09000  0.3396000     27.97000  0.3385000     0.1185000      0.4795000 
1 1 1 7  35 2  o 10.61000  0.1543000     10.81000  0.2183000     10.42000  0.2182000     0.3859000      0.3087000 
1 1 1 7  35 3  o 22.01000  0.2025000     21.74000  0.2837000     22.28000  0.2891000     -0.5463000     0.4050000 
1 1 1 7  35 4  o 25.85000  0.2633000     26.02000  0.3755000     25.68000  0.3693000     0.3369000      0.5266000 
1 1 1 7  35 5  o 26.10000  0.4615000     26.10000  0.4615000     ?         ?             ?              ?         
1 1 1 7  35 6  o 2.928000  0.4964000     2.811000  0.6856000     3.046000  0.7181000     -0.2352000     0.9928000 
1 1 1 7  35 7  o 14.65000  0.1747000     14.81000  0.2512000     14.48000  0.2429000     0.3253000      0.3494000 
1 1 1 7  35 8  o 30.03000  0.2777000     29.72000  0.4161000     30.33000  0.3679000     -0.6115000     0.5554000 
1 1 1 7  35 9  o 9.078000  0.1857000     9.014000  0.2760000     9.142000  0.2484000     -0.1283000     0.3713000 
1 1 1 7  35 10 o 1.513000  0.4418000     1.689000  0.6595000     1.338000  0.5882000     0.3509000      0.8837000 
1 1 1 7  35 11 o 2.097000  0.4843000     1.933000  0.6912000     2.261000  0.6784000     -0.3280000     0.9685000 
1 1 1 7  35 12 o 16.39000  0.1943000     16.90000  0.2761000     15.88000  0.2734000     1.018000       0.3886000 
1 1 1 7  35 13 o 4.889000  0.3111000     5.211000  0.4102000     4.568000  0.4679000     0.6429000      0.6222000 
1 1 1 7  35 14 o 7.099000  0.3481000     7.242000  0.4942000     6.956000  0.4903000     0.2854000      0.6961000 
1 1 1 7  35 15 o 4.150000  0.4810000     3.344000  0.8537000     4.956000  0.4434000     -1.612000      0.9620000 
1 1 1 7  35 16 o 3.188000  0.4649000     2.545000  0.7450000     3.831000  0.5564000     -1.286000      0.9299000 
1 1 1 7  35 17 o 2.871000  0.4921000     3.266000  0.6441000     2.476000  0.7442000     0.7903000      0.9842000 
1 1 1 7  35 18 o 2.780000  0.4531000     3.723000  0.5542000     1.837000  0.7170000     1.886000       0.9063000 
1 1 1 7  35 19 o 1.151000  0.3972000     1.319000  0.6307000     0.9825000 0.4830000     0.3365000      0.7944000 
1 1 1 7  35 20 o 1.094000  0.3819000     0.9364000 0.4714000     1.251000  0.6010000     -0.3146000     0.7638000 
1 1 1 7  35 21 o 2.095000  0.5791000     1.838000  0.8828000     2.351000  0.7497000     -0.5133000     1.158000  
1 1 1 7  35 22 o 1.359000  0.4387000     1.311000  0.6100000     1.406000  0.6307000     -0.9498000E-01 0.8774000 
1 1 1 7  35 23 o 1.257000  0.4162000     1.505000  0.6660000     1.010000  0.4994000     0.4945000      0.8324000 
1 1 1 7  36 0  o 3.596000  0.3778000     3.596000  0.3778000     3.596000  0.3778000     -0.000000      0.000000  
1 1 1 7  36 1  o 14.13000  0.1634000     13.94000  0.2298000     14.31000  0.2322000     -0.3667000     0.3267000 
1 1 1 7  36 2  o 1.950000  0.4318000     2.017000  0.6418000     1.883000  0.5777000     0.1332000      0.8635000 
1 1 1 7  36 3  o 13.16000  0.2127000     13.21000  0.3286000     13.12000  0.2703000     0.9022000E-01  0.4255000 
1 1 1 7  36 4  o 21.65000  0.3356000     21.65000  0.3356000     ?         ?             ?              ?         
1 1 1 7  36 5  o 10.58000  0.2287000     10.26000  0.3226000     10.90000  0.3242000     -0.6426000     0.4574000 
1 1 1 7  36 6  o 12.23000  0.1678000     12.09000  0.2365000     12.36000  0.2382000     -0.2666000     0.3356000 
1 1 1 7  36 7  o 17.58000  0.1854000     17.49000  0.2635000     17.67000  0.2609000     -0.1764000     0.3708000 
1 1 1 7  36 8  o 9.126000  0.1869000     9.183000  0.2776000     9.068000  0.2503000     0.1148000      0.3738000 
1 1 1 7  36 9  o 9.247000  0.1901000     8.862000  0.2877000     9.631000  0.2486000     -0.7691000     0.3802000 
1 1 1 7  36 10 o 14.93000  0.1953000     14.81000  0.2935000     15.05000  0.2576000     -0.2394000     0.3905000 
1 1 1 7  36 11 o 7.545000  0.2126000     8.135000  0.2892000     6.955000  0.3117000     1.179000       0.4252000 
1 1 1 7  36 12 o 5.745000  0.2626000     5.468000  0.3865000     6.022000  0.3557000     -0.5538000     0.5252000 
1 1 1 7  36 13 o 1.815000  0.5084000     1.895000  0.7273000     1.736000  0.7106000     0.1589000      1.017000  
1 1 1 7  36 14 o 4.872000  0.4550000     4.872000  0.4550000     ?         ?             ?              ?         
1 1 1 7  36 15 o 1.753000  0.5098000     1.773000  0.7188000     1.734000  0.7232000     0.3973000E-01  1.020000  
1 1 1 7  36 16 o 7.184000  0.2382000     7.161000  0.3308000     7.207000  0.3427000     -0.4569000E-01 0.4763000 
1 1 1 7  36 17 f 6.740000  0.2510000     6.562000  0.3608000     6.919000  0.3492000     -0.3571000     0.5021000 
1 1 1 7  36 18 o 1.784000  0.5018000     1.832000  0.7138000     1.736000  0.7055000     0.9590000E-01  1.004000  
1 1 1 7  36 19 o 1.725000  0.4712000     1.357000  0.6112000     2.093000  0.7174000     -0.7360000     0.9424000 
1 1 1 7  36 20 o 1.967000  0.5803000     2.063000  0.7442000     1.871000  0.8905000     0.1917000      1.161000  
1 1 1 7  36 21 o 1.714000  0.5175000     1.872000  0.7847000     1.556000  0.6750000     0.3152000      1.035000  
1 1 1 7  36 22 o 2.787000  0.5142000     2.560000  0.7478000     3.013000  0.7061000     -0.4529000     1.028000  
1 1 1 7  36 23 o 1.384000  0.4365000     1.750000  0.7136000     1.018000  0.5029000     0.7311000      0.8730000 
1 1 1 7  37 0  o 15.25000  0.3456000     15.25000  0.3456000     15.25000  0.3456000     -0.000000      0.000000  
1 1 1 7  37 1  o 5.062000  0.3806000     5.426000  0.4313000     4.699000  0.6271000     0.7279000      0.7611000 
1 1 1 7  37 2  o 17.54000  0.5096000     17.54000  0.5096000     ?         ?             ?              ?         
1 1 1 7  37 3  o 23.42000  0.3720000     23.05000  0.4205000     23.80000  0.6138000     -0.7522000     0.7440000 
1 1 1 7  37 4  o 22.95000  0.2721000     23.12000  0.4225000     22.77000  0.3429000     0.3539000      0.5442000 
1 1 1 7  37 5  o 12.47000  0.1783000     12.52000  0.2338000     12.42000  0.2693000     0.1002000      0.3566000 
1 1 1 7  37 6  f 17.04000  0.1837000     16.95000  0.2568000     17.14000  0.2628000     -0.1909000     0.3675000 
1 1 1 7  37 7  o 15.61000  0.1790000     15.76000  0.2557000     15.45000  0.2506000     0.3131000      0.3580000 
1 1 1 7  37 8  o 10.49000  0.2023000     10.15000  0.3221000     10.84000  0.2447000     -0.6862000     0.4046000 
1 1 1 7  37 9  o 20.17000  0.2169000     20.56000  0.3291000     19.78000  0.2828000     0.7724000      0.4339000 
1 1 1 7  37 10 o 2.857000  0.4405000     2.666000  0.6835000     3.048000  0.5560000     -0.3814000     0.8811000 
1 1 1 7  37 11 o 11.03000  0.1888000     11.27000  0.2685000     10.79000  0.2655000     0.4816000      0.3776000 
1 1 1 7  37 12 o 4.341000  0.3433000     4.199000  0.5012000     4.482000  0.4694000     -0.2827000     0.6866000 
1 1 1 7  37 13 o 6.667000  0.3513000     6.487000  0.5176000     6.847000  0.4752000     -0.3607000     0.7026000 
1 1 1 7  37 14 o 6.749000  0.3396000     6.516000  0.5211000     6.981000  0.4357000     -0.4653000     0.6793000 
1 1 1 7  37 15 o 1.916000  0.5162000     1.721000  0.7075000     2.111000  0.7520000     -0.3900000     1.032000  
1 1 1 7  37 16 o 1.719000  0.4932000     1.499000  0.6625000     1.939000  0.7308000     -0.4398000     0.9864000 
1 1 1 7  37 17 o 2.363000  0.5103000     2.822000  0.7102000     1.904000  0.7330000     0.9179000      1.021000  
1 1 1 7  37 18 o 3.870000  0.3850000     4.119000  0.4973000     3.620000  0.5878000     0.4988000      0.7700000 
1 1 1 7  37 19 o 1.412000  0.4398000     1.194000  0.5639000     1.630000  0.6750000     -0.4357000     0.8796000 
1 1 1 7  37 20 o 2.893000  0.5411000     3.332000  0.7408000     2.455000  0.7888000     0.8767000      1.082000  
1 1 1 7  37 21 o 1.755000  0.5020000     1.572000  0.6823000     1.938000  0.7364000     -0.3662000     1.004000  
1 1 1 7  37 22 o 1.423000  0.4544000     1.529000  0.6713000     1.317000  0.6125000     0.2117000      0.9088000 
1 1 1 7  38 0  o 18.88000  0.3718000     18.88000  0.3718000     18.88000  0.3718000     0.000000       0.000000  
1 1 1 7  38 1  o 24.90000  0.2861000     24.86000  0.4420000     24.94000  0.3633000     -0.8099000E-01 0.5722000 
1 1 1 7  38 2  o 14.12000  0.1821000     14.36000  0.2772000     13.88000  0.2360000     0.4806000      0.3641000 
1 1 1 7  38 3  o 21.21000  0.2013000     21.16000  0.2841000     21.27000  0.2851000     -0.1091000     0.4025000 
1 1 1 7  38 4  o 14.98000  0.1855000     15.07000  0.2442000     14.88000  0.2793000     0.1961000      0.3711000 
1 1 1 7  38 5  o 5.185000  0.2374000     5.293000  0.3109000     5.077000  0.3588000     0.2151000      0.4747000 
1 1 1 7  38 6  o 1.354000  0.4104000     1.375000  0.5826000     1.332000  0.5783000     0.4259000E-01  0.8208000 
1 1 1 7  38 7  o 10.03000  0.1741000     10.23000  0.2456000     9.819000  0.2467000     0.4147000      0.3481000 
1 1 1 7  38 8  o 7.795000  0.2012000     8.067000  0.3010000     7.523000  0.2671000     0.5441000      0.4024000 
1 1 1 7  38 9  o 8.917000  0.1991000     8.902000  0.2990000     8.932000  0.2630000     -0.3043000E-01 0.3982000 
1 1 1 7  38 10 o 4.265000  0.3191000     4.158000  0.4863000     4.372000  0.4135000     -0.2145000     0.6383000 
1 1 1 7  38 11 o 7.691000  0.2189000     8.120000  0.3026000     7.262000  0.3165000     0.8580000      0.4379000 
1 1 1 7  38 12 o 12.88000  0.1955000     13.11000  0.2778000     12.65000  0.2750000     0.4624000      0.3909000 
1 1 1 7  38 13 o 11.65000  0.2889000     11.65000  0.2889000     ?         ?             ?              ?         
1 1 1 7  38 14 o 4.641000  0.3428000     4.403000  0.5006000     4.879000  0.4683000     -0.4766000     0.6855000 
1 1 1 7  38 15 o 6.945000  0.2471000     6.439000  0.3648000     7.450000  0.3335000     -1.011000      0.4943000 
1 1 1 7  38 16 o 6.369000  0.2550000     6.529000  0.3606000     6.210000  0.3607000     0.3192000      0.5100000 
1 1 1 7  38 17 o 3.119000  0.4709000     3.417000  0.6000000     2.820000  0.7260000     0.5972000      0.9418000 
1 1 1 7  38 18 o 2.239000  0.4948000     2.588000  0.6929000     1.890000  0.7066000     0.6975000      0.9896000 
1 1 1 7  38 19 o 1.416000  0.4576000     1.373000  0.6553000     1.460000  0.6388000     -0.8750000E-01 0.9151000 
1 1 1 7  38 20 o 1.695000  0.5179000     1.704000  0.7349000     1.686000  0.7299000     0.1813000E-01  1.036000  
1 1 1 7  38 21 o 1.106000  0.3808000     1.063000  0.5228000     1.148000  0.5539000     -0.8430000E-01 0.7617000 
1 1 1 7  38 22 o 1.317000  0.4326000     1.331000  0.6172000     1.304000  0.6064000     0.2658000E-01  0.8653000 
1 1 1 7  39 0  o 18.12000  0.2613000     18.12000  0.2613000     18.12000  0.2613000     0.000000       0.000000  
1 1 1 7  39 1  o 8.649000  0.1690000     8.616000  0.2395000     8.683000  0.2386000     -0.6710000E-01 0.3381000 
1 1 1 7  39 2  o 4.287000  0.2471000     4.410000  0.3381000     4.165000  0.3604000     0.2447000      0.4942000 
1 1 1 7  39 3  o 5.783000  0.2022000     5.945000  0.2800000     5.621000  0.2917000     0.3238000      0.4043000 
1 1 1 7  39 4  o 6.796000  0.2016000     6.651000  0.2699000     6.941000  0.2994000     -0.2898000     0.4031000 
1 1 1 7  39 5  o 10.18000  0.1835000     10.20000  0.2408000     10.16000  0.2769000     0.3959000E-01  0.3670000 
1 1 1 7  39 6  o 13.22000  0.1862000     13.20000  0.2418000     13.23000  0.2833000     -0.3981000E-01 0.3725000 
1 1 1 7  39 7  o 6.007000  0.2197000     5.794000  0.3243000     6.220000  0.2965000     -0.4261000     0.4394000 
1 1 1 7  39 8  o 8.873000  0.1984000     8.911000  0.2956000     8.835000  0.2646000     0.7595000E-01  0.3967000 
1 1 1 7  39 9  o 8.044000  0.2111000     8.164000  0.3147000     7.923000  0.2816000     0.2418000      0.4223000 
1 1 1 7  39 10 o 8.183000  0.2180000     8.535000  0.3219000     7.831000  0.2941000     0.7042000      0.4360000 
1 1 1 7  39 11 o 1.688000  0.4801000     1.859000  0.7070000     1.517000  0.6497000     0.3419000      0.9602000 
1 1 1 7  39 12 o 5.551000  0.4028000     5.543000  0.5887000     5.558000  0.5499000     -0.1564000E-01 0.8056000 
1 1 1 7  39 13 o 3.227000  0.5920000     2.762000  0.9290000     3.692000  0.7340000     -0.9300000     1.184000  
1 1 1 7  39 14 o 6.858000  0.2494000     6.936000  0.3486000     6.781000  0.3568000     0.1550000      0.4988000 
1 1 1 7  39 15 o 7.779000  0.2297000     7.774000  0.3251000     7.784000  0.3246000     -0.9676000E-02 0.4594000 
1 1 1 7  39 16 o 2.638000  0.5160000     2.757000  0.7118000     2.518000  0.7474000     0.2388000      1.032000  
1 1 1 7  39 17 o 3.397000  0.4301000     3.646000  0.5712000     3.149000  0.6431000     0.4963000      0.8602000 
1 1 1 7  39 18 o 5.352000  0.2870000     5.488000  0.3920000     5.215000  0.4193000     0.2725000      0.5740000 
1 1 1 7  39 19 o 1.746000  0.5087000     1.463000  0.6364000     2.030000  0.7939000     -0.5667000     1.017000  
1 1 1 7  39 20 o 1.509000  0.4616000     1.478000  0.6595000     1.541000  0.6459000     -0.6334000E-01 0.9231000 
1 1 1 7  39 21 o 2.100000  0.5205000     2.309000  0.7396000     1.890000  0.7327000     0.4189000      1.041000  
1 1 1 7  39 22 o 1.577000  0.4506000     2.149000  0.7501000     1.005000  0.4994000     1.143000       0.9012000 
1 1 1 7  40 0  o 1.185000  0.6854000     1.185000  0.6854000     1.185000  0.6854000     0.000000       0.000000  
1 1 1 7  40 1  o 11.36000  0.1658000     11.37000  0.2345000     11.36000  0.2344000     0.3668000E-02  0.3315000 
1 1 1 7  40 2  o 20.47000  0.1989000     20.18000  0.2794000     20.75000  0.2831000     -0.5672000     0.3978000 
1 1 1 7  40 3  o 9.886000  0.1708000     10.06000  0.2403000     9.715000  0.2427000     0.3424000      0.3415000 
1 1 1 7  40 4  o 6.664000  0.2080000     6.751000  0.2743000     6.577000  0.3127000     0.1747000      0.4159000 
1 1 1 7  40 5  o 13.57000  0.1864000     13.66000  0.2441000     13.47000  0.2818000     0.1861000      0.3728000 
1 1 1 7  40 6  o 7.805000  0.2022000     7.736000  0.2691000     7.875000  0.3019000     -0.1388000     0.4044000 
1 1 1 7  40 7  o 9.009000  0.1879000     8.896000  0.2668000     9.123000  0.2648000     -0.2271000     0.3759000 
1 1 1 7  40 8  o 10.64000  0.1947000     10.76000  0.2939000     10.51000  0.2555000     0.2535000      0.3895000 
1 1 1 7  40 9  o 4.236000  0.3276000     4.474000  0.4621000     3.997000  0.4645000     0.4764000      0.6552000 
1 1 1 7  40 10 o 8.673000  0.2156000     8.559000  0.3232000     8.788000  0.2855000     -0.2295000     0.4312000 
1 1 1 7  40 11 o 9.111000  0.2579000     9.060000  0.4265000     9.163000  0.2902000     -0.1029000     0.5158000 
1 1 1 7  40 12 o 4.631000  0.4845000     4.631000  0.4845000     ?         ?             ?              ?         
1 1 1 7  40 13 o 3.452000  0.4573000     3.946000  0.5612000     2.957000  0.7222000     0.9892000      0.9146000 
1 1 1 7  40 14 o 3.957000  0.3863000     4.022000  0.5413000     3.893000  0.5512000     0.1291000      0.7725000 
1 1 1 7  40 15 o 6.629000  0.2454000     6.624000  0.3483000     6.634000  0.3458000     -0.9568000E-02 0.4908000 
1 1 1 7  40 16 o 3.659000  0.4166000     3.820000  0.5576000     3.499000  0.6192000     0.3207000      0.8333000 
1 1 1 7  40 17 o 1.130000  0.3850000     1.058000  0.5173000     1.203000  0.5705000     -0.1451000     0.7701000 
1 1 1 7  40 18 o 1.759000  0.4877000     1.454000  0.6393000     2.064000  0.7366000     -0.6099000     0.9754000 
1 1 1 7  40 19 o 2.419000  0.5429000     2.650000  0.6731000     2.188000  0.8519000     0.4624000      1.086000  
1 1 1 7  40 20 o 1.356000  0.4249000     1.179000  0.5524000     1.533000  0.6457000     -0.3542000     0.8498000 
1 1 1 7  40 21 o 1.743000  0.4782000     2.358000  0.7951000     1.129000  0.5314000     1.229000       0.9563000 
1 1 1 7  40 22 o 1.479000  0.4858000     1.520000  0.7021000     1.438000  0.6717000     0.8264000E-01  0.9716000 
1 1 1 7  41 0  o 3.323000  0.4549000     3.323000  0.4549000     3.323000  0.4549000     -0.000000      0.000000  
1 1 1 7  41 1  o 4.678000  0.2413000     4.611000  0.3517000     4.746000  0.3305000     -0.1344000     0.4826000 
1 1 1 7  41 2  o 14.34000  0.1744000     14.09000  0.2449000     14.58000  0.2483000     -0.4947000     0.3488000 
1 1 1 7  41 3  o 17.25000  0.1852000     17.26000  0.2603000     17.23000  0.2634000     0.3459000E-01  0.3703000 
1 1 1 7  41 4  o 3.892000  0.3122000     4.124000  0.3814000     3.660000  0.4945000     0.4635000      0.6245000 
1 1 1 7  41 5  o 7.511000  0.2084000     7.990000  0.2652000     7.033000  0.3214000     0.9569000      0.4167000 
1 1 1 7  41 6  o 4.594000  0.2976000     4.733000  0.3738000     4.455000  0.4632000     0.2775000      0.5952000 
1 1 1 7  41 7  o 18.77000  0.1980000     18.99000  0.2814000     18.55000  0.2786000     0.4338000      0.3960000 
1 1 1 7  41 8  o 8.015000  0.2167000     7.900000  0.3296000     8.130000  0.2813000     -0.2297000     0.4333000 
1 1 1 7  41 9  o 7.054000  0.2352000     6.941000  0.3531000     7.167000  0.3110000     -0.2257000     0.4705000 
1 1 1 7  41 10 o 4.879000  0.3120000     4.959000  0.4564000     4.799000  0.4255000     0.1603000      0.6240000 
1 1 1 7  41 11 o 3.003000  0.6640000     2.971000  0.8627000     3.035000  1.010000      -0.6440000E-01 1.328000  
1 1 1 7  41 12 o 7.441000  0.2926000     7.537000  0.4783000     7.344000  0.3372000     0.1935000      0.5852000 
1 1 1 7  41 13 o 3.127000  0.4742000     3.055000  0.6829000     3.198000  0.6580000     -0.1425000     0.9483000 
1 1 1 7  41 14 o 1.450000  0.4599000     1.368000  0.6280000     1.533000  0.6721000     -0.1645000     0.9198000 
1 1 1 7  41 15 o 1.744000  0.4930000     1.589000  0.6741000     1.898000  0.7196000     -0.3091000     0.9860000 
1 1 1 7  41 16 o 2.720000  0.5141000     2.818000  0.7064000     2.622000  0.7471000     0.1961000      1.028000  
1 1 1 7  41 17 o 1.543000  0.4636000     1.623000  0.6693000     1.464000  0.6418000     0.1585000      0.9273000 
1 1 1 7  41 18 o 1.394000  0.4630000     1.673000  0.7520000     1.115000  0.5404000     0.5579000      0.9260000 
1 1 1 7  41 19 o 1.390000  0.4510000     1.482000  0.6800000     1.299000  0.5926000     0.1834000      0.9020000 
1 1 1 7  41 20 o 1.368000  0.4196000     1.064000  0.5133000     1.673000  0.6640000     -0.6092000     0.8393000 
1 1 1 7  41 21 o 2.444000  0.4981000     2.433000  0.7058000     2.454000  0.7029000     -0.2162000E-01 0.9961000 
1 1 1 7  42 0  o 6.614000  0.2814000     6.614000  0.2814000     6.614000  0.2814000     0.000000       0.000000  
1 1 1 7  42 1  o 2.902000  0.3811000     2.435000  0.6032000     3.369000  0.4661000     -0.9338000     0.7623000 
1 1 1 7  42 2  o 6.503000  0.2034000     6.697000  0.2861000     6.309000  0.2891000     0.3883000      0.4067000 
1 1 1 7  42 3  o 11.20000  0.1731000     11.18000  0.2436000     11.21000  0.2461000     -0.3844000E-01 0.3463000 
1 1 1 7  42 4  o 8.984000  0.1933000     8.927000  0.2544000     9.042000  0.2911000     -0.1148000     0.3866000 
1 1 1 7  42 5  o 16.48000  0.2012000     16.46000  0.2630000     16.51000  0.3047000     -0.4771000E-01 0.4025000 
1 1 1 7  42 6  o 12.18000  0.1949000     12.28000  0.2548000     12.08000  0.2951000     0.1961000      0.3898000 
1 1 1 7  42 7  o 4.882000  0.2731000     4.899000  0.3854000     4.865000  0.3871000     0.3402000E-01  0.5462000 
1 1 1 7  42 8  o 3.216000  0.4303000     3.561000  0.5817000     2.871000  0.6342000     0.6898000      0.8606000 
1 1 1 7  42 9  o 9.548000  0.2125000     9.812000  0.3172000     9.284000  0.2828000     0.5281000      0.4249000 
1 1 1 7  42 10 o 5.903000  0.3250000     5.906000  0.5386000     5.899000  0.3639000     0.7294000E-02  0.6500000 
1 1 1 7  42 11 o 7.275000  0.3416000     7.924000  0.4438000     6.627000  0.5194000     1.297000       0.6832000 
1 1 1 7  42 12 o 6.582000  0.2516000     6.524000  0.3579000     6.641000  0.3538000     -0.1175000     0.5033000 
1 1 1 7  42 13 o 1.970000  0.5100000     2.345000  0.7617000     1.595000  0.6785000     0.7495000      1.020000  
1 1 1 7  42 14 o 1.742000  0.4653000     2.314000  0.7437000     1.170000  0.5594000     1.143000       0.9306000 
1 1 1 7  42 15 o 2.100000  0.5027000     1.655000  0.6893000     2.544000  0.7317000     -0.8888000     1.005000  
1 1 1 7  42 16 o 1.356000  0.4382000     1.361000  0.6207000     1.350000  0.6188000     0.1088000E-01  0.8764000 
1 1 1 7  42 17 o 2.176000  0.4497000     1.385000  0.6228000     2.967000  0.6489000     -1.582000      0.8994000 
1 1 1 7  42 18 f 1.567000  0.4983000     1.615000  0.6733000     1.519000  0.7347000     0.9564000E-01  0.9966000 
1 1 1 7  42 19 o 1.569000  0.4478000     2.032000  0.7221000     1.107000  0.5296000     0.9254000      0.8955000 
1 1 1 7  42 20 o 1.062000  0.3628000     1.139000  0.5410000     0.9860000 0.4835000     0.1526000      0.7256000 
1 1 1 7  42 21 o 1.193000  0.3936000     1.405000  0.6227000     0.9798000 0.4817000     0.4254000      0.7872000 
1 1 1 7  43 0  o 11.27000  0.2462000     11.27000  0.2462000     11.27000  0.2462000     0.000000       0.000000  
1 1 1 7  43 1  o 14.85000  0.1793000     15.05000  0.2536000     14.65000  0.2534000     0.3988000      0.3585000 
1 1 1 7  43 2  o 15.71000  0.1818000     15.86000  0.2585000     15.56000  0.2555000     0.3076000      0.3635000 
1 1 1 7  43 3  o 13.77000  0.1788000     13.81000  0.2523000     13.73000  0.2534000     0.8085000E-01  0.3576000 
1 1 1 7  43 4  o 5.879000  0.2407000     6.078000  0.3068000     5.681000  0.3710000     0.3976000      0.4814000 
1 1 1 7  43 5  o 6.464000  0.2362000     6.552000  0.3051000     6.376000  0.3607000     0.1757000      0.4724000 
1 1 1 7  43 6  f 9.388000  0.2048000     9.327000  0.2664000     9.450000  0.3110000     -0.1235000     0.4095000 
1 1 1 7  43 7  o 1.523000  0.4526000     1.680000  0.6712000     1.365000  0.6073000     0.3154000      0.9052000 
1 1 1 7  43 8  o 7.583000  0.2161000     7.355000  0.3147000     7.810000  0.2962000     -0.4545000     0.4322000 
1 1 1 7  43 9  o 13.17000  0.2726000     12.95000  0.3905000     13.39000  0.3805000     -0.4401000     0.5452000 
1 1 1 7  43 10 o 7.589000  0.3609000     7.589000  0.3609000     ?         ?             ?              ?         
1 1 1 7  43 11 o 5.003000  0.3845000     4.449000  0.6651000     5.558000  0.3858000     -1.109000      0.7689000 
1 1 1 7  43 12 o 4.825000  0.3198000     5.115000  0.4285000     4.536000  0.4750000     0.5790000      0.6397000 
1 1 1 7  43 13 o 2.519000  0.4208000     3.684000  0.5661000     1.354000  0.6227000     2.330000       0.8416000 
1 1 1 7  43 14 o 2.097000  0.5254000     2.037000  0.7396000     2.157000  0.7466000     -0.1204000     1.051000  
1 1 1 7  43 15 o 3.084000  0.4653000     3.765000  0.5663000     2.402000  0.7385000     1.363000       0.9306000 
1 1 1 7  43 16 o 3.124000  0.4670000     3.295000  0.6428000     2.953000  0.6777000     0.3425000      0.9340000 
1 1 1 7  43 17 o 3.299000  0.5166000     3.271000  0.8402000     3.327000  0.6015000     -0.5626000E-01 1.033000  
1 1 1 7  43 18 o 1.998000  0.5536000     2.188000  0.7741000     1.809000  0.7916000     0.3784000      1.107000  
1 1 1 7  43 19 o 1.940000  0.5013000     1.794000  0.6976000     2.086000  0.7201000     -0.2918000     1.003000  
1 1 1 7  43 20 o 1.354000  0.4302000     1.442000  0.6312000     1.267000  0.5846000     0.1751000      0.8603000 
1 1 1 7  43 21 o 1.879000  0.5991000     2.379000  0.9875000     1.379000  0.6788000     1.000000       1.198000  
1 1 1 7  44 0  o 3.669000  0.4710000     3.669000  0.4710000     3.669000  0.4710000     0.000000       0.000000  
1 1 1 7  44 1  o 6.038000  0.2199000     5.909000  0.3166000     6.168000  0.3052000     -0.2587000     0.4397000 
1 1 1 7  44 2  o 5.792000  0.2316000     6.162000  0.3084000     5.423000  0.3456000     0.7389000      0.4632000 
1 1 1 7  44 3  o 2.553000  0.4210000     1.843000  0.6634000     3.263000  0.5187000     -1.420000      0.8421000 
1 1 1 7  44 4  o 10.01000  0.1962000     10.08000  0.2577000     9.946000  0.2958000     0.1298000      0.3924000 
1 1 1 7  44 5  f 8.699000  0.2080000     8.489000  0.2803000     8.910000  0.3073000     -0.4209000     0.4160000 
1 1 1 7  44 6  o 2.451000  0.4899000     1.903000  0.6895000     2.999000  0.6962000     -1.096000      0.9798000 
1 1 1 7  44 7  o 1.947000  0.4445000     1.244000  0.5797000     2.649000  0.6740000     -1.404000      0.8890000 
1 1 1 7  44 8  o 4.590000  0.3518000     4.886000  0.5413000     4.294000  0.4495000     0.5919000      0.7036000 
1 1 1 7  44 9  f 7.019000  0.3694000     7.019000  0.3694000     ?         ?             ?              ?         
1 1 1 7  44 10 o 8.151000  0.3274000     7.502000  0.5816000     8.801000  0.3009000     -1.299000      0.6548000 
1 1 1 7  44 11 o 8.033000  0.2383000     7.589000  0.3605000     8.477000  0.3117000     -0.8883000     0.4765000 
1 1 1 7  44 12 o 3.894000  0.3810000     4.094000  0.5136000     3.695000  0.5628000     0.3984000      0.7620000 
1 1 1 7  44 13 o 1.296000  0.4256000     1.247000  0.5869000     1.346000  0.6165000     -0.9809000E-01 0.8512000 
1 1 1 7  44 14 o 1.928000  0.4930000     1.526000  0.6643000     2.329000  0.7285000     -0.8032000     0.9859000 
1 1 1 7  44 15 o 1.706000  0.4733000     1.179000  0.5649000     2.232000  0.7595000     -1.053000      0.9466000 
1 1 1 7  44 16 o 1.523000  0.4664000     1.365000  0.6211000     1.682000  0.6960000     -0.3173000     0.9328000 
1 1 1 7  44 17 o 2.898000  0.5580000     2.540000  0.7563000     3.257000  0.8207000     -0.7169000     1.116000  
1 1 1 7  44 18 o 1.728000  0.5044000     1.888000  0.7639000     1.568000  0.6589000     0.3192000      1.009000  
1 1 1 7  44 19 o 1.343000  0.4274000     1.260000  0.5795000     1.427000  0.6284000     -0.1667000     0.8548000 
1 1 1 7  44 20 o 1.207000  0.3959000     0.9949000 0.4893000     1.420000  0.6224000     -0.4247000     0.7917000 
1 1 1 7  45 0  o 0.7922000 0.5498000     0.7922000 0.5498000     0.7922000 0.5498000     0.000000       0.000000  
1 1 1 7  45 1  o 9.351000  0.1868000     9.368000  0.2645000     9.334000  0.2639000     0.3436000E-01  0.3736000 
1 1 1 7  45 2  o 8.209000  0.1948000     8.411000  0.2735000     8.007000  0.2775000     0.4036000      0.3897000 
1 1 1 7  45 3  o 12.54000  0.1821000     12.36000  0.2594000     12.72000  0.2556000     -0.3580000     0.3642000 
1 1 1 7  45 4  o 9.866000  0.2014000     9.886000  0.2627000     9.845000  0.3053000     0.4130000E-01  0.4028000 
1 1 1 7  45 5  o 7.937000  0.2227000     7.817000  0.2905000     8.057000  0.3376000     -0.2401000     0.4453000 
1 1 1 7  45 6  o 7.120000  0.2373000     6.949000  0.3119000     7.291000  0.3578000     -0.3420000     0.4747000 
1 1 1 7  45 7  o 9.063000  0.2266000     8.693000  0.3565000     9.433000  0.2799000     -0.7395000     0.4532000 
1 1 1 7  45 8  o 2.180000  0.7761000     2.180000  0.7761000     ?         ?             ?              ?         
1 1 1 7  45 9  o 3.751000  0.5310000     3.926000  0.8894000     3.575000  0.5803000     0.3511000      1.062000  
1 1 1 7  45 10 o 7.088000  0.2531000     6.795000  0.3855000     7.380000  0.3281000     -0.5851000     0.5062000 
1 1 1 7  45 11 o 6.657000  0.2597000     6.858000  0.3788000     6.456000  0.3552000     0.4021000      0.5193000 
1 1 1 7  45 12 o 2.116000  0.5124000     2.139000  0.7300000     2.093000  0.7192000     0.4574000E-01  1.025000  
1 1 1 7  45 13 o 4.224000  0.3543000     4.156000  0.5076000     4.293000  0.4945000     -0.1366000     0.7087000 
1 1 1 7  45 14 o 3.454000  0.4360000     3.409000  0.6390000     3.499000  0.5932000     -0.8978000E-01 0.8719000 
1 1 1 7  45 15 o 1.155000  0.3931000     1.120000  0.5416000     1.190000  0.5698000     -0.6954000E-01 0.7861000 
1 1 1 7  45 16 o 1.426000  0.4700000     1.537000  0.7167000     1.315000  0.6083000     0.2221000      0.9400000 
1 1 1 7  45 17 o 1.628000  0.5132000     1.476000  0.6556000     1.781000  0.7897000     -0.3052000     1.026000  
1 1 1 7  45 18 o 1.411000  0.4392000     1.580000  0.6610000     1.241000  0.5786000     0.3391000      0.8785000 
1 1 1 7  45 19 o 1.503000  0.4465000     1.788000  0.6855000     1.218000  0.5723000     0.5693000      0.8930000 
1 1 1 7  45 20 o 1.288000  0.4158000     1.053000  0.5089000     1.523000  0.6576000     -0.4695000     0.8315000 
1 1 1 7  46 0  o 3.779000  0.4961000     3.779000  0.4961000     3.779000  0.4961000     0.000000       0.000000  
1 1 1 7  46 1  o 6.105000  0.2303000     5.893000  0.3324000     6.318000  0.3188000     -0.4251000     0.4605000 
1 1 1 7  46 2  o 5.265000  0.2536000     5.057000  0.3675000     5.474000  0.3495000     -0.4167000     0.5071000 
1 1 1 7  46 3  o 4.787000  0.2784000     4.905000  0.3869000     4.669000  0.4003000     0.2355000      0.5567000 
1 1 1 7  46 4  o 7.374000  0.2280000     7.338000  0.2999000     7.410000  0.3435000     -0.7210000E-01 0.4560000 
1 1 1 7  46 5  o 1.432000  0.4479000     1.447000  0.6250000     1.417000  0.6418000     0.2944000E-01  0.8959000 
1 1 1 7  46 6  o 2.150000  0.5708000     2.175000  0.8501000     2.125000  0.7621000     0.5003000E-01  1.142000  
1 1 1 7  46 7  o 6.278000  0.4085000     6.278000  0.4085000     ?         ?             ?              ?         
1 1 1 7  46 8  o 4.307000  0.4155000     4.049000  0.6853000     4.565000  0.4699000     -0.5157000     0.8309000 
1 1 1 7  46 9  o 2.675000  0.5110000     2.334000  0.7740000     3.017000  0.6673000     -0.6833000     1.022000  
1 1 1 7  46 10 o 3.861000  0.4100000     4.413000  0.5362000     3.308000  0.6203000     1.106000       0.8200000 
1 1 1 7  46 11 o 1.508000  0.4674000     1.445000  0.6552000     1.572000  0.6669000     -0.1264000     0.9349000 
1 1 1 7  46 12 o 1.471000  0.4564000     1.411000  0.6334000     1.531000  0.6572000     -0.1197000     0.9127000 
1 1 1 7  46 13 o 1.913000  0.4916000     1.518000  0.6615000     2.308000  0.7275000     -0.7896000     0.9833000 
1 1 1 7  46 14 o 2.485000  0.5137000     2.261000  0.7408000     2.709000  0.7118000     -0.4475000     1.027000  
1 1 1 7  46 15 o 1.761000  0.4618000     2.369000  0.7381000     1.153000  0.5552000     1.216000       0.9236000 
1 1 1 7  46 16 o 1.654000  0.5251000     1.447000  0.6906000     1.862000  0.7911000     -0.4144000     1.050000  
1 1 1 7  46 17 o 2.344000  0.5492000     2.418000  0.8207000     2.271000  0.7300000     0.1472000      1.098000  
1 1 1 7  46 18 o 1.255000  0.4095000     1.234000  0.5727000     1.276000  0.5854000     -0.4173000E-01 0.8190000 
1 1 1 7  46 19 o 1.389000  0.4329000     1.629000  0.6730000     1.148000  0.5447000     0.4808000      0.8658000 
1 1 1 7  47 0  o 7.378000  0.3048000     7.378000  0.3048000     7.378000  0.3048000     0.000000       0.000000  
1 1 1 7  47 1  o 1.749000  0.4796000     1.757000  0.6772000     1.742000  0.6793000     0.1550000E-01  0.9592000 
1 1 1 7  47 2  o 8.728000  0.2020000     8.832000  0.2828000     8.625000  0.2886000     0.2066000      0.4041000 
1 1 1 7  47 3  o 5.182000  0.2692000     5.573000  0.3540000     4.791000  0.4057000     0.7823000      0.5384000 
1 1 1 7  47 4  o 7.920000  0.2239000     7.649000  0.2993000     8.190000  0.3330000     -0.5412000     0.4477000 
1 1 1 7  47 5  o 9.976000  0.2788000     9.887000  0.3932000     10.06000  0.3952000     -0.1778000     0.5575000 
1 1 1 7  47 6  f 7.966000  0.3496000     7.966000  0.3496000     ?         ?             ?              ?         
1 1 1 7  47 7  o 7.416000  0.2686000     7.523000  0.4249000     7.309000  0.3286000     0.2144000      0.5371000 
1 1 1 7  47 8  o 4.076000  0.3553000     4.289000  0.4661000     3.864000  0.5365000     0.4249000      0.7107000 
1 1 1 7  47 9  o 2.066000  0.5228000     2.434000  0.7810000     1.699000  0.6953000     0.7344000      1.046000  
1 1 1 7  47 10 o 6.231000  0.2754000     6.269000  0.4085000     6.193000  0.3694000     0.7591000E-01  0.5508000 
1 1 1 7  47 11 o 2.138000  0.5308000     2.399000  0.7834000     1.877000  0.7164000     0.5218000      1.062000  
1 1 1 7  47 12 f 1.964000  0.5044000     1.680000  0.6913000     2.248000  0.7346000     -0.5676000     1.009000  
1 1 1 7  47 13 o 2.282000  0.5087000     2.642000  0.7144000     1.923000  0.7243000     0.7190000      1.017000  
1 1 1 7  47 14 o 2.951000  0.4735000     3.375000  0.6017000     2.526000  0.7312000     0.8486000      0.9470000 
1 1 1 7  47 15 o 4.527000  0.4264000     4.291000  0.7331000     4.764000  0.4356000     -0.4728000     0.8528000 
1 1 1 7  47 16 o 2.745000  0.6238000     2.900000  0.7176000     2.589000  1.021000      0.3114000      1.248000  
1 1 1 7  47 17 o 1.246000  0.4130000     1.118000  0.5382000     1.375000  0.6266000     -0.2568000     0.8260000 
1 1 1 7  47 18 o 1.815000  0.4898000     1.533000  0.6575000     2.097000  0.7261000     -0.5640000     0.9796000 
1 1 1 7  47 19 o 1.658000  0.4761000     1.855000  0.7020000     1.461000  0.6435000     0.3945000      0.9523000 
1 1 1 7  48 0  o 5.100000  0.3865000     5.100000  0.3865000     5.100000  0.3865000     -0.000000      0.000000  
1 1 1 7  48 1  o 4.464000  0.3032000     4.367000  0.4459000     4.561000  0.4111000     -0.1943000     0.6065000 
1 1 1 7  48 2  o 8.624000  0.2265000     8.556000  0.3461000     8.691000  0.2923000     -0.1348000     0.4530000 
1 1 1 7  48 3  o 14.24000  0.2487000     14.35000  0.3876000     14.12000  0.3117000     0.2373000      0.4974000 
1 1 1 7  48 4  o 4.148000  0.6868000     4.148000  0.6868000     ?         ?             ?              ?         
1 1 1 7  48 5  o 2.641000  0.6415000     1.686000  0.7415000     3.596000  1.047000      -1.910000      1.283000  
1 1 1 7  48 6  o 3.030000  0.5101000     3.407000  0.6730000     2.653000  0.7667000     0.7534000      1.020000  
1 1 1 7  48 7  o 2.031000  0.5095000     1.803000  0.7055000     2.259000  0.7354000     -0.4551000     1.019000  
1 1 1 7  48 8  o 3.160000  0.4614000     3.103000  0.6507000     3.217000  0.6544000     -0.1142000     0.9228000 
1 1 1 7  48 9  o 4.183000  0.3802000     4.209000  0.5766000     4.157000  0.4956000     0.5192000E-01  0.7603000 
1 1 1 7  48 10 o 5.556000  0.2994000     5.854000  0.4395000     5.257000  0.4065000     0.5976000      0.5987000 
1 1 1 7  48 11 o 4.872000  0.3309000     4.949000  0.4884000     4.795000  0.4466000     0.1548000      0.6618000 
1 1 1 7  48 12 o 1.511000  0.4649000     1.409000  0.6337000     1.613000  0.6804000     -0.2039000     0.9298000 
1 1 1 7  48 13 o 4.952000  0.3148000     4.634000  0.4729000     5.271000  0.4156000     -0.6371000     0.6295000 
1 1 1 7  48 14 o 4.196000  0.3636000     4.473000  0.4806000     3.919000  0.5456000     0.5537000      0.7271000 
1 1 1 7  48 15 o 2.085000  0.5753000     1.861000  0.8044000     2.309000  0.8226000     -0.4479000     1.151000  
1 1 1 7  48 16 o 1.513000  0.4756000     1.446000  0.6753000     1.580000  0.6700000     -0.1343000     0.9513000 
1 1 1 7  48 17 o 1.950000  0.5085000     1.994000  0.7228000     1.907000  0.7153000     0.8741000E-01  1.017000  
1 1 1 7  48 18 o 1.230000  0.4050000     1.112000  0.5342000     1.348000  0.6089000     -0.2357000     0.8100000 
1 1 1 7  48 19 o 1.675000  0.4951000     1.706000  0.7039000     1.644000  0.6964000     0.6237000E-01  0.9901000 
1 1 1 7  49 0  o 3.223000  1.262000      3.223000  1.262000      3.223000  1.262000      -0.000000      0.000000  
1 1 1 7  49 1  o 4.135000  1.021000      4.135000  1.021000      ?         ?             ?              ?         
1 1 1 7  49 2  o 11.67000  0.5436000     11.67000  0.5436000     ?         ?             ?              ?         
1 1 1 7  49 3  o 6.184000  0.4413000     6.302000  0.4787000     6.065000  0.7414000     0.2366000      0.8825000 
1 1 1 7  49 4  o 6.175000  0.3234000     5.931000  0.5038000     6.419000  0.4058000     -0.4881000     0.6469000 
1 1 1 7  49 5  o 5.284000  0.2941000     4.892000  0.4044000     5.676000  0.4272000     -0.7835000     0.5882000 
1 1 1 7  49 6  o 3.731000  0.4098000     3.237000  0.6094000     4.226000  0.5480000     -0.9884000     0.8195000 
1 1 1 7  49 7  o 4.654000  0.3293000     5.030000  0.4208000     4.278000  0.5066000     0.7517000      0.6586000 
1 1 1 7  49 8  o 3.929000  0.3961000     4.338000  0.4978000     3.521000  0.6163000     0.8166000      0.7923000 
1 1 1 7  49 9  o 2.489000  0.4757000     3.188000  0.6400000     1.791000  0.7041000     1.397000       0.9515000 
1 1 1 7  49 10 o 4.808000  0.3358000     5.055000  0.4834000     4.562000  0.4661000     0.4931000      0.6715000 
1 1 1 7  49 11 o 2.141000  0.5327000     2.068000  0.7701000     2.214000  0.7363000     -0.1457000     1.065000  
1 1 1 7  49 12 o 4.978000  0.3150000     5.642000  0.3937000     4.313000  0.4919000     1.330000       0.6300000 
1 1 1 7  49 13 o 1.439000  0.4514000     1.287000  0.5973000     1.591000  0.6769000     -0.3032000     0.9028000 
1 1 1 7  49 14 o 3.584000  0.5216000     2.993000  0.9216000     4.176000  0.4888000     -1.184000      1.043000  
1 1 1 7  49 15 f 1.640000  0.5163000     1.652000  0.6985000     1.628000  0.7605000     0.2341000E-01  1.033000  
1 1 1 7  49 16 o 4.640000  0.3225000     4.069000  0.4921000     5.211000  0.4170000     -1.142000      0.6451000 
1 1 1 7  49 17 f 1.389000  0.4324000     1.672000  0.6815000     1.106000  0.5325000     0.5665000      0.8649000 
1 1 1 7  49 18 o 1.618000  0.4598000     1.159000  0.5534000     2.077000  0.7346000     -0.9180000     0.9197000 
1 1 1 7  50 0  o 8.929000  0.3356000     8.929000  0.3356000     8.929000  0.3356000     0.000000       0.000000  
1 1 1 7  50 1  o 3.783000  0.4112000     4.312000  0.5562000     3.255000  0.6057000     1.057000       0.8224000 
1 1 1 7  50 2  o 9.302000  0.2043000     9.168000  0.2931000     9.437000  0.2847000     -0.2683000     0.4086000 
1 1 1 7  50 3  o 2.312000  0.4894000     1.813000  0.6996000     2.812000  0.6845000     -0.9995000     0.9788000 
1 1 1 7  50 4  o 4.514000  0.3464000     4.761000  0.4251000     4.266000  0.5471000     0.4946000      0.6928000 
1 1 1 7  50 5  o 4.039000  0.3809000     3.967000  0.4913000     4.111000  0.5822000     -0.1441000     0.7618000 
1 1 1 7  50 6  o 2.869000  0.4897000     2.191000  0.7231000     3.548000  0.6604000     -1.357000      0.9793000 
1 1 1 7  50 7  o 9.428000  0.2117000     9.162000  0.2994000     9.694000  0.2995000     -0.5321000     0.4235000 
1 1 1 7  50 8  o 3.632000  0.4054000     3.763000  0.5515000     3.501000  0.5943000     0.2622000      0.8108000 
1 1 1 7  50 9  o 1.696000  0.4841000     1.977000  0.7331000     1.415000  0.6323000     0.5617000      0.9681000 
1 1 1 7  50 10 f 2.113000  0.5086000     1.652000  0.7187000     2.573000  0.7197000     -0.9212000     1.017000  
1 1 1 7  50 11 o 4.327000  0.3677000     4.065000  0.5683000     4.588000  0.4669000     -0.5235000     0.7355000 
1 1 1 7  50 12 o 1.959000  0.4849000     2.633000  0.7662000     1.284000  0.5946000     1.349000       0.9699000 
1 1 1 7  50 13 o 2.177000  0.5032000     2.563000  0.7159000     1.791000  0.7073000     0.7722000      1.006000  
1 1 1 7  50 14 o 2.674000  0.5815000     1.822000  0.7098000     3.526000  0.9213000     -1.703000      1.163000  
1 1 1 7  50 15 o 2.076000  0.5072000     1.640000  0.7087000     2.512000  0.7258000     -0.8723000     1.014000  
1 1 1 7  50 16 o 1.270000  0.4168000     1.262000  0.5862000     1.278000  0.5926000     -0.1544000E-01 0.8336000 
1 1 1 7  50 17 o 2.044000  0.5058000     2.092000  0.7171000     1.996000  0.7135000     0.9589000E-01  1.012000  
1 1 1 7  50 18 o 1.603000  0.4453000     1.117000  0.5376000     2.090000  0.7099000     -0.9727000     0.8905000 
1 1 1 7  51 0  o 13.26000  0.2720000     13.26000  0.2720000     13.26000  0.2720000     -0.000000      0.000000  
1 1 1 7  51 1  o 9.937000  0.2018000     9.701000  0.2869000     10.17000  0.2840000     -0.4727000     0.4037000 
1 1 1 7  51 2  o 10.16000  0.2010000     10.04000  0.2850000     10.28000  0.2834000     -0.2437000     0.4019000 
1 1 1 7  51 3  o 6.932000  0.2383000     7.058000  0.3289000     6.806000  0.3450000     0.2515000      0.4767000 
1 1 1 7  51 4  o 9.080000  0.2236000     9.103000  0.2924000     9.057000  0.3384000     0.4536000E-01  0.4472000 
1 1 1 7  51 5  o 3.176000  0.4704000     2.964000  0.6471000     3.387000  0.6829000     -0.4226000     0.9408000 
1 1 1 7  51 6  o 2.955000  0.4959000     2.756000  0.6837000     3.155000  0.7186000     -0.3998000     0.9918000 
1 1 1 7  51 7  o 2.945000  0.5121000     3.159000  0.7296000     2.730000  0.7189000     0.4293000      1.024000  
1 1 1 7  51 8  o 3.702000  0.4001000     3.476000  0.6105000     3.928000  0.5171000     -0.4523000     0.8001000 
1 1 1 7  51 9  o 1.684000  0.4826000     1.428000  0.6474000     1.939000  0.7159000     -0.5119000     0.9652000 
1 1 1 7  51 10 o 5.024000  0.3371000     4.756000  0.5265000     5.291000  0.4212000     -0.5349000     0.6743000 
1 1 1 7  51 11 o 3.959000  0.4170000     3.643000  0.6676000     4.275000  0.4997000     -0.6320000     0.8339000 
1 1 1 7  51 12 o 1.496000  0.4640000     1.429000  0.6483000     1.563000  0.6641000     -0.1338000     0.9281000 
1 1 1 7  51 13 o 2.339000  0.5914000     2.200000  0.8689000     2.478000  0.8026000     -0.2775000     1.183000  
1 1 1 7  51 14 o 2.403000  0.5890000     2.621000  0.8418000     2.184000  0.8241000     0.4366000      1.178000  
1 1 1 7  51 15 o 1.551000  0.4701000     1.542000  0.6600000     1.561000  0.6696000     -0.1870000E-01 0.9402000 
1 1 1 7  51 16 o 1.508000  0.4528000     1.283000  0.5881000     1.732000  0.6887000     -0.4483000     0.9057000 
1 1 1 7  51 17 o 2.040000  0.5104000     2.144000  0.7226000     1.936000  0.7210000     0.2079000      1.021000  
1 1 1 7  52 0  o 6.341000  0.3566000     6.341000  0.3566000     6.341000  0.3566000     -0.000000      0.000000  
1 1 1 7  52 1  o 6.261000  0.2526000     6.360000  0.3525000     6.162000  0.3618000     0.1979000      0.5051000 
1 1 1 7  52 2  o 7.654000  0.2263000     7.859000  0.3178000     7.449000  0.3222000     0.4109000      0.4526000 
1 1 1 7  52 3  o 1.448000  0.4528000     1.367000  0.6200000     1.528000  0.6601000     -0.1609000     0.9056000 
1 1 1 7  52 4  o 6.579000  0.2636000     6.622000  0.3377000     6.535000  0.4048000     0.8743000E-01  0.5271000 
1 1 1 7  52 5  o 8.024000  0.2364000     7.901000  0.3139000     8.148000  0.3534000     -0.2469000     0.4727000 
1 1 1 7  52 6  o 4.852000  0.3221000     5.008000  0.4047000     4.695000  0.5013000     0.3127000      0.6442000 
1 1 1 7  52 7  o 2.100000  0.5167000     1.857000  0.7153000     2.343000  0.7459000     -0.4861000     1.033000  
1 1 1 7  52 8  o 3.698000  0.3985000     3.295000  0.6223000     4.101000  0.4980000     -0.8060000     0.7971000 
1 1 1 7  52 9  o 2.798000  0.5082000     2.838000  0.7186000     2.759000  0.7187000     0.7917000E-01  1.016000  
1 1 1 7  52 10 o 3.990000  0.4013000     4.294000  0.5744000     3.687000  0.5606000     0.6069000      0.8026000 
1 1 1 7  52 11 o 1.584000  0.4756000     1.912000  0.7468000     1.257000  0.5892000     0.6544000      0.9512000 
1 1 1 7  52 12 o 2.040000  0.5599000     2.060000  0.8475000     2.021000  0.7320000     0.3887000E-01  1.120000  
1 1 1 7  52 13 o 5.185000  0.4640000     5.185000  0.4640000     ?         ?             ?              ?         
1 1 1 7  52 14 o 1.792000  0.5003000     1.625000  0.6866000     1.959000  0.7279000     -0.3333000     1.001000  
1 1 1 7  52 15 o 1.844000  0.4961000     2.096000  0.7302000     1.593000  0.6718000     0.5028000      0.9923000 
1 1 1 7  52 16 o 1.878000  0.4998000     1.844000  0.7034000     1.912000  0.7102000     -0.6834000E-01 0.9996000 
1 1 1 7  52 17 f 2.150000  0.4327000     1.200000  0.5643000     3.100000  0.6561000     -1.900000      0.8654000 
1 1 1 7  53 0  o 2.996000  0.8976000     2.996000  0.8976000     2.996000  0.8976000     -0.000000      0.000000  
1 1 1 7  53 1  o 1.652000  0.4817000     1.778000  0.7029000     1.526000  0.6590000     0.2516000      0.9635000 
1 1 1 7  53 2  o 7.554000  0.2302000     7.448000  0.3334000     7.659000  0.3176000     -0.2106000     0.4605000 
1 1 1 7  53 3  o 1.486000  0.4594000     1.416000  0.6334000     1.557000  0.6656000     -0.1408000     0.9188000 
1 1 1 7  53 4  o 9.256000  0.2247000     9.186000  0.2985000     9.326000  0.3361000     -0.1398000     0.4495000 
1 1 1 7  53 5  o 2.214000  0.5267000     2.185000  0.7148000     2.242000  0.7736000     -0.5682000E-01 1.053000  
1 1 1 7  53 6  o 2.526000  0.5342000     2.451000  0.7212000     2.601000  0.7881000     -0.1501000     1.068000  
1 1 1 7  53 7  o 3.029000  0.4656000     2.664000  0.7059000     3.394000  0.6072000     -0.7304000     0.9312000 
1 1 1 7  53 8  o 5.704000  0.2828000     5.500000  0.4163000     5.907000  0.3827000     -0.4065000     0.5655000 
1 1 1 7  53 9  o 8.077000  0.2322000     8.276000  0.3290000     7.878000  0.3276000     0.3982000      0.4643000 
1 1 1 7  53 10 o 1.765000  0.5009000     1.560000  0.6878000     1.971000  0.7282000     -0.4102000     1.002000  
1 1 1 7  53 11 o 3.495000  0.5279000     2.836000  0.9195000     4.154000  0.5187000     -1.317000      1.056000  
1 1 1 7  53 12 o 4.868000  0.5122000     4.868000  0.5122000     ?         ?             ?              ?         
1 1 1 7  53 13 o 4.712000  0.4044000     4.636000  0.6683000     4.789000  0.4554000     -0.1532000     0.8087000 
1 1 1 7  53 14 o 2.335000  0.5171000     2.176000  0.7281000     2.495000  0.7346000     -0.3188000     1.034000  
1 1 1 7  53 15 o 1.291000  0.4193000     1.233000  0.5774000     1.350000  0.6083000     -0.1166000     0.8387000 
1 1 1 7  53 16 o 1.119000  0.3801000     1.031000  0.5047000     1.207000  0.5685000     -0.1755000     0.7602000 
1 1 1 7  54 0  o 0.9870000 0.6577000     0.9870000 0.6577000     0.9870000 0.6577000     0.000000       0.000000  
1 1 1 7  54 1  o 7.470000  0.2305000     7.333000  0.3272000     7.607000  0.3246000     -0.2745000     0.4609000 
1 1 1 7  54 2  o 7.100000  0.2390000     7.165000  0.3364000     7.035000  0.3396000     0.1305000      0.4780000 
1 1 1 7  54 3  o 1.649000  0.4580000     1.160000  0.5555000     2.138000  0.7284000     -0.9785000     0.9160000 
1 1 1 7  54 4  o 5.380000  0.3025000     5.292000  0.3981000     5.468000  0.4555000     -0.1758000     0.6050000 
1 1 1 7  54 5  o 4.042000  0.3896000     4.253000  0.4786000     3.831000  0.6150000     0.4218000      0.7792000 
1 1 1 7  54 6  o 4.065000  0.3871000     3.703000  0.5579000     4.428000  0.5366000     -0.7249000     0.7741000 
1 1 1 7  54 7  o 3.250000  0.4504000     4.061000  0.5088000     2.439000  0.7434000     1.622000       0.9008000 
1 1 1 7  54 8  o 6.006000  0.2710000     5.960000  0.3901000     6.053000  0.3763000     -0.9240000E-01 0.5421000 
1 1 1 7  54 9  o 1.646000  0.4861000     1.774000  0.7092000     1.518000  0.6650000     0.2557000      0.9722000 
1 1 1 7  54 10 o 2.506000  0.5298000     2.760000  0.7596000     2.252000  0.7386000     0.5080000      1.060000  
1 1 1 7  54 11 o 2.774000  0.6725000     2.719000  0.9047000     2.830000  0.9954000     -0.1110000     1.345000  
1 1 1 7  54 12 o 2.910000  0.6103000     3.293000  0.9660000     2.526000  0.7463000     0.7672000      1.221000  
1 1 1 7  54 13 o 2.072000  0.5154000     1.966000  0.7198000     2.178000  0.7380000     -0.2120000     1.031000  
1 1 1 7  54 14 o 2.985000  0.4687000     3.137000  0.6576000     2.832000  0.6679000     0.3043000      0.9373000 
1 1 1 7  54 15 o 3.489000  0.4213000     3.517000  0.6020000     3.461000  0.5897000     0.5626000E-01  0.8427000 
1 1 1 7  54 16 o 1.213000  0.4119000     1.250000  0.5967000     1.175000  0.5681000     0.7538000E-01  0.8239000 
1 1 1 7  55 0  o 0.7898000 0.5578000     0.7898000 0.5578000     0.7898000 0.5578000     -0.000000      0.000000  
1 1 1 7  55 1  o 4.508000  0.3283000     3.933000  0.5108000     5.083000  0.4126000     -1.150000      0.6567000 
1 1 1 7  55 2  o 4.457000  0.3248000     4.385000  0.4750000     4.529000  0.4433000     -0.1438000     0.6497000 
1 1 1 7  55 3  o 2.145000  0.5092000     2.491000  0.7344000     1.799000  0.7056000     0.6924000      1.018000  
1 1 1 7  55 4  o 1.983000  0.5225000     2.083000  0.7336000     1.883000  0.7442000     0.1997000      1.045000  
1 1 1 7  55 5  o 4.240000  0.3908000     3.290000  0.6230000     5.189000  0.4719000     -1.899000      0.7816000 
1 1 1 7  55 6  o 1.565000  0.4807000     1.655000  0.6894000     1.475000  0.6699000     0.1799000      0.9613000 
1 1 1 7  55 7  f 5.107000  0.3026000     5.274000  0.4075000     4.940000  0.4473000     0.3346000      0.6051000 
1 1 1 7  55 8  o 2.341000  0.5212000     2.623000  0.7376000     2.059000  0.7366000     0.5647000      1.042000  
1 1 1 7  55 9  o 2.261000  0.5229000     2.146000  0.7497000     2.376000  0.7292000     -0.2293000     1.046000  
1 1 1 7  55 10 o 2.312000  0.6368000     1.813000  0.8046000     2.812000  0.9872000     -0.9991000     1.274000  
1 1 1 7  55 11 o 2.019000  0.5894000     2.503000  0.9483000     1.536000  0.7003000     0.9667000      1.179000  
1 1 1 7  55 12 o 2.323000  0.4630000     3.326000  0.6754000     1.319000  0.6336000     2.007000       0.9261000 
1 1 1 7  55 13 o 1.834000  0.5134000     2.016000  0.7630000     1.652000  0.6870000     0.3638000      1.027000  
1 1 1 7  55 14 o 2.941000  0.4666000     3.261000  0.6154000     2.621000  0.7014000     0.6401000      0.9331000 
1 1 1 7  55 15 o 1.979000  0.5041000     1.658000  0.6910000     2.300000  0.7341000     -0.6425000     1.008000  
1 1 1 7  56 0  o 0.8744000 0.6045000     0.8744000 0.6045000     0.8744000 0.6045000     0.000000       0.000000  
1 1 1 7  56 1  o 3.496000  0.4128000     3.343000  0.6118000     3.648000  0.5544000     -0.3046000     0.8256000 
1 1 1 7  56 2  o 1.669000  0.4754000     2.072000  0.7465000     1.265000  0.5890000     0.8072000      0.9509000 
1 1 1 7  56 3  f 2.538000  0.4844000     1.950000  0.7310000     3.126000  0.6358000     -1.176000      0.9688000 
1 1 1 7  56 4  o 2.157000  0.5261000     2.034000  0.7307000     2.280000  0.7572000     -0.2462000     1.052000  
1 1 1 7  56 5  o 3.793000  0.4255000     4.060000  0.5208000     3.526000  0.6731000     0.5341000      0.8511000 
1 1 1 7  56 6  o 1.805000  0.5129000     1.868000  0.7233000     1.743000  0.7273000     0.1247000      1.026000  
1 1 1 7  56 7  o 2.449000  0.5007000     1.905000  0.7254000     2.993000  0.6902000     -1.088000      1.001000  
1 1 1 7  56 8  o 1.761000  0.4570000     1.159000  0.5568000     2.362000  0.7247000     -1.203000      0.9139000 
1 1 1 7  56 9  o 1.947000  0.5786000     2.416000  0.9220000     1.478000  0.6992000     0.9387000      1.157000  
1 1 1 7  56 10 o 1.584000  0.5184000     1.528000  0.7086000     1.639000  0.7569000     -0.1111000     1.037000  
1 1 1 7  56 11 o 1.752000  0.4894000     1.369000  0.6421000     2.136000  0.7388000     -0.7670000     0.9788000 
1 1 1 7  56 12 o 2.280000  0.5367000     2.207000  0.7809000     2.352000  0.7364000     -0.1448000     1.073000  
1 1 1 7  56 13 o 2.658000  0.5045000     2.231000  0.7756000     3.085000  0.6455000     -0.8539000     1.009000  
1 1 1 7  56 14 o 1.528000  0.4681000     1.571000  0.6710000     1.485000  0.6529000     0.8600000E-01  0.9362000 
1 1 1 7  57 0  o 4.954000  0.4325000     4.954000  0.4325000     4.954000  0.4325000     -0.000000      0.000000  
1 1 1 7  57 1  o 1.984000  0.4908000     1.551000  0.6707000     2.417000  0.7166000     -0.8661000     0.9815000 
1 1 1 7  57 2  o 1.301000  0.4229000     1.557000  0.6724000     1.045000  0.5132000     0.5121000      0.8459000 
1 1 1 7  57 3  o 4.382000  0.3448000     4.610000  0.4591000     4.154000  0.5147000     0.4564000      0.6897000 
1 1 1 7  57 4  o 3.042000  0.4627000     3.474000  0.5832000     2.610000  0.7184000     0.8639000      0.9253000 
1 1 1 7  57 5  o 4.603000  0.3524000     4.451000  0.4822000     4.756000  0.5140000     -0.3048000     0.7048000 
1 1 1 7  57 6  o 3.251000  0.4786000     3.501000  0.5804000     3.001000  0.7611000     0.5001000      0.9571000 
1 1 1 7  57 7  o 3.175000  0.5140000     3.048000  0.7999000     3.302000  0.6458000     -0.2537000     1.028000  
1 1 1 7  57 8  o 2.466000  0.8866000     2.466000  0.8866000     ?         ?             ?              ?         
1 1 1 7  57 9  o 1.390000  0.4711000     1.129000  0.5612000     1.651000  0.7569000     -0.5224000     0.9422000 
1 1 1 7  57 10 o 1.244000  0.4112000     1.157000  0.5560000     1.331000  0.6059000     -0.1743000     0.8224000 
1 1 1 7  57 11 f 1.386000  0.4398000     1.072000  0.5290000     1.700000  0.7026000     -0.6283000     0.8795000 
1 1 1 7  57 12 o 2.258000  0.5366000     2.392000  0.7835000     2.124000  0.7335000     0.2686000      1.073000  
1 1 1 7  57 13 o 2.409000  0.5326000     2.728000  0.7847000     2.090000  0.7204000     0.6381000      1.065000  
1 1 1 7  57 14 o 1.392000  0.4439000     1.443000  0.6398000     1.340000  0.6154000     0.1024000      0.8877000 
1 1 1 7  58 0  o 3.369000  0.6687000     3.369000  0.6687000     3.369000  0.6687000     -0.000000      0.000000  
1 1 1 7  58 1  o 4.787000  0.3346000     5.656000  0.4003000     3.919000  0.5364000     1.736000       0.6693000 
1 1 1 7  58 2  o 2.041000  0.4947000     1.514000  0.6603000     2.569000  0.7368000     -1.055000      0.9894000 
1 1 1 7  58 3  o 2.620000  0.4409000     1.613000  0.6719000     3.626000  0.5710000     -2.013000      0.8818000 
1 1 1 7  58 4  o 1.826000  0.4805000     2.186000  0.7106000     1.466000  0.6470000     0.7208000      0.9611000 
1 1 1 7  58 5  o 4.625000  0.3571000     4.008000  0.5271000     5.242000  0.4821000     -1.234000      0.7143000 
1 1 1 7  58 6  o 5.048000  0.4169000     4.773000  0.6685000     5.323000  0.4984000     -0.5495000     0.8338000 
1 1 1 7  58 7  o 1.281000  0.6109000     1.281000  0.6109000     ?         ?             ?              ?         
1 1 1 7  58 8  o 2.123000  0.5143000     1.517000  0.6996000     2.729000  0.7541000     -1.213000      1.029000  
1 1 1 7  58 9  o 5.517000  0.3082000     4.963000  0.4626000     6.072000  0.4073000     -1.109000      0.6163000 
1 1 1 7  58 10 o 3.299000  0.4666000     3.566000  0.6226000     3.032000  0.6951000     0.5331000      0.9332000 
1 1 1 7  58 11 o 1.840000  0.5113000     2.119000  0.7742000     1.561000  0.6682000     0.5589000      1.023000  
1 1 1 7  58 12 o 1.289000  0.4278000     1.289000  0.6120000     1.290000  0.5978000     -0.1647000E-02 0.8555000 
1 1 1 7  58 13 o 1.139000  0.3881000     0.9867000 0.4927000     1.291000  0.5998000     -0.3039000     0.7763000 
1 1 1 7  59 0  o 7.487000  0.3461000     7.487000  0.3461000     7.487000  0.3461000     0.000000       0.000000  
1 1 1 7  59 1  o 4.326000  0.3472000     4.565000  0.4710000     4.087000  0.5103000     0.4780000      0.6944000 
1 1 1 7  59 2  f 4.399000  0.3452000     4.606000  0.4576000     4.191000  0.5170000     0.4148000      0.6904000 
1 1 1 7  59 3  o 3.788000  0.4467000     3.374000  0.7464000     4.201000  0.4909000     -0.8267000     0.8933000 
1 1 1 7  59 4  o 4.065000  0.5036000     3.527000  0.8414000     4.603000  0.5537000     -1.076000      1.007000  
1 1 1 7  59 5  o 4.732000  0.6340000     6.430000  0.5506000     3.035000  1.142000      3.395000       1.268000  
1 1 1 7  59 6  o 3.063000  0.7350000     3.018000  0.8821000     3.107000  1.176000      -0.8966000E-01 1.470000  
1 1 1 7  59 7  o 1.163000  0.4052000     1.303000  0.6318000     1.023000  0.5074000     0.2799000      0.8103000 
1 1 1 7  59 8  o 4.268000  0.3821000     4.529000  0.4981000     4.008000  0.5796000     0.5205000      0.7642000 
1 1 1 7  59 9  o 1.222000  0.4093000     1.352000  0.6196000     1.092000  0.5351000     0.2593000      0.8186000 
1 1 1 7  59 10 o 3.381000  0.4500000     2.984000  0.7035000     3.778000  0.5613000     -0.7934000     0.9000000 
1 1 1 7  59 11 f 1.753000  0.4875000     2.224000  0.7737000     1.283000  0.5931000     0.9416000      0.9749000 
1 1 1 7  59 12 o 1.823000  0.5067000     1.558000  0.6909000     2.087000  0.7414000     -0.5286000     1.013000  
1 1 1 7  60 0  o 0.8318000 0.6023000     0.8318000 0.6023000     0.8318000 0.6023000     -0.000000      0.000000  
1 1 1 7  60 1  o 1.417000  0.4784000     1.478000  0.6990000     1.356000  0.6533000     0.1218000      0.9568000 
1 1 1 7  60 2  o 1.747000  0.5795000     1.506000  0.7097000     1.988000  0.9162000     -0.4824000     1.159000  
1 1 1 7  60 3  o 2.197000  0.9581000     2.197000  0.9581000     ?         ?             ?              ?         
1 1 1 7  60 4  o 4.493000  0.6333000     5.243000  0.6214000     3.742000  1.104000      1.501000       1.267000  
1 1 1 7  60 5  o 3.865000  0.5019000     4.576000  0.6450000     3.153000  0.7692000     1.423000       1.004000  
1 1 1 7  60 6  o 3.964000  0.4192000     3.784000  0.5760000     4.144000  0.6092000     -0.3604000     0.8384000 
1 1 1 7  60 7  o 5.173000  0.3179000     5.498000  0.4181000     4.849000  0.4789000     0.6490000      0.6358000 
1 1 1 7  60 8  o 1.513000  0.4668000     1.683000  0.6987000     1.343000  0.6193000     0.3402000      0.9337000 
1 1 1 7  60 9  o 2.574000  0.4999000     1.927000  0.7368000     3.220000  0.6760000     -1.294000      0.9999000 
1 1 1 7  60 10 o 4.002000  0.3902000     3.860000  0.5769000     4.145000  0.5254000     -0.2854000     0.7803000 
1 1 1 7  60 11 o 1.151000  0.3907000     1.272000  0.5943000     1.030000  0.5074000     0.2423000      0.7815000 
1 1 1 7  61 0  o 9.440000  0.4436000     9.440000  0.4436000     9.440000  0.4436000     -0.000000      0.000000  
1 1 1 7  61 1  o 1.795000  0.5378000     1.294000  0.6288000     2.296000  0.8727000     -1.002000      1.076000  
1 1 1 7  61 2  o 4.852000  0.4272000     5.006000  0.6480000     4.698000  0.5569000     0.3076000      0.8545000 
1 1 1 7  61 3  f 3.537000  0.4788000     3.083000  0.7734000     3.992000  0.5645000     -0.9088000     0.9575000 
1 1 1 7  61 4  o 1.228000  0.4100000     1.082000  0.5295000     1.374000  0.6262000     -0.2913000     0.8200000 
1 1 1 7  61 5  o 3.627000  0.4553000     2.884000  0.6919000     4.371000  0.5921000     -1.487000      0.9107000 
1 1 1 7  61 6  o 3.294000  0.4979000     3.551000  0.5966000     3.037000  0.7972000     0.5143000      0.9957000 
1 1 1 7  61 7  o 1.738000  0.5115000     1.810000  0.7207000     1.666000  0.7260000     0.1438000      1.023000  
1 1 1 7  61 8  o 5.499000  0.3128000     5.369000  0.4418000     5.630000  0.4429000     -0.2614000     0.6256000 
1 1 1 7  61 9  o 5.332000  0.3145000     5.415000  0.4414000     5.250000  0.4480000     0.1646000      0.6289000 
1 1 1 7  61 10 o 2.590000  0.5296000     2.765000  0.7459000     2.416000  0.7520000     0.3498000      1.059000  
1 1 1 7  61 11 o 1.157000  0.5928000     ?         ?             1.157000  0.5928000     ?              ?         
1 1 1 7  62 0  o 1.465000  0.8317000     1.465000  0.8317000     1.465000  0.8317000     -0.000000      0.000000  
1 1 1 7  62 1  o 7.006000  0.2588000     6.712000  0.3760000     7.299000  0.3556000     -0.5868000     0.5175000 
1 1 1 7  62 2  o 1.289000  0.4249000     1.238000  0.5837000     1.341000  0.6176000     -0.1027000     0.8498000 
1 1 1 7  62 3  o 3.495000  0.4347000     3.173000  0.6605000     3.816000  0.5654000     -0.6431000     0.8695000 
1 1 1 7  62 4  o 5.663000  0.3011000     5.712000  0.4158000     5.615000  0.4357000     0.9777000E-01  0.6022000 
1 1 1 7  62 5  o 4.664000  0.3699000     4.684000  0.4830000     4.643000  0.5602000     0.4143000E-01  0.7397000 
1 1 1 7  62 6  o 2.058000  0.5188000     2.370000  0.7325000     1.745000  0.7350000     0.6254000      1.038000  
1 1 1 7  62 7  o 4.541000  0.3747000     4.761000  0.4624000     4.321000  0.5896000     0.4404000      0.7493000 
1 1 1 7  62 8  o 1.004000  0.3560000     0.9786000 0.4889000     1.030000  0.5176000     -0.5151000E-01 0.7120000 
1 1 1 7  62 9  o 3.252000  0.4612000     2.578000  0.7329000     3.927000  0.5599000     -1.349000      0.9223000 
1 1 1 7  63 0  o 6.360000  0.3885000     6.360000  0.3885000     6.360000  0.3885000     0.000000       0.000000  
1 1 1 7  63 1  o 1.489000  0.4639000     1.668000  0.7018000     1.311000  0.6070000     0.3570000      0.9279000 
1 1 1 7  63 2  o 1.499000  0.4610000     1.745000  0.7082000     1.253000  0.5904000     0.4922000      0.9220000 
1 1 1 7  63 3  o 5.435000  0.3083000     5.178000  0.4520000     5.693000  0.4194000     -0.5147000     0.6166000 
1 1 1 7  63 4  o 3.929000  0.4034000     3.726000  0.6007000     4.133000  0.5387000     -0.4069000     0.8068000 
1 1 1 7  63 5  o 2.133000  0.5360000     2.241000  0.7324000     2.026000  0.7829000     0.2146000      1.072000  
1 1 1 7  63 6  o 3.083000  0.5050000     2.714000  0.7171000     3.451000  0.7111000     -0.7366000     1.010000  
1 1 1 7  63 7  o 2.444000  0.4872000     3.232000  0.6586000     1.655000  0.7182000     1.577000       0.9745000 
1 1 1 7  63 8  o 1.819000  0.5106000     1.785000  0.7197000     1.853000  0.7246000     -0.6744000E-01 1.021000  
1 1 1 7  64 0  o 1.315000  0.8035000     1.315000  0.8035000     1.315000  0.8035000     -0.000000      0.000000  
1 1 1 7  64 1  o 1.579000  0.4678000     1.212000  0.5770000     1.945000  0.7366000     -0.7337000     0.9356000 
1 1 1 7  64 2  o 1.717000  0.4984000     1.858000  0.7271000     1.576000  0.6820000     0.2817000      0.9969000 
1 1 1 7  64 3  o 2.540000  0.5270000     2.730000  0.7233000     2.350000  0.7665000     0.3799000      1.054000  
1 1 1 7  64 4  o 1.952000  0.5148000     2.040000  0.7396000     1.864000  0.7161000     0.1760000      1.030000  
1 1 1 7  64 5  o 1.845000  0.4994000     2.171000  0.7269000     1.519000  0.6849000     0.6524000      0.9988000 
1 1 1 7  64 6  o 1.152000  0.3950000     1.105000  0.5369000     1.199000  0.5795000     -0.9347000E-01 0.7900000 
1 1 1 7  64 7  o 1.351000  0.4450000     1.324000  0.6122000     1.379000  0.6461000     -0.5492000E-01 0.8900000 
1 1 1 7  65 0  o 0.9906000 0.6656000     0.9906000 0.6656000     0.9906000 0.6656000     -0.000000      0.000000  
1 1 1 7  65 1  o 1.949000  0.4849000     2.543000  0.7408000     1.354000  0.6258000     1.189000       0.9697000 
1 1 1 7  65 2  o 1.507000  0.4655000     1.712000  0.7062000     1.302000  0.6066000     0.4101000      0.9309000 
1 1 1 7  65 3  f 0.9913000 0.3480000     1.006000  0.4978000     0.9771000 0.4863000     0.2840000E-01  0.6959000 
1 1 1 7  65 4  o 1.282000  0.4223000     1.352000  0.6153000     1.211000  0.5785000     0.1407000      0.8445000 
1 1 1 7  65 5  o 1.722000  0.4987000     1.324000  0.6071000     2.120000  0.7914000     -0.7957000     0.9975000 
1 1 1 7  66 0  o 2.020000  0.8920000     2.020000  0.8920000     2.020000  0.8920000     0.000000       0.000000  
1 1 1 7  66 1  o 1.785000  0.4793000     1.316000  0.6102000     2.255000  0.7393000     -0.9387000     0.9586000 
1 1 1 7  66 2  o 1.619000  0.4842000     1.796000  0.7192000     1.441000  0.6485000     0.3547000      0.9684000 
1 1 1 7  66 3  o 1.343000  0.4381000     1.331000  0.6123000     1.354000  0.6268000     -0.2254000E-01 0.8762000 
1 1 1 8  0  1  o 7.361000  0.1100000     7.361000  0.1100000     7.361000  0.1100000     0.000000       0.000000  
1 1 1 8  0  2  o 0.5914000 0.3319000     0.5914000 0.3319000     0.5914000 0.3319000     0.000000       0.000000  
1 1 1 8  0  3  o 1.733000  0.2604000     1.733000  0.2604000     1.733000  0.2604000     0.000000       0.000000  
1 1 1 8  0  4  o 40.91000  0.4494000     40.91000  0.4494000     40.91000  0.4494000     0.000000       0.000000  
1 1 1 8  0  5  o 23.10000  0.3085000     23.10000  0.3085000     23.10000  0.3085000     0.000000       0.000000  
1 1 1 8  0  6  o 25.90000  0.3453000     25.90000  0.3453000     25.90000  0.3453000     0.000000       0.000000  
1 1 1 8  0  7  o 12.83000  0.1906000     12.83000  0.1906000     12.83000  0.1906000     0.000000       0.000000  
1 1 1 8  0  8  o 4.729000  0.2447000     4.729000  0.2447000     4.729000  0.2447000     0.000000       0.000000  
1 1 1 8  0  9  o 4.927000  0.2650000     4.927000  0.2650000     4.927000  0.2650000     -0.000000      0.000000  
1 1 1 8  0  10 o 1.339000  0.7859000     1.339000  0.7859000     1.339000  0.7859000     0.000000       0.000000  
1 1 1 8  0  11 o 6.582000  0.3354000     6.582000  0.3354000     6.582000  0.3354000     0.000000       0.000000  
1 1 1 8  0  12 o 4.930000  0.3862000     4.930000  0.3862000     4.930000  0.3862000     -0.000000      0.000000  
1 1 1 8  0  13 o 7.723000  0.3058000     7.723000  0.3058000     7.723000  0.3058000     -0.000000      0.000000  
1 1 1 8  0  14 o 2.721000  0.9564000     2.721000  0.9564000     2.721000  0.9564000     0.000000       0.000000  
1 1 1 8  0  15 o 12.25000  0.3402000     12.25000  0.3402000     12.25000  0.3402000     -0.000000      0.000000  
1 1 1 8  0  16 o 3.028000  1.452000      3.028000  1.452000      3.028000  1.452000      0.000000       0.000000  
1 1 1 8  0  17 o 1.312000  0.8530000     1.312000  0.8530000     1.312000  0.8530000     -0.000000      0.000000  
1 1 1 8  0  18 o 6.618000  0.4992000     6.618000  0.4992000     6.618000  0.4992000     -0.000000      0.000000  
1 1 1 8  0  19 o 2.510000  1.191000      2.510000  1.191000      2.510000  1.191000      0.000000       0.000000  
1 1 1 8  0  20 o 2.276000  1.297000      2.276000  1.297000      2.276000  1.297000      0.000000       0.000000  
1 1 1 8  0  21 o 1.501000  0.9971000     1.501000  0.9971000     1.501000  0.9971000     0.000000       0.000000  
1 1 1 8  0  22 o 4.218000  0.7774000     4.218000  0.7774000     4.218000  0.7774000     0.000000       0.000000  
1 1 1 8  0  23 f 1.633000  0.9581000     1.633000  0.9581000     1.633000  0.9581000     0.000000       0.000000  
1 1 1 8  0  24 o 1.553000  0.9247000     1.553000  0.9247000     1.553000  0.9247000     0.000000       0.000000  
1 1 1 8  0  25 o 1.417000  0.8879000     1.417000  0.8879000     1.417000  0.8879000     0.000000       0.000000  
1 1 1 8  0  26 o 1.667000  0.9139000     1.667000  0.9139000     1.667000  0.9139000     0.000000       0.000000  
1 1 1 8  0  27 o 1.472000  0.8634000     1.472000  0.8634000     1.472000  0.8634000     0.000000       0.000000  
1 1 1 8  1  0  o 30.87000  0.4767000     30.87000  0.4767000     30.87000  0.4767000     0.000000       0.000000  
1 1 1 8  1  1  o 16.29000  0.1574000     16.53000  0.1836000     16.05000  0.2557000     0.4769000      0.3148000 
1 1 1 8  1  2  o 13.96000  0.1151000     13.87000  0.1620000     14.04000  0.1634000     -0.1679000     0.2301000 
1 1 1 8  1  3  o 11.49000  0.1046000     11.44000  0.1473000     11.54000  0.1487000     -0.9794000E-01 0.2093000 
1 1 1 8  1  4  o 24.19000  0.1943000     23.97000  0.2727000     24.41000  0.2768000     -0.4349000     0.3886000 
1 1 1 8  1  5  o 14.87000  0.1555000     14.88000  0.2201000     14.86000  0.2196000     0.1807000E-01  0.3109000 
1 1 1 8  1  6  o 29.20000  0.2716000     28.95000  0.3811000     29.45000  0.3870000     -0.5011000     0.5432000 
1 1 1 8  1  7  o 23.54000  0.1977000     23.60000  0.2802000     23.47000  0.2790000     0.1303000      0.3954000 
1 1 1 8  1  8  o 17.99000  0.1664000     17.82000  0.2339000     18.16000  0.2368000     -0.3411000     0.3328000 
1 1 1 8  1  9  f 21.63000  0.1927000     21.46000  0.2708000     21.80000  0.2742000     -0.3342000     0.3854000 
1 1 1 8  1  10 o 13.04000  0.2249000     12.84000  0.3186000     13.24000  0.3175000     -0.4066000     0.4498000 
1 1 1 8  1  11 o 6.042000  0.2499000     5.990000  0.3570000     6.094000  0.3497000     -0.1038000     0.4997000 
1 1 1 8  1  12 o 1.543000  0.4496000     1.289000  0.5818000     1.796000  0.6857000     -0.5065000     0.8993000 
1 1 1 8  1  13 o 5.654000  0.2689000     6.138000  0.3564000     5.170000  0.4029000     0.9682000      0.5378000 
1 1 1 8  1  14 o 5.091000  0.3459000     5.081000  0.4962000     5.100000  0.4820000     -0.1870000E-01 0.6917000 
1 1 1 8  1  15 o 7.896000  0.2817000     8.143000  0.3925000     7.650000  0.4043000     0.4929000      0.5635000 
1 1 1 8  1  16 o 14.17000  0.4353000     14.17000  0.6176000     14.17000  0.6137000     -0.1271000E-02 0.8707000 
1 1 1 8  1  17 o 13.05000  0.2333000     13.42000  0.3256000     12.69000  0.3342000     0.7295000      0.4666000 
1 1 1 8  1  18 o 5.585000  0.4239000     4.906000  0.6544000     6.264000  0.5389000     -1.358000      0.8477000 
1 1 1 8  1  19 o 1.765000  0.5613000     1.317000  0.6516000     2.212000  0.9141000     -0.8944000     1.123000  
1 1 1 8  1  20 o 5.091000  0.7149000     5.564000  0.9477000     4.618000  1.071000      0.9456000      1.430000  
1 1 1 8  1  21 o 2.616000  0.6420000     1.656000  0.7940000     3.577000  1.009000      -1.922000      1.284000  
1 1 1 8  1  22 o 2.963000  0.6485000     3.032000  0.9217000     2.894000  0.9125000     0.1380000      1.297000  
1 1 1 8  1  23 o 2.289000  0.5687000     2.966000  0.8703000     1.611000  0.7324000     1.354000       1.137000  
1 1 1 8  1  24 o 1.760000  0.5402000     1.590000  0.7216000     1.930000  0.8041000     -0.3408000     1.080000  
1 1 1 8  1  25 o 1.839000  0.5557000     1.883000  0.7930000     1.794000  0.7787000     0.8893000E-01  1.111000  
1 1 1 8  1  26 o 2.098000  0.5394000     1.761000  0.7335000     2.436000  0.7912000     -0.6748000     1.079000  
1 1 1 8  1  27 o 1.595000  0.4731000     1.036000  0.5155000     2.155000  0.7933000     -1.119000      0.9461000 
1 1 1 8  2  0  o 32.63000  0.4109000     32.63000  0.4109000     32.63000  0.4109000     0.000000       0.000000  
1 1 1 8  2  1  o 26.55000  0.3275000     26.61000  0.5870000     26.49000  0.2904000     0.1184000      0.6549000 
1 1 1 8  2  2  o 9.697000  0.9221000E-01 9.692000  0.1100000     9.703000  0.1480000     -0.1090000E-01 0.1844000 
1 1 1 8  2  3  o 18.81000  0.1531000     18.86000  0.2171000     18.75000  0.2160000     0.1167000      0.3062000 
1 1 1 8  2  4  o 11.88000  0.1133000     11.92000  0.1607000     11.85000  0.1598000     0.7397000E-01  0.2267000 
1 1 1 8  2  5  o 6.853000  0.1249000     6.633000  0.1755000     7.074000  0.1779000     -0.4412000     0.2499000 
1 1 1 8  2  6  o 14.85000  0.1516000     14.99000  0.1999000     14.72000  0.2279000     0.2772000      0.3032000 
1 1 1 8  2  7  o 23.88000  0.2001000     23.84000  0.2825000     23.92000  0.2834000     -0.7439000E-01 0.4002000 
1 1 1 8  2  8  o 9.340000  0.1346000     9.446000  0.1908000     9.234000  0.1900000     0.2126000      0.2693000 
1 1 1 8  2  9  o 9.010000  0.1455000     9.120000  0.2051000     8.900000  0.2064000     0.2200000      0.2910000 
1 1 1 8  2  10 o 6.948000  0.2425000     6.703000  0.3469000     7.192000  0.3390000     -0.4886000     0.4850000 
1 1 1 8  2  11 f 10.95000  0.1961000     10.74000  0.2780000     11.16000  0.2766000     -0.4164000     0.3922000 
1 1 1 8  2  12 o 7.518000  0.2040000     7.292000  0.2935000     7.744000  0.2834000     -0.4515000     0.4080000 
1 1 1 8  2  13 o 1.230000  0.4084000     1.191000  0.5644000     1.269000  0.5903000     -0.7760000E-01 0.8168000 
1 1 1 8  2  14 o 8.579000  0.2521000     8.643000  0.3515000     8.515000  0.3614000     0.1278000      0.5041000 
1 1 1 8  2  15 o 5.134000  0.3898000     4.913000  0.5563000     5.355000  0.5461000     -0.4427000     0.7796000 
1 1 1 8  2  16 o 6.577000  0.6097000     6.780000  0.8379000     6.375000  0.8859000     0.4050000      1.219000  
1 1 1 8  2  17 o 2.606000  0.6152000     2.270000  0.8685000     2.943000  0.8715000     -0.6734000     1.230000  
1 1 1 8  2  18 o 10.75000  0.2614000     10.62000  0.3721000     10.88000  0.3672000     -0.2598000     0.5228000 
1 1 1 8  2  19 o 3.435000  0.6615000     2.519000  0.9537000     4.352000  0.9168000     -1.833000      1.323000  
1 1 1 8  2  20 o 5.111000  0.7105000     5.281000  0.9735000     4.941000  1.035000      0.3397000      1.421000  
1 1 1 8  2  21 o 3.465000  0.7358000     3.914000  1.030000      3.017000  1.051000      0.8970000      1.472000  
1 1 1 8  2  22 o 2.138000  0.5717000     2.843000  0.9110000     1.434000  0.6910000     1.409000       1.143000  
1 1 1 8  2  23 o 3.050000  0.6034000     3.185000  0.8376000     2.915000  0.8687000     0.2701000      1.207000  
1 1 1 8  2  24 o 1.741000  0.5388000     1.925000  0.8081000     1.557000  0.7130000     0.3682000      1.078000  
1 1 1 8  2  25 o 1.452000  0.4799000     1.141000  0.5661000     1.763000  0.7752000     -0.6221000     0.9598000 
1 1 1 8  2  26 o 1.873000  0.5355000     1.942000  0.7702000     1.805000  0.7441000     0.1376000      1.071000  
1 1 1 8  2  27 o 1.698000  0.5165000     1.578000  0.7027000     1.817000  0.7572000     -0.2381000     1.033000  
1 1 1 8  3  0  o 42.95000  0.4667000     42.95000  0.4667000     42.95000  0.4667000     0.000000       0.000000  
1 1 1 8  3  1  o 26.99000  0.2264000     27.22000  0.3447000     26.75000  0.2936000     0.4736000      0.4528000 
1 1 1 8  3  2  o 21.06000  0.1721000     21.16000  0.2730000     20.96000  0.2095000     0.2049000      0.3441000 
1 1 1 8  3  3  o 20.17000  0.1687000     20.16000  0.2049000     20.19000  0.2680000     -0.2951000E-01 0.3374000 
1 1 1 8  3  4  o 11.08000  0.1100000     11.06000  0.1557000     11.09000  0.1555000     -0.2950000E-01 0.2201000 
1 1 1 8  3  5  o 16.70000  0.1691000     16.74000  0.2397000     16.67000  0.2385000     0.7609000E-01  0.3382000 
1 1 1 8  3  6  o 13.03000  0.1303000     13.02000  0.1842000     13.04000  0.1845000     -0.2374000E-01 0.2607000 
1 1 1 8  3  7  o 21.61000  0.1851000     21.57000  0.2615000     21.66000  0.2621000     -0.8280000E-01 0.3702000 
1 1 1 8  3  8  o 10.90000  0.1361000     10.99000  0.1928000     10.81000  0.1920000     0.1793000      0.2721000 
1 1 1 8  3  9  o 11.87000  0.1473000     11.92000  0.2086000     11.82000  0.2082000     0.9908000E-01  0.2947000 
1 1 1 8  3  10 o 8.471000  0.2301000     9.111000  0.3161000     7.831000  0.3344000     1.280000       0.4601000 
1 1 1 8  3  11 o 7.757000  0.2135000     7.617000  0.3011000     7.898000  0.3028000     -0.2814000     0.4270000 
1 1 1 8  3  12 o 6.875000  0.2165000     7.037000  0.2976000     6.713000  0.3146000     0.3242000      0.4331000 
1 1 1 8  3  13 o 1.660000  0.4830000     1.831000  0.7112000     1.489000  0.6539000     0.3421000      0.9661000 
1 1 1 8  3  14 o 5.151000  0.3521000     5.233000  0.5104000     5.069000  0.4851000     0.1645000      0.7042000 
1 1 1 8  3  15 o 4.183000  0.5658000     4.009000  0.8288000     4.356000  0.7704000     -0.3472000     1.132000  
1 1 1 8  3  16 o 9.654000  0.4806000     9.237000  0.6903000     10.07000  0.6690000     -0.8358000     0.9613000 
1 1 1 8  3  17 o 7.229000  0.3078000     7.368000  0.4339000     7.090000  0.4367000     0.2784000      0.6157000 
1 1 1 8  3  18 o 6.027000  0.3955000     5.963000  0.5658000     6.092000  0.5527000     -0.1286000     0.7910000 
1 1 1 8  3  19 o 3.090000  0.7125000     3.103000  0.9675000     3.077000  1.046000      0.2626000E-01  1.425000  
1 1 1 8  3  20 o 2.438000  0.7476000     2.272000  1.015000      2.605000  1.097000      -0.3329000     1.495000  
1 1 1 8  3  21 o 3.350000  0.6908000     2.545000  1.009000      4.155000  0.9439000     -1.610000      1.382000  
1 1 1 8  3  22 o 2.174000  0.6236000     2.021000  0.8570000     2.326000  0.9062000     -0.3049000     1.247000  
1 1 1 8  3  23 o 1.807000  0.5456000     2.145000  0.8474000     1.469000  0.6874000     0.6759000      1.091000  
1 1 1 8  3  24 o 1.788000  0.5470000     1.810000  0.7774000     1.766000  0.7697000     0.4456000E-01  1.094000  
1 1 1 8  3  25 o 1.381000  0.4688000     1.390000  0.6683000     1.371000  0.6577000     0.1945000E-01  0.9376000 
1 1 1 8  3  26 o 1.215000  0.4169000     1.227000  0.5948000     1.202000  0.5844000     0.2510000E-01  0.8339000 
1 1 1 8  3  27 o 1.376000  0.4543000     1.404000  0.6493000     1.349000  0.6356000     0.5457000E-01  0.9086000 
1 1 1 8  4  0  o 8.372000  0.1066000     8.372000  0.1066000     8.372000  0.1066000     0.000000       0.000000  
1 1 1 8  4  1  o 15.82000  0.1269000     15.73000  0.1783000     15.92000  0.1805000     -0.1900000     0.2537000 
1 1 1 8  4  2  o 17.15000  0.1383000     17.07000  0.1951000     17.23000  0.1962000     -0.1637000     0.2767000 
1 1 1 8  4  3  o 10.70000  0.1002000     10.74000  0.1404000     10.66000  0.1430000     0.8277000E-01  0.2004000 
1 1 1 8  4  4  o 40.97000  0.3305000     40.41000  0.3972000     41.52000  0.5284000     -1.109000      0.6610000 
1 1 1 8  4  5  f 3.770000  0.1481000     3.829000  0.2116000     3.711000  0.2071000     0.1182000      0.2961000 
1 1 1 8  4  6  o 17.31000  0.1544000     17.41000  0.2194000     17.21000  0.2174000     0.2017000      0.3088000 
1 1 1 8  4  7  o 19.70000  0.1731000     19.72000  0.2450000     19.68000  0.2448000     0.3867000E-01  0.3463000 
1 1 1 8  4  8  o 13.28000  0.1433000     13.28000  0.2032000     13.28000  0.2022000     0.2985000E-03  0.2867000 
1 1 1 8  4  9  o 7.321000  0.1567000     7.356000  0.2241000     7.285000  0.2190000     0.7181000E-01  0.3133000 
1 1 1 8  4  10 o 8.257000  0.1993000     8.447000  0.2755000     8.067000  0.2882000     0.3793000      0.3987000 
1 1 1 8  4  11 o 11.74000  0.1978000     11.78000  0.2815000     11.70000  0.2780000     0.8025000E-01  0.3956000 
1 1 1 8  4  12 o 10.39000  0.1848000     10.70000  0.2598000     10.08000  0.2627000     0.6219000      0.3695000 
1 1 1 8  4  13 o 5.722000  0.2743000     6.008000  0.3771000     5.437000  0.3984000     0.5708000      0.5486000 
1 1 1 8  4  14 o 5.397000  0.3463000     5.326000  0.4884000     5.469000  0.4909000     -0.1432000     0.6925000 
1 1 1 8  4  15 o 4.681000  0.5279000     5.050000  0.6829000     4.313000  0.8053000     0.7371000      1.056000  
1 1 1 8  4  16 o 2.992000  0.7256000     3.466000  1.063000      2.518000  0.9880000     0.9479000      1.451000  
1 1 1 8  4  17 o 14.84000  0.2481000     14.58000  0.3712000     15.11000  0.3292000     -0.5371000     0.4962000 
1 1 1 8  4  18 o 1.954000  0.5974000     2.202000  0.9021000     1.705000  0.7835000     0.4969000      1.195000  
1 1 1 8  4  19 o 2.859000  0.7085000     3.086000  0.9745000     2.632000  1.029000      0.4541000      1.417000  
1 1 1 8  4  20 o 3.850000  0.8281000     4.068000  1.138000      3.631000  1.203000      0.4371000      1.656000  
1 1 1 8  4  21 o 2.391000  0.7093000     2.472000  1.025000      2.309000  0.9803000     0.1628000      1.419000  
1 1 1 8  4  22 f 2.659000  0.6462000     2.981000  0.9239000     2.337000  0.9036000     0.6441000      1.292000  
1 1 1 8  4  23 o 2.148000  0.5425000     1.410000  0.6767000     2.886000  0.8482000     -1.475000      1.085000  
1 1 1 8  4  24 o 1.578000  0.5090000     1.443000  0.6792000     1.713000  0.7582000     -0.2701000     1.018000  
1 1 1 8  4  25 f 1.527000  0.5014000     1.611000  0.7350000     1.443000  0.6822000     0.1683000      1.003000  
1 1 1 8  4  26 o 1.456000  0.4682000     1.315000  0.6244000     1.596000  0.6978000     -0.2810000     0.9363000 
1 1 1 8  4  27 o 1.194000  0.4107000     1.178000  0.5738000     1.210000  0.5877000     -0.3153000E-01 0.8214000 
1 1 1 8  5  0  o 11.91000  0.1415000     11.91000  0.1415000     11.91000  0.1415000     -0.000000      0.000000  
1 1 1 8  5  1  o 31.65000  0.2454000     31.70000  0.3476000     31.61000  0.3465000     0.9976000E-01  0.4908000 
1 1 1 8  5  2  o 20.02000  0.1725000     20.13000  0.2276000     19.92000  0.2593000     0.2101000      0.3450000 
1 1 1 8  5  3  o 12.93000  0.1076000     12.92000  0.1598000     12.95000  0.1441000     -0.2278000E-01 0.2151000 
1 1 1 8  5  4  o 21.00000  0.1854000     21.04000  0.2429000     20.96000  0.2802000     0.8395000E-01  0.3708000 
1 1 1 8  5  5  o 21.39000  0.2182000     21.69000  0.2530000     21.08000  0.3556000     0.6152000      0.4364000 
1 1 1 8  5  6  o 21.88000  0.1841000     21.75000  0.2592000     22.01000  0.2616000     -0.2633000     0.3683000 
1 1 1 8  5  7  o 5.882000  0.1406000     5.632000  0.2028000     6.131000  0.1947000     -0.4983000     0.2811000 
1 1 1 8  5  8  o 7.162000  0.1411000     6.964000  0.2017000     7.360000  0.1973000     -0.3963000     0.2821000 
1 1 1 8  5  9  o 17.22000  0.1694000     17.48000  0.2414000     16.96000  0.2377000     0.5243000      0.3388000 
1 1 1 8  5  10 o 10.13000  0.2041000     10.10000  0.3156000     10.16000  0.2589000     -0.6552000E-01 0.4082000 
1 1 1 8  5  11 o 12.97000  0.1982000     12.98000  0.2789000     12.96000  0.2818000     0.2179000E-01  0.3965000 
1 1 1 8  5  12 f 6.228000  0.2361000     6.071000  0.3416000     6.384000  0.3259000     -0.3132000     0.4721000 
1 1 1 8  5  13 o 6.130000  0.2601000     6.256000  0.3609000     6.003000  0.3746000     0.2530000      0.5202000 
1 1 1 8  5  14 o 5.966000  0.3241000     5.770000  0.4609000     6.163000  0.4559000     -0.3932000     0.6483000 
1 1 1 8  5  15 o 7.527000  0.3658000     7.942000  0.4955000     7.112000  0.5382000     0.8307000      0.7315000 
1 1 1 8  5  16 o 5.479000  0.5215000     5.320000  0.7790000     5.638000  0.6936000     -0.3177000     1.043000  
1 1 1 8  5  17 o 9.936000  0.2816000     10.22000  0.4165000     9.649000  0.3793000     0.5759000      0.5633000 
1 1 1 8  5  18 f 4.389000  0.5465000     3.719000  0.8662000     5.058000  0.6665000     -1.339000      1.093000  
1 1 1 8  5  19 o 2.395000  0.6414000     1.793000  0.8222000     2.996000  0.9846000     -1.203000      1.283000  
1 1 1 8  5  20 o 3.424000  0.7409000     4.553000  1.069000      2.296000  1.026000      2.257000       1.482000  
1 1 1 8  5  21 f 2.546000  0.6953000     3.089000  1.059000      2.003000  0.9019000     1.085000       1.391000  
1 1 1 8  5  22 o 2.249000  0.6097000     1.839000  0.8095000     2.658000  0.9121000     -0.8182000     1.219000  
1 1 1 8  5  23 o 2.065000  0.5889000     2.195000  0.8587000     1.934000  0.8063000     0.2606000      1.178000  
1 1 1 8  5  24 o 1.683000  0.5296000     1.829000  0.7912000     1.536000  0.7043000     0.2935000      1.059000  
1 1 1 8  5  25 o 2.622000  0.6190000     2.521000  0.8759000     2.723000  0.8749000     -0.2024000     1.238000  
1 1 1 8  5  26 o 1.819000  0.5287000     1.998000  0.7777000     1.640000  0.7163000     0.3571000      1.057000  
1 1 1 8  5  27 o 1.166000  0.4030000     1.130000  0.5563000     1.202000  0.5832000     -0.7235000E-01 0.8059000 
1 1 1 8  6  0  o 7.638000  0.1088000     7.638000  0.1088000     7.638000  0.1088000     0.000000       0.000000  
1 1 1 8  6  1  o 27.34000  0.2134000     27.37000  0.3021000     27.31000  0.3016000     0.5685000E-01  0.4269000 
1 1 1 8  6  2  o 27.59000  0.2164000     27.39000  0.3040000     27.79000  0.3079000     -0.4060000     0.4327000 
1 1 1 8  6  3  o 32.42000  0.2535000     32.54000  0.3596000     32.31000  0.3573000     0.2253000      0.5069000 
1 1 1 8  6  4  o 19.39000  0.1960000     19.69000  0.3225000     19.09000  0.2229000     0.5927000      0.3920000 
1 1 1 8  6  5  o 24.91000  0.3366000     25.25000  0.5888000     24.57000  0.3262000     0.6801000      0.6731000 
1 1 1 8  6  6  o 15.13000  0.1472000     15.44000  0.1793000     14.82000  0.2335000     0.6214000      0.2944000 
1 1 1 8  6  7  o 30.07000  0.2444000     29.74000  0.3425000     30.40000  0.3486000     -0.6556000     0.4887000 
1 1 1 8  6  8  o 18.06000  0.1677000     17.91000  0.2361000     18.22000  0.2383000     -0.3022000     0.3355000 
1 1 1 8  6  9  o 8.939000  0.1506000     8.815000  0.2146000     9.063000  0.2115000     -0.2479000     0.3013000 
1 1 1 8  6  10 o 5.336000  0.2435000     5.425000  0.3371000     5.246000  0.3516000     0.1790000      0.4871000 
1 1 1 8  6  11 o 10.55000  0.1735000     10.33000  0.2453000     10.77000  0.2454000     -0.4436000     0.3470000 
1 1 1 8  6  12 o 3.092000  0.4109000     3.262000  0.5589000     2.921000  0.6024000     0.3409000      0.8217000 
1 1 1 8  6  13 o 4.908000  0.3040000     4.618000  0.4498000     5.197000  0.4091000     -0.5782000     0.6080000 
1 1 1 8  6  14 o 7.602000  0.2778000     7.793000  0.3850000     7.412000  0.4005000     0.3813000      0.5556000 
1 1 1 8  6  15 o 17.94000  0.3009000     17.67000  0.4273000     18.22000  0.4239000     -0.5503000     0.6019000 
1 1 1 8  6  16 o 3.962000  0.6780000     4.518000  0.8780000     3.405000  1.033000      1.113000       1.356000  
1 1 1 8  6  17 o 5.776000  0.3970000     6.124000  0.5721000     5.428000  0.5504000     0.6959000      0.7939000 
1 1 1 8  6  18 o 6.543000  0.3835000     6.546000  0.5453000     6.540000  0.5394000     0.6025000E-02  0.7670000 
1 1 1 8  6  19 o 2.089000  0.6275000     1.799000  0.8236000     2.379000  0.9469000     -0.5806000     1.255000  
1 1 1 8  6  20 o 3.362000  0.7307000     2.821000  1.056000      3.902000  1.010000      -1.080000      1.461000  
1 1 1 8  6  21 o 2.135000  0.6599000     2.407000  0.9942000     1.864000  0.8681000     0.5434000      1.320000  
1 1 1 8  6  22 o 2.732000  0.6490000     2.627000  0.9194000     2.836000  0.9162000     -0.2093000     1.298000  
1 1 1 8  6  23 o 2.564000  0.6220000     2.704000  0.8899000     2.424000  0.8693000     0.2806000      1.244000  
1 1 1 8  6  24 f 1.691000  0.5113000     2.096000  0.8082000     1.287000  0.6265000     0.8089000      1.023000  
1 1 1 8  6  25 o 1.284000  0.4334000     1.187000  0.5792000     1.381000  0.6448000     -0.1947000     0.8667000 
1 1 1 8  6  26 o 1.366000  0.4528000     1.262000  0.6044000     1.470000  0.6745000     -0.2075000     0.9057000 
1 1 1 8  6  27 o 1.279000  0.4318000     1.222000  0.5920000     1.336000  0.6287000     -0.1138000     0.8635000 
1 1 1 8  7  0  o 11.25000  0.1407000     11.25000  0.1407000     11.25000  0.1407000     -0.000000      0.000000  
1 1 1 8  7  1  o 18.40000  0.1485000     18.39000  0.2099000     18.40000  0.2101000     -0.5533000E-02 0.2970000 
1 1 1 8  7  2  o 34.08000  0.2653000     33.95000  0.3740000     34.21000  0.3765000     -0.2597000     0.5307000 
1 1 1 8  7  3  o 45.64000  0.3537000     45.86000  0.5020000     45.42000  0.4983000     0.4354000      0.7073000 
1 1 1 8  7  4  o 8.836000  0.1352000     8.881000  0.1930000     8.792000  0.1893000     0.8896000E-01  0.2704000 
1 1 1 8  7  5  o 19.84000  0.2700000     19.72000  0.4843000     19.96000  0.2388000     -0.2399000     0.5400000 
1 1 1 8  7  6  o 26.67000  0.2167000     26.66000  0.3057000     26.68000  0.3072000     -0.1963000E-01 0.4334000 
1 1 1 8  7  7  o 30.03000  0.2523000     29.95000  0.3062000     30.11000  0.4011000     -0.1600000     0.5046000 
1 1 1 8  7  8  o 1.973000  0.3604000     2.233000  0.4802000     1.714000  0.5377000     0.5187000      0.7208000 
1 1 1 8  7  9  o 11.86000  0.1517000     11.59000  0.2149000     12.12000  0.2143000     -0.5340000     0.3035000 
1 1 1 8  7  10 o 6.222000  0.1916000     6.049000  0.2783000     6.395000  0.2636000     -0.3458000     0.3833000 
1 1 1 8  7  11 f 10.10000  0.1736000     10.18000  0.2482000     10.01000  0.2430000     0.1692000      0.3473000 
1 1 1 8  7  12 o 5.374000  0.2569000     5.446000  0.3531000     5.303000  0.3732000     0.1438000      0.5138000 
1 1 1 8  7  13 o 10.65000  0.1959000     10.35000  0.2765000     10.95000  0.2774000     -0.6021000     0.3917000 
1 1 1 8  7  14 o 5.495000  0.3216000     5.423000  0.4404000     5.568000  0.4687000     -0.1449000     0.6432000 
1 1 1 8  7  15 o 5.907000  0.4376000     6.075000  0.5983000     5.740000  0.6388000     0.3357000      0.8752000 
1 1 1 8  7  16 o 10.44000  0.3300000     10.71000  0.4727000     10.18000  0.4607000     0.5272000      0.6601000 
1 1 1 8  7  17 f 2.687000  0.6464000     2.458000  0.9327000     2.915000  0.8954000     -0.4576000     1.293000  
1 1 1 8  7  18 o 6.301000  0.3899000     6.009000  0.5629000     6.593000  0.5396000     -0.5843000     0.7798000 
1 1 1 8  7  19 o 2.295000  0.6569000     2.442000  0.9508000     2.148000  0.9068000     0.2947000      1.314000  
1 1 1 8  7  20 o 4.155000  0.6631000     5.404000  0.7941000     2.906000  1.062000      2.498000       1.326000  
1 1 1 8  7  21 o 2.773000  0.7294000     2.328000  0.9904000     3.219000  1.071000      -0.8912000     1.459000  
1 1 1 8  7  22 o 2.630000  0.6244000     2.193000  0.8807000     3.068000  0.8854000     -0.8755000     1.249000  
1 1 1 8  7  23 o 1.828000  0.5571000     1.672000  0.7573000     1.984000  0.8173000     -0.3121000     1.114000  
1 1 1 8  7  24 o 1.671000  0.5137000     1.916000  0.7741000     1.427000  0.6754000     0.4889000      1.027000  
1 1 1 8  7  25 o 2.097000  0.5629000     2.267000  0.8250000     1.926000  0.7659000     0.3412000      1.126000  
1 1 1 8  7  26 o 1.232000  0.4198000     1.056000  0.5263000     1.408000  0.6543000     -0.3517000     0.8397000 
1 1 1 8  7  27 o 1.066000  0.3741000     1.105000  0.5458000     1.026000  0.5117000     0.7917000E-01  0.7481000 
1 1 1 8  8  0  o 30.53000  0.3369000     30.53000  0.3369000     30.53000  0.3369000     -0.000000      0.000000  
1 1 1 8  8  1  o 35.00000  0.2720000     34.81000  0.3826000     35.18000  0.3868000     -0.3683000     0.5441000 
1 1 1 8  8  2  o 21.65000  0.1740000     21.87000  0.2482000     21.42000  0.2440000     0.4468000      0.3481000 
1 1 1 8  8  3  o 18.22000  0.1513000     18.17000  0.2134000     18.28000  0.2144000     -0.1044000     0.3026000 
1 1 1 8  8  4  o 27.22000  0.3396000     27.31000  0.3078000     27.14000  0.6053000     0.1640000      0.6791000 
1 1 1 8  8  5  o 14.95000  0.2210000     14.51000  0.3970000     15.39000  0.1940000     -0.8817000     0.4419000 
1 1 1 8  8  6  o 18.04000  0.1586000     17.76000  0.2211000     18.32000  0.2273000     -0.5613000     0.3171000 
1 1 1 8  8  7  o 14.71000  0.1424000     14.54000  0.1990000     14.88000  0.2038000     -0.3393000     0.2849000 
1 1 1 8  8  8  f 21.85000  0.1978000     21.88000  0.2387000     21.82000  0.3154000     0.5305000E-01  0.3955000 
1 1 1 8  8  9  o 10.82000  0.1522000     10.71000  0.2159000     10.93000  0.2146000     -0.2247000     0.3044000 
1 1 1 8  8  10 o 2.306000  0.4493000     2.518000  0.5798000     2.094000  0.6865000     0.4244000      0.8986000 
1 1 1 8  8  11 o 5.647000  0.2264000     5.596000  0.3268000     5.698000  0.3136000     -0.1024000     0.4529000 
1 1 1 8  8  12 o 4.783000  0.2824000     4.690000  0.4050000     4.876000  0.3936000     -0.1858000     0.5647000 
1 1 1 8  8  13 o 9.751000  0.2056000     9.561000  0.2913000     9.941000  0.2903000     -0.3805000     0.4113000 
1 1 1 8  8  14 o 10.82000  0.2238000     10.90000  0.2978000     10.74000  0.3341000     0.1631000      0.4476000 
1 1 1 8  8  15 o 4.014000  0.6092000     3.561000  0.9174000     4.467000  0.8018000     -0.9062000     1.218000  
1 1 1 8  8  16 o 6.468000  0.4080000     6.427000  0.5339000     6.510000  0.6171000     -0.8288000E-01 0.8160000 
1 1 1 8  8  17 o 6.744000  0.3584000     6.915000  0.5332000     6.574000  0.4790000     0.3416000      0.7168000 
1 1 1 8  8  18 o 7.585000  0.3363000     7.157000  0.5020000     8.012000  0.4476000     -0.8552000     0.6726000 
1 1 1 8  8  19 o 6.597000  0.4078000     7.053000  0.5541000     6.140000  0.5986000     0.9131000      0.8157000 
1 1 1 8  8  20 o 2.646000  0.7252000     2.426000  1.002000      2.866000  1.049000      -0.4398000     1.450000  
1 1 1 8  8  21 o 1.706000  0.5551000     1.440000  0.6984000     1.973000  0.8631000     -0.5336000     1.110000  
1 1 1 8  8  22 o 3.310000  0.6028000     3.240000  0.8730000     3.380000  0.8313000     -0.1405000     1.206000  
1 1 1 8  8  23 o 3.204000  0.6064000     3.262000  0.8571000     3.145000  0.8580000     0.1171000      1.213000  
1 1 1 8  8  24 o 1.884000  0.5073000     2.497000  0.8031000     1.271000  0.6202000     1.226000       1.015000  
1 1 1 8  8  25 o 1.438000  0.4750000     1.307000  0.6230000     1.569000  0.7172000     -0.2618000     0.9500000 
1 1 1 8  8  26 f 1.430000  0.4630000     1.387000  0.6405000     1.473000  0.6689000     -0.8617000E-01 0.9261000 
1 1 1 8  8  27 o 1.363000  0.4527000     1.312000  0.6217000     1.414000  0.6582000     -0.1020000     0.9053000 
1 1 1 8  9  0  o 7.010000  0.1198000     7.010000  0.1198000     7.010000  0.1198000     -0.000000      0.000000  
1 1 1 8  9  1  o 4.305000  0.8932000E-01 4.357000  0.1260000     4.252000  0.1267000     0.1053000      0.1786000 
1 1 1 8  9  2  o 11.81000  0.1090000     11.89000  0.1544000     11.73000  0.1538000     0.1563000      0.2179000 
1 1 1 8  9  3  o 30.90000  0.2983000     30.88000  0.4868000     30.93000  0.3450000     -0.4943000E-01 0.5966000 
1 1 1 8  9  4  o 20.81000  0.2218000     20.82000  0.2790000     20.80000  0.3449000     0.2012000E-01  0.4437000 
1 1 1 8  9  5  o 16.46000  0.1444000     16.42000  0.2038000     16.51000  0.2045000     -0.8544000E-01 0.2888000 
1 1 1 8  9  6  o 21.94000  0.1902000     21.86000  0.3008000     22.02000  0.2328000     -0.1673000     0.3804000 
1 1 1 8  9  7  o 7.002000  0.1226000     7.028000  0.1706000     6.976000  0.1761000     0.5234000E-01  0.2452000 
1 1 1 8  9  8  o 9.851000  0.1306000     9.825000  0.1810000     9.877000  0.1884000     -0.5202000E-01 0.2613000 
1 1 1 8  9  9  o 6.317000  0.2116000     6.422000  0.2048000     6.211000  0.3703000     0.2111000      0.4231000 
1 1 1 8  9  10 o 4.259000  0.3019000     4.657000  0.4020000     3.860000  0.4506000     0.7970000      0.6039000 
1 1 1 8  9  11 o 4.033000  0.2996000     4.120000  0.4215000     3.947000  0.4258000     0.1729000      0.5992000 
1 1 1 8  9  12 o 10.13000  0.1887000     10.03000  0.2694000     10.23000  0.2644000     -0.1959000     0.3775000 
1 1 1 8  9  13 o 10.75000  0.1979000     10.43000  0.2781000     11.08000  0.2817000     -0.6499000     0.3958000 
1 1 1 8  9  14 o 8.590000  0.2456000     8.594000  0.3230000     8.587000  0.3700000     0.7149000E-02  0.4912000 
1 1 1 8  9  15 o 4.785000  0.5551000     5.601000  0.6531000     3.968000  0.8977000     1.633000       1.110000  
1 1 1 8  9  16 o 9.369000  0.2918000     9.593000  0.4080000     9.144000  0.4175000     0.4485000      0.5837000 
1 1 1 8  9  17 o 7.906000  0.3304000     8.646000  0.4677000     7.167000  0.4668000     1.479000       0.6608000 
1 1 1 8  9  18 o 7.053000  0.3507000     6.715000  0.5095000     7.391000  0.4821000     -0.6758000     0.7015000 
1 1 1 8  9  19 o 8.025000  0.3478000     7.661000  0.5046000     8.388000  0.4787000     -0.7277000     0.6956000 
1 1 1 8  9  20 o 4.113000  0.6900000     3.985000  0.9693000     4.240000  0.9824000     -0.2548000     1.380000  
1 1 1 8  9  21 o 2.887000  0.6608000     2.268000  0.9239000     3.507000  0.9450000     -1.240000      1.322000  
1 1 1 8  9  22 o 5.334000  0.3902000     5.109000  0.5774000     5.558000  0.5250000     -0.4495000     0.7804000 
1 1 1 8  9  23 o 1.943000  0.5738000     1.708000  0.7600000     2.178000  0.8600000     -0.4704000     1.148000  
1 1 1 8  9  24 o 1.743000  0.5282000     1.448000  0.6648000     2.037000  0.8210000     -0.5881000     1.056000  
1 1 1 8  9  25 o 1.406000  0.4647000     0.9943000 0.4994000     1.818000  0.7840000     -0.8240000     0.9295000 
1 1 1 8  9  26 o 1.361000  0.4491000     1.273000  0.6087000     1.448000  0.6604000     -0.1758000     0.8981000 
1 1 1 8  9  27 o 1.167000  0.4004000     1.045000  0.5179000     1.289000  0.6108000     -0.2437000     0.8008000 
1 1 1 8  10 0  o 25.88000  0.2904000     25.88000  0.2904000     25.88000  0.2904000     0.000000       0.000000  
1 1 1 8  10 1  o 6.600000  0.8781000E-01 6.700000  0.1241000     6.501000  0.1242000     0.1995000      0.1756000 
1 1 1 8  10 2  o 18.80000  0.1555000     18.93000  0.2210000     18.66000  0.2187000     0.2694000      0.3110000 
1 1 1 8  10 3  o 12.62000  0.1785000     12.89000  0.1688000     12.36000  0.3147000     0.5314000      0.3571000 
1 1 1 8  10 4  o 7.407000  0.1768000     7.511000  0.3249000     7.302000  0.1395000     0.2096000      0.3536000 
1 1 1 8  10 5  o 26.91000  0.2170000     26.82000  0.3061000     27.00000  0.3076000     -0.1846000     0.4339000 
1 1 1 8  10 6  o 9.562000  0.1248000     9.668000  0.1775000     9.455000  0.1755000     0.2129000      0.2496000 
1 1 1 8  10 7  o 4.355000  0.1491000     4.491000  0.2000000     4.219000  0.2212000     0.2722000      0.2982000 
1 1 1 8  10 8  o 2.639000  0.2370000     2.886000  0.3031000     2.393000  0.3645000     0.4935000      0.4740000 
1 1 1 8  10 9  o 2.435000  0.3212000     3.079000  0.3300000     1.791000  0.5511000     1.288000       0.6424000 
1 1 1 8  10 10 o 1.531000  0.4762000     1.566000  0.6790000     1.496000  0.6678000     0.6999000E-01  0.9523000 
1 1 1 8  10 11 o 3.668000  0.3498000     4.060000  0.4379000     3.276000  0.5456000     0.7841000      0.6996000 
1 1 1 8  10 12 o 2.156000  0.5110000     1.958000  0.7160000     2.354000  0.7294000     -0.3955000     1.022000  
1 1 1 8  10 13 o 9.417000  0.2069000     9.590000  0.2868000     9.243000  0.2983000     0.3466000      0.4138000 
1 1 1 8  10 14 o 3.169000  0.5137000     2.697000  0.7779000     3.640000  0.6712000     -0.9428000     1.027000  
1 1 1 8  10 15 o 8.535000  0.2859000     9.075000  0.3832000     7.995000  0.4245000     1.080000       0.5719000 
1 1 1 8  10 16 f 8.149000  0.3140000     7.869000  0.4549000     8.430000  0.4330000     -0.5615000     0.6280000 
1 1 1 8  10 17 o 11.70000  0.2654000     11.71000  0.3970000     11.68000  0.3522000     0.3520000E-01  0.5307000 
1 1 1 8  10 18 o 4.036000  0.5908000     3.427000  0.9249000     4.644000  0.7354000     -1.217000      1.182000  
1 1 1 8  10 19 o 4.467000  0.5783000     3.837000  0.9115000     5.097000  0.7118000     -1.260000      1.157000  
1 1 1 8  10 20 o 4.815000  0.5465000     4.702000  0.8055000     4.928000  0.7389000     -0.2256000     1.093000  
1 1 1 8  10 21 o 2.365000  0.6351000     1.901000  0.8402000     2.829000  0.9527000     -0.9279000     1.270000  
1 1 1 8  10 22 o 1.391000  0.4709000     1.495000  0.7028000     1.286000  0.6269000     0.2097000      0.9417000 
1 1 1 8  10 23 o 1.835000  0.5587000     1.774000  0.7772000     1.896000  0.8027000     -0.1228000     1.117000  
1 1 1 8  10 24 o 1.528000  0.4762000     1.915000  0.7652000     1.141000  0.5670000     0.7737000      0.9524000 
1 1 1 8  10 25 o 2.090000  0.5762000     2.078000  0.8139000     2.101000  0.8158000     -0.2302000E-01 1.152000  
1 1 1 8  10 26 o 1.445000  0.4673000     1.817000  0.7687000     1.073000  0.5316000     0.7440000      0.9346000 
1 1 1 8  10 27 f 1.276000  0.4313000     1.323000  0.6268000     1.228000  0.5926000     0.9429000E-01  0.8625000 
1 1 1 8  11 0  o 13.10000  0.1671000     13.10000  0.1671000     13.10000  0.1671000     0.000000       0.000000  
1 1 1 8  11 1  o 10.85000  0.1059000     10.89000  0.1500000     10.80000  0.1495000     0.9534000E-01  0.2118000 
1 1 1 8  11 2  o 15.02000  0.1699000     14.91000  0.2609000     15.13000  0.2175000     -0.2210000     0.3397000 
1 1 1 8  11 3  o 40.53000  0.4481000     40.91000  0.6388000     40.16000  0.6286000     0.7453000      0.8962000 
1 1 1 8  11 4  o 22.35000  0.1838000     22.60000  0.2623000     22.10000  0.2576000     0.4973000      0.3677000 
1 1 1 8  11 5  o 8.676000  0.1075000     8.667000  0.1527000     8.685000  0.1514000     -0.1806000E-01 0.2150000 
1 1 1 8  11 6  o 19.97000  0.1708000     20.01000  0.2419000     19.94000  0.2411000     0.6297000E-01  0.3415000 
1 1 1 8  11 7  o 8.843000  0.1259000     8.665000  0.2003000     9.021000  0.1527000     -0.3560000     0.2519000 
1 1 1 8  11 8  o 15.24000  0.1535000     15.75000  0.2188000     14.73000  0.2153000     1.020000       0.3070000 
1 1 1 8  11 9  o 8.656000  0.2486000     9.033000  0.2186000     8.278000  0.4466000     0.7551000      0.4972000 
1 1 1 8  11 10 o 2.884000  0.4380000     2.807000  0.7753000     2.961000  0.4078000     -0.1536000     0.8760000 
1 1 1 8  11 11 o 5.426000  0.1925000     5.258000  0.2605000     5.595000  0.2834000     -0.3371000     0.3849000 
1 1 1 8  11 12 f 5.376000  0.2700000     5.678000  0.2623000     5.073000  0.4721000     0.6050000      0.5401000 
1 1 1 8  11 13 o 9.776000  0.2095000     9.708000  0.2968000     9.844000  0.2959000     -0.1358000     0.4191000 
1 1 1 8  11 14 o 8.417000  0.2546000     8.323000  0.3389000     8.510000  0.3801000     -0.1864000     0.5092000 
1 1 1 8  11 15 o 9.022000  0.3421000     8.732000  0.4884000     9.311000  0.4791000     -0.5789000     0.6842000 
1 1 1 8  11 16 o 4.730000  0.4871000     4.457000  0.7523000     5.002000  0.6191000     -0.5457000     0.9743000 
1 1 1 8  11 17 o 5.782000  0.4219000     5.452000  0.6695000     6.112000  0.5136000     -0.6604000     0.8438000 
1 1 1 8  11 18 o 10.61000  0.2740000     10.34000  0.3920000     10.88000  0.3830000     -0.5441000     0.5480000 
1 1 1 8  11 19 o 3.315000  0.6960000     3.473000  0.9659000     3.156000  1.002000      0.3167000      1.392000  
1 1 1 8  11 20 o 5.362000  0.5680000     5.828000  0.6652000     4.897000  0.9210000     0.9316000      1.136000  
1 1 1 8  11 21 o 2.088000  0.6040000     2.676000  0.9697000     1.501000  0.7203000     1.175000       1.208000  
1 1 1 8  11 22 o 1.880000  0.5686000     2.115000  0.8607000     1.645000  0.7433000     0.4701000      1.137000  
1 1 1 8  11 23 o 1.540000  0.5047000     1.611000  0.7348000     1.469000  0.6921000     0.1418000      1.009000  
1 1 1 8  11 24 o 2.003000  0.5779000     2.071000  0.8279000     1.934000  0.8065000     0.1371000      1.156000  
1 1 1 8  11 25 o 1.759000  0.5373000     1.702000  0.7495000     1.816000  0.7701000     -0.1141000     1.075000  
1 1 1 8  11 26 o 1.268000  0.4278000     1.387000  0.6460000     1.149000  0.5610000     0.2385000      0.8556000 
1 1 1 8  11 27 o 1.177000  0.4047000     1.239000  0.5958000     1.114000  0.5478000     0.1250000      0.8093000 
1 1 1 8  12 0  o 4.858000  0.1988000     4.858000  0.1988000     4.858000  0.1988000     -0.000000      0.000000  
1 1 1 8  12 1  o 52.64000  0.7163000     51.80000  0.8046000     53.48000  1.185000      -1.686000      1.433000  
1 1 1 8  12 2  o 29.30000  0.4650000     29.30000  0.4650000     ?         ?             ?              ?         
1 1 1 8  12 3  o 20.91000  0.1875000     20.87000  0.2837000     20.96000  0.2452000     -0.8589000E-01 0.3750000 
1 1 1 8  12 4  o 18.18000  0.1561000     18.14000  0.2204000     18.22000  0.2210000     -0.7615000E-01 0.3121000 
1 1 1 8  12 5  o 9.310000  0.1108000     9.379000  0.1575000     9.241000  0.1560000     0.1379000      0.2216000 
1 1 1 8  12 6  o 4.649000  0.1246000     4.745000  0.1732000     4.553000  0.1792000     0.1915000      0.2492000 
1 1 1 8  12 7  o 10.59000  0.1231000     10.72000  0.1751000     10.47000  0.1731000     0.2484000      0.2462000 
1 1 1 8  12 8  o 12.33000  0.1424000     12.47000  0.2266000     12.20000  0.1727000     0.2729000      0.2849000 
1 1 1 8  12 9  o 11.75000  0.1887000     11.71000  0.2063000     11.78000  0.3161000     -0.6896000E-01 0.3774000 
1 1 1 8  12 10 o 6.863000  0.2030000     6.655000  0.3354000     7.070000  0.2290000     -0.4150000     0.4061000 
1 1 1 8  12 11 f 3.639000  0.2643000     3.716000  0.3448000     3.563000  0.4008000     0.1531000      0.5287000 
1 1 1 8  12 12 o 3.280000  0.3187000     3.573000  0.4100000     2.987000  0.4881000     0.5859000      0.6374000 
1 1 1 8  12 13 o 10.63000  0.2103000     10.50000  0.2299000     10.76000  0.3521000     -0.2689000     0.4205000 
1 1 1 8  12 14 o 12.51000  0.2362000     12.63000  0.3380000     12.38000  0.3300000     0.2505000      0.4724000 
1 1 1 8  12 15 o 4.512000  0.5748000     4.972000  0.7575000     4.051000  0.8646000     0.9213000      1.150000  
1 1 1 8  12 16 o 6.340000  0.4017000     5.469000  0.6361000     7.210000  0.4907000     -1.741000      0.8033000 
1 1 1 8  12 17 o 8.207000  0.3288000     8.411000  0.4953000     8.003000  0.4324000     0.4085000      0.6575000 
1 1 1 8  12 18 o 2.847000  0.6653000     2.570000  0.9409000     3.125000  0.9408000     -0.5552000     1.331000  
1 1 1 8  12 19 o 2.670000  0.6367000     1.862000  0.8517000     3.478000  0.9466000     -1.616000      1.273000  
1 1 1 8  12 20 o 5.092000  0.6053000     6.093000  0.6982000     4.091000  0.9889000     2.002000       1.211000  
1 1 1 8  12 21 o 2.382000  0.6488000     2.395000  0.9197000     2.369000  0.9153000     0.2545000E-01  1.298000  
1 1 1 8  12 22 f 1.467000  0.4894000     1.270000  0.6264000     1.663000  0.7522000     -0.3934000     0.9789000 
1 1 1 8  12 23 o 1.783000  0.5457000     2.039000  0.8277000     1.527000  0.7114000     0.5122000      1.091000  
1 1 1 8  12 24 o 1.769000  0.5529000     1.595000  0.7181000     1.943000  0.8409000     -0.3477000     1.106000  
1 1 1 8  12 25 o 1.759000  0.5362000     1.770000  0.7616000     1.748000  0.7550000     0.2203000E-01  1.072000  
1 1 1 8  12 26 o 1.466000  0.4725000     1.346000  0.6316000     1.587000  0.7031000     -0.2407000     0.9451000 
1 1 1 8  12 27 o 1.347000  0.4524000     1.623000  0.7275000     1.071000  0.5378000     0.5524000      0.9047000 
1 1 1 8  13 0  o 20.33000  0.3369000     20.33000  0.3369000     20.33000  0.3369000     -0.000000      0.000000  
1 1 1 8  13 1  o 23.52000  0.2458000     23.16000  0.3766000     23.89000  0.3161000     -0.7274000     0.4917000 
1 1 1 8  13 2  o 5.606000  0.1119000     5.626000  0.1698000     5.587000  0.1457000     0.3885000E-01  0.2238000 
1 1 1 8  13 3  o 12.32000  0.1198000     12.36000  0.1701000     12.27000  0.1689000     0.9080000E-01  0.2397000 
1 1 1 8  13 4  o 12.95000  0.1255000     12.90000  0.1773000     12.99000  0.1777000     -0.8501000E-01 0.2511000 
1 1 1 8  13 5  o 12.95000  0.1276000     12.91000  0.1807000     12.98000  0.1802000     -0.7310000E-01 0.2552000 
1 1 1 8  13 6  o 16.03000  0.1472000     16.21000  0.2096000     15.85000  0.2066000     0.3595000      0.2943000 
1 1 1 8  13 7  o 5.797000  0.1241000     5.965000  0.1722000     5.628000  0.1787000     0.3369000      0.2481000 
1 1 1 8  13 8  o 1.434000  0.3263000     1.368000  0.4636000     1.500000  0.4593000     -0.1320000     0.6526000 
1 1 1 8  13 9  o 7.297000  0.1608000     7.276000  0.2096000     7.318000  0.2440000     -0.4148000E-01 0.3217000 
1 1 1 8  13 10 o 12.14000  0.1563000     11.82000  0.2188000     12.45000  0.2231000     -0.6305000     0.3125000 
1 1 1 8  13 11 o 2.662000  0.3583000     2.338000  0.5464000     2.986000  0.4636000     -0.6486000     0.7166000 
1 1 1 8  13 12 o 5.632000  0.2114000     5.676000  0.2884000     5.589000  0.3091000     0.8647000E-01  0.4228000 
1 1 1 8  13 13 o 8.520000  0.1976000     8.536000  0.2657000     8.504000  0.2925000     0.3175000E-01  0.3952000 
1 1 1 8  13 14 o 5.251000  0.3912000     5.206000  0.3894000     5.296000  0.6786000     -0.8997000E-01 0.7824000 
1 1 1 8  13 15 o 4.921000  0.7877000     4.438000  1.218000      5.404000  0.9990000     -0.9659000     1.575000  
1 1 1 8  13 16 o 10.23000  0.2867000     10.88000  0.3981000     9.570000  0.4125000     1.314000       0.5733000 
1 1 1 8  13 17 o 13.36000  0.2669000     13.34000  0.4039000     13.39000  0.3489000     -0.5412000E-01 0.5337000 
1 1 1 8  13 18 o 3.670000  0.6205000     3.179000  0.9462000     4.162000  0.8030000     -0.9830000     1.241000  
1 1 1 8  13 19 o 7.054000  0.4432000     7.525000  0.6071000     6.582000  0.6458000     0.9431000      0.8863000 
1 1 1 8  13 20 o 2.650000  0.7138000     3.007000  1.053000      2.294000  0.9641000     0.7138000      1.428000  
1 1 1 8  13 21 o 3.439000  0.6235000     3.215000  0.9190000     3.662000  0.8429000     -0.4471000     1.247000  
1 1 1 8  13 22 o 3.082000  0.6293000     2.946000  0.9186000     3.219000  0.8605000     -0.2737000     1.259000  
1 1 1 8  13 23 o 2.265000  0.5945000     1.930000  0.8008000     2.600000  0.8790000     -0.6696000     1.189000  
1 1 1 8  13 24 o 1.486000  0.4952000     1.301000  0.6289000     1.672000  0.7652000     -0.3708000     0.9905000 
1 1 1 8  13 25 o 1.554000  0.5233000     1.765000  0.8088000     1.342000  0.6642000     0.4224000      1.047000  
1 1 1 8  13 26 o 1.439000  0.4625000     1.652000  0.7145000     1.226000  0.5876000     0.4261000      0.9251000 
1 1 1 8  14 0  o 10.04000  0.1521000     10.04000  0.1521000     10.04000  0.1521000     -0.000000      0.000000  
1 1 1 8  14 1  o 5.622000  0.1025000     5.657000  0.1443000     5.587000  0.1456000     0.6970000E-01  0.2050000 
1 1 1 8  14 2  o 13.17000  0.1244000     13.13000  0.1755000     13.22000  0.1763000     -0.9007000E-01 0.2488000 
1 1 1 8  14 3  o 21.22000  0.1771000     21.33000  0.2512000     21.12000  0.2496000     0.2116000      0.3541000 
1 1 1 8  14 4  o 30.01000  0.2402000     30.36000  0.3432000     29.67000  0.3362000     0.6922000      0.4805000 
1 1 1 8  14 5  f 22.11000  0.1855000     22.13000  0.2624000     22.08000  0.2622000     0.4901000E-01  0.3709000 
1 1 1 8  14 6  o 8.744000  0.1164000     8.716000  0.1644000     8.772000  0.1649000     -0.5554000E-01 0.2329000 
1 1 1 8  14 7  o 11.46000  0.1301000     11.65000  0.1849000     11.26000  0.1830000     0.3902000      0.2601000 
1 1 1 8  14 8  o 1.200000  0.3207000     1.702000  0.5439000     0.6988000 0.3399000     1.003000       0.6414000 
1 1 1 8  14 9  o 5.020000  0.2077000     5.224000  0.2950000     4.815000  0.2924000     0.4086000      0.4153000 
1 1 1 8  14 10 o 2.020000  0.3522000     2.673000  0.4354000     1.367000  0.5536000     1.306000       0.7043000 
1 1 1 8  14 11 o 1.981000  0.4292000     1.893000  0.5947000     2.069000  0.6190000     -0.1761000     0.8584000 
1 1 1 8  14 12 o 12.62000  0.1733000     12.35000  0.2447000     12.88000  0.2456000     -0.5319000     0.3467000 
1 1 1 8  14 13 o 6.628000  0.2243000     6.936000  0.2861000     6.320000  0.3454000     0.6165000      0.4485000 
1 1 1 8  14 14 f 2.623000  0.6436000     2.268000  0.6917000     2.979000  1.086000      -0.7104000     1.287000  
1 1 1 8  14 15 o 5.282000  0.7382000     4.737000  1.314000      5.828000  0.6736000     -1.091000      1.476000  
1 1 1 8  14 16 o 6.212000  0.3930000     6.422000  0.3877000     6.002000  0.6837000     0.4199000      0.7859000 
1 1 1 8  14 17 o 9.831000  0.3016000     9.580000  0.4534000     10.08000  0.3980000     -0.5021000     0.6033000 
1 1 1 8  14 18 o 5.387000  0.4545000     5.674000  0.6073000     5.099000  0.6763000     0.5754000      0.9089000 
1 1 1 8  14 19 o 6.316000  0.4960000     5.847000  0.7710000     6.785000  0.6241000     -0.9378000     0.9919000 
1 1 1 8  14 20 o 5.394000  0.6652000     3.780000  1.176000      7.009000  0.6225000     -3.228000      1.330000  
1 1 1 8  14 21 o 3.183000  0.6526000     3.088000  0.9349000     3.277000  0.9108000     -0.1897000     1.305000  
1 1 1 8  14 22 o 4.872000  0.4529000     5.027000  0.6832000     4.718000  0.5947000     0.3084000      0.9058000 
1 1 1 8  14 23 o 2.147000  0.5213000     1.297000  0.6272000     2.996000  0.8329000     -1.699000      1.043000  
1 1 1 8  14 24 o 1.327000  0.4567000     1.279000  0.6168000     1.376000  0.6738000     -0.9681000E-01 0.9135000 
1 1 1 8  14 25 o 1.703000  0.5472000     1.732000  0.7869000     1.675000  0.7606000     0.5632000E-01  1.094000  
1 1 1 8  14 26 o 2.035000  0.5393000     1.802000  0.7399000     2.268000  0.7849000     -0.4653000     1.079000  
1 1 1 8  15 0  o 3.987000  0.1701000     3.987000  0.1701000     3.987000  0.1701000     -0.000000      0.000000  
1 1 1 8  15 1  o 2.106000  0.2052000     1.737000  0.3336000     2.475000  0.2390000     -0.7383000     0.4103000 
1 1 1 8  15 2  o 15.30000  0.1382000     15.30000  0.1954000     15.31000  0.1955000     -0.9632000E-02 0.2764000 
1 1 1 8  15 3  o 17.20000  0.1510000     17.33000  0.2144000     17.07000  0.2126000     0.2637000      0.3019000 
1 1 1 8  15 4  o 14.65000  0.1371000     14.68000  0.1945000     14.63000  0.1934000     0.5424000E-01  0.2743000 
1 1 1 8  15 5  o 6.264000  0.1145000     6.320000  0.1598000     6.208000  0.1640000     0.1122000      0.2290000 
1 1 1 8  15 6  o 5.237000  0.1273000     5.459000  0.1746000     5.014000  0.1853000     0.4456000      0.2546000 
1 1 1 8  15 7  o 8.990000  0.1246000     8.829000  0.1762000     9.151000  0.1762000     -0.3219000     0.2492000 
1 1 1 8  15 8  o 17.10000  0.2272000     17.10000  0.3222000     17.10000  0.3203000     0.3353000E-02  0.4543000 
1 1 1 8  15 9  o 17.60000  0.2859000     17.68000  0.5201000     17.53000  0.2379000     0.1521000      0.5719000 
1 1 1 8  15 10 o 9.870000  0.1582000     9.786000  0.2204000     9.954000  0.2271000     -0.1677000     0.3164000 
1 1 1 8  15 11 o 10.54000  0.1659000     10.30000  0.2326000     10.78000  0.2366000     -0.4829000     0.3318000 
1 1 1 8  15 12 o 8.784000  0.1905000     8.804000  0.2508000     8.765000  0.2868000     0.3889000E-01  0.3810000 
1 1 1 8  15 13 o 17.07000  0.2062000     16.69000  0.2706000     17.46000  0.3111000     -0.7694000     0.4123000 
1 1 1 8  15 14 o 13.73000  0.3212000     12.86000  0.2703000     14.60000  0.5828000     -1.742000      0.6425000 
1 1 1 8  15 15 o 13.90000  0.3940000     13.86000  0.6510000     13.94000  0.4439000     -0.7547000E-01 0.7879000 
1 1 1 8  15 16 o 11.08000  0.2642000     11.22000  0.3344000     10.94000  0.4093000     0.2867000      0.5285000 
1 1 1 8  15 17 o 4.635000  0.3679000     4.646000  0.5287000     4.624000  0.5116000     0.2210000E-01  0.7357000 
1 1 1 8  15 18 o 5.506000  0.5461000     6.596000  0.5718000     4.416000  0.9306000     2.181000       1.092000  
1 1 1 8  15 19 o 2.900000  0.7847000     2.976000  1.085000      2.823000  1.134000      0.1534000      1.569000  
1 1 1 8  15 20 o 1.757000  0.5948000     1.719000  0.8346000     1.795000  0.8478000     -0.7563000E-01 1.190000  
1 1 1 8  15 21 o 5.024000  0.4495000     4.745000  0.6794000     5.303000  0.5887000     -0.5584000     0.8990000 
1 1 1 8  15 22 o 2.582000  0.6056000     2.231000  0.8815000     2.932000  0.8307000     -0.7008000     1.211000  
1 1 1 8  15 23 o 1.756000  0.5401000     1.831000  0.7807000     1.681000  0.7465000     0.1506000      1.080000  
1 1 1 8  15 24 o 1.677000  0.5479000     1.967000  0.8549000     1.388000  0.6854000     0.5789000      1.096000  
1 1 1 8  15 25 o 1.518000  0.4960000     1.671000  0.7439000     1.366000  0.6561000     0.3050000      0.9919000 
1 1 1 8  15 26 o 1.549000  0.4835000     1.319000  0.6224000     1.778000  0.7400000     -0.4591000     0.9670000 
1 1 1 8  16 0  o 19.46000  0.2342000     19.46000  0.2342000     19.46000  0.2342000     0.000000       0.000000  
1 1 1 8  16 1  o 28.42000  0.2285000     28.27000  0.3214000     28.57000  0.3248000     -0.3034000     0.4569000 
1 1 1 8  16 2  o 36.65000  0.2888000     36.70000  0.4088000     36.59000  0.4080000     0.1090000      0.5776000 
1 1 1 8  16 3  o 21.26000  0.1787000     21.44000  0.2543000     21.07000  0.2510000     0.3727000      0.3573000 
1 1 1 8  16 4  o 11.54000  0.1223000     11.77000  0.1747000     11.30000  0.1713000     0.4679000      0.2447000 
1 1 1 8  16 5  o 11.69000  0.1260000     11.71000  0.1781000     11.67000  0.1784000     0.3531000E-01  0.2521000 
1 1 1 8  16 6  o 4.614000  0.1379000     4.586000  0.1965000     4.643000  0.1934000     -0.5671000E-01 0.2757000 
1 1 1 8  16 7  o 3.387000  0.1834000     3.585000  0.2464000     3.189000  0.2717000     0.3958000      0.3668000 
1 1 1 8  16 8  o 2.557000  0.3230000     2.570000  0.3561000     2.544000  0.5390000     0.2551000E-01  0.6460000 
1 1 1 8  16 9  o 6.836000  0.1455000     6.834000  0.2101000     6.838000  0.2013000     -0.3966000E-02 0.2910000 
1 1 1 8  16 10 o 11.75000  0.1595000     11.65000  0.2539000     11.85000  0.1930000     -0.1999000     0.3189000 
1 1 1 8  16 11 o 10.02000  0.1678000     10.08000  0.2351000     9.965000  0.2395000     0.1175000      0.3356000 
1 1 1 8  16 12 o 16.80000  0.1861000     17.00000  0.2612000     16.61000  0.2651000     0.3827000      0.3722000 
1 1 1 8  16 13 o 8.134000  0.2103000     8.219000  0.2706000     8.050000  0.3220000     0.1686000      0.4206000 
1 1 1 8  16 14 o 9.471000  0.3667000     10.21000  0.2802000     8.730000  0.6777000     1.482000       0.7334000 
1 1 1 8  16 15 o 6.112000  0.3743000     6.111000  0.4142000     6.113000  0.6237000     -0.1875000E-02 0.7487000 
1 1 1 8  16 16 o 12.31000  0.2606000     12.30000  0.3268000     12.32000  0.4060000     -0.2407000E-01 0.5211000 
1 1 1 8  16 17 o 6.696000  0.2960000     6.525000  0.4324000     6.867000  0.4044000     -0.3427000     0.5921000 
1 1 1 8  16 18 o 4.767000  0.4236000     4.475000  0.6400000     5.059000  0.5551000     -0.5841000     0.8472000 
1 1 1 8  16 19 o 5.936000  0.6729000     6.421000  0.4475000     5.452000  1.269000      0.9688000      1.346000  
1 1 1 8  16 20 o 2.632000  0.6692000     1.792000  0.8408000     3.471000  1.041000      -1.679000      1.338000  
1 1 1 8  16 21 o 1.650000  0.5384000     1.591000  0.7432000     1.708000  0.7793000     -0.1167000     1.077000  
1 1 1 8  16 22 o 2.180000  0.5933000     2.134000  0.8522000     2.225000  0.8255000     -0.9047000E-01 1.187000  
1 1 1 8  16 23 o 2.237000  0.5847000     2.050000  0.8113000     2.423000  0.8421000     -0.3731000     1.169000  
1 1 1 8  16 24 o 2.730000  0.5080000     3.952000  0.7261000     1.507000  0.7106000     2.445000       1.016000  
1 1 1 8  16 25 o 1.946000  0.5772000     1.955000  0.8087000     1.936000  0.8239000     0.1928000E-01  1.154000  
1 1 1 8  16 26 o 1.960000  0.5227000     1.608000  0.6986000     2.312000  0.7776000     -0.7040000     1.045000  
1 1 1 8  17 0  o 1.509000  0.4459000     1.509000  0.4459000     1.509000  0.4459000     -0.000000      0.000000  
1 1 1 8  17 1  o 6.068000  0.1104000     6.312000  0.1545000     5.824000  0.1577000     0.4882000      0.2208000 
1 1 1 8  17 2  o 13.42000  0.1294000     13.22000  0.1813000     13.63000  0.1845000     -0.4092000     0.2587000 
1 1 1 8  17 3  o 18.18000  0.1585000     18.08000  0.2230000     18.29000  0.2254000     -0.2120000     0.3171000 
1 1 1 8  17 4  o 16.23000  0.1480000     16.25000  0.2097000     16.20000  0.2089000     0.5142000E-01  0.2960000 
1 1 1 8  17 5  o 9.810000  0.1206000     9.736000  0.1698000     9.885000  0.1713000     -0.1492000     0.2412000 
1 1 1 8  17 6  o 4.244000  0.1594000     4.359000  0.2060000     4.129000  0.2431000     0.2300000      0.3187000 
1 1 1 8  17 7  o 15.28000  0.1851000     15.08000  0.3007000     15.48000  0.2160000     -0.4065000     0.3702000 
1 1 1 8  17 8  o 13.48000  0.1899000     12.91000  0.2286000     14.05000  0.3033000     -1.138000      0.3798000 
1 1 1 8  17 9  o 10.43000  0.1412000     10.62000  0.1998000     10.24000  0.1996000     0.3846000      0.2825000 
1 1 1 8  17 10 o 7.930000  0.1486000     8.021000  0.2104000     7.839000  0.2100000     0.1821000      0.2972000 
1 1 1 8  17 11 o 10.81000  0.1707000     10.98000  0.2422000     10.63000  0.2408000     0.3509000      0.3415000 
1 1 1 8  17 12 o 4.304000  0.2726000     4.077000  0.3845000     4.530000  0.3865000     -0.4523000     0.5452000 
1 1 1 8  17 13 f 21.40000  0.2305000     20.92000  0.2994000     21.88000  0.3504000     -0.9589000     0.4609000 
1 1 1 8  17 14 o 9.674000  0.3703000     10.03000  0.3099000     9.316000  0.6728000     0.7171000      0.7407000 
1 1 1 8  17 15 o 2.635000  0.6243000     2.607000  0.7870000     2.663000  0.9694000     -0.5658000E-01 1.249000  
1 1 1 8  17 16 o 3.763000  0.5515000     2.373000  0.8339000     5.153000  0.7219000     -2.780000      1.103000  
1 1 1 8  17 17 o 4.046000  0.4822000     3.441000  0.7778000     4.651000  0.5702000     -1.210000      0.9644000 
1 1 1 8  17 18 o 4.491000  0.4707000     4.235000  0.7162000     4.746000  0.6111000     -0.5103000     0.9415000 
1 1 1 8  17 19 o 2.592000  0.7160000     1.936000  0.8081000     3.247000  1.182000      -1.311000      1.432000  
1 1 1 8  17 20 o 1.872000  0.5343000     1.346000  0.6416000     2.397000  0.8546000     -1.051000      1.069000  
1 1 1 8  17 21 o 2.461000  0.5607000     2.543000  0.7764000     2.380000  0.8091000     0.1626000      1.121000  
1 1 1 8  17 22 o 1.633000  0.5283000     1.719000  0.7669000     1.548000  0.7268000     0.1713000      1.057000  
1 1 1 8  17 23 o 1.889000  0.5873000     1.509000  0.7001000     2.269000  0.9431000     -0.7604000     1.175000  
1 1 1 8  17 24 o 1.817000  0.5642000     1.881000  0.8107000     1.753000  0.7849000     0.1282000      1.128000  
1 1 1 8  17 25 o 1.353000  0.4495000     1.397000  0.6504000     1.310000  0.6205000     0.8695000E-01  0.8990000 
1 1 1 8  17 26 o 1.414000  0.4587000     1.327000  0.6254000     1.500000  0.6712000     -0.1725000     0.9174000 
1 1 1 8  18 0  o 26.91000  0.3087000     26.91000  0.3087000     26.91000  0.3087000     -0.000000      0.000000  
1 1 1 8  18 1  o 4.349000  0.1270000     4.573000  0.1742000     4.125000  0.1849000     0.4478000      0.2541000 
1 1 1 8  18 2  o 16.06000  0.1454000     16.25000  0.2070000     15.88000  0.2043000     0.3703000      0.2908000 
1 1 1 8  18 3  o 12.72000  0.1282000     12.95000  0.1824000     12.49000  0.1803000     0.4572000      0.2565000 
1 1 1 8  18 4  o 1.784000  0.2731000     1.525000  0.4181000     2.043000  0.3516000     -0.5184000     0.5463000 
1 1 1 8  18 5  o 4.144000  0.1471000     3.995000  0.2152000     4.293000  0.2007000     -0.2983000     0.2943000 
1 1 1 8  18 6  o 13.80000  0.1415000     13.80000  0.1997000     13.80000  0.2004000     0.8974000E-03  0.2829000 
1 1 1 8  18 7  o 3.260000  0.2409000     3.347000  0.2957000     3.174000  0.3804000     0.1725000      0.4818000 
1 1 1 8  18 8  o 8.705000  0.1662000     8.706000  0.2719000     8.703000  0.1910000     0.2846000E-02  0.3323000 
1 1 1 8  18 9  o 7.916000  0.1429000     7.883000  0.2008000     7.948000  0.2035000     -0.6549000E-01 0.2858000 
1 1 1 8  18 10 o 11.23000  0.1850000     11.72000  0.2637000     10.74000  0.2594000     0.9824000      0.3700000 
1 1 1 8  18 11 o 9.415000  0.2073000     9.179000  0.2681000     9.652000  0.3162000     -0.4728000     0.4146000 
1 1 1 8  18 12 o 14.62000  0.1812000     14.65000  0.2531000     14.58000  0.2593000     0.6900000E-01  0.3624000 
1 1 1 8  18 13 o 6.549000  0.2546000     6.723000  0.3352000     6.376000  0.3835000     0.3472000      0.5093000 
1 1 1 8  18 14 o 7.523000  0.5576000     8.076000  0.7355000     6.969000  0.8382000     1.107000       1.115000  
1 1 1 8  18 15 o 15.68000  0.2657000     15.95000  0.2982000     15.41000  0.4398000     0.5430000      0.5314000 
1 1 1 8  18 16 o 2.376000  0.6164000     2.605000  0.8365000     2.148000  0.9057000     0.4564000      1.233000  
1 1 1 8  18 17 o 7.658000  0.2886000     7.584000  0.4241000     7.733000  0.3914000     -0.1483000     0.5771000 
1 1 1 8  18 18 o 8.604000  0.2900000     8.521000  0.4259000     8.687000  0.3936000     -0.1663000     0.5799000 
1 1 1 8  18 19 o 5.411000  0.3799000     5.204000  0.5528000     5.618000  0.5214000     -0.4134000     0.7599000 
1 1 1 8  18 20 o 1.636000  0.5050000     1.284000  0.6131000     1.989000  0.8027000     -0.7049000     1.010000  
1 1 1 8  18 21 o 1.540000  0.4893000     1.595000  0.7062000     1.485000  0.6773000     0.1100000      0.9785000 
1 1 1 8  18 22 o 3.110000  0.5997000     2.643000  1.000000      3.578000  0.6620000     -0.9353000     1.199000  
1 1 1 8  18 23 o 2.097000  0.5917000     3.065000  1.048000      1.129000  0.5502000     1.936000       1.183000  
1 1 1 8  18 24 o 1.382000  0.4453000     1.370000  0.6089000     1.394000  0.6501000     -0.2426000E-01 0.8907000 
1 1 1 8  18 25 o 1.266000  0.4309000     0.9062000 0.4523000     1.627000  0.7336000     -0.7204000     0.8618000 
1 1 1 8  18 26 o 1.427000  0.4548000     1.484000  0.6302000     1.371000  0.6558000     0.1135000      0.9095000 
1 1 1 8  19 0  o 1.014000  0.5011000     1.014000  0.5011000     1.014000  0.5011000     -0.000000      0.000000  
1 1 1 8  19 1  f 15.44000  0.1426000     15.30000  0.2004000     15.57000  0.2028000     -0.2627000     0.2852000 
1 1 1 8  19 2  o 7.762000  0.1128000     7.838000  0.1598000     7.687000  0.1591000     0.1506000      0.2255000 
1 1 1 8  19 3  o 10.85000  0.1219000     10.82000  0.1712000     10.88000  0.1736000     -0.6240000E-01 0.2439000 
1 1 1 8  19 4  o 12.66000  0.1320000     12.40000  0.1849000     12.93000  0.1884000     -0.5284000     0.2640000 
1 1 1 8  19 5  o 8.693000  0.1238000     8.518000  0.1773000     8.867000  0.1729000     -0.3493000     0.2477000 
1 1 1 8  19 6  o 10.68000  0.1600000     10.46000  0.2600000     10.90000  0.1865000     -0.4422000     0.3200000 
1 1 1 8  19 7  o 6.891000  0.1770000     6.763000  0.1967000     7.018000  0.2944000     -0.2548000     0.3540000 
1 1 1 8  19 8  o 10.47000  0.1391000     10.35000  0.1961000     10.58000  0.1973000     -0.2377000     0.2782000 
1 1 1 8  19 9  f 5.304000  0.1674000     5.285000  0.2351000     5.324000  0.2384000     -0.3922000E-01 0.3348000 
1 1 1 8  19 10 o 10.06000  0.1483000     9.953000  0.2105000     10.16000  0.2089000     -0.2039000     0.2965000 
1 1 1 8  19 11 o 11.72000  0.1558000     11.68000  0.2206000     11.75000  0.2200000     -0.7034000E-01 0.3115000 
1 1 1 8  19 12 o 2.309000  0.4684000     2.359000  0.6667000     2.259000  0.6582000     0.1003000      0.9369000 
1 1 1 8  19 13 o 8.917000  0.3347000     8.776000  0.3010000     9.059000  0.5978000     -0.2827000     0.6693000 
1 1 1 8  19 14 o 6.298000  0.4605000     6.660000  0.6778000     5.936000  0.6235000     0.7235000      0.9210000 
1 1 1 8  19 15 o 10.42000  0.2797000     10.34000  0.3080000     10.50000  0.4670000     -0.1594000     0.5594000 
1 1 1 8  19 16 o 2.812000  0.6491000     1.968000  0.9062000     3.656000  0.9297000     -1.688000      1.298000  
1 1 1 8  19 17 o 9.627000  0.2663000     9.273000  0.4010000     9.982000  0.3506000     -0.7089000     0.5326000 
1 1 1 8  19 18 f 2.440000  0.5440000     3.422000  0.8474000     1.459000  0.6824000     1.963000       1.088000  
1 1 1 8  19 19 o 2.932000  0.6347000     2.972000  0.8828000     2.891000  0.9121000     0.8156000E-01  1.269000  
1 1 1 8  19 20 o 2.167000  0.5774000     2.165000  0.8147000     2.169000  0.8184000     -0.4336000E-02 1.155000  
1 1 1 8  19 21 o 2.716000  0.5621000     3.127000  0.7648000     2.305000  0.8241000     0.8220000      1.124000  
1 1 1 8  19 22 o 1.417000  0.4730000     1.343000  0.6690000     1.492000  0.6689000     -0.1491000     0.9460000 
1 1 1 8  19 23 o 2.539000  0.5807000     2.010000  0.8953000     3.068000  0.7397000     -1.058000      1.161000  
1 1 1 8  19 24 o 1.656000  0.4878000     1.373000  0.6263000     1.940000  0.7480000     -0.5668000     0.9756000 
1 1 1 8  19 25 o 1.329000  0.4320000     1.484000  0.6552000     1.174000  0.5632000     0.3101000      0.8639000 
1 1 1 8  19 26 o 1.889000  0.4824000     1.317000  0.6093000     2.462000  0.7481000     -1.146000      0.9648000 
1 1 1 8  20 0  o 10.46000  0.1689000     10.46000  0.1689000     10.46000  0.1689000     0.000000       0.000000  
1 1 1 8  20 1  o 13.54000  0.1336000     13.64000  0.1893000     13.45000  0.1886000     0.1899000      0.2673000 
1 1 1 8  20 2  o 9.452000  0.1178000     9.298000  0.1658000     9.606000  0.1673000     -0.3083000     0.2355000 
1 1 1 8  20 3  o 3.738000  0.1555000     3.732000  0.2167000     3.745000  0.2230000     -0.1343000E-01 0.3110000 
1 1 1 8  20 4  o 6.611000  0.1249000     6.558000  0.1783000     6.665000  0.1748000     -0.1062000     0.2497000 
1 1 1 8  20 5  o 14.56000  0.1452000     14.42000  0.2048000     14.71000  0.2059000     -0.2907000     0.2904000 
1 1 1 8  20 6  o 4.212000  0.2110000     4.176000  0.2656000     4.249000  0.3280000     -0.7253000E-01 0.4220000 
1 1 1 8  20 7  o 11.04000  0.1678000     11.06000  0.2729000     11.02000  0.1954000     0.4255000E-01  0.3357000 
1 1 1 8  20 8  o 8.800000  0.1391000     8.776000  0.1963000     8.823000  0.1971000     -0.4664000E-01 0.2781000 
1 1 1 8  20 9  f 12.78000  0.1509000     12.61000  0.2132000     12.95000  0.2137000     -0.3392000     0.3019000 
1 1 1 8  20 10 o 12.10000  0.1547000     12.25000  0.2170000     11.95000  0.2205000     0.3023000      0.3094000 
1 1 1 8  20 11 o 4.355000  0.2203000     4.593000  0.2951000     4.118000  0.3272000     0.4756000      0.4406000 
1 1 1 8  20 12 o 2.187000  0.3851000     2.720000  0.4829000     1.655000  0.6000000     1.065000       0.7702000 
1 1 1 8  20 13 o 12.50000  0.3093000     12.18000  0.2646000     12.81000  0.5591000     -0.6283000     0.6185000 
1 1 1 8  20 14 o 8.588000  0.2956000     9.279000  0.2997000     7.896000  0.5096000     1.383000       0.5912000 
1 1 1 8  20 15 o 6.415000  0.3720000     5.712000  0.4303000     7.117000  0.6068000     -1.404000      0.7439000 
1 1 1 8  20 16 o 9.058000  0.2598000     8.626000  0.3842000     9.491000  0.3498000     -0.8649000     0.5195000 
1 1 1 8  20 17 o 2.930000  0.6015000     3.143000  0.8280000     2.717000  0.8726000     0.4262000      1.203000  
1 1 1 8  20 18 o 4.488000  0.4907000     4.383000  0.7232000     4.592000  0.6633000     -0.2087000     0.9813000 
1 1 1 8  20 19 o 1.647000  0.5362000     1.486000  0.7145000     1.807000  0.7997000     -0.3202000     1.072000  
1 1 1 8  20 20 o 3.761000  0.4945000     3.542000  0.6995000     3.980000  0.6991000     -0.4384000     0.9890000 
1 1 1 8  20 21 o 3.482000  0.5088000     3.280000  0.7494000     3.684000  0.6883000     -0.4038000     1.018000  
1 1 1 8  20 22 o 2.034000  0.6115000     2.363000  0.9854000     1.705000  0.7243000     0.6580000      1.223000  
1 1 1 8  20 23 o 2.735000  0.5876000     2.017000  0.9384000     3.453000  0.7074000     -1.436000      1.175000  
1 1 1 8  20 24 o 2.394000  0.5596000     2.318000  0.7989000     2.471000  0.7839000     -0.1529000     1.119000  
1 1 1 8  20 25 o 1.343000  0.4318000     1.187000  0.5656000     1.499000  0.6527000     -0.3117000     0.8637000 
1 1 1 8  20 26 o 1.419000  0.4497000     1.412000  0.6340000     1.426000  0.6380000     -0.1414000E-01 0.8994000 
1 1 1 8  21 0  o 2.623000  0.2798000     2.623000  0.2798000     2.623000  0.2798000     -0.000000      0.000000  
1 1 1 8  21 1  o 5.983000  0.1229000     6.018000  0.1735000     5.949000  0.1740000     0.6851000E-01  0.2457000 
1 1 1 8  21 2  o 5.947000  0.1247000     5.916000  0.1760000     5.978000  0.1766000     -0.6188000E-01 0.2493000 
1 1 1 8  21 3  o 11.50000  0.1283000     11.65000  0.1820000     11.34000  0.1810000     0.3086000      0.2567000 
1 1 1 8  21 4  o 5.930000  0.1332000     5.959000  0.1866000     5.902000  0.1901000     0.5691000E-01  0.2664000 
1 1 1 8  21 5  o 14.48000  0.1796000     14.40000  0.2936000     14.56000  0.2071000     -0.1574000     0.3592000 
1 1 1 8  21 6  o 16.33000  0.2082000     16.06000  0.2519000     16.61000  0.3316000     -0.5570000     0.4164000 
1 1 1 8  21 7  o 7.711000  0.1399000     7.506000  0.1983000     7.917000  0.1973000     -0.4105000     0.2798000 
1 1 1 8  21 8  o 7.299000  0.1475000     7.404000  0.2092000     7.194000  0.2081000     0.2107000      0.2951000 
1 1 1 8  21 9  o 7.617000  0.1535000     7.703000  0.2182000     7.530000  0.2160000     0.1731000      0.3070000 
1 1 1 8  21 10 o 12.42000  0.1547000     12.78000  0.2200000     12.05000  0.2175000     0.7295000      0.3094000 
1 1 1 8  21 11 o 16.33000  0.1747000     16.37000  0.2477000     16.29000  0.2462000     0.7721000E-01  0.3493000 
1 1 1 8  21 12 o 6.326000  0.2243000     6.575000  0.3626000     6.078000  0.2640000     0.4971000      0.4485000 
1 1 1 8  21 13 o 14.07000  0.3393000     14.08000  0.2990000     14.06000  0.6093000     0.1733000E-01  0.6787000 
1 1 1 8  21 14 o 13.95000  0.2572000     14.12000  0.2807000     13.78000  0.4312000     0.3368000      0.5145000 
1 1 1 8  21 15 o 10.06000  0.2856000     9.840000  0.3097000     10.28000  0.4798000     -0.4436000     0.5711000 
1 1 1 8  21 16 o 2.278000  0.5861000     1.980000  0.7995000     2.576000  0.8573000     -0.5955000     1.172000  
1 1 1 8  21 17 o 5.185000  0.4000000     5.435000  0.5702000     4.935000  0.5613000     0.4997000      0.8001000 
1 1 1 8  21 18 o 2.509000  0.6714000     2.862000  0.8765000     2.156000  1.017000      0.7064000      1.343000  
1 1 1 8  21 19 o 7.030000  0.6890000     5.931000  1.317000      8.128000  0.4064000     -2.198000      1.378000  
1 1 1 8  21 20 o 3.564000  0.5221000     3.016000  0.8115000     4.112000  0.6570000     -1.096000      1.044000  
1 1 1 8  21 21 o 1.764000  0.5179000     2.106000  0.7998000     1.421000  0.6582000     0.6849000      1.036000  
1 1 1 8  21 22 o 3.572000  0.6129000     4.169000  0.9782000     2.975000  0.7387000     1.193000       1.226000  
1 1 1 8  21 23 o 2.229000  0.5590000     2.833000  0.8522000     1.624000  0.7237000     1.210000       1.118000  
1 1 1 8  21 24 o 2.237000  0.5273000     1.489000  0.7432000     2.986000  0.7481000     -1.497000      1.055000  
1 1 1 8  21 25 o 1.569000  0.4694000     1.806000  0.7084000     1.332000  0.6161000     0.4742000      0.9388000 
1 1 1 8  21 26 o 1.157000  0.3984000     1.232000  0.5902000     1.082000  0.5353000     0.1506000      0.7968000 
1 1 1 8  22 0  o 17.18000  0.2217000     17.18000  0.2217000     17.18000  0.2217000     0.000000       0.000000  
1 1 1 8  22 1  o 10.84000  0.1261000     10.71000  0.1776000     10.98000  0.1790000     -0.2647000     0.2522000 
1 1 1 8  22 2  o 5.588000  0.1328000     5.956000  0.1829000     5.221000  0.1926000     0.7358000      0.2656000 
1 1 1 8  22 3  o 11.45000  0.1300000     11.33000  0.1828000     11.56000  0.1849000     -0.2311000     0.2600000 
1 1 1 8  22 4  o 2.949000  0.2494000     3.169000  0.3839000     2.729000  0.3185000     0.4397000      0.4988000 
1 1 1 8  22 5  o 8.420000  0.1844000     8.420000  0.1844000     ?         ?             ?              ?         
1 1 1 8  22 6  o 9.072000  0.1652000     9.039000  0.2713000     9.106000  0.1884000     -0.6660000E-01 0.3303000 
1 1 1 8  22 7  o 12.42000  0.1450000     12.62000  0.2072000     12.22000  0.2029000     0.3995000      0.2900000 
1 1 1 8  22 8  o 10.13000  0.1441000     10.16000  0.2048000     10.10000  0.2028000     0.6123000E-01  0.2882000 
1 1 1 8  22 9  o 17.48000  0.1730000     17.48000  0.2449000     17.48000  0.2443000     -0.1123000E-02 0.3459000 
1 1 1 8  22 10 o 16.43000  0.1715000     16.34000  0.2421000     16.52000  0.2428000     -0.1790000     0.3429000 
1 1 1 8  22 11 o 3.553000  0.2674000     3.800000  0.3535000     3.306000  0.4014000     0.4949000      0.5349000 
1 1 1 8  22 12 f 4.474000  0.3198000     4.693000  0.4511000     4.256000  0.4536000     0.4371000      0.6397000 
1 1 1 8  22 13 o 4.491000  0.5719000     4.403000  0.5128000     4.579000  1.022000      -0.1755000     1.144000  
1 1 1 8  22 14 o 6.341000  0.3787000     6.991000  0.3793000     5.691000  0.6555000     1.300000       0.7573000 
1 1 1 8  22 15 o 11.06000  0.2839000     11.12000  0.3006000     11.00000  0.4818000     0.1240000      0.5679000 
1 1 1 8  22 16 o 11.18000  0.2435000     11.06000  0.3528000     11.29000  0.3358000     -0.2375000     0.4871000 
1 1 1 8  22 17 o 1.473000  0.4903000     1.474000  0.6927000     1.471000  0.6941000     0.2171000E-02  0.9806000 
1 1 1 8  22 18 o 2.680000  0.7198000     2.478000  0.8819000     2.883000  1.138000      -0.4052000     1.440000  
1 1 1 8  22 19 o 1.739000  0.5877000     1.967000  0.9434000     1.510000  0.7011000     0.4569000      1.175000  
1 1 1 8  22 20 o 3.574000  0.5089000     3.223000  0.7694000     3.926000  0.6663000     -0.7030000     1.018000  
1 1 1 8  22 21 o 3.027000  0.5472000     3.272000  0.7569000     2.783000  0.7905000     0.4899000      1.094000  
1 1 1 8  22 22 o 1.870000  0.5928000     2.464000  1.020000      1.276000  0.6041000     1.187000       1.186000  
1 1 1 8  22 23 o 1.498000  0.6825000     1.498000  0.6825000     ?         ?             ?              ?         
1 1 1 8  22 24 o 1.744000  0.5500000     1.649000  0.8146000     1.839000  0.7391000     -0.1894000     1.100000  
1 1 1 8  22 25 o 1.421000  0.4430000     1.129000  0.5456000     1.714000  0.6981000     -0.5850000     0.8860000 
1 1 1 8  23 0  o 19.32000  0.2420000     19.32000  0.2420000     19.32000  0.2420000     -0.000000      0.000000  
1 1 1 8  23 1  o 10.36000  0.1266000     10.29000  0.1783000     10.42000  0.1799000     -0.1388000     0.2533000 
1 1 1 8  23 2  o 3.629000  0.1716000     3.609000  0.2405000     3.649000  0.2449000     -0.4028000E-01 0.3432000 
1 1 1 8  23 3  o 13.51000  0.1730000     13.70000  0.2838000     13.32000  0.1980000     0.3819000      0.3460000 
1 1 1 8  23 4  o 13.08000  0.2268000     13.08000  0.2268000     ?         ?             ?              ?         
1 1 1 8  23 5  o 15.62000  0.1899000     15.67000  0.3093000     15.58000  0.2204000     0.8410000E-01  0.3798000 
1 1 1 8  23 6  o 13.22000  0.1462000     12.95000  0.2060000     13.48000  0.2074000     -0.5242000     0.2923000 
1 1 1 8  23 7  o 12.55000  0.1474000     12.60000  0.2092000     12.49000  0.2077000     0.1095000      0.2948000 
1 1 1 8  23 8  o 12.59000  0.1512000     12.50000  0.2145000     12.69000  0.2131000     -0.1909000     0.3024000 
1 1 1 8  23 9  o 18.19000  0.1779000     18.31000  0.2527000     18.06000  0.2504000     0.2540000      0.3558000 
1 1 1 8  23 10 o 16.63000  0.1727000     16.43000  0.2429000     16.83000  0.2455000     -0.3969000     0.3454000 
1 1 1 8  23 11 o 11.42000  0.1607000     11.16000  0.2271000     11.67000  0.2274000     -0.5008000     0.3214000 
1 1 1 8  23 12 o 7.154000  0.2195000     7.193000  0.2578000     7.115000  0.3553000     0.7801000E-01  0.4390000 
1 1 1 8  23 13 o 4.785000  0.3277000     4.869000  0.4986000     4.701000  0.4253000     0.1678000      0.6553000 
1 1 1 8  23 14 f 3.881000  0.5309000     3.758000  0.5980000     4.004000  0.8774000     -0.2466000     1.062000  
1 1 1 8  23 15 o 2.072000  0.5939000     1.475000  0.6702000     2.668000  0.9806000     -1.193000      1.188000  
1 1 1 8  23 16 o 3.313000  0.5428000     3.772000  0.6986000     2.854000  0.8309000     0.9175000      1.086000  
1 1 1 8  23 17 o 4.127000  0.5121000     3.920000  0.7755000     4.334000  0.6689000     -0.4141000     1.024000  
1 1 1 8  23 18 o 5.489000  0.4297000     5.329000  0.5985000     5.648000  0.6169000     -0.3186000     0.8595000 
1 1 1 8  23 19 o 2.871000  0.5612000     2.187000  0.8273000     3.555000  0.7586000     -1.368000      1.122000  
1 1 1 8  23 20 o 1.855000  0.5425000     1.687000  0.7350000     2.023000  0.7981000     -0.3356000     1.085000  
1 1 1 8  23 21 o 3.148000  0.5470000     3.256000  0.7846000     3.039000  0.7624000     0.2174000      1.094000  
1 1 1 8  23 22 o 3.657000  0.6311000     3.390000  1.056000      3.923000  0.6913000     -0.5332000     1.262000  
1 1 1 8  23 23 o 1.618000  0.5307000     1.618000  0.7026000     1.618000  0.7955000     0.4467000E-03  1.061000  
1 1 1 8  23 24 o 1.596000  0.5088000     1.521000  0.7311000     1.671000  0.7077000     -0.1503000     1.018000  
1 1 1 8  23 25 o 1.500000  0.4419000     0.9491000 0.4740000     2.051000  0.7460000     -1.102000      0.8839000 
1 1 1 8  24 0  o 10.50000  0.1836000     10.50000  0.1836000     10.50000  0.1836000     -0.000000      0.000000  
1 1 1 8  24 1  o 12.27000  0.1463000     11.99000  0.2199000     12.55000  0.1930000     -0.5628000     0.2926000 
1 1 1 8  24 2  o 8.772000  0.1660000     8.640000  0.2565000     8.903000  0.2108000     -0.2632000     0.3320000 
1 1 1 8  24 3  o 7.659000  0.2156000     7.659000  0.2156000     ?         ?             ?              ?         
1 1 1 8  24 4  o 19.97000  0.2194000     19.62000  0.3544000     20.31000  0.2587000     -0.6960000     0.4387000 
1 1 1 8  24 5  o 21.19000  0.1884000     21.17000  0.2662000     21.21000  0.2667000     -0.4007000E-01 0.3768000 
1 1 1 8  24 6  o 11.11000  0.1416000     10.94000  0.2013000     11.29000  0.1992000     -0.3515000     0.2832000 
1 1 1 8  24 7  o 11.58000  0.1467000     11.58000  0.2081000     11.58000  0.2070000     0.7801000E-02  0.2935000 
1 1 1 8  24 8  o 13.49000  0.1761000     13.38000  0.2467000     13.59000  0.2513000     -0.2120000     0.3522000 
1 1 1 8  24 9  o 11.74000  0.1544000     12.05000  0.2195000     11.43000  0.2172000     0.6213000      0.3088000 
1 1 1 8  24 10 o 10.16000  0.1570000     10.04000  0.2235000     10.29000  0.2205000     -0.2542000     0.3139000 
1 1 1 8  24 11 o 16.83000  0.1986000     16.68000  0.3057000     16.97000  0.2536000     -0.2965000     0.3972000 
1 1 1 8  24 12 o 10.22000  0.2152000     10.21000  0.2381000     10.22000  0.3586000     -0.7839000E-02 0.4304000 
1 1 1 8  24 13 o 4.336000  0.3095000     4.084000  0.4123000     4.589000  0.4617000     -0.5054000     0.6190000 
1 1 1 8  24 14 f 11.47000  0.2055000     11.72000  0.2581000     11.23000  0.3198000     0.4887000      0.4110000 
1 1 1 8  24 15 o 6.371000  0.4141000     6.899000  0.3919000     5.844000  0.7297000     1.055000       0.8283000 
1 1 1 8  24 16 o 2.848000  0.5956000     2.887000  0.8371000     2.809000  0.8475000     0.7773000E-01  1.191000  
1 1 1 8  24 17 o 6.647000  0.3349000     6.117000  0.5201000     7.178000  0.4219000     -1.061000      0.6697000 
1 1 1 8  24 18 f 3.387000  0.6183000     3.106000  0.9074000     3.669000  0.8402000     -0.5629000     1.237000  
1 1 1 8  24 19 o 2.915000  0.5948000     2.952000  0.8254000     2.879000  0.8566000     0.7274000E-01  1.190000  
1 1 1 8  24 20 o 2.275000  0.5676000     2.298000  0.8002000     2.253000  0.8051000     0.4490000E-01  1.135000  
1 1 1 8  24 21 o 1.473000  0.4916000     1.441000  0.7106000     1.506000  0.6795000     -0.6535000E-01 0.9832000 
1 1 1 8  24 22 o 1.668000  0.5456000     1.926000  0.8747000     1.410000  0.6526000     0.5159000      1.091000  
1 1 1 8  24 23 o 1.791000  0.5290000     1.941000  0.7497000     1.641000  0.7466000     0.3000000      1.058000  
1 1 1 8  24 24 f 1.030000  0.3606000     1.141000  0.5514000     0.9192000 0.4649000     0.2216000      0.7212000 
1 1 1 8  24 25 o 1.307000  0.4287000     1.288000  0.6001000     1.327000  0.6123000     -0.3851000E-01 0.8574000 
1 1 1 8  25 0  o 19.58000  0.5045000     19.58000  0.5045000     19.58000  0.5045000     0.000000       0.000000  
1 1 1 8  25 1  o 11.96000  0.2814000     11.96000  0.2814000     ?         ?             ?              ?         
1 1 1 8  25 2  o 9.274000  0.2301000     9.374000  0.2632000     9.174000  0.3774000     0.2004000      0.4601000 
1 1 1 8  25 3  o 12.34000  0.1703000     12.38000  0.2775000     12.30000  0.1974000     0.8574000E-01  0.3406000 
1 1 1 8  25 4  o 13.02000  0.1440000     12.99000  0.2025000     13.05000  0.2048000     -0.6061000E-01 0.2881000 
1 1 1 8  25 5  o 5.197000  0.1614000     5.343000  0.2220000     5.052000  0.2343000     0.2919000      0.3228000 
1 1 1 8  25 6  o 20.79000  0.1890000     20.48000  0.2645000     21.09000  0.2700000     -0.6077000     0.3780000 
1 1 1 8  25 7  f 18.08000  0.1868000     18.23000  0.2823000     17.92000  0.2447000     0.3097000      0.3736000 
1 1 1 8  25 8  o 19.91000  0.2035000     19.93000  0.2638000     19.89000  0.3098000     0.4731000E-01  0.4069000 
1 1 1 8  25 9  o 10.25000  0.1547000     10.08000  0.2194000     10.43000  0.2182000     -0.3453000     0.3094000 
1 1 1 8  25 10 o 11.05000  0.1577000     11.17000  0.2237000     10.92000  0.2225000     0.2547000      0.3155000 
1 1 1 8  25 11 o 9.054000  0.2219000     8.727000  0.3353000     9.381000  0.2908000     -0.6534000     0.4439000 
1 1 1 8  25 12 o 6.841000  0.2753000     6.765000  0.3825000     6.918000  0.3961000     -0.1527000     0.5507000 
1 1 1 8  25 13 o 9.410000  0.2006000     9.378000  0.2529000     9.442000  0.3115000     -0.6335000E-01 0.4012000 
1 1 1 8  25 14 o 6.218000  0.2593000     6.080000  0.3383000     6.356000  0.3931000     -0.2759000     0.5186000 
1 1 1 8  25 15 o 4.061000  0.5668000     4.282000  0.5724000     3.841000  0.9785000     0.4409000      1.134000  
1 1 1 8  25 16 o 8.817000  0.2779000     8.914000  0.3947000     8.721000  0.3914000     0.1924000      0.5559000 
1 1 1 8  25 17 o 4.764000  0.4581000     5.051000  0.6164000     4.476000  0.6777000     0.5746000      0.9161000 
1 1 1 8  25 18 o 4.663000  0.6937000     ?         ?             4.663000  0.6937000     ?              ?         
1 1 1 8  25 19 o 1.976000  0.5535000     2.390000  0.8464000     1.561000  0.7135000     0.8287000      1.107000  
1 1 1 8  25 20 o 1.680000  0.5101000     1.893000  0.7660000     1.467000  0.6738000     0.4261000      1.020000  
1 1 1 8  25 21 o 3.088000  0.5806000     2.478000  0.9827000     3.698000  0.6185000     -1.220000      1.161000  
1 1 1 8  25 22 o 1.995000  0.5896000     2.002000  0.8957000     1.987000  0.7668000     0.1494000E-01  1.179000  
1 1 1 8  25 23 o 1.440000  0.4670000     1.517000  0.6798000     1.363000  0.6405000     0.1539000      0.9340000 
1 1 1 8  25 24 o 1.440000  0.4498000     1.734000  0.7064000     1.145000  0.5571000     0.5897000      0.8997000 
1 1 1 8  25 25 o 1.467000  0.4491000     1.816000  0.7151000     1.118000  0.5436000     0.6978000      0.8982000 
1 1 1 8  26 0  o 0.7792000 0.5091000     0.7792000 0.5091000     0.7792000 0.5091000     -0.000000      0.000000  
1 1 1 8  26 1  o 8.912000  0.1430000     8.994000  0.2166000     8.830000  0.1868000     0.1633000      0.2860000 
1 1 1 8  26 2  o 4.151000  0.1754000     4.125000  0.2451000     4.176000  0.2511000     -0.5156000E-01 0.3508000 
1 1 1 8  26 3  o 5.325000  0.1549000     5.308000  0.2189000     5.342000  0.2194000     -0.3365000E-01 0.3099000 
1 1 1 8  26 4  o 15.06000  0.1549000     15.25000  0.2201000     14.88000  0.2179000     0.3718000      0.3097000 
1 1 1 8  26 5  o 1.489000  0.3453000     1.097000  0.4729000     1.882000  0.5033000     -0.7847000     0.6906000 
1 1 1 8  26 6  o 12.16000  0.1474000     12.09000  0.2078000     12.24000  0.2090000     -0.1528000     0.2947000 
1 1 1 8  26 7  o 2.732000  0.2992000     3.077000  0.3707000     2.387000  0.4698000     0.6897000      0.5985000 
1 1 1 8  26 8  o 11.80000  0.1540000     11.57000  0.2186000     12.03000  0.2168000     -0.4604000     0.3079000 
1 1 1 8  26 9  o 6.283000  0.1780000     6.444000  0.2473000     6.122000  0.2561000     0.3218000      0.3560000 
1 1 1 8  26 10 o 1.872000  0.3941000     1.351000  0.5645000     2.392000  0.5499000     -1.041000      0.7881000 
1 1 1 8  26 11 o 10.54000  0.2039000     10.69000  0.2363000     10.40000  0.3324000     0.2934000      0.4078000 
1 1 1 8  26 12 f 5.424000  0.2584000     5.341000  0.4033000     5.508000  0.3232000     -0.1670000     0.5168000 
1 1 1 8  26 13 f 4.274000  0.3132000     3.948000  0.4299000     4.600000  0.4556000     -0.6515000     0.6264000 
1 1 1 8  26 14 o 2.062000  0.5121000     2.246000  0.7019000     1.879000  0.7459000     0.3674000      1.024000  
1 1 1 8  26 15 o 5.500000  0.3425000     5.610000  0.4913000     5.389000  0.4775000     0.2214000      0.6851000 
1 1 1 8  26 16 o 2.288000  0.6008000     2.481000  0.8717000     2.096000  0.8270000     0.3852000      1.202000  
1 1 1 8  26 17 o 4.054000  0.7000000     4.705000  0.6295000     3.403000  1.251000      1.302000       1.400000  
1 1 1 8  26 18 o 3.431000  0.6841000     2.549000  1.202000      4.313000  0.6529000     -1.764000      1.368000  
1 1 1 8  26 19 o 3.219000  0.5578000     2.634000  0.8677000     3.804000  0.7010000     -1.170000      1.116000  
1 1 1 8  26 20 o 3.993000  0.4282000     3.901000  0.6214000     4.085000  0.5892000     -0.1840000     0.8564000 
1 1 1 8  26 21 o 2.806000  0.6406000     3.386000  1.008000      2.226000  0.7913000     1.161000       1.281000  
1 1 1 8  26 22 o 2.214000  0.6707000     2.708000  1.110000      1.719000  0.7524000     0.9889000      1.341000  
1 1 1 8  26 23 o 1.811000  0.5182000     1.459000  0.6706000     2.163000  0.7903000     -0.7041000     1.036000  
1 1 1 8  26 24 f 1.944000  0.5136000     1.440000  0.6457000     2.448000  0.7989000     -1.008000      1.027000  
1 1 1 8  26 25 o 1.387000  0.4384000     1.697000  0.6998000     1.077000  0.5283000     0.6194000      0.8769000 
1 1 1 8  27 0  o 12.91000  0.2033000     12.91000  0.2033000     12.91000  0.2033000     0.000000       0.000000  
1 1 1 8  27 1  o 5.669000  0.1499000     5.855000  0.2087000     5.483000  0.2153000     0.3722000      0.2999000 
1 1 1 8  27 2  o 15.11000  0.1545000     15.21000  0.2191000     15.01000  0.2178000     0.2025000      0.3089000 
1 1 1 8  27 3  o 8.956000  0.1381000     8.905000  0.1955000     9.008000  0.1950000     -0.1033000     0.2761000 
1 1 1 8  27 4  o 7.178000  0.1446000     7.144000  0.2034000     7.211000  0.2057000     -0.6687000E-01 0.2893000 
1 1 1 8  27 5  o 9.341000  0.1440000     9.492000  0.2039000     9.191000  0.2034000     0.3013000      0.2880000 
1 1 1 8  27 6  o 2.397000  0.3217000     2.418000  0.4515000     2.376000  0.4583000     0.4231000E-01  0.6434000 
1 1 1 8  27 7  o 1.682000  0.3787000     1.434000  0.5412000     1.931000  0.5298000     -0.4966000     0.7573000 
1 1 1 8  27 8  o 22.23000  0.2028000     21.90000  0.2830000     22.55000  0.2905000     -0.6466000     0.4056000 
1 1 1 8  27 9  o 6.225000  0.1812000     6.013000  0.2594000     6.438000  0.2531000     -0.4253000     0.3624000 
1 1 1 8  27 10 o 4.595000  0.2743000     4.677000  0.4412000     4.512000  0.3261000     0.1654000      0.5486000 
1 1 1 8  27 11 o 7.242000  0.2442000     7.445000  0.2852000     7.038000  0.3966000     0.4071000      0.4885000 
1 1 1 8  27 12 o 3.679000  0.3104000     3.460000  0.4628000     3.898000  0.4139000     -0.4375000     0.6209000 
1 1 1 8  27 13 o 7.843000  0.2193000     7.634000  0.2813000     8.052000  0.3365000     -0.4186000     0.4386000 
1 1 1 8  27 14 o 11.26000  0.2122000     10.83000  0.2748000     11.69000  0.3234000     -0.8600000     0.4244000 
1 1 1 8  27 15 o 2.318000  0.5424000     2.481000  0.7289000     2.154000  0.8035000     0.3271000      1.085000  
1 1 1 8  27 16 o 5.263000  0.4030000     4.861000  0.6200000     5.664000  0.5151000     -0.8023000     0.8061000 
1 1 1 8  27 17 o 1.668000  0.5705000     1.364000  0.6588000     1.972000  0.9316000     -0.6085000     1.141000  
1 1 1 8  27 18 o 2.188000  0.5886000     1.931000  0.8020000     2.445000  0.8617000     -0.5136000     1.177000  
1 1 1 8  27 19 o 1.920000  0.5428000     2.201000  0.8133000     1.640000  0.7190000     0.5607000      1.086000  
1 1 1 8  27 20 o 1.653000  0.5013000     1.424000  0.6549000     1.882000  0.7591000     -0.4586000     1.003000  
1 1 1 8  27 21 o 1.971000  0.5611000     1.704000  0.8034000     2.237000  0.7835000     -0.5330000     1.122000  
1 1 1 8  27 22 o 1.640000  0.5651000     1.731000  0.8412000     1.548000  0.7547000     0.1830000      1.130000  
1 1 1 8  27 23 o 1.736000  0.5552000     1.665000  0.8173000     1.808000  0.7518000     -0.1432000     1.110000  
1 1 1 8  27 24 o 1.358000  0.4378000     0.9426000 0.4714000     1.774000  0.7379000     -0.8310000     0.8757000 
1 1 1 8  27 25 o 1.940000  0.5007000     1.244000  0.5999000     2.636000  0.8019000     -1.392000      1.001000  
1 1 1 8  28 0  o 4.819000  0.2404000     4.819000  0.2404000     4.819000  0.2404000     0.000000       0.000000  
1 1 1 8  28 1  o 12.57000  0.1444000     12.53000  0.2042000     12.60000  0.2041000     -0.6776000E-01 0.2887000 
1 1 1 8  28 2  o 12.11000  0.1441000     12.02000  0.2033000     12.20000  0.2044000     -0.1803000     0.2883000 
1 1 1 8  28 3  o 4.063000  0.1955000     3.786000  0.2904000     4.339000  0.2619000     -0.5535000     0.3910000 
1 1 1 8  28 4  o 12.07000  0.1461000     12.25000  0.2070000     11.90000  0.2062000     0.3508000      0.2922000 
1 1 1 8  28 5  o 10.63000  0.1451000     10.50000  0.2052000     10.76000  0.2052000     -0.2543000     0.2901000 
1 1 1 8  28 6  o 9.852000  0.1466000     9.672000  0.2091000     10.03000  0.2057000     -0.3617000     0.2933000 
1 1 1 8  28 7  f 10.57000  0.1500000     10.62000  0.2133000     10.51000  0.2111000     0.1154000      0.3001000 
1 1 1 8  28 8  o 5.050000  0.2201000     5.571000  0.3210000     4.530000  0.3013000     1.041000       0.4402000 
1 1 1 8  28 9  o 17.09000  0.1888000     17.04000  0.2814000     17.13000  0.2518000     -0.9414000E-01 0.3776000 
1 1 1 8  28 10 o 14.47000  0.2085000     14.29000  0.2455000     14.64000  0.3371000     -0.3502000     0.4170000 
1 1 1 8  28 11 o 12.44000  0.2079000     12.21000  0.3383000     12.67000  0.2417000     -0.4563000     0.4157000 
1 1 1 8  28 12 o 15.88000  0.1958000     16.05000  0.2598000     15.72000  0.2930000     0.3336000      0.3916000 
1 1 1 8  28 13 o 9.695000  0.2084000     9.633000  0.2646000     9.757000  0.3219000     -0.1235000     0.4167000 
1 1 1 8  28 14 o 12.97000  0.2087000     13.01000  0.2680000     12.94000  0.3202000     0.7455000E-01  0.4175000 
1 1 1 8  28 15 o 3.402000  0.4690000     3.263000  0.6220000     3.542000  0.7022000     -0.2787000     0.9380000 
1 1 1 8  28 16 o 3.916000  0.5125000     3.883000  0.8379000     3.949000  0.5906000     -0.6610000E-01 1.025000  
1 1 1 8  28 17 o 3.462000  0.6206000     3.097000  0.9374000     3.827000  0.8135000     -0.7302000     1.241000  
1 1 1 8  28 18 o 1.944000  0.5616000     2.123000  0.8256000     1.765000  0.7615000     0.3578000      1.123000  
1 1 1 8  28 19 o 4.790000  0.3928000     4.248000  0.6307000     5.333000  0.4685000     -1.085000      0.7856000 
1 1 1 8  28 20 o 4.580000  0.3648000     4.643000  0.5137000     4.516000  0.5181000     0.1274000      0.7296000 
1 1 1 8  28 21 o 1.391000  0.4828000     1.632000  0.7871000     1.149000  0.5593000     0.4835000      0.9656000 
1 1 1 8  28 22 o 2.147000  0.6722000     2.081000  0.9050000     2.212000  0.9943000     -0.1303000     1.344000  
1 1 1 8  28 23 o 1.500000  0.4942000     1.449000  0.7051000     1.551000  0.6926000     -0.1026000     0.9883000 
1 1 1 8  28 24 o 1.206000  0.4085000     1.049000  0.5165000     1.364000  0.6331000     -0.3147000     0.8170000 
1 1 1 8  29 0  o 7.287000  0.2405000     7.287000  0.2405000     7.287000  0.2405000     0.000000       0.000000  
1 1 1 8  29 1  o 7.453000  0.1449000     7.399000  0.2037000     7.508000  0.2061000     -0.1095000     0.2898000 
1 1 1 8  29 2  o 14.39000  0.1540000     14.20000  0.2171000     14.59000  0.2185000     -0.3960000     0.3080000 
1 1 1 8  29 3  o 6.031000  0.1602000     5.977000  0.2267000     6.085000  0.2265000     -0.1078000     0.3204000 
1 1 1 8  29 4  o 4.468000  0.1900000     4.295000  0.2738000     4.642000  0.2634000     -0.3464000     0.3800000 
1 1 1 8  29 5  o 9.589000  0.1459000     9.674000  0.2059000     9.504000  0.2069000     0.1703000      0.2919000 
1 1 1 8  29 6  o 15.12000  0.1615000     14.95000  0.2284000     15.29000  0.2285000     -0.3363000     0.3231000 
1 1 1 8  29 7  o 20.56000  0.1918000     20.30000  0.2690000     20.82000  0.2734000     -0.5231000     0.3836000 
1 1 1 8  29 8  o 8.271000  0.1618000     8.310000  0.2276000     8.231000  0.2300000     0.7935000E-01  0.3236000 
1 1 1 8  29 9  o 9.326000  0.2024000     9.371000  0.3306000     9.281000  0.2335000     0.8944000E-01  0.4048000 
1 1 1 8  29 10 o 4.287000  0.3524000     4.773000  0.3573000     3.801000  0.6076000     0.9719000      0.7048000 
1 1 1 8  29 11 o 13.34000  0.1739000     13.52000  0.2470000     13.16000  0.2448000     0.3567000      0.3478000 
1 1 1 8  29 12 o 8.946000  0.1856000     8.633000  0.2629000     9.259000  0.2620000     -0.6256000     0.3711000 
1 1 1 8  29 13 o 6.871000  0.2461000     6.756000  0.3086000     6.985000  0.3833000     -0.2290000     0.4921000 
1 1 1 8  29 14 o 6.203000  0.2757000     6.361000  0.3503000     6.046000  0.4258000     0.3152000      0.5514000 
1 1 1 8  29 15 o 3.685000  0.4564000     3.124000  0.6735000     4.246000  0.6160000     -1.122000      0.9128000 
1 1 1 8  29 16 o 4.455000  0.4798000     4.513000  0.7220000     4.396000  0.6323000     0.1166000      0.9597000 
1 1 1 8  29 17 o 3.672000  0.7619000     ?         ?             3.672000  0.7619000     ?              ?         
1 1 1 8  29 18 o 2.114000  0.5764000     1.862000  0.7966000     2.367000  0.8332000     -0.5045000     1.153000  
1 1 1 8  29 19 o 3.128000  0.5301000     3.913000  0.6771000     2.342000  0.8158000     1.571000       1.060000  
1 1 1 8  29 20 o 1.618000  0.5002000     1.627000  0.7068000     1.608000  0.7078000     0.1971000E-01  1.000000  
1 1 1 8  29 21 o 2.962000  0.5787000     2.238000  0.9584000     3.686000  0.6489000     -1.448000      1.157000  
1 1 1 8  29 22 o 2.086000  0.6030000     2.421000  0.9426000     1.751000  0.7523000     0.6698000      1.206000  
1 1 1 8  29 23 o 1.473000  0.4654000     1.235000  0.5856000     1.710000  0.7236000     -0.4757000     0.9309000 
1 1 1 8  29 24 o 1.294000  0.4314000     1.299000  0.6081000     1.289000  0.6120000     0.9488000E-02  0.8627000 
1 1 1 8  30 0  f 19.95000  0.2599000     19.95000  0.2599000     19.95000  0.2599000     0.000000       0.000000  
1 1 1 8  30 1  o 19.18000  0.1791000     18.94000  0.2515000     19.43000  0.2551000     -0.4885000     0.3582000 
1 1 1 8  30 2  o 9.949000  0.1434000     9.862000  0.2035000     10.04000  0.2022000     -0.1741000     0.2869000 
1 1 1 8  30 3  o 8.193000  0.1463000     8.204000  0.2070000     8.183000  0.2068000     0.2123000E-01  0.2926000 
1 1 1 8  30 4  o 10.53000  0.1449000     10.44000  0.2050000     10.61000  0.2049000     -0.1714000     0.2899000 
1 1 1 8  30 5  o 12.05000  0.1508000     12.19000  0.2133000     11.90000  0.2131000     0.2867000      0.3015000 
1 1 1 8  30 6  o 13.19000  0.1562000     12.91000  0.2198000     13.47000  0.2221000     -0.5666000     0.3125000 
1 1 1 8  30 7  o 15.36000  0.1668000     15.35000  0.2361000     15.37000  0.2356000     -0.2008000E-01 0.3335000 
1 1 1 8  30 8  o 5.287000  0.2004000     5.222000  0.2845000     5.351000  0.2823000     -0.1295000     0.4008000 
1 1 1 8  30 9  o 7.108000  0.2478000     7.526000  0.2520000     6.690000  0.4267000     0.8362000      0.4955000 
1 1 1 8  30 10 o 3.422000  0.3780000     4.124000  0.5294000     2.720000  0.5397000     1.404000       0.7560000 
1 1 1 8  30 11 o 6.544000  0.2028000     6.556000  0.2877000     6.531000  0.2860000     0.2492000E-01  0.4057000 
1 1 1 8  30 12 f 2.220000  0.4765000     2.226000  0.6667000     2.215000  0.6810000     0.1087000E-01  0.9531000 
1 1 1 8  30 13 o 11.80000  0.2055000     11.87000  0.2621000     11.72000  0.3166000     0.1476000      0.4111000 
1 1 1 8  30 14 o 3.573000  0.4576000     3.449000  0.5738000     3.696000  0.7129000     -0.2472000     0.9151000 
1 1 1 8  30 15 o 7.220000  0.2629000     7.170000  0.3384000     7.269000  0.4025000     -0.9832000E-01 0.5259000 
1 1 1 8  30 16 o 2.427000  0.5697000     2.663000  0.7574000     2.191000  0.8513000     0.4728000      1.139000  
1 1 1 8  30 17 o 2.618000  0.7339000     2.964000  1.257000      2.273000  0.7587000     0.6919000      1.468000  
1 1 1 8  30 18 o 2.172000  0.5788000     2.497000  0.8598000     1.847000  0.7751000     0.6500000      1.158000  
1 1 1 8  30 19 o 1.703000  0.5206000     1.693000  0.7438000     1.713000  0.7285000     -0.2069000E-01 1.041000  
1 1 1 8  30 20 o 1.509000  0.4729000     1.783000  0.7357000     1.236000  0.5943000     0.5474000      0.9458000 
1 1 1 8  30 21 o 1.974000  0.5792000     2.839000  1.024000      1.109000  0.5420000     1.730000       1.158000  
1 1 1 8  30 22 o 3.029000  0.6009000     2.553000  0.9601000     3.506000  0.7227000     -0.9525000     1.202000  
1 1 1 8  30 23 o 1.425000  0.4567000     1.013000  0.5011000     1.837000  0.7636000     -0.8243000     0.9133000 
1 1 1 8  30 24 f 2.160000  0.5256000     2.480000  0.7450000     1.841000  0.7416000     0.6395000      1.051000  
1 1 1 8  31 0  o 4.678000  0.2664000     4.678000  0.2664000     4.678000  0.2664000     -0.000000      0.000000  
1 1 1 8  31 1  o 23.06000  0.2037000     22.69000  0.2846000     23.44000  0.2914000     -0.7411000     0.4073000 
1 1 1 8  31 2  o 13.63000  0.1534000     13.71000  0.2173000     13.55000  0.2165000     0.1604000      0.3068000 
1 1 1 8  31 3  f 7.491000  0.1511000     7.637000  0.2113000     7.346000  0.2161000     0.2908000      0.3022000 
1 1 1 8  31 4  o 13.33000  0.1542000     13.45000  0.2189000     13.21000  0.2171000     0.2331000      0.3083000 
1 1 1 8  31 5  o 9.941000  0.1512000     9.982000  0.2129000     9.901000  0.2146000     0.8119000E-01  0.3023000 
1 1 1 8  31 6  o 19.46000  0.1860000     19.42000  0.2636000     19.50000  0.2625000     -0.7583000E-01 0.3720000 
1 1 1 8  31 7  o 14.16000  0.1635000     14.18000  0.2325000     14.15000  0.2299000     0.3384000E-01  0.3270000 
1 1 1 8  31 8  o 21.06000  0.3057000     20.67000  0.5402000     21.45000  0.2863000     -0.7809000     0.6114000 
1 1 1 8  31 9  o 19.15000  0.2495000     19.32000  0.3084000     18.99000  0.3923000     0.3375000      0.4990000 
1 1 1 8  31 10 o 10.40000  0.1907000     10.16000  0.2945000     10.64000  0.2423000     -0.4753000     0.3814000 
1 1 1 8  31 11 o 2.516000  0.4260000     3.035000  0.5324000     1.998000  0.6652000     1.037000       0.8521000 
1 1 1 8  31 12 o 2.741000  0.4362000     3.326000  0.5389000     2.156000  0.6860000     1.170000       0.8724000 
1 1 1 8  31 13 o 14.77000  0.2079000     14.74000  0.2712000     14.79000  0.3152000     -0.4879000E-01 0.4158000 
1 1 1 8  31 14 o 7.210000  0.2614000     7.350000  0.3267000     7.070000  0.4082000     0.2799000      0.5228000 
1 1 1 8  31 15 o 2.052000  0.5572000     1.650000  0.7356000     2.454000  0.8372000     -0.8043000     1.114000  
1 1 1 8  31 16 o 1.674000  0.5333000     1.448000  0.6519000     1.900000  0.8440000     -0.4525000     1.067000  
1 1 1 8  31 17 o 2.168000  0.5315000     2.570000  0.7746000     1.765000  0.7279000     0.8052000      1.063000  
1 1 1 8  31 18 o 2.943000  0.5896000     2.982000  0.8473000     2.904000  0.8200000     0.7797000E-01  1.179000  
1 1 1 8  31 19 o 2.721000  0.5073000     1.807000  0.7624000     3.635000  0.6695000     -1.828000      1.015000  
1 1 1 8  31 20 o 2.474000  0.5527000     2.357000  0.7838000     2.592000  0.7796000     -0.2352000     1.105000  
1 1 1 8  31 21 o 3.258000  0.6830000     2.864000  1.144000      3.652000  0.7465000     -0.7882000     1.366000  
1 1 1 8  31 22 o 2.526000  0.6115000     2.002000  0.9351000     3.051000  0.7882000     -1.049000      1.223000  
1 1 1 8  31 23 o 2.071000  0.5423000     1.943000  0.7488000     2.199000  0.7845000     -0.2560000     1.085000  
1 1 1 8  31 24 o 1.345000  0.4425000     1.280000  0.5965000     1.410000  0.6539000     -0.1293000     0.8851000 
1 1 1 8  32 0  o 16.85000  0.2376000     16.85000  0.2376000     16.85000  0.2376000     0.000000       0.000000  
1 1 1 8  32 1  o 13.03000  0.1521000     13.07000  0.2158000     12.98000  0.2143000     0.9189000E-01  0.3042000 
1 1 1 8  32 2  o 21.80000  0.1970000     21.91000  0.2795000     21.69000  0.2776000     0.2255000      0.3939000 
1 1 1 8  32 3  o 10.07000  0.1475000     9.998000  0.2081000     10.15000  0.2090000     -0.1478000     0.2949000 
1 1 1 8  32 4  o 18.16000  0.1773000     18.37000  0.2520000     17.95000  0.2493000     0.4143000      0.3545000 
1 1 1 8  32 5  o 4.900000  0.2002000     4.545000  0.2946000     5.255000  0.2712000     -0.7099000     0.4005000 
1 1 1 8  32 6  o 19.42000  0.1873000     19.07000  0.2624000     19.77000  0.2673000     -0.6982000     0.3746000 
1 1 1 8  32 7  o 13.87000  0.2032000     14.20000  0.3349000     13.53000  0.2303000     0.6635000      0.4064000 
1 1 1 8  32 8  o 13.13000  0.2319000     13.13000  0.2319000     ?         ?             ?              ?         
1 1 1 8  32 9  o 10.21000  0.1868000     10.48000  0.2896000     9.940000  0.2360000     0.5364000      0.3736000 
1 1 1 8  32 10 o 10.74000  0.1728000     10.36000  0.2444000     11.11000  0.2444000     -0.7529000     0.3456000 
1 1 1 8  32 11 o 3.666000  0.3270000     3.911000  0.4246000     3.422000  0.4975000     0.4893000      0.6540000 
1 1 1 8  32 12 o 9.809000  0.1891000     9.748000  0.2706000     9.869000  0.2642000     -0.1219000     0.3782000 
1 1 1 8  32 13 o 7.222000  0.2534000     7.556000  0.3230000     6.887000  0.3905000     0.6690000      0.5068000 
1 1 1 8  32 14 o 2.183000  0.5346000     2.461000  0.7360000     1.906000  0.7757000     0.5550000      1.069000  
1 1 1 8  32 15 o 7.090000  0.3288000     6.748000  0.5146000     7.431000  0.4093000     -0.6831000     0.6575000 
1 1 1 8  32 16 o 2.020000  0.5891000     1.827000  0.8070000     2.213000  0.8584000     -0.3860000     1.178000  
1 1 1 8  32 17 o 2.108000  0.5410000     2.234000  0.7688000     1.982000  0.7613000     0.2525000      1.082000  
1 1 1 8  32 18 o 2.143000  0.5811000     2.133000  0.8472000     2.153000  0.7956000     -0.1995000E-01 1.162000  
1 1 1 8  32 19 f 1.572000  0.4870000     1.886000  0.7670000     1.258000  0.6002000     0.6284000      0.9739000 
1 1 1 8  32 20 o 2.477000  0.5528000     2.210000  0.8107000     2.744000  0.7517000     -0.5331000     1.106000  
1 1 1 8  32 21 o 2.293000  0.6566000     3.017000  1.057000      1.568000  0.7792000     1.449000       1.313000  
1 1 1 8  32 22 o 2.285000  0.5388000     1.632000  0.8055000     2.938000  0.7158000     -1.305000      1.078000  
1 1 1 8  32 23 o 1.183000  0.4037000     1.171000  0.5628000     1.194000  0.5789000     -0.2296000E-01 0.8073000 
1 1 1 8  32 24 o 2.034000  0.5754000     1.704000  0.7650000     2.364000  0.8597000     -0.6601000     1.151000  
1 1 1 8  33 0  o 18.32000  0.2508000     18.32000  0.2508000     18.32000  0.2508000     -0.000000      0.000000  
1 1 1 8  33 1  o 25.66000  0.2223000     25.80000  0.3155000     25.51000  0.3132000     0.2901000      0.4446000 
1 1 1 8  33 2  o 10.55000  0.1500000     10.46000  0.2124000     10.64000  0.2118000     -0.1831000     0.3000000 
1 1 1 8  33 3  o 13.60000  0.1578000     13.62000  0.2233000     13.58000  0.2230000     0.3702000E-01  0.3155000 
1 1 1 8  33 4  o 11.67000  0.1544000     11.70000  0.2180000     11.63000  0.2187000     0.7601000E-01  0.3088000 
1 1 1 8  33 5  o 7.019000  0.1697000     6.856000  0.2389000     7.181000  0.2412000     -0.3254000     0.3395000 
1 1 1 8  33 6  o 14.59000  0.1824000     14.69000  0.2785000     14.49000  0.2357000     0.2001000      0.3648000 
1 1 1 8  33 7  o 10.60000  0.2500000     10.79000  0.2625000     10.41000  0.4256000     0.3707000      0.5000000 
1 1 1 8  33 8  o 2.106000  0.4753000     2.202000  0.7264000     2.009000  0.6133000     0.1927000      0.9506000 
1 1 1 8  33 9  o 11.38000  0.1691000     11.16000  0.2430000     11.60000  0.2353000     -0.4469000     0.3382000 
1 1 1 8  33 10 o 9.265000  0.1797000     9.244000  0.2558000     9.285000  0.2525000     -0.4069000E-01 0.3595000 
1 1 1 8  33 11 o 6.836000  0.2165000     6.691000  0.3116000     6.981000  0.3008000     -0.2903000     0.4330000 
1 1 1 8  33 12 o 8.127000  0.2071000     8.271000  0.2922000     7.983000  0.2936000     0.2879000      0.4142000 
1 1 1 8  33 13 o 3.097000  0.4958000     2.987000  0.6519000     3.207000  0.7472000     -0.2199000     0.9916000 
1 1 1 8  33 14 o 8.858000  0.2391000     8.694000  0.3062000     9.021000  0.3672000     -0.3269000     0.4781000 
1 1 1 8  33 15 o 1.899000  0.5024000     2.422000  0.7570000     1.377000  0.6609000     1.044000       1.005000  
1 1 1 8  33 16 o 2.688000  0.5732000     3.009000  0.8565000     2.367000  0.7619000     0.6416000      1.146000  
1 1 1 8  33 17 f 2.635000  0.5338000     2.794000  0.7499000     2.476000  0.7598000     0.3184000      1.068000  
1 1 1 8  33 18 o 4.466000  0.3550000     4.902000  0.4942000     4.029000  0.5098000     0.8722000      0.7101000 
1 1 1 8  33 19 o 2.130000  0.5550000     2.238000  0.8084000     2.022000  0.7608000     0.2165000      1.110000  
1 1 1 8  33 20 o 2.582000  0.5373000     2.196000  0.8153000     2.968000  0.7000000     -0.7720000     1.075000  
1 1 1 8  33 21 o 1.630000  0.5389000     1.649000  0.7752000     1.610000  0.7488000     0.3916000E-01  1.078000  
1 1 1 8  33 22 o 1.216000  0.4118000     1.179000  0.5720000     1.253000  0.5925000     -0.7449000E-01 0.8235000 
1 1 1 8  33 23 o 1.149000  0.3949000     1.256000  0.5977000     1.042000  0.5163000     0.2137000      0.7899000 
1 1 1 8  34 0  o 21.47000  0.2786000     21.47000  0.2786000     21.47000  0.2786000     0.000000       0.000000  
1 1 1 8  34 1  o 15.08000  0.1638000     15.16000  0.2320000     15.00000  0.2314000     0.1579000      0.3277000 
1 1 1 8  34 2  o 11.28000  0.1534000     11.37000  0.2172000     11.18000  0.2166000     0.1858000      0.3067000 
1 1 1 8  34 3  o 9.559000  0.1541000     9.700000  0.2169000     9.417000  0.2188000     0.2835000      0.3081000 
1 1 1 8  34 4  o 10.97000  0.1549000     10.97000  0.2184000     10.97000  0.2197000     -0.3792000E-02 0.3098000 
1 1 1 8  34 5  o 8.607000  0.1779000     8.456000  0.2715000     8.759000  0.2298000     -0.3036000     0.3557000 
1 1 1 8  34 6  o 15.58000  0.2910000     15.46000  0.3470000     15.70000  0.4671000     -0.2337000     0.5819000 
1 1 1 8  34 7  o 18.44000  0.2406000     18.35000  0.3678000     18.53000  0.3103000     -0.1764000     0.4812000 
1 1 1 8  34 8  o 5.217000  0.2168000     5.216000  0.3087000     5.219000  0.3045000     -0.3467000E-02 0.4336000 
1 1 1 8  34 9  o 12.06000  0.1700000     12.10000  0.2408000     12.03000  0.2399000     0.6240000E-01  0.3399000 
1 1 1 8  34 10 o 10.37000  0.1774000     10.73000  0.2492000     10.02000  0.2524000     0.7146000      0.3547000 
1 1 1 8  34 11 o 8.243000  0.1976000     7.856000  0.2839000     8.630000  0.2750000     -0.7741000     0.3953000 
1 1 1 8  34 12 f 8.682000  0.2034000     8.776000  0.2832000     8.587000  0.2919000     0.1889000      0.4067000 
1 1 1 8  34 13 o 3.181000  0.4980000     2.854000  0.6885000     3.509000  0.7197000     -0.6547000     0.9960000 
1 1 1 8  34 14 o 2.940000  0.6084000     3.353000  0.8624000     2.527000  0.8584000     0.8261000      1.217000  
1 1 1 8  34 15 o 2.733000  0.6641000     3.023000  0.7483000     2.444000  1.097000      0.5790000      1.328000  
1 1 1 8  34 16 o 2.849000  0.5070000     2.677000  0.7170000     3.021000  0.7171000     -0.3439000     1.014000  
1 1 1 8  34 17 o 7.454000  0.2785000     7.367000  0.4350000     7.540000  0.3479000     -0.1725000     0.5570000 
1 1 1 8  34 18 o 4.365000  0.3653000     4.511000  0.5081000     4.219000  0.5249000     0.2916000      0.7306000 
1 1 1 8  34 19 o 1.499000  0.4793000     1.433000  0.6650000     1.564000  0.6904000     -0.1304000     0.9586000 
1 1 1 8  34 20 o 1.433000  0.4973000     1.623000  0.7996000     1.244000  0.5916000     0.3797000      0.9947000 
1 1 1 8  34 21 o 1.862000  0.5580000     2.451000  0.9366000     1.273000  0.6068000     1.178000       1.116000  
1 1 1 8  34 22 o 1.834000  0.4852000     2.404000  0.7694000     1.264000  0.5913000     1.140000       0.9703000 
1 1 1 8  34 23 o 1.955000  0.5346000     1.923000  0.7389000     1.987000  0.7727000     -0.6323000E-01 1.069000  
1 1 1 8  35 0  o 30.22000  0.3598000     30.22000  0.3598000     30.22000  0.3598000     -0.000000      0.000000  
1 1 1 8  35 1  o 16.03000  0.1689000     16.34000  0.2411000     15.72000  0.2366000     0.6224000      0.3378000 
1 1 1 8  35 2  o 13.94000  0.1744000     14.04000  0.2639000     13.84000  0.2281000     0.2009000      0.3488000 
1 1 1 8  35 3  o 16.22000  0.1713000     16.38000  0.2425000     16.07000  0.2419000     0.3083000      0.3425000 
1 1 1 8  35 4  o 19.99000  0.2090000     20.23000  0.3203000     19.74000  0.2686000     0.4876000      0.4180000 
1 1 1 8  35 5  o 12.00000  0.3222000     12.00000  0.3222000     ?         ?             ?              ?         
1 1 1 8  35 6  o 16.65000  0.2501000     16.92000  0.3531000     16.38000  0.3543000     0.5409000      0.5002000 
1 1 1 8  35 7  o 11.22000  0.1650000     11.34000  0.2349000     11.10000  0.2319000     0.2331000      0.3301000 
1 1 1 8  35 8  o 15.66000  0.1780000     15.56000  0.2497000     15.75000  0.2537000     -0.1911000     0.3560000 
1 1 1 8  35 9  o 4.622000  0.2493000     4.742000  0.3413000     4.503000  0.3636000     0.2388000      0.4987000 
1 1 1 8  35 10 o 5.418000  0.2376000     5.193000  0.3533000     5.644000  0.3178000     -0.4507000     0.4752000 
1 1 1 8  35 11 o 4.240000  0.3132000     4.099000  0.4645000     4.382000  0.4202000     -0.2831000     0.6264000 
1 1 1 8  35 12 o 4.566000  0.3107000     4.480000  0.4441000     4.652000  0.4345000     -0.1727000     0.6213000 
1 1 1 8  35 13 o 2.362000  0.5096000     2.922000  0.6926000     1.801000  0.7476000     1.121000       1.019000  
1 1 1 8  35 14 o 4.458000  0.4663000     5.203000  0.4805000     3.713000  0.7992000     1.490000       0.9326000 
1 1 1 8  35 15 o 1.741000  0.5357000     2.123000  0.8514000     1.360000  0.6503000     0.7629000      1.071000  
1 1 1 8  35 16 o 5.733000  0.3022000     5.994000  0.3929000     5.472000  0.4593000     0.5212000      0.6044000 
1 1 1 8  35 17 o 2.050000  0.5274000     1.845000  0.7195000     2.256000  0.7712000     -0.4107000     1.055000  
1 1 1 8  35 18 f 1.965000  0.5181000     1.744000  0.7219000     2.186000  0.7432000     -0.4426000     1.036000  
1 1 1 8  35 19 o 4.333000  0.4270000     4.151000  0.7524000     4.514000  0.4041000     -0.3624000     0.8540000 
1 1 1 8  35 20 o 2.210000  0.6837000     2.313000  1.023000      2.108000  0.9079000     0.2045000      1.367000  
1 1 1 8  35 21 o 1.668000  0.5325000     1.603000  0.7923000     1.734000  0.7115000     -0.1309000     1.065000  
1 1 1 8  35 22 o 1.772000  0.4957000     1.352000  0.6240000     2.191000  0.7704000     -0.8390000     0.9914000 
1 1 1 8  35 23 o 1.118000  0.3861000     1.211000  0.5780000     1.025000  0.5122000     0.1853000      0.7723000 
1 1 1 8  36 0  o 18.54000  0.2584000     18.54000  0.2584000     18.54000  0.2584000     -0.000000      0.000000  
1 1 1 8  36 1  o 18.49000  0.1826000     18.33000  0.2569000     18.65000  0.2594000     -0.3234000     0.3651000 
1 1 1 8  36 2  o 2.721000  0.3726000     3.049000  0.5215000     2.392000  0.5325000     0.6569000      0.7453000 
1 1 1 8  36 3  o 7.638000  0.2209000     7.846000  0.3382000     7.431000  0.2843000     0.4144000      0.4418000 
1 1 1 8  36 4  o 13.11000  0.2695000     13.11000  0.2695000     ?         ?             ?              ?         
1 1 1 8  36 5  o 15.73000  0.2258000     15.95000  0.3444000     15.51000  0.2923000     0.4390000      0.4517000 
1 1 1 8  36 6  o 16.33000  0.1786000     16.01000  0.2510000     16.66000  0.2540000     -0.6509000     0.3571000 
1 1 1 8  36 7  o 4.860000  0.2633000     4.152000  0.4370000     5.567000  0.2937000     -1.415000      0.5265000 
1 1 1 8  36 8  o 15.58000  0.1786000     15.39000  0.2522000     15.77000  0.2530000     -0.3769000     0.3572000 
1 1 1 8  36 9  o 16.61000  0.1863000     16.66000  0.2649000     16.57000  0.2621000     0.9052000E-01  0.3726000 
1 1 1 8  36 10 o 5.483000  0.2408000     5.221000  0.3551000     5.745000  0.3255000     -0.5246000     0.4817000 
1 1 1 8  36 11 o 8.606000  0.2005000     8.658000  0.2837000     8.553000  0.2835000     0.1053000      0.4011000 
1 1 1 8  36 12 o 4.115000  0.3550000     3.960000  0.5272000     4.270000  0.4757000     -0.3092000     0.7101000 
1 1 1 8  36 13 o 6.104000  0.3289000     6.212000  0.4618000     5.997000  0.4684000     0.2144000      0.6577000 
1 1 1 8  36 14 o 2.914000  0.7245000     2.914000  0.7245000     ?         ?             ?              ?         
1 1 1 8  36 15 o 5.748000  0.3327000     6.315000  0.3716000     5.180000  0.5520000     1.135000       0.6654000 
1 1 1 8  36 16 o 2.122000  0.5436000     1.654000  0.6937000     2.590000  0.8370000     -0.9364000     1.087000  
1 1 1 8  36 17 o 3.643000  0.4293000     3.935000  0.5571000     3.350000  0.6533000     0.5850000      0.8586000 
1 1 1 8  36 18 o 4.085000  0.4539000     4.540000  0.4989000     3.630000  0.7583000     0.9101000      0.9077000 
1 1 1 8  36 19 o 2.262000  0.5128000     2.570000  0.7318000     1.954000  0.7186000     0.6155000      1.026000  
1 1 1 8  36 20 o 2.134000  0.6677000     2.549000  1.079000      1.718000  0.7863000     0.8306000      1.335000  
1 1 1 8  36 21 o 1.412000  0.4619000     1.261000  0.6313000     1.564000  0.6745000     -0.3027000     0.9238000 
1 1 1 8  36 22 o 1.408000  0.4502000     1.621000  0.6940000     1.196000  0.5736000     0.4250000      0.9004000 
1 1 1 8  36 23 o 1.722000  0.5367000     1.887000  0.7981000     1.556000  0.7178000     0.3311000      1.073000  
1 1 1 8  37 1  o 14.36000  0.2983000     14.58000  0.3530000     14.13000  0.4811000     0.4435000      0.5967000 
1 1 1 8  37 2  f 6.766000  0.3554000     6.766000  0.3554000     ?         ?             ?              ?         
1 1 1 8  37 3  o 5.303000  0.3679000     5.421000  0.4021000     5.185000  0.6162000     0.2357000      0.7358000 
1 1 1 8  37 4  o 6.785000  0.2213000     6.738000  0.3575000     6.832000  0.2609000     -0.9364000E-01 0.4426000 
1 1 1 8  37 5  o 11.39000  0.1646000     11.70000  0.2321000     11.08000  0.2334000     0.6160000      0.3292000 
1 1 1 8  37 6  o 13.01000  0.1693000     13.07000  0.2396000     12.94000  0.2393000     0.1331000      0.3386000 
1 1 1 8  37 7  f 23.20000  0.2151000     23.34000  0.3059000     23.06000  0.3026000     0.2803000      0.4303000 
1 1 1 8  37 8  o 13.03000  0.1741000     12.98000  0.2455000     13.09000  0.2471000     -0.1164000     0.3483000 
1 1 1 8  37 9  o 3.008000  0.3946000     2.647000  0.6275000     3.369000  0.4784000     -0.7224000     0.7891000 
1 1 1 8  37 10 o 4.579000  0.2836000     4.155000  0.4448000     5.003000  0.3519000     -0.8476000     0.5672000 
1 1 1 8  37 11 o 4.094000  0.3391000     3.974000  0.5092000     4.213000  0.4480000     -0.2393000     0.6782000 
1 1 1 8  37 12 o 3.410000  0.4257000     3.880000  0.5220000     2.941000  0.6726000     0.9395000      0.8513000 
1 1 1 8  37 13 o 5.971000  0.3818000     6.016000  0.5597000     5.926000  0.5195000     0.9008000E-01  0.7636000 
1 1 1 8  37 14 o 7.482000  0.3856000     6.593000  0.5147000     8.371000  0.5743000     -1.778000      0.7712000 
1 1 1 8  37 15 o 2.961000  0.5469000     3.134000  0.6824000     2.788000  0.8549000     0.3457000      1.094000  
1 1 1 8  37 16 o 6.932000  0.2836000     6.509000  0.3749000     7.356000  0.4256000     -0.8464000     0.5671000 
1 1 1 8  37 17 o 4.567000  0.3329000     4.778000  0.4527000     4.356000  0.4883000     0.4222000      0.6658000 
1 1 1 8  37 18 o 2.150000  0.4847000     1.533000  0.6790000     2.767000  0.6917000     -1.234000      0.9693000 
1 1 1 8  37 19 o 1.707000  0.4432000     1.134000  0.5488000     2.280000  0.6962000     -1.146000      0.8865000 
1 1 1 8  37 20 o 1.622000  0.5452000     1.838000  0.8759000     1.407000  0.6494000     0.4313000      1.090000  
1 1 1 8  37 21 o 1.311000  0.4562000     1.608000  0.7617000     1.014000  0.5022000     0.5939000      0.9123000 
1 1 1 8  37 22 o 1.715000  0.5032000     1.633000  0.6912000     1.797000  0.7315000     -0.1646000     1.006000  
1 1 1 8  38 0  o 16.35000  0.3467000     16.35000  0.3467000     16.35000  0.3467000     -0.000000      0.000000  
1 1 1 8  38 1  o 6.204000  0.2392000     6.130000  0.3665000     6.279000  0.3076000     -0.1493000     0.4785000 
1 1 1 8  38 2  o 12.30000  0.1762000     12.24000  0.2665000     12.36000  0.2305000     -0.1201000     0.3523000 
1 1 1 8  38 3  o 14.50000  0.1696000     14.76000  0.2408000     14.24000  0.2390000     0.5211000      0.3392000 
1 1 1 8  38 4  o 5.901000  0.2000000     6.257000  0.2715000     5.545000  0.2938000     0.7126000      0.4000000 
1 1 1 8  38 5  o 6.500000  0.1892000     6.382000  0.2716000     6.619000  0.2634000     -0.2368000     0.3783000 
1 1 1 8  38 6  o 12.32000  0.1697000     12.63000  0.2395000     12.02000  0.2406000     0.6160000      0.3395000 
1 1 1 8  38 7  o 7.859000  0.1882000     8.117000  0.2639000     7.602000  0.2683000     0.5144000      0.3763000 
1 1 1 8  38 8  o 9.656000  0.1775000     9.725000  0.2526000     9.588000  0.2495000     0.1376000      0.3550000 
1 1 1 8  38 9  o 4.981000  0.2552000     4.840000  0.3712000     5.123000  0.3503000     -0.2829000     0.5104000 
1 1 1 8  38 10 o 4.368000  0.2979000     4.895000  0.3723000     3.840000  0.4652000     1.055000       0.5959000 
1 1 1 8  38 11 o 5.599000  0.2631000     5.771000  0.3697000     5.428000  0.3746000     0.3430000      0.5263000 
1 1 1 8  38 12 o 3.745000  0.4627000     3.290000  0.7816000     4.200000  0.4955000     -0.9104000     0.9254000 
1 1 1 8  38 13 o 4.963000  0.4528000     4.963000  0.4528000     ?         ?             ?              ?         
1 1 1 8  38 14 o 2.821000  0.5465000     3.004000  0.7096000     2.638000  0.8312000     0.3658000      1.093000  
1 1 1 8  38 15 o 7.229000  0.2717000     7.611000  0.3238000     6.848000  0.4363000     0.7627000      0.5434000 
1 1 1 8  38 16 o 4.018000  0.4841000     4.020000  0.6869000     4.016000  0.6823000     0.4689000E-02  0.9681000 
1 1 1 8  38 17 o 1.686000  0.4719000     2.120000  0.7354000     1.251000  0.5916000     0.8681000      0.9438000 
1 1 1 8  38 18 o 3.101000  0.4583000     2.679000  0.7237000     3.523000  0.5626000     -0.8438000     0.9166000 
1 1 1 8  38 19 o 1.574000  0.4933000     1.956000  0.8086000     1.192000  0.5653000     0.7634000      0.9866000 
1 1 1 8  38 20 o 2.358000  0.7606000     ?         ?             2.358000  0.7606000     ?              ?         
1 1 1 8  38 21 o 1.594000  0.5226000     1.843000  0.8418000     1.345000  0.6195000     0.4981000      1.045000  
1 1 1 8  38 22 o 1.249000  0.4167000     1.346000  0.6195000     1.151000  0.5576000     0.1951000      0.8334000 
1 1 1 8  39 0  o 14.93000  0.2415000     14.93000  0.2415000     14.93000  0.2415000     -0.000000      0.000000  
1 1 1 8  39 1  o 8.990000  0.1671000     8.676000  0.2386000     9.305000  0.2340000     -0.6281000     0.3342000 
1 1 1 8  39 2  o 13.12000  0.1662000     13.12000  0.2348000     13.13000  0.2353000     -0.4361000E-02 0.3324000 
1 1 1 8  39 3  o 9.530000  0.1672000     9.600000  0.2351000     9.460000  0.2377000     0.1392000      0.3343000 
1 1 1 8  39 4  o 3.287000  0.3126000     3.167000  0.4680000     3.407000  0.4144000     -0.2394000     0.6251000 
1 1 1 8  39 5  o 4.192000  0.2598000     4.040000  0.3783000     4.345000  0.3562000     -0.3047000     0.5196000 
1 1 1 8  39 6  o 7.259000  0.1921000     7.401000  0.2662000     7.116000  0.2770000     0.2848000      0.3842000 
1 1 1 8  39 7  o 16.28000  0.1843000     16.53000  0.2632000     16.03000  0.2581000     0.5000000      0.3687000 
1 1 1 8  39 8  o 9.441000  0.1834000     9.470000  0.2603000     9.412000  0.2585000     0.5836000E-01  0.3669000 
1 1 1 8  39 9  o 9.284000  0.1894000     9.447000  0.2680000     9.120000  0.2677000     0.3276000      0.3788000 
1 1 1 8  39 10 o 1.937000  0.4979000     1.962000  0.7078000     1.913000  0.7005000     0.4911000E-01  0.9958000 
1 1 1 8  39 11 o 9.806000  0.1993000     9.732000  0.2838000     9.879000  0.2801000     -0.1469000     0.3987000 
1 1 1 8  39 12 o 3.195000  0.6037000     3.405000  0.8586000     2.985000  0.8490000     0.4203000      1.207000  
1 1 1 8  39 13 o 1.821000  0.5595000     1.650000  0.7601000     1.992000  0.8212000     -0.3425000     1.119000  
1 1 1 8  39 14 o 4.711000  0.3733000     5.186000  0.4271000     4.236000  0.6125000     0.9498000      0.7467000 
1 1 1 8  39 15 o 3.768000  0.4549000     3.956000  0.5234000     3.579000  0.7441000     0.3764000      0.9098000 
1 1 1 8  39 16 f 2.031000  0.5201000     2.377000  0.7358000     1.686000  0.7354000     0.6913000      1.040000  
1 1 1 8  39 17 o 1.439000  0.4528000     1.511000  0.6575000     1.367000  0.6229000     0.1439000      0.9057000 
1 1 1 8  39 18 o 2.163000  0.5189000     2.102000  0.7437000     2.223000  0.7240000     -0.1213000     1.038000  
1 1 1 8  39 19 o 1.438000  0.4604000     1.161000  0.5554000     1.715000  0.7344000     -0.5545000     0.9208000 
1 1 1 8  39 20 f 2.181000  0.5431000     2.699000  0.8557000     1.663000  0.6692000     1.037000       1.086000  
1 1 1 8  39 21 o 1.308000  0.4564000     1.394000  0.7022000     1.222000  0.5831000     0.1716000      0.9128000 
1 1 1 8  39 22 o 1.599000  0.4852000     1.783000  0.7263000     1.414000  0.6436000     0.3692000      0.9704000 
1 1 1 8  40 0  o 2.517000  0.6448000     2.517000  0.6448000     2.517000  0.6448000     -0.000000      0.000000  
1 1 1 8  40 1  o 15.18000  0.1738000     15.35000  0.2462000     15.02000  0.2455000     0.3252000      0.3477000 
1 1 1 8  40 2  o 6.465000  0.1945000     6.535000  0.2738000     6.395000  0.2763000     0.1398000      0.3890000 
1 1 1 8  40 3  o 15.00000  0.1745000     14.95000  0.2461000     15.05000  0.2475000     -0.9690000E-01 0.3490000 
1 1 1 8  40 4  o 4.765000  0.2421000     4.845000  0.3420000     4.685000  0.3429000     0.1610000      0.4843000 
1 1 1 8  40 5  o 10.80000  0.1712000     10.79000  0.2419000     10.81000  0.2424000     -0.2837000E-01 0.3425000 
1 1 1 8  40 6  o 6.513000  0.2061000     6.560000  0.2933000     6.467000  0.2896000     0.9329000E-01  0.4122000 
1 1 1 8  40 7  o 2.868000  0.4032000     3.785000  0.4514000     1.952000  0.6682000     1.832000       0.8064000 
1 1 1 8  40 8  o 9.612000  0.1865000     9.587000  0.2684000     9.638000  0.2590000     -0.5077000E-01 0.3730000 
1 1 1 8  40 9  o 2.416000  0.4780000     2.416000  0.6772000     2.415000  0.6748000     0.1605000E-02  0.9560000 
1 1 1 8  40 10 o 6.563000  0.2335000     6.624000  0.3240000     6.501000  0.3362000     0.1229000      0.4669000 
1 1 1 8  40 11 f 9.998000  0.2502000     9.837000  0.4151000     10.16000  0.2797000     -0.3216000     0.5005000 
1 1 1 8  40 12 o 4.593000  0.5216000     4.520000  0.4842000     4.666000  0.9241000     -0.1459000     1.043000  
1 1 1 8  40 13 o 1.535000  0.4766000     1.369000  0.6316000     1.701000  0.7140000     -0.3318000     0.9533000 
1 1 1 8  40 14 o 4.163000  0.4071000     4.208000  0.5062000     4.119000  0.6378000     0.8986000E-01  0.8143000 
1 1 1 8  40 15 o 3.827000  0.4472000     4.117000  0.4977000     3.536000  0.7433000     0.5807000      0.8945000 
1 1 1 8  40 16 o 3.454000  0.4850000     4.029000  0.5194000     2.878000  0.8191000     1.151000       0.9699000 
1 1 1 8  40 17 o 1.665000  0.4852000     1.582000  0.6682000     1.749000  0.7037000     -0.1663000     0.9704000 
1 1 1 8  40 18 o 1.110000  0.3870000     1.184000  0.5852000     1.035000  0.5065000     0.1496000      0.7740000 
1 1 1 8  40 19 o 1.539000  0.4903000     1.284000  0.5973000     1.794000  0.7777000     -0.5099000     0.9806000 
1 1 1 8  40 20 o 1.546000  0.4531000     1.179000  0.5774000     1.914000  0.6984000     -0.7350000     0.9061000 
1 1 1 8  40 21 o 1.284000  0.4588000     1.581000  0.7815000     0.9858000 0.4809000     0.5957000      0.9176000 
1 1 1 8  41 0  o 3.695000  0.4329000     3.695000  0.4329000     3.695000  0.4329000     -0.000000      0.000000  
1 1 1 8  41 1  o 4.070000  0.2709000     4.208000  0.3705000     3.932000  0.3954000     0.2759000      0.5419000 
1 1 1 8  41 2  o 8.550000  0.1764000     8.566000  0.2494000     8.534000  0.2496000     0.3191000E-01  0.3529000 
1 1 1 8  41 3  o 6.341000  0.2028000     6.324000  0.2847000     6.358000  0.2890000     -0.3399000E-01 0.4057000 
1 1 1 8  41 4  f 8.700000  0.1800000     8.628000  0.2569000     8.773000  0.2522000     -0.1450000     0.3600000 
1 1 1 8  41 5  o 1.530000  0.4339000     1.734000  0.6454000     1.326000  0.5803000     0.4076000      0.8679000 
1 1 1 8  41 6  o 16.56000  0.1873000     17.09000  0.2684000     16.03000  0.2613000     1.068000       0.3746000 
1 1 1 8  41 7  o 5.903000  0.2313000     6.124000  0.3260000     5.682000  0.3282000     0.4424000      0.4626000 
1 1 1 8  41 8  o 4.132000  0.3209000     4.021000  0.4701000     4.242000  0.4369000     -0.2211000     0.6418000 
1 1 1 8  41 9  o 3.550000  0.3736000     3.588000  0.5346000     3.512000  0.5219000     0.7664000E-01  0.7471000 
1 1 1 8  41 10 o 13.49000  0.1920000     13.65000  0.2717000     13.32000  0.2714000     0.3319000      0.3840000 
1 1 1 8  41 11 o 1.584000  0.5097000     1.213000  0.5820000     1.955000  0.8370000     -0.7422000     1.019000  
1 1 1 8  41 12 o 1.751000  0.5343000     2.078000  0.8546000     1.424000  0.6413000     0.6535000      1.069000  
1 1 1 8  41 13 o 4.516000  0.3403000     4.395000  0.4816000     4.637000  0.4809000     -0.2424000     0.6806000 
1 1 1 8  41 14 o 3.512000  0.4729000     4.435000  0.4677000     2.588000  0.8222000     1.847000       0.9459000 
1 1 1 8  41 15 o 6.752000  0.3008000     6.964000  0.3346000     6.539000  0.5000000     0.4252000      0.6016000 
1 1 1 8  41 16 o 5.973000  0.3078000     6.477000  0.3665000     5.468000  0.4946000     1.008000       0.6155000 
1 1 1 8  41 17 o 4.096000  0.3758000     3.594000  0.5583000     4.598000  0.5032000     -1.004000      0.7516000 
1 1 1 8  41 18 o 1.789000  0.5328000     1.561000  0.7170000     2.018000  0.7884000     -0.4569000     1.066000  
1 1 1 8  41 19 o 4.930000  0.4389000     4.833000  0.6830000     5.028000  0.5513000     -0.1949000     0.8778000 
1 1 1 8  41 20 o 1.480000  0.4687000     1.876000  0.7786000     1.084000  0.5219000     0.7925000      0.9373000 
1 1 1 8  41 21 o 1.791000  0.4780000     2.243000  0.7378000     1.338000  0.6081000     0.9048000      0.9561000 
1 1 1 8  42 0  o 2.284000  0.7298000     2.284000  0.7298000     2.284000  0.7298000     -0.000000      0.000000  
1 1 1 8  42 1  o 2.125000  0.4431000     1.933000  0.6378000     2.317000  0.6152000     -0.3845000     0.8862000 
1 1 1 8  42 2  o 6.390000  0.2036000     6.535000  0.2868000     6.245000  0.2890000     0.2901000      0.4071000 
1 1 1 8  42 3  o 11.05000  0.1722000     11.11000  0.2439000     10.99000  0.2432000     0.1116000      0.3445000 
1 1 1 8  42 4  o 4.767000  0.2516000     4.904000  0.3417000     4.629000  0.3694000     0.2749000      0.5032000 
1 1 1 8  42 5  o 6.536000  0.2117000     6.628000  0.2976000     6.443000  0.3012000     0.1851000      0.4235000 
1 1 1 8  42 6  o 5.463000  0.2437000     5.649000  0.3432000     5.278000  0.3460000     0.3709000      0.4873000 
1 1 1 8  42 7  o 8.785000  0.1929000     8.944000  0.2724000     8.627000  0.2732000     0.3168000      0.3858000 
1 1 1 8  42 8  o 8.089000  0.2078000     8.293000  0.2936000     7.885000  0.2941000     0.4082000      0.4155000 
1 1 1 8  42 9  o 3.310000  0.4101000     2.904000  0.6378000     3.717000  0.5158000     -0.8134000     0.8203000 
1 1 1 8  42 10 f 6.313000  0.3294000     6.460000  0.5081000     6.167000  0.4194000     0.2928000      0.6589000 
1 1 1 8  42 11 o 6.467000  0.3365000     6.582000  0.4006000     6.352000  0.5408000     0.2297000      0.6730000 
1 1 1 8  42 12 o 1.502000  0.4593000     1.192000  0.5704000     1.812000  0.7202000     -0.6201000     0.9187000 
1 1 1 8  42 13 o 2.461000  0.5157000     2.917000  0.7037000     2.006000  0.7541000     0.9115000      1.031000  
1 1 1 8  42 14 o 2.280000  0.5532000     2.309000  0.7303000     2.251000  0.8312000     0.5871000E-01  1.106000  
1 1 1 8  42 15 o 3.073000  0.5115000     3.547000  0.6046000     2.598000  0.8252000     0.9486000      1.023000  
1 1 1 8  42 16 o 2.991000  0.5074000     3.383000  0.6112000     2.599000  0.8101000     0.7842000      1.015000  
1 1 1 8  42 17 o 2.406000  0.5046000     2.640000  0.6934000     2.172000  0.7331000     0.4684000      1.009000  
1 1 1 8  42 18 o 1.266000  0.4268000     1.301000  0.5987000     1.231000  0.6085000     0.6988000E-01  0.8536000 
1 1 1 8  42 19 o 1.360000  0.4306000     1.130000  0.5568000     1.589000  0.6570000     -0.4583000     0.8612000 
1 1 1 8  42 20 o 2.696000  0.5034000     2.243000  0.8064000     3.150000  0.6029000     -0.9074000     1.007000  
1 1 1 8  42 21 o 1.496000  0.4461000     1.964000  0.7379000     1.028000  0.5014000     0.9364000      0.8922000 
1 1 1 8  43 0  o 4.802000  0.3580000     4.802000  0.3580000     4.802000  0.3580000     0.000000       0.000000  
1 1 1 8  43 1  o 11.23000  0.1751000     11.19000  0.2489000     11.26000  0.2464000     -0.6595000E-01 0.3502000 
1 1 1 8  43 2  o 10.16000  0.1754000     10.21000  0.2497000     10.11000  0.2462000     0.9717000E-01  0.3507000 
1 1 1 8  43 3  o 5.553000  0.2281000     5.724000  0.3123000     5.383000  0.3326000     0.3420000      0.4562000 
1 1 1 8  43 4  o 5.359000  0.2392000     4.974000  0.3562000     5.743000  0.3194000     -0.7692000     0.4785000 
1 1 1 8  43 5  o 4.525000  0.2695000     4.312000  0.3903000     4.738000  0.3716000     -0.4260000     0.5389000 
1 1 1 8  43 6  o 10.96000  0.1829000     11.05000  0.2576000     10.86000  0.2597000     0.1907000      0.3658000 
1 1 1 8  43 7  o 7.213000  0.2192000     7.218000  0.3128000     7.209000  0.3072000     0.8541000E-02  0.4385000 
1 1 1 8  43 8  o 2.836000  0.4609000     2.841000  0.6648000     2.832000  0.6386000     0.9604000E-02  0.9219000 
1 1 1 8  43 9  o 8.357000  0.2654000     8.306000  0.4413000     8.408000  0.2949000     -0.1022000     0.5307000 
1 1 1 8  43 10 o 8.502000  0.3041000     8.502000  0.3041000     ?         ?             ?              ?         
1 1 1 8  43 11 o 2.179000  0.5440000     2.482000  0.8185000     1.877000  0.7167000     0.6047000      1.088000  
1 1 1 8  43 12 o 6.364000  0.2629000     6.069000  0.3851000     6.659000  0.3580000     -0.5904000     0.5258000 
1 1 1 8  43 13 o 4.356000  0.3606000     4.114000  0.5367000     4.598000  0.4819000     -0.4846000     0.7213000 
1 1 1 8  43 14 o 4.651000  0.3750000     4.920000  0.4431000     4.383000  0.6051000     0.5367000      0.7500000 
1 1 1 8  43 15 o 1.787000  0.5220000     1.822000  0.7194000     1.752000  0.7566000     0.6959000E-01  1.044000  
1 1 1 8  43 16 o 1.710000  0.5045000     1.476000  0.6462000     1.944000  0.7751000     -0.4680000     1.009000  
1 1 1 8  43 17 o 2.171000  0.5096000     1.602000  0.7355000     2.740000  0.7056000     -1.137000      1.019000  
1 1 1 8  43 18 o 1.862000  0.5475000     1.517000  0.6686000     2.208000  0.8671000     -0.6913000     1.095000  
1 1 1 8  43 19 o 1.368000  0.4381000     1.249000  0.5998000     1.488000  0.6386000     -0.2392000     0.8761000 
1 1 1 8  43 20 o 1.183000  0.3965000     1.054000  0.5235000     1.312000  0.5956000     -0.2577000     0.7929000 
1 1 1 8  44 0  o 5.240000  0.3378000     5.240000  0.3378000     5.240000  0.3378000     -0.000000      0.000000  
1 1 1 8  44 1  o 6.605000  0.2072000     6.632000  0.2903000     6.579000  0.2958000     0.5272000E-01  0.4144000 
1 1 1 8  44 2  o 3.100000  0.3875000     3.589000  0.4672000     2.611000  0.6183000     0.9772000      0.7749000 
1 1 1 8  44 3  o 7.481000  0.1995000     7.581000  0.2807000     7.381000  0.2835000     0.1992000      0.3990000 
1 1 1 8  44 4  o 3.676000  0.3256000     3.797000  0.4384000     3.554000  0.4816000     0.2431000      0.6512000 
1 1 1 8  44 5  o 9.963000  0.1855000     9.872000  0.2627000     10.05000  0.2619000     -0.1822000     0.3710000 
1 1 1 8  44 6  o 10.86000  0.1873000     10.86000  0.2641000     10.87000  0.2657000     -0.1306000E-01 0.3746000 
1 1 1 8  44 7  o 14.63000  0.1912000     14.77000  0.2711000     14.48000  0.2696000     0.2954000      0.3823000 
1 1 1 8  44 8  o 11.40000  0.2439000     11.33000  0.4063000     11.47000  0.2699000     -0.1390000     0.4878000 
1 1 1 8  44 9  o 6.513000  0.3430000     6.513000  0.3430000     ?         ?             ?              ?         
1 1 1 8  44 10 o 5.483000  0.3335000     5.175000  0.5490000     5.792000  0.3787000     -0.6162000     0.6669000 
1 1 1 8  44 11 o 3.500000  0.4278000     4.033000  0.5199000     2.967000  0.6795000     1.066000       0.8556000 
1 1 1 8  44 12 o 2.315000  0.5195000     1.962000  0.7402000     2.669000  0.7293000     -0.7069000     1.039000  
1 1 1 8  44 13 f 1.941000  0.5151000     1.838000  0.7137000     2.044000  0.7430000     -0.2061000     1.030000  
1 1 1 8  44 14 o 1.811000  0.4855000     2.301000  0.7423000     1.320000  0.6261000     0.9804000      0.9711000 
1 1 1 8  44 15 o 1.547000  0.4842000     1.536000  0.6719000     1.557000  0.6973000     -0.2076000E-01 0.9684000 
1 1 1 8  44 16 o 1.690000  0.5039000     1.532000  0.6618000     1.848000  0.7601000     -0.3163000     1.008000  
1 1 1 8  44 17 o 1.584000  0.4936000     1.539000  0.6606000     1.629000  0.7336000     -0.8997000E-01 0.9873000 
1 1 1 8  44 18 o 2.988000  0.5006000     2.408000  0.8270000     3.567000  0.5643000     -1.159000      1.001000  
1 1 1 8  44 19 o 2.493000  0.5334000     2.866000  0.7760000     2.119000  0.7321000     0.7474000      1.067000  
1 1 1 8  44 20 o 1.664000  0.4905000     1.506000  0.6862000     1.823000  0.7012000     -0.3173000     0.9811000 
1 1 1 8  45 0  o 5.029000  0.3647000     5.029000  0.3647000     5.029000  0.3647000     -0.000000      0.000000  
1 1 1 8  45 1  f 7.759000  0.1991000     7.965000  0.2761000     7.553000  0.2870000     0.4126000      0.3983000 
1 1 1 8  45 2  f 13.54000  0.1814000     13.34000  0.2563000     13.74000  0.2567000     -0.3992000     0.3627000 
1 1 1 8  45 3  o 8.933000  0.1907000     8.495000  0.2736000     9.370000  0.2658000     -0.8756000     0.3815000 
1 1 1 8  45 4  o 7.771000  0.2032000     7.552000  0.2909000     7.990000  0.2838000     -0.4383000     0.4064000 
1 1 1 8  45 5  o 6.675000  0.2239000     6.446000  0.3216000     6.903000  0.3115000     -0.4568000     0.4477000 
1 1 1 8  45 6  o 7.760000  0.2136000     7.890000  0.2990000     7.631000  0.3051000     0.2584000      0.4272000 
1 1 1 8  45 7  o 8.760000  0.2370000     8.257000  0.3762000     9.264000  0.2884000     -1.007000      0.4740000 
1 1 1 8  45 8  o 5.267000  0.4636000     5.267000  0.4636000     ?         ?             ?              ?         
1 1 1 8  45 9  o 3.510000  0.4870000     3.569000  0.7847000     3.451000  0.5769000     0.1176000      0.9740000 
1 1 1 8  45 10 o 8.757000  0.2140000     8.466000  0.3049000     9.048000  0.3004000     -0.5818000     0.4280000 
1 1 1 8  45 11 o 2.004000  0.4682000     2.635000  0.6961000     1.373000  0.6265000     1.262000       0.9365000 
1 1 1 8  45 12 o 1.692000  0.4933000     1.634000  0.6850000     1.750000  0.7100000     -0.1163000     0.9866000 
1 1 1 8  45 13 f 3.333000  0.4421000     3.988000  0.5127000     2.678000  0.7204000     1.310000       0.8842000 
1 1 1 8  45 14 o 3.088000  0.5112000     2.833000  0.7064000     3.342000  0.7392000     -0.5081000     1.022000  
1 1 1 8  45 15 o 2.585000  0.5601000     2.739000  0.7096000     2.431000  0.8668000     0.3078000      1.120000  
1 1 1 8  45 16 o 1.981000  0.5571000     2.433000  0.8827000     1.529000  0.6800000     0.9041000      1.114000  
1 1 1 8  45 17 o 2.044000  0.5312000     2.306000  0.7105000     1.782000  0.7898000     0.5239000      1.062000  
1 1 1 8  45 18 o 1.553000  0.4580000     1.220000  0.5703000     1.886000  0.7168000     -0.6653000     0.9160000 
1 1 1 8  45 19 o 1.268000  0.4258000     1.507000  0.6883000     1.028000  0.5016000     0.4795000      0.8517000 
1 1 1 8  45 20 o 1.256000  0.4198000     1.331000  0.6323000     1.182000  0.5525000     0.1489000      0.8397000 
1 1 1 8  46 0  o 7.828000  0.2830000     7.828000  0.2830000     7.828000  0.2830000     0.000000       0.000000  
1 1 1 8  46 1  o 4.433000  0.2923000     4.141000  0.4393000     4.724000  0.3858000     -0.5825000     0.5847000 
1 1 1 8  46 2  o 1.752000  0.4102000     2.464000  0.6484000     1.040000  0.5027000     1.424000       0.8204000 
1 1 1 8  46 3  o 2.490000  0.4627000     2.165000  0.6821000     2.815000  0.6255000     -0.6508000     0.9255000 
1 1 1 8  46 4  o 4.845000  0.2792000     4.981000  0.3878000     4.709000  0.4017000     0.2717000      0.5584000 
1 1 1 8  46 5  o 6.870000  0.2253000     7.241000  0.3074000     6.499000  0.3296000     0.7418000      0.4507000 
1 1 1 8  46 6  o 7.841000  0.2688000     7.924000  0.4445000     7.759000  0.3024000     0.1649000      0.5376000 
1 1 1 8  46 7  o 6.813000  0.3890000     6.813000  0.3890000     ?         ?             ?              ?         
1 1 1 8  46 8  o 4.147000  0.4205000     4.064000  0.6847000     4.230000  0.4883000     -0.1662000     0.8410000 
1 1 1 8  46 9  o 6.143000  0.2628000     6.036000  0.3823000     6.250000  0.3606000     -0.2145000     0.5255000 
1 1 1 8  46 10 o 2.720000  0.4960000     2.709000  0.7041000     2.730000  0.6988000     -0.2051000E-01 0.9920000 
1 1 1 8  46 11 o 4.622000  0.3351000     4.024000  0.5122000     5.221000  0.4322000     -1.198000      0.6702000 
1 1 1 8  46 12 o 1.679000  0.4686000     2.113000  0.7301000     1.245000  0.5875000     0.8679000      0.9371000 
1 1 1 8  46 13 o 2.817000  0.4989000     2.709000  0.7024000     2.925000  0.7089000     -0.2157000     0.9979000 
1 1 1 8  46 14 f 1.967000  0.5257000     1.628000  0.6848000     2.306000  0.7977000     -0.6776000     1.051000  
1 1 1 8  46 15 o 2.766000  0.5121000     2.197000  0.7435000     3.336000  0.7044000     -1.139000      1.024000  
1 1 1 8  46 16 o 1.209000  0.4114000     1.362000  0.6298000     1.056000  0.5296000     0.3061000      0.8228000 
1 1 1 8  46 17 o 1.574000  0.4904000     1.727000  0.7468000     1.422000  0.6360000     0.3053000      0.9809000 
1 1 1 8  46 18 o 1.253000  0.4131000     1.227000  0.5768000     1.279000  0.5915000     -0.5149000E-01 0.8262000 
1 1 1 8  46 19 o 1.330000  0.4368000     1.413000  0.6535000     1.247000  0.5796000     0.1664000      0.8735000 
1 1 1 8  47 0  o 0.8559000 0.5887000     0.8559000 0.5887000     0.8559000 0.5887000     -0.000000      0.000000  
1 1 1 8  47 1  o 16.21000  0.1920000     16.26000  0.2710000     16.16000  0.2721000     0.9375000E-01  0.3840000 
1 1 1 8  47 2  o 11.00000  0.1891000     11.16000  0.2668000     10.83000  0.2680000     0.3367000      0.3781000 
1 1 1 8  47 3  o 6.163000  0.2412000     6.385000  0.3341000     5.940000  0.3481000     0.4447000      0.4825000 
1 1 1 8  47 4  o 10.21000  0.1931000     9.951000  0.2763000     10.47000  0.2697000     -0.5191000     0.3861000 
1 1 1 8  47 5  o 9.336000  0.2588000     9.590000  0.3977000     9.082000  0.3312000     0.5077000      0.5176000 
1 1 1 8  47 6  o 10.79000  0.3186000     10.79000  0.3186000     ?         ?             ?              ?         
1 1 1 8  47 7  o 1.955000  0.5189000     1.620000  0.7223000     2.289000  0.7453000     -0.6684000     1.038000  
1 1 1 8  47 8  o 3.124000  0.4512000     3.336000  0.6033000     2.912000  0.6710000     0.4246000      0.9023000 
1 1 1 8  47 9  o 3.293000  0.4399000     3.760000  0.5400000     2.827000  0.6945000     0.9335000      0.8797000 
1 1 1 8  47 10 o 3.307000  0.4468000     3.669000  0.5487000     2.945000  0.7052000     0.7237000      0.8935000 
1 1 1 8  47 11 f 2.412000  0.5178000     2.174000  0.7335000     2.649000  0.7309000     -0.4750000     1.036000  
1 1 1 8  47 12 o 2.260000  0.5180000     2.417000  0.7392000     2.104000  0.7258000     0.3132000      1.036000  
1 1 1 8  47 13 o 3.658000  0.3999000     3.629000  0.5812000     3.687000  0.5495000     -0.5824000E-01 0.7998000 
1 1 1 8  47 14 o 2.201000  0.5415000     2.138000  0.7295000     2.263000  0.8005000     -0.1250000     1.083000  
1 1 1 8  47 15 o 1.484000  0.4878000     1.608000  0.7421000     1.359000  0.6335000     0.2491000      0.9757000 
1 1 1 8  47 16 o 2.387000  0.6373000     2.364000  0.7223000     2.410000  1.050000      -0.4648000E-01 1.275000  
1 1 1 8  47 17 f 1.734000  0.4601000     2.228000  0.7139000     1.239000  0.5805000     0.9889000      0.9201000 
1 1 1 8  47 18 o 1.847000  0.4885000     1.520000  0.6494000     2.175000  0.7300000     -0.6546000     0.9770000 
1 1 1 8  47 19 o 1.079000  0.3710000     1.078000  0.5302000     1.079000  0.5192000     -0.7679000E-03 0.7421000 
1 1 1 8  48 0  o 13.99000  0.2666000     13.99000  0.2666000     13.99000  0.2666000     0.000000       0.000000  
1 1 1 8  48 1  o 6.234000  0.2370000     6.067000  0.3443000     6.402000  0.3257000     -0.3350000     0.4739000 
1 1 1 8  48 2  o 3.206000  0.4447000     3.767000  0.5923000     2.645000  0.6635000     1.122000       0.8894000 
1 1 1 8  48 3  o 7.724000  0.2821000     7.697000  0.4405000     7.751000  0.3524000     -0.5424000E-01 0.5642000 
1 1 1 8  48 5  o 5.023000  0.5219000     4.329000  0.6606000     5.718000  0.8081000     -1.389000      1.044000  
1 1 1 8  48 6  o 2.431000  0.5262000     2.373000  0.7804000     2.488000  0.7060000     -0.1142000     1.052000  
1 1 1 8  48 7  o 3.954000  0.3690000     3.789000  0.5425000     4.119000  0.5003000     -0.3302000     0.7380000 
1 1 1 8  48 8  o 3.342000  0.4503000     4.219000  0.5112000     2.466000  0.7414000     1.753000       0.9006000 
1 1 1 8  48 9  o 4.310000  0.3524000     3.718000  0.5447000     4.902000  0.4474000     -1.184000      0.7049000 
1 1 1 8  48 10 o 3.401000  0.4234000     3.650000  0.5384000     3.151000  0.6537000     0.4997000      0.8468000 
1 1 1 8  48 11 o 3.097000  0.4566000     2.497000  0.7214000     3.698000  0.5600000     -1.201000      0.9132000 
1 1 1 8  48 12 o 4.206000  0.3495000     4.459000  0.4663000     3.954000  0.5207000     0.5045000      0.6990000 
1 1 1 8  48 13 o 4.687000  0.3209000     4.959000  0.4360000     4.415000  0.4710000     0.5437000      0.6418000 
1 1 1 8  48 14 o 2.758000  0.4774000     3.643000  0.5746000     1.873000  0.7626000     1.770000       0.9549000 
1 1 1 8  48 15 o 4.060000  0.4298000     3.932000  0.5739000     4.188000  0.6400000     -0.2564000     0.8597000 
1 1 1 8  48 16 o 2.316000  0.5647000     2.046000  0.8010000     2.586000  0.7961000     -0.5398000     1.129000  
1 1 1 8  48 17 o 1.942000  0.5058000     1.921000  0.7083000     1.963000  0.7222000     -0.4181000E-01 1.012000  
1 1 1 8  48 18 o 1.224000  0.4062000     1.170000  0.5590000     1.279000  0.5896000     -0.1096000     0.8125000 
1 1 1 8  49 0  o 1.151000  0.8060000     1.151000  0.8060000     1.151000  0.8060000     0.000000       0.000000  
1 1 1 8  49 1  o 4.874000  0.8591000     4.874000  0.8591000     ?         ?             ?              ?         
1 1 1 8  49 2  o 3.211000  1.080000      3.211000  1.080000      ?         ?             ?              ?         
1 1 1 8  49 3  o 3.511000  0.6156000     2.346000  0.8416000     4.676000  0.8986000     -2.330000      1.231000  
1 1 1 8  49 4  o 6.897000  0.2890000     6.386000  0.4852000     7.407000  0.3142000     -1.022000      0.5780000 
1 1 1 8  49 5  o 3.288000  0.4228000     3.234000  0.5889000     3.342000  0.6068000     -0.1072000     0.8456000 
1 1 1 8  49 6  o 4.444000  0.3206000     4.488000  0.4489000     4.400000  0.4578000     0.8878000E-01  0.6412000 
1 1 1 8  49 7  o 2.003000  0.5149000     2.048000  0.7256000     1.959000  0.7307000     0.8947000E-01  1.030000  
1 1 1 8  49 8  o 3.280000  0.4405000     3.433000  0.5982000     3.127000  0.6469000     0.3061000      0.8811000 
1 1 1 8  49 9  o 7.617000  0.2287000     7.903000  0.3170000     7.332000  0.3297000     0.5708000      0.4574000 
1 1 1 8  49 10 o 1.426000  0.4466000     1.581000  0.6649000     1.270000  0.5964000     0.3109000      0.8932000 
1 1 1 8  49 11 o 5.734000  0.2790000     5.833000  0.3795000     5.635000  0.4090000     0.1984000      0.5580000 
1 1 1 8  49 12 o 3.815000  0.3822000     4.121000  0.5013000     3.510000  0.5770000     0.6114000      0.7643000 
1 1 1 8  49 13 o 1.941000  0.4867000     1.468000  0.6471000     2.415000  0.7272000     -0.9462000     0.9734000 
1 1 1 8  49 14 o 1.582000  0.5004000     1.932000  0.8095000     1.232000  0.5885000     0.7002000      1.001000  
1 1 1 8  49 15 o 2.378000  0.5891000     2.777000  0.7316000     1.979000  0.9236000     0.7977000      1.178000  
1 1 1 8  49 16 o 1.782000  0.5078000     1.728000  0.6934000     1.836000  0.7420000     -0.1075000     1.016000  
1 1 1 8  49 17 o 1.349000  0.4265000     1.587000  0.6635000     1.112000  0.5362000     0.4746000      0.8531000 
1 1 1 8  49 18 o 2.100000  0.5257000     2.407000  0.7854000     1.793000  0.6990000     0.6136000      1.051000  
1 1 1 8  50 0  o 4.430000  0.5291000     4.430000  0.5291000     4.430000  0.5291000     0.000000       0.000000  
1 1 1 8  50 1  o 2.640000  0.5176000     2.597000  0.7671000     2.684000  0.6950000     -0.8735000E-01 1.035000  
1 1 1 8  50 2  o 3.213000  0.4367000     3.321000  0.6074000     3.105000  0.6276000     0.2156000      0.8734000 
1 1 1 8  50 3  o 2.457000  0.4474000     3.250000  0.5804000     1.663000  0.6810000     1.587000       0.8947000 
1 1 1 8  50 4  o 2.109000  0.5062000     2.278000  0.7225000     1.939000  0.7093000     0.3398000      1.012000  
1 1 1 8  50 5  o 4.695000  0.3191000     5.290000  0.3813000     4.100000  0.5119000     1.191000       0.6383000 
1 1 1 8  50 6  o 4.192000  0.3455000     3.888000  0.5151000     4.495000  0.4607000     -0.6073000     0.6911000 
1 1 1 8  50 7  o 3.080000  0.4447000     2.138000  0.7247000     4.021000  0.5158000     -1.883000      0.8895000 
1 1 1 8  50 8  o 3.239000  0.4512000     3.164000  0.6376000     3.314000  0.6386000     -0.1500000     0.9024000 
1 1 1 8  50 9  o 2.600000  0.4839000     3.088000  0.6323000     2.112000  0.7327000     0.9758000      0.9678000 
1 1 1 8  50 10 o 3.217000  0.4518000     2.503000  0.7423000     3.931000  0.5150000     -1.428000      0.9035000 
1 1 1 8  50 11 o 3.162000  0.4591000     2.801000  0.7026000     3.523000  0.5911000     -0.7215000     0.9182000 
1 1 1 8  50 12 o 1.396000  0.4457000     1.425000  0.6375000     1.367000  0.6230000     0.5892000E-01  0.8914000 
1 1 1 8  50 13 o 3.392000  0.4281000     3.655000  0.5534000     3.129000  0.6533000     0.5264000      0.8562000 
1 1 1 8  50 14 o 3.011000  0.5408000     3.351000  0.5824000     2.670000  0.9114000     0.6805000      1.082000  
1 1 1 8  50 15 o 2.231000  0.5649000     2.672000  0.8604000     1.790000  0.7324000     0.8825000      1.130000  
1 1 1 8  50 16 o 1.351000  0.4387000     1.101000  0.5304000     1.601000  0.6990000     -0.5004000     0.8774000 
1 1 1 8  50 17 o 2.012000  0.5028000     1.751000  0.6936000     2.273000  0.7282000     -0.5217000     1.006000  
1 1 1 8  51 0  o 1.357000  0.7938000     1.357000  0.7938000     1.357000  0.7938000     -0.000000      0.000000  
1 1 1 8  51 1  o 2.237000  0.5070000     2.182000  0.7213000     2.292000  0.7127000     -0.1106000     1.014000  
1 1 1 8  51 2  o 6.085000  0.2494000     5.882000  0.3612000     6.289000  0.3441000     -0.4073000     0.4989000 
1 1 1 8  51 3  o 7.935000  0.2176000     7.833000  0.3076000     8.037000  0.3077000     -0.2039000     0.4351000 
1 1 1 8  51 4  o 3.405000  0.4140000     3.337000  0.5934000     3.472000  0.5775000     -0.1354000     0.8281000 
1 1 1 8  51 5  o 5.908000  0.2575000     6.008000  0.3499000     5.809000  0.3778000     0.1995000      0.5149000 
1 1 1 8  51 6  o 10.14000  0.2047000     10.34000  0.2844000     9.944000  0.2946000     0.3934000      0.4095000 
1 1 1 8  51 7  o 4.850000  0.3048000     4.588000  0.4450000     5.111000  0.4165000     -0.5226000     0.6095000 
1 1 1 8  51 8  o 7.136000  0.2415000     7.002000  0.3416000     7.271000  0.3414000     -0.2681000     0.4830000 
1 1 1 8  51 9  f 3.569000  0.4254000     3.168000  0.6584000     3.970000  0.5388000     -0.8019000     0.8508000 
1 1 1 8  51 10 o 5.167000  0.3057000     5.241000  0.4333000     5.093000  0.4312000     0.1480000      0.6113000 
1 1 1 8  51 11 o 4.917000  0.3124000     4.611000  0.4681000     5.223000  0.4139000     -0.6126000     0.6248000 
1 1 1 8  51 12 o 6.274000  0.2662000     6.616000  0.3586000     5.932000  0.3936000     0.6844000      0.5324000 
1 1 1 8  51 13 o 3.132000  0.6006000     3.130000  0.9015000     3.135000  0.7937000     -0.4968000E-02 1.201000  
1 1 1 8  51 14 o 1.867000  0.5773000     1.760000  0.7629000     1.974000  0.8666000     -0.2148000     1.155000  
1 1 1 8  51 15 o 1.461000  0.4514000     1.058000  0.5158000     1.864000  0.7410000     -0.8065000     0.9029000 
1 1 1 8  51 16 o 2.824000  0.5149000     2.844000  0.6796000     2.803000  0.7736000     0.4080000E-01  1.030000  
1 1 1 8  51 17 o 1.387000  0.4387000     1.398000  0.6229000     1.376000  0.6179000     0.2214000E-01  0.8774000 
1 1 1 8  52 0  o 0.9855000 0.6607000     0.9855000 0.6607000     0.9855000 0.6607000     0.000000       0.000000  
1 1 1 8  52 1  o 2.400000  0.5060000     2.325000  0.7197000     2.476000  0.7116000     -0.1509000     1.012000  
1 1 1 8  52 2  o 4.809000  0.3042000     4.658000  0.4413000     4.960000  0.4187000     -0.3021000     0.6084000 
1 1 1 8  52 3  o 9.589000  0.2047000     9.728000  0.2888000     9.450000  0.2903000     0.2785000      0.4095000 
1 1 1 8  52 4  o 3.711000  0.3806000     3.462000  0.5703000     3.960000  0.5041000     -0.4988000     0.7611000 
1 1 1 8  52 5  o 7.182000  0.2324000     7.275000  0.3275000     7.088000  0.3299000     0.1871000      0.4648000 
1 1 1 8  52 6  o 1.681000  0.4735000     1.981000  0.7142000     1.381000  0.6219000     0.6000000      0.9470000 
1 1 1 8  52 7  o 8.550000  0.2164000     8.810000  0.2970000     8.290000  0.3149000     0.5203000      0.4329000 
1 1 1 8  52 8  o 7.424000  0.2359000     7.368000  0.3345000     7.481000  0.3327000     -0.1124000     0.4718000 
1 1 1 8  52 9  o 5.406000  0.2932000     5.679000  0.4035000     5.132000  0.4256000     0.5469000      0.5865000 
1 1 1 8  52 10 o 2.239000  0.5205000     2.270000  0.7298000     2.209000  0.7423000     0.6070000E-01  1.041000  
1 1 1 8  52 11 o 2.693000  0.4975000     2.563000  0.7125000     2.823000  0.6945000     -0.2604000     0.9950000 
1 1 1 8  52 12 o 1.770000  0.4986000     1.370000  0.6606000     2.170000  0.7471000     -0.8000000     0.9972000 
1 1 1 8  52 13 f 3.895000  0.6389000     4.469000  0.5321000     3.320000  1.162000      1.149000       1.278000  
1 1 1 8  52 14 o 2.349000  0.5498000     2.114000  0.7558000     2.585000  0.7988000     -0.4706000     1.100000  
1 1 1 8  52 15 f 4.316000  0.3799000     4.616000  0.4624000     4.017000  0.6028000     0.5986000      0.7598000 
1 1 1 8  52 16 o 1.550000  0.4660000     1.769000  0.6943000     1.330000  0.6217000     0.4398000      0.9320000 
1 1 1 8  53 0  o 1.968000  0.8828000     1.968000  0.8828000     1.968000  0.8828000     0.000000       0.000000  
1 1 1 8  53 1  o 2.250000  0.5048000     2.237000  0.7125000     2.262000  0.7153000     -0.2470000E-01 1.010000  
1 1 1 8  53 2  o 5.922000  0.2622000     5.516000  0.3889000     6.329000  0.3517000     -0.8131000     0.5243000 
1 1 1 8  53 3  o 5.707000  0.2748000     6.344000  0.3492000     5.069000  0.4245000     1.274000       0.5496000 
1 1 1 8  53 4  o 4.936000  0.3056000     4.389000  0.4667000     5.484000  0.3946000     -1.095000      0.6112000 
1 1 1 8  53 5  o 1.801000  0.4934000     1.929000  0.7065000     1.674000  0.6891000     0.2542000      0.9869000 
1 1 1 8  53 6  o 2.117000  0.4938000     1.766000  0.6957000     2.468000  0.7011000     -0.7015000     0.9877000 
1 1 1 8  53 7  o 3.705000  0.3906000     3.856000  0.5327000     3.554000  0.5715000     0.3025000      0.7812000 
1 1 1 8  53 8  o 5.503000  0.2879000     5.900000  0.3874000     5.106000  0.4260000     0.7938000      0.5758000 
1 1 1 8  53 9  o 2.803000  0.4938000     2.551000  0.7237000     3.055000  0.6720000     -0.5031000     0.9876000 
1 1 1 8  53 10 f 2.960000  0.4797000     2.531000  0.7321000     3.390000  0.6201000     -0.8588000     0.9595000 
1 1 1 8  53 11 o 5.290000  0.3400000     5.201000  0.5430000     5.378000  0.4095000     -0.1768000     0.6801000 
1 1 1 8  53 12 o 4.038000  0.5116000     4.038000  0.5116000     ?         ?             ?              ?         
1 1 1 8  53 13 f 1.813000  0.5262000     1.949000  0.7987000     1.677000  0.6853000     0.2724000      1.052000  
1 1 1 8  53 14 o 3.473000  0.4519000     3.158000  0.6375000     3.789000  0.6406000     -0.6313000     0.9037000 
1 1 1 8  53 15 o 2.491000  0.5332000     2.541000  0.7254000     2.442000  0.7816000     0.9952000E-01  1.066000  
1 1 1 8  53 16 o 2.929000  0.5100000     2.824000  0.6664000     3.034000  0.7724000     -0.2104000     1.020000  
1 1 1 8  54 0  f 1.523000  0.8216000     1.523000  0.8216000     1.523000  0.8216000     0.000000       0.000000  
1 1 1 8  54 1  o 2.492000  0.4974000     2.639000  0.6850000     2.344000  0.7215000     0.2951000      0.9949000 
1 1 1 8  54 2  o 2.141000  0.5058000     2.299000  0.7245000     1.983000  0.7061000     0.3161000      1.012000  
1 1 1 8  54 3  o 4.314000  0.3385000     4.600000  0.4553000     4.028000  0.5009000     0.5725000      0.6769000 
1 1 1 8  54 4  o 6.441000  0.2485000     6.230000  0.3569000     6.652000  0.3459000     -0.4222000     0.4970000 
1 1 1 8  54 5  o 4.405000  0.3326000     4.677000  0.4469000     4.134000  0.4927000     0.5434000      0.6651000 
1 1 1 8  54 6  o 4.840000  0.3066000     5.052000  0.4231000     4.627000  0.4439000     0.4253000      0.6133000 
1 1 1 8  54 7  o 3.837000  0.3807000     4.134000  0.4832000     3.541000  0.5884000     0.5931000      0.7613000 
1 1 1 8  54 8  f 3.088000  0.4688000     3.185000  0.6484000     2.991000  0.6773000     0.1938000      0.9376000 
1 1 1 8  54 9  o 1.912000  0.5055000     2.167000  0.7410000     1.657000  0.6878000     0.5098000      1.011000  
1 1 1 8  54 10 o 2.663000  0.5078000     2.391000  0.7477000     2.935000  0.6875000     -0.5436000     1.016000  
1 1 1 8  54 11 o 1.140000  0.4030000     1.036000  0.5146000     1.244000  0.6203000     -0.2073000     0.8060000 
1 1 1 8  54 12 o 1.628000  0.4716000     1.186000  0.5802000     2.070000  0.7436000     -0.8838000     0.9432000 
1 1 1 8  54 13 o 1.866000  0.4928000     1.510000  0.6569000     2.221000  0.7348000     -0.7110000     0.9856000 
1 1 1 8  54 14 f 1.757000  0.5071000     1.793000  0.7048000     1.721000  0.7294000     0.7142000E-01  1.014000  
1 1 1 8  54 15 o 4.346000  0.3766000     4.372000  0.4902000     4.320000  0.5719000     0.5200000E-01  0.7532000 
1 1 1 8  55 0  o 6.543000  0.3443000     6.543000  0.3443000     6.543000  0.3443000     0.000000       0.000000  
1 1 1 8  55 1  o 1.999000  0.5074000     1.878000  0.7084000     2.119000  0.7265000     -0.2416000     1.015000  
1 1 1 8  55 2  o 1.809000  0.4950000     1.724000  0.6907000     1.894000  0.7093000     -0.1704000     0.9900000 
1 1 1 8  55 3  o 5.035000  0.3042000     4.390000  0.4676000     5.680000  0.3893000     -1.290000      0.6084000 
1 1 1 8  55 4  f 4.910000  0.3102000     5.122000  0.4213000     4.698000  0.4554000     0.4240000      0.6204000 
1 1 1 8  55 5  o 1.425000  0.4490000     1.483000  0.6490000     1.368000  0.6205000     0.1153000      0.8979000 
1 1 1 8  55 6  o 1.729000  0.4780000     1.307000  0.6032000     2.151000  0.7418000     -0.8437000     0.9561000 
1 1 1 8  55 7  o 3.029000  0.4782000     3.225000  0.6265000     2.834000  0.7227000     0.3913000      0.9565000 
1 1 1 8  55 8  o 3.749000  0.4035000     3.266000  0.6380000     4.231000  0.4942000     -0.9642000     0.8070000 
1 1 1 8  55 9  o 1.839000  0.5078000     1.986000  0.7340000     1.691000  0.7021000     0.2949000      1.016000  
1 1 1 8  55 10 o 1.987000  0.5806000     2.443000  0.8970000     1.531000  0.7374000     0.9120000      1.161000  
1 1 1 8  55 11 o 1.708000  0.5217000     1.476000  0.6915000     1.940000  0.7814000     -0.4639000     1.043000  
1 1 1 8  55 12 o 1.670000  0.4720000     1.292000  0.5979000     2.048000  0.7306000     -0.7556000     0.9441000 
1 1 1 8  55 13 o 1.378000  0.4332000     1.627000  0.6773000     1.130000  0.5403000     0.4970000      0.8664000 
1 1 1 8  55 14 o 1.486000  0.4674000     1.368000  0.6173000     1.603000  0.7021000     -0.2344000     0.9349000 
1 1 1 8  55 15 o 1.695000  0.4891000     1.967000  0.7315000     1.422000  0.6494000     0.5454000      0.9781000 
1 1 1 8  56 0  o 4.129000  0.5074000     4.129000  0.5074000     4.129000  0.5074000     0.000000       0.000000  
1 1 1 8  56 1  o 3.135000  0.4463000     2.813000  0.6842000     3.457000  0.5731000     -0.6441000     0.8925000 
1 1 1 8  56 2  o 8.333000  0.2259000     8.654000  0.3141000     8.013000  0.3246000     0.6414000      0.4517000 
1 1 1 8  56 3  o 8.708000  0.2228000     8.622000  0.3153000     8.794000  0.3148000     -0.1721000     0.4455000 
1 1 1 8  56 4  o 3.015000  0.4622000     2.768000  0.6863000     3.263000  0.6194000     -0.4941000     0.9245000 
1 1 1 8  56 5  o 4.346000  0.3395000     4.494000  0.4544000     4.197000  0.5046000     0.2972000      0.6791000 
1 1 1 8  56 6  o 3.822000  0.3932000     4.326000  0.4779000     3.319000  0.6245000     1.007000       0.7864000 
1 1 1 8  56 7  f 1.420000  0.4493000     1.586000  0.6785000     1.253000  0.5891000     0.3332000      0.8986000 
1 1 1 8  56 8  o 2.986000  0.4755000     3.041000  0.6621000     2.931000  0.6826000     0.1102000      0.9510000 
1 1 1 8  56 9  o 2.002000  0.6050000     2.207000  0.8848000     1.798000  0.8255000     0.4096000      1.210000  
1 1 1 8  56 10 o 1.712000  0.5312000     1.709000  0.7542000     1.715000  0.7482000     -0.5971000E-02 1.062000  
1 1 1 8  56 11 o 3.970000  0.3816000     3.947000  0.5466000     3.994000  0.5328000     -0.4763000E-01 0.7633000 
1 1 1 8  56 12 o 3.142000  0.4621000     2.973000  0.6853000     3.310000  0.6202000     -0.3372000     0.9243000 
1 1 1 8  56 13 o 1.850000  0.4994000     2.009000  0.7248000     1.691000  0.6873000     0.3179000      0.9988000 
1 1 1 8  56 14 o 1.176000  0.3990000     0.9959000 0.4923000     1.356000  0.6280000     -0.3597000     0.7980000 
1 1 1 8  57 0  o 0.9827000 0.6591000     0.9827000 0.6591000     0.9827000 0.6591000     -0.000000      0.000000  
1 1 1 8  57 1  o 3.838000  0.3770000     3.749000  0.5382000     3.928000  0.5281000     -0.1795000     0.7540000 
1 1 1 8  57 2  o 4.379000  0.3457000     4.338000  0.4992000     4.420000  0.4785000     -0.8101000E-01 0.6915000 
1 1 1 8  57 3  o 3.736000  0.3954000     3.355000  0.6167000     4.117000  0.4951000     -0.7615000     0.7908000 
1 1 1 8  57 4  o 3.288000  0.4366000     3.937000  0.5109000     2.639000  0.7080000     1.297000       0.8731000 
1 1 1 8  57 5  o 4.343000  0.3402000     4.225000  0.4857000     4.461000  0.4766000     -0.2363000     0.6805000 
1 1 1 8  57 6  o 1.412000  0.4489000     1.390000  0.6283000     1.435000  0.6413000     -0.4491000E-01 0.8978000 
1 1 1 8  57 7  o 2.462000  0.5533000     2.616000  0.8218000     2.307000  0.7410000     0.3090000      1.107000  
1 1 1 8  57 8  o 1.615000  0.7469000     1.615000  0.7469000     ?         ?             ?              ?         
1 1 1 8  57 9  o 1.583000  0.5134000     1.346000  0.6457000     1.820000  0.7985000     -0.4740000     1.027000  
1 1 1 8  57 10 o 3.851000  0.3865000     4.175000  0.5129000     3.527000  0.5783000     0.6485000      0.7729000 
1 1 1 8  57 11 o 2.253000  0.5014000     1.752000  0.7039000     2.753000  0.7142000     -1.001000      1.003000  
1 1 1 8  57 12 o 1.495000  0.4506000     1.785000  0.6981000     1.204000  0.5699000     0.5808000      0.9012000 
1 1 1 8  57 13 o 1.263000  0.4152000     1.399000  0.6292000     1.126000  0.5420000     0.2726000      0.8305000 
1 1 1 8  58 0  o 1.540000  0.8440000     1.540000  0.8440000     1.540000  0.8440000     0.000000       0.000000  
1 1 1 8  58 1  f 4.249000  0.3583000     3.698000  0.5563000     4.800000  0.4517000     -1.102000      0.7166000 
1 1 1 8  58 2  o 1.621000  0.4739000     1.392000  0.6274000     1.849000  0.7105000     -0.4566000     0.9479000 
1 1 1 8  58 3  o 3.843000  0.3789000     3.737000  0.5473000     3.949000  0.5243000     -0.2123000     0.7579000 
1 1 1 8  58 4  o 1.229000  0.4069000     1.185000  0.5603000     1.273000  0.5902000     -0.8762000E-01 0.8138000 
1 1 1 8  58 5  o 1.609000  0.4754000     1.782000  0.7016000     1.435000  0.6416000     0.3465000      0.9507000 
1 1 1 8  58 6  o 2.340000  0.5822000     2.324000  0.8769000     2.355000  0.7661000     -0.3095000E-01 1.164000  
1 1 1 8  58 7  o 3.341000  0.7329000     3.341000  0.7329000     ?         ?             ?              ?         
1 1 1 8  58 8  o 2.042000  0.5662000     2.168000  0.8487000     1.915000  0.7496000     0.2534000      1.132000  
1 1 1 8  58 9  o 4.729000  0.3395000     4.856000  0.4607000     4.603000  0.4988000     0.2529000      0.6790000 
1 1 1 8  58 10 o 2.348000  0.5268000     2.113000  0.7504000     2.583000  0.7397000     -0.4702000     1.054000  
1 1 1 8  58 11 o 3.290000  0.4486000     2.473000  0.7339000     4.108000  0.5162000     -1.636000      0.8973000 
1 1 1 8  58 12 o 1.678000  0.4741000     2.079000  0.7358000     1.278000  0.5980000     0.8012000      0.9482000 
1 1 1 8  58 13 o 1.774000  0.5018000     1.660000  0.6900000     1.888000  0.7288000     -0.2272000     1.004000  
1 1 1 8  59 0  o 4.945000  0.4415000     4.945000  0.4415000     4.945000  0.4415000     0.000000       0.000000  
1 1 1 8  59 1  o 2.407000  0.5174000     2.477000  0.7177000     2.337000  0.7454000     0.1395000      1.035000  
1 1 1 8  59 2  o 1.216000  0.4078000     1.249000  0.5878000     1.183000  0.5653000     0.6600000E-01  0.8155000 
1 1 1 8  59 3  o 1.970000  0.5170000     2.005000  0.7364000     1.935000  0.7258000     0.6928000E-01  1.034000  
1 1 1 8  59 4  o 2.184000  0.5818000     2.497000  0.8861000     1.870000  0.7543000     0.6272000      1.164000  
1 1 1 8  59 5  o 2.689000  0.9116000     2.689000  0.9116000     ?         ?             ?              ?         
1 1 1 8  59 6  o 5.294000  0.6317000     6.031000  0.5471000     4.558000  1.139000      1.474000       1.263000  
1 1 1 8  59 7  o 1.680000  0.5187000     1.948000  0.8193000     1.413000  0.6365000     0.5351000      1.037000  
1 1 1 8  59 8  o 1.223000  0.4107000     1.080000  0.5286000     1.366000  0.6288000     -0.2852000     0.8215000 
1 1 1 8  59 9  o 4.000000  0.3894000     3.849000  0.5626000     4.151000  0.5385000     -0.3015000     0.7787000 
1 1 1 8  59 10 o 5.519000  0.2991000     5.200000  0.4467000     5.838000  0.3980000     -0.6376000     0.5983000 
1 1 1 8  59 11 o 1.903000  0.5071000     1.830000  0.7089000     1.975000  0.7254000     -0.1446000     1.014000  
1 1 1 8  59 12 o 1.271000  0.4176000     1.353000  0.6151000     1.190000  0.5652000     0.1623000      0.8353000 
1 1 1 8  60 0  o 1.206000  0.8136000     1.206000  0.8136000     1.206000  0.8136000     0.000000       0.000000  
1 1 1 8  60 1  o 3.858000  0.5835000     3.875000  0.8046000     3.841000  0.8452000     0.3418000E-01  1.167000  
1 1 1 8  60 2  o 2.701000  0.6190000     3.562000  0.8722000     1.841000  0.8786000     1.722000       1.238000  
1 1 1 8  60 3  o 4.383000  0.7632000     4.383000  0.7632000     ?         ?             ?              ?         
1 1 1 8  60 4  o 3.521000  0.6901000     3.196000  0.8671000     3.846000  1.074000      -0.6505000     1.380000  
1 1 1 8  60 5  o 3.371000  0.5167000     2.881000  0.8739000     3.860000  0.5515000     -0.9785000     1.033000  
1 1 1 8  60 6  o 1.840000  0.5117000     1.805000  0.7118000     1.874000  0.7353000     -0.6920000E-01 1.023000  
1 1 1 8  60 7  o 1.866000  0.5073000     1.691000  0.6978000     2.040000  0.7367000     -0.3495000     1.015000  
1 1 1 8  60 8  o 2.318000  0.5191000     2.727000  0.7308000     1.908000  0.7372000     0.8191000      1.038000  
1 1 1 8  60 9  o 6.413000  0.2816000     6.775000  0.3768000     6.050000  0.4185000     0.7249000      0.5631000 
1 1 1 8  60 10 o 2.351000  0.5327000     2.289000  0.7520000     2.414000  0.7546000     -0.1250000     1.065000  
1 1 1 8  60 11 o 1.774000  0.4994000     1.990000  0.7413000     1.558000  0.6693000     0.4319000      0.9987000 
1 1 1 8  61 0  o 0.8432000 0.6077000     0.8432000 0.6077000     0.8432000 0.6077000     0.000000       0.000000  
1 1 1 8  61 1  o 2.013000  0.5874000     2.116000  0.8507000     1.911000  0.8102000     0.2055000      1.175000  
1 1 1 8  61 2  o 1.995000  0.5738000     2.063000  0.8413000     1.927000  0.7803000     0.1355000      1.148000  
1 1 1 8  61 3  o 6.161000  0.3044000     6.171000  0.4599000     6.150000  0.3988000     0.2097000E-01  0.6087000 
1 1 1 8  61 4  o 1.581000  0.4739000     1.347000  0.6196000     1.815000  0.7173000     -0.4684000     0.9478000 
1 1 1 8  61 5  o 2.302000  0.5312000     2.301000  0.7497000     2.303000  0.7526000     -0.1912000E-02 1.062000  
1 1 1 8  61 6  o 3.182000  0.4555000     3.289000  0.6244000     3.074000  0.6634000     0.2147000      0.9111000 
1 1 1 8  61 7  o 1.382000  0.4436000     1.331000  0.6114000     1.433000  0.6428000     -0.1026000     0.8871000 
1 1 1 8  61 8  o 2.728000  0.5211000     2.617000  0.7417000     2.839000  0.7321000     -0.2225000     1.042000  
1 1 1 8  61 9  o 2.655000  0.4847000     3.448000  0.6315000     1.863000  0.7355000     1.585000       0.9694000 
1 1 1 8  61 10 o 2.500000  0.5193000     2.205000  0.7573000     2.795000  0.7108000     -0.5895000     1.039000  
1 1 1 8  62 0  o 0.8482000 0.5928000     0.8482000 0.5928000     0.8482000 0.5928000     -0.000000      0.000000  
1 1 1 8  62 1  o 3.042000  0.4764000     2.702000  0.7200000     3.383000  0.6240000     -0.6807000     0.9528000 
1 1 1 8  62 2  o 4.785000  0.3323000     4.680000  0.4749000     4.890000  0.4649000     -0.2103000     0.6645000 
1 1 1 8  62 3  o 1.824000  0.4950000     1.495000  0.6572000     2.153000  0.7403000     -0.6578000     0.9899000 
1 1 1 8  62 4  o 3.123000  0.4799000     3.373000  0.6387000     2.874000  0.7164000     0.4991000      0.9598000 
1 1 1 8  62 5  o 2.530000  0.5103000     2.616000  0.7173000     2.445000  0.7261000     0.1710000      1.021000  
1 1 1 8  62 6  o 1.694000  0.4854000     1.493000  0.6524000     1.895000  0.7189000     -0.4019000     0.9708000 
1 1 1 8  62 7  o 1.477000  0.4617000     1.573000  0.6749000     1.381000  0.6302000     0.1921000      0.9234000 
1 1 1 8  62 8  o 1.462000  0.4561000     1.767000  0.7184000     1.156000  0.5623000     0.6107000      0.9123000 
1 1 1 8  62 9  o 2.187000  0.5285000     2.370000  0.7600000     2.004000  0.7347000     0.3658000      1.057000  
1 1 1 8  63 0  o 1.755000  0.8980000     1.755000  0.8980000     1.755000  0.8980000     0.000000       0.000000  
1 1 1 8  63 1  o 4.352000  0.3632000     4.579000  0.4899000     4.126000  0.5363000     0.4532000      0.7264000 
1 1 1 8  63 2  o 3.224000  0.4842000     3.106000  0.7005000     3.341000  0.6687000     -0.2350000     0.9684000 
1 1 1 8  63 3  o 5.836000  0.2890000     6.076000  0.3954000     5.597000  0.4217000     0.4781000      0.5780000 
1 1 1 8  63 4  o 2.121000  0.5073000     2.520000  0.7374000     1.722000  0.6970000     0.7982000      1.015000  
1 1 1 8  63 5  o 3.445000  0.4285000     3.547000  0.5803000     3.343000  0.6305000     0.2033000      0.8569000 
1 1 1 8  63 6  o 1.339000  0.4314000     1.160000  0.5556000     1.518000  0.6601000     -0.3584000     0.8627000 
1 1 1 8  63 7  o 2.195000  0.5071000     1.720000  0.7084000     2.670000  0.7257000     -0.9500000     1.014000  
1 1 1 8  63 8  o 1.570000  0.4672000     1.180000  0.5647000     1.961000  0.7444000     -0.7814000     0.9343000 
1 1 1 8  64 0  o 2.500000  0.8657000     2.500000  0.8657000     2.500000  0.8657000     -0.000000      0.000000  
1 1 1 8  64 1  o 2.715000  0.5214000     2.683000  0.7613000     2.748000  0.7126000     -0.6511000E-01 1.043000  
1 1 1 8  64 2  o 6.559000  0.2728000     6.576000  0.3778000     6.542000  0.3937000     0.3413000E-01  0.5457000 
1 1 1 8  64 3  o 5.610000  0.3048000     6.032000  0.4127000     5.188000  0.4487000     0.8433000      0.6096000 
1 1 1 8  64 4  o 5.832000  0.2922000     5.866000  0.4090000     5.798000  0.4173000     0.6805000E-01  0.5843000 
1 1 1 8  64 5  o 1.294000  0.4225000     1.459000  0.6471000     1.129000  0.5433000     0.3302000      0.8449000 
1 1 1 8  64 6  o 2.109000  0.5236000     2.312000  0.7485000     1.907000  0.7324000     0.4046000      1.047000  
1 1 1 8  64 7  f 1.167000  0.5966000     ?         ?             1.167000  0.5966000     ?              ?         
1 1 1 8  65 0  o 1.022000  0.6781000     1.022000  0.6781000     1.022000  0.6781000     0.000000       0.000000  
1 1 1 8  65 1  o 3.227000  0.4669000     3.813000  0.5903000     2.641000  0.7236000     1.172000       0.9338000 
1 1 1 8  65 2  o 1.845000  0.5017000     2.157000  0.7529000     1.533000  0.6631000     0.6241000      1.003000  
1 1 1 8  65 3  o 1.540000  0.4739000     1.724000  0.7125000     1.356000  0.6250000     0.3687000      0.9478000 
1 1 1 8  65 4  o 1.418000  0.4370000     0.9640000 0.4808000     1.872000  0.7300000     -0.9076000     0.8741000 
1 1 1 8  65 5  o 1.890000  0.5437000     1.917000  0.7720000     1.863000  0.7659000     0.5444000E-01  1.087000  
1 1 1 8  66 0  o 4.370000  0.5170000     4.370000  0.5170000     4.370000  0.5170000     0.000000       0.000000  
1 1 1 8  66 1  o 2.194000  0.5284000     2.069000  0.7477000     2.320000  0.7468000     -0.2506000     1.057000  
1 1 1 8  66 2  o 1.133000  0.4016000     1.209000  0.5997000     1.057000  0.5343000     0.1515000      0.8032000 
1 1 1 9  0  1  o 24.59000  0.3119000     24.59000  0.3119000     24.59000  0.3119000     0.000000       0.000000  
1 1 1 9  0  2  o 20.93000  0.2333000     20.93000  0.2333000     20.93000  0.2333000     -0.000000      0.000000  
1 1 1 9  0  3  o 14.48000  0.1741000     14.48000  0.1741000     14.48000  0.1741000     0.000000       0.000000  
1 1 1 9  0  4  o 12.50000  0.1642000     12.50000  0.1642000     12.50000  0.1642000     -0.000000      0.000000  
1 1 1 9  0  5  o 15.18000  0.2226000     15.18000  0.2226000     15.18000  0.2226000     0.000000       0.000000  
1 1 1 9  0  6  o 2.269000  0.4455000     2.269000  0.4455000     2.269000  0.4455000     -0.000000      0.000000  
1 1 1 9  0  7  o 3.175000  0.3016000     3.175000  0.3016000     3.175000  0.3016000     -0.000000      0.000000  
1 1 1 9  0  8  o 8.593000  0.1945000     8.593000  0.1945000     8.593000  0.1945000     0.000000       0.000000  
1 1 1 9  0  9  o 5.402000  0.2577000     5.402000  0.2577000     5.402000  0.2577000     0.000000       0.000000  
1 1 1 9  0  10 o 8.111000  0.3244000     8.111000  0.3244000     8.111000  0.3244000     0.000000       0.000000  
1 1 1 9  0  11 o 9.542000  0.3547000     9.542000  0.3547000     9.542000  0.3547000     0.000000       0.000000  
1 1 1 9  0  12 o 7.754000  0.2850000     7.754000  0.2850000     7.754000  0.2850000     -0.000000      0.000000  
1 1 1 9  0  13 o 2.444000  0.8442000     2.444000  0.8442000     2.444000  0.8442000     -0.000000      0.000000  
1 1 1 9  0  14 o 12.21000  0.2782000     12.21000  0.2782000     12.21000  0.2782000     -0.000000      0.000000  
1 1 1 9  0  15 o 6.468000  0.5783000     6.468000  0.5783000     6.468000  0.5783000     0.000000       0.000000  
1 1 1 9  0  16 o 1.800000  1.078000      1.800000  1.078000      1.800000  1.078000      0.000000       0.000000  
1 1 1 9  0  17 f 1.784000  1.039000      1.784000  1.039000      1.784000  1.039000      0.000000       0.000000  
1 1 1 9  0  18 o 4.924000  0.7123000     4.924000  0.7123000     4.924000  0.7123000     -0.000000      0.000000  
1 1 1 9  0  19 o 4.790000  0.7858000     4.790000  0.7858000     4.790000  0.7858000     0.000000       0.000000  
1 1 1 9  0  20 o 2.805000  1.386000      2.805000  1.386000      2.805000  1.386000      0.000000       0.000000  
1 1 1 9  0  21 o 1.754000  1.115000      1.754000  1.115000      1.754000  1.115000      -0.000000      0.000000  
1 1 1 9  0  22 o 3.182000  0.9968000     3.182000  0.9968000     3.182000  0.9968000     0.000000       0.000000  
1 1 1 9  0  23 o 2.984000  0.9036000     2.984000  0.9036000     2.984000  0.9036000     0.000000       0.000000  
1 1 1 9  0  24 o 0.7998000 0.5745000     0.7998000 0.5745000     0.7998000 0.5745000     0.000000       0.000000  
1 1 1 9  0  25 o 1.472000  0.9292000     1.472000  0.9292000     1.472000  0.9292000     -0.000000      0.000000  
1 1 1 9  0  26 o 1.392000  0.8617000     1.392000  0.8617000     1.392000  0.8617000     0.000000       0.000000  
1 1 1 9  0  27 o 0.9684000 0.6745000     0.9684000 0.6745000     0.9684000 0.6745000     0.000000       0.000000  
1 1 1 9  1  0  o 2.202000  0.1671000     2.202000  0.1671000     2.202000  0.1671000     0.000000       0.000000  
1 1 1 9  1  1  o 30.19000  0.3018000     29.90000  0.3782000     30.49000  0.4703000     -0.5917000     0.6035000 
1 1 1 9  1  2  o 36.48000  0.2817000     36.26000  0.3959000     36.70000  0.4008000     -0.4427000     0.5634000 
1 1 1 9  1  3  o 39.62000  0.3068000     39.46000  0.4321000     39.78000  0.4356000     -0.3204000     0.6136000 
1 1 1 9  1  4  o 33.22000  0.2605000     33.32000  0.3694000     33.13000  0.3674000     0.1844000      0.5210000 
1 1 1 9  1  5  o 21.60000  0.2060000     21.55000  0.2908000     21.64000  0.2918000     -0.9316000E-01 0.4120000 
1 1 1 9  1  6  o 43.78000  0.3958000     43.59000  0.5574000     43.96000  0.5621000     -0.3738000     0.7916000 
1 1 1 9  1  7  o 10.57000  0.1289000     10.35000  0.1821000     10.78000  0.1824000     -0.4322000     0.2577000 
1 1 1 9  1  8  o 16.80000  0.1605000     17.02000  0.2284000     16.57000  0.2256000     0.4543000      0.3210000 
1 1 1 9  1  9  o 8.663000  0.1489000     8.723000  0.2101000     8.602000  0.2110000     0.1207000      0.2977000 
1 1 1 9  1  10 o 7.338000  0.2452000     7.451000  0.3474000     7.226000  0.3462000     0.2250000      0.4904000 
1 1 1 9  1  11 o 7.515000  0.2736000     7.689000  0.3866000     7.341000  0.3872000     0.3484000      0.5471000 
1 1 1 9  1  12 o 7.315000  0.2090000     7.473000  0.2913000     7.157000  0.2998000     0.3156000      0.4180000 
1 1 1 9  1  13 f 13.06000  0.1883000     12.91000  0.2666000     13.22000  0.2661000     -0.3050000     0.3766000 
1 1 1 9  1  14 o 2.288000  0.4901000     1.628000  0.6895000     2.948000  0.6968000     -1.321000      0.9802000 
1 1 1 9  1  15 o 14.68000  0.2932000     14.93000  0.4134000     14.42000  0.4160000     0.5121000      0.5864000 
1 1 1 9  1  16 o 6.007000  0.4823000     6.154000  0.6858000     5.859000  0.6784000     0.2957000      0.9646000 
1 1 1 9  1  17 o 2.818000  0.6728000     2.820000  0.9573000     2.816000  0.9456000     0.3971000E-02  1.346000  
1 1 1 9  1  18 f 3.867000  0.5818000     4.423000  0.7345000     3.311000  0.9025000     1.112000       1.164000  
1 1 1 9  1  19 o 1.727000  0.5594000     2.055000  0.8838000     1.399000  0.6860000     0.6563000      1.119000  
1 1 1 9  1  20 o 3.011000  0.7954000     2.799000  1.107000      3.223000  1.143000      -0.4233000     1.591000  
1 1 1 9  1  21 o 2.468000  0.7374000     2.783000  1.105000      2.154000  0.9764000     0.6288000      1.475000  
1 1 1 9  1  22 o 3.370000  0.6104000     3.674000  0.8185000     3.066000  0.9058000     0.6078000      1.221000  
1 1 1 9  1  23 o 1.380000  0.4548000     1.163000  0.5688000     1.598000  0.7098000     -0.4352000     0.9096000 
1 1 1 9  1  24 o 2.043000  0.5063000     2.734000  0.7844000     1.352000  0.6403000     1.382000       1.013000  
1 1 1 9  1  25 o 1.668000  0.5424000     1.566000  0.7396000     1.771000  0.7935000     -0.2053000     1.085000  
1 1 1 9  1  26 o 1.797000  0.5454000     1.871000  0.7859000     1.724000  0.7563000     0.1472000      1.091000  
1 1 1 9  1  27 o 1.341000  0.4515000     1.420000  0.6628000     1.262000  0.6133000     0.1579000      0.9030000 
1 1 1 9  2  0  o 50.77000  0.7810000     50.77000  0.7810000     50.77000  0.7810000     0.000000       0.000000  
1 1 1 9  2  1  o 8.881000  0.1013000     9.233000  0.1586000     8.528000  0.1259000     0.7044000      0.2025000 
1 1 1 9  2  2  o 17.43000  0.1449000     17.48000  0.1768000     17.38000  0.2295000     0.9782000E-01  0.2897000 
1 1 1 9  2  3  o 9.526000  0.9518000E-01 9.553000  0.1348000     9.498000  0.1345000     0.5418000E-01  0.1904000 
1 1 1 9  2  4  o 20.99000  0.1716000     20.80000  0.2407000     21.18000  0.2446000     -0.3818000     0.3431000 
1 1 1 9  2  5  o 10.72000  0.1310000     10.72000  0.1852000     10.71000  0.1853000     0.1074000E-01  0.2619000 
1 1 1 9  2  6  o 34.20000  0.3137000     33.86000  0.4395000     34.53000  0.4479000     -0.6741000     0.6275000 
1 1 1 9  2  7  o 29.31000  0.2383000     29.32000  0.3372000     29.31000  0.3369000     0.1649000E-01  0.4767000 
1 1 1 9  2  8  o 16.12000  0.1567000     16.12000  0.2221000     16.11000  0.2213000     0.1272000E-01  0.3135000 
1 1 1 9  2  9  o 3.622000  0.2491000     3.404000  0.3764000     3.840000  0.3265000     -0.4361000     0.4983000 
1 1 1 9  2  10 o 7.584000  0.2367000     7.385000  0.3341000     7.783000  0.3353000     -0.3979000     0.4733000 
1 1 1 9  2  11 o 10.90000  0.2453000     11.28000  0.3442000     10.51000  0.3495000     0.7628000      0.4906000 
1 1 1 9  2  12 o 2.314000  0.4788000     2.048000  0.6942000     2.581000  0.6597000     -0.5330000     0.9576000 
1 1 1 9  2  13 o 5.547000  0.2716000     5.324000  0.3958000     5.770000  0.3720000     -0.4457000     0.5431000 
1 1 1 9  2  14 f 9.219000  0.2126000     8.909000  0.3014000     9.529000  0.3000000     -0.6207000     0.4253000 
1 1 1 9  2  15 o 8.275000  0.3398000     7.908000  0.4963000     8.642000  0.4642000     -0.7339000     0.6796000 
1 1 1 9  2  16 o 4.446000  0.6244000     5.256000  0.7580000     3.637000  0.9924000     1.619000       1.249000  
1 1 1 9  2  17 o 7.345000  0.3615000     7.198000  0.5142000     7.493000  0.5082000     -0.2949000     0.7229000 
1 1 1 9  2  18 o 8.330000  0.3119000     8.118000  0.4478000     8.542000  0.4344000     -0.4239000     0.6239000 
1 1 1 9  2  19 o 2.137000  0.6146000     1.624000  0.7654000     2.649000  0.9618000     -1.025000      1.229000  
1 1 1 9  2  20 o 3.556000  0.6523000     5.228000  0.9505000     1.883000  0.8935000     3.344000       1.305000  
1 1 1 9  2  21 o 1.981000  0.6357000     1.813000  0.8617000     2.149000  0.9350000     -0.3359000     1.271000  
1 1 1 9  2  22 o 2.209000  0.6062000     2.538000  0.8970000     1.880000  0.8156000     0.6580000      1.212000  
1 1 1 9  2  23 o 2.520000  0.5681000     2.785000  0.7955000     2.255000  0.8111000     0.5301000      1.136000  
1 1 1 9  2  24 o 1.368000  0.4524000     1.404000  0.6523000     1.332000  0.6271000     0.7246000E-01  0.9049000 
1 1 1 9  2  25 o 1.504000  0.4924000     1.791000  0.7738000     1.217000  0.6091000     0.5736000      0.9847000 
1 1 1 9  2  26 o 1.530000  0.4954000     1.592000  0.7128000     1.468000  0.6882000     0.1237000      0.9908000 
1 1 1 9  2  27 o 1.344000  0.4532000     1.495000  0.6911000     1.193000  0.5866000     0.3015000      0.9065000 
1 1 1 9  3  0  o 31.59000  0.3445000     31.59000  0.3445000     31.59000  0.3445000     -0.000000      0.000000  
1 1 1 9  3  1  o 26.67000  0.2233000     26.38000  0.2893000     26.97000  0.3403000     -0.5935000     0.4466000 
1 1 1 9  3  2  o 10.56000  0.1091000     10.40000  0.1503000     10.72000  0.1582000     -0.3216000     0.2182000 
1 1 1 9  3  3  o 49.02000  0.3913000     48.88000  0.4764000     49.16000  0.6208000     -0.2772000     0.7825000 
1 1 1 9  3  4  o 19.85000  0.1640000     19.67000  0.2303000     20.03000  0.2335000     -0.3571000     0.3280000 
1 1 1 9  3  5  o 5.952000  0.1162000     5.808000  0.1665000     6.096000  0.1622000     -0.2873000     0.2324000 
1 1 1 9  3  6  o 11.18000  0.1345000     11.12000  0.1752000     11.25000  0.2040000     -0.1323000     0.2689000 
1 1 1 9  3  7  o 9.141000  0.1281000     8.895000  0.1815000     9.388000  0.1808000     -0.4932000     0.2562000 
1 1 1 9  3  8  o 6.329000  0.1518000     6.255000  0.2170000     6.402000  0.2123000     -0.1463000     0.3036000 
1 1 1 9  3  9  o 8.185000  0.1551000     8.171000  0.2200000     8.200000  0.2186000     -0.2883000E-01 0.3102000 
1 1 1 9  3  10 o 8.300000  0.1967000     8.304000  0.2788000     8.297000  0.2777000     0.7410000E-02  0.3935000 
1 1 1 9  3  11 o 4.661000  0.3089000     4.953000  0.4021000     4.368000  0.4691000     0.5848000      0.6178000 
1 1 1 9  3  12 o 1.729000  0.4654000     2.056000  0.6954000     1.401000  0.6188000     0.6550000      0.9309000 
1 1 1 9  3  13 o 9.252000  0.2006000     9.288000  0.2820000     9.217000  0.2855000     0.7084000E-01  0.4013000 
1 1 1 9  3  14 o 9.852000  0.2114000     9.803000  0.3004000     9.902000  0.2975000     -0.9821000E-01 0.4228000 
1 1 1 9  3  15 o 2.023000  0.6086000     1.976000  0.8504000     2.069000  0.8709000     -0.9323000E-01 1.217000  
1 1 1 9  3  16 o 6.244000  0.4685000     6.702000  0.6147000     5.786000  0.7071000     0.9156000      0.9369000 
1 1 1 9  3  17 o 2.899000  0.5870000     4.008000  0.8496000     1.790000  0.8103000     2.218000       1.174000  
1 1 1 9  3  18 o 7.091000  0.3537000     6.294000  0.5370000     7.889000  0.4604000     -1.595000      0.7073000 
1 1 1 9  3  19 o 4.911000  0.5178000     4.735000  0.7475000     5.088000  0.7168000     -0.3530000     1.036000  
1 1 1 9  3  20 o 3.150000  0.7995000     2.662000  1.089000      3.638000  1.171000      -0.9759000     1.599000  
1 1 1 9  3  21 o 2.213000  0.6732000     2.514000  1.014000      1.911000  0.8852000     0.6039000      1.346000  
1 1 1 9  3  22 o 1.966000  0.5911000     1.838000  0.8085000     2.093000  0.8627000     -0.2548000     1.182000  
1 1 1 9  3  23 o 1.910000  0.5513000     1.903000  0.7731000     1.917000  0.7860000     -0.1373000E-01 1.103000  
1 1 1 9  3  24 o 1.421000  0.4523000     1.046000  0.5223000     1.796000  0.7385000     -0.7500000     0.9046000 
1 1 1 9  3  25 o 1.758000  0.5462000     1.247000  0.6101000     2.269000  0.9062000     -1.022000      1.092000  
1 1 1 9  3  26 o 1.500000  0.4910000     1.285000  0.6234000     1.716000  0.7588000     -0.4312000     0.9821000 
1 1 1 9  3  27 o 1.469000  0.4709000     1.050000  0.5244000     1.888000  0.7824000     -0.8376000     0.9419000 
1 1 1 9  4  0  o 24.84000  0.2727000     24.84000  0.2727000     24.84000  0.2727000     0.000000       0.000000  
1 1 1 9  4  1  o 7.930000  0.7431000E-01 7.937000  0.1048000     7.922000  0.1053000     0.1434000E-01  0.1486000 
1 1 1 9  4  2  o 28.59000  0.2226000     28.56000  0.3144000     28.62000  0.3151000     -0.5692000E-01 0.4452000 
1 1 1 9  4  3  o 9.275000  0.1244000     9.241000  0.1556000     9.310000  0.1940000     -0.6924000E-01 0.2487000 
1 1 1 9  4  4  o 17.18000  0.1509000     17.36000  0.1846000     16.99000  0.2389000     0.3726000      0.3019000 
1 1 1 9  4  5  f 22.98000  0.1888000     22.87000  0.2660000     23.09000  0.2681000     -0.2176000     0.3777000 
1 1 1 9  4  6  o 31.22000  0.2500000     31.29000  0.3540000     31.16000  0.3530000     0.1327000      0.4999000 
1 1 1 9  4  7  o 20.43000  0.1783000     20.37000  0.2517000     20.50000  0.2527000     -0.1267000     0.3567000 
1 1 1 9  4  8  o 11.55000  0.1382000     11.54000  0.1962000     11.57000  0.1947000     -0.2460000E-01 0.2764000 
1 1 1 9  4  9  o 11.78000  0.1514000     11.90000  0.2154000     11.66000  0.2129000     0.2365000      0.3028000 
1 1 1 9  4  10 o 5.672000  0.2417000     5.814000  0.3371000     5.529000  0.3464000     0.2849000      0.4834000 
1 1 1 9  4  11 o 8.456000  0.2203000     8.717000  0.3036000     8.196000  0.3193000     0.5207000      0.4405000 
1 1 1 9  4  12 o 10.65000  0.1836000     10.63000  0.2568000     10.67000  0.2625000     -0.3357000E-01 0.3673000 
1 1 1 9  4  13 o 2.542000  0.4816000     3.175000  0.6287000     1.908000  0.7297000     1.267000       0.9631000 
1 1 1 9  4  14 o 3.938000  0.4034000     4.217000  0.5194000     3.659000  0.6175000     0.5580000      0.8069000 
1 1 1 9  4  15 o 5.948000  0.4593000     6.503000  0.5702000     5.392000  0.7202000     1.111000       0.9186000 
1 1 1 9  4  16 f 7.670000  0.4070000     8.064000  0.5483000     7.275000  0.6015000     0.7895000      0.8139000 
1 1 1 9  4  17 o 2.891000  0.6864000     3.021000  0.9802000     2.761000  0.9613000     0.2608000      1.373000  
1 1 1 9  4  18 o 6.546000  0.3793000     6.177000  0.5636000     6.915000  0.5077000     -0.7380000     0.7585000 
1 1 1 9  4  19 o 5.823000  0.4413000     5.699000  0.6413000     5.948000  0.6065000     -0.2485000     0.8826000 
1 1 1 9  4  20 o 6.111000  0.5103000     5.899000  0.7474000     6.322000  0.6951000     -0.4234000     1.021000  
1 1 1 9  4  21 o 2.553000  0.7091000     2.125000  0.9493000     2.981000  1.054000      -0.8551000     1.418000  
1 1 1 9  4  22 o 2.491000  0.6276000     2.242000  0.8790000     2.740000  0.8960000     -0.4980000     1.255000  
1 1 1 9  4  23 o 2.580000  0.5761000     2.830000  0.8108000     2.329000  0.8186000     0.5013000      1.152000  
1 1 1 9  4  24 o 1.582000  0.4969000     1.748000  0.7456000     1.415000  0.6572000     0.3323000      0.9939000 
1 1 1 9  4  25 o 1.405000  0.4718000     1.375000  0.6589000     1.435000  0.6754000     -0.6022000E-01 0.9436000 
1 1 1 9  4  26 o 1.338000  0.4519000     1.176000  0.5788000     1.499000  0.6942000     -0.3228000     0.9039000 
1 1 1 9  4  27 o 1.284000  0.4386000     1.115000  0.5543000     1.453000  0.6799000     -0.3381000     0.8772000 
1 1 1 9  5  0  o 23.92000  0.2640000     23.92000  0.2640000     23.92000  0.2640000     0.000000       0.000000  
1 1 1 9  5  1  o 12.42000  0.1044000     12.27000  0.1459000     12.58000  0.1493000     -0.3060000     0.2088000 
1 1 1 9  5  2  o 18.05000  0.1455000     18.13000  0.2068000     17.97000  0.2049000     0.1659000      0.2911000 
1 1 1 9  5  3  o 37.55000  0.3021000     37.90000  0.4813000     37.19000  0.3654000     0.7088000      0.6043000 
1 1 1 9  5  4  o 19.58000  0.1857000     19.76000  0.2631000     19.41000  0.2623000     0.3461000      0.3715000 
1 1 1 9  5  5  f 32.54000  0.3170000     32.44000  0.3631000     32.65000  0.5197000     -0.2112000     0.6340000 
1 1 1 9  5  6  o 33.87000  0.2693000     34.03000  0.3826000     33.70000  0.3792000     0.3338000      0.5387000 
1 1 1 9  5  7  o 9.209000  0.1291000     9.128000  0.1822000     9.290000  0.1830000     -0.1617000     0.2582000 
1 1 1 9  5  8  f 25.85000  0.2175000     25.89000  0.3079000     25.82000  0.3072000     0.7118000E-01  0.4349000 
1 1 1 9  5  9  o 6.178000  0.1767000     6.202000  0.2520000     6.154000  0.2477000     0.4740000E-01  0.3533000 
1 1 1 9  5  10 o 7.847000  0.2015000     7.920000  0.2885000     7.774000  0.2813000     0.1455000      0.4029000 
1 1 1 9  5  11 o 6.762000  0.2429000     6.655000  0.3457000     6.870000  0.3414000     -0.2143000     0.4859000 
1 1 1 9  5  12 o 4.368000  0.3117000     4.642000  0.4184000     4.094000  0.4620000     0.5476000      0.6233000 
1 1 1 9  5  13 o 12.18000  0.1920000     12.38000  0.2717000     11.98000  0.2713000     0.3999000      0.3840000 
1 1 1 9  5  14 o 10.76000  0.2075000     10.52000  0.2942000     11.00000  0.2926000     -0.4768000     0.4149000 
1 1 1 9  5  15 o 18.08000  0.2804000     17.78000  0.3609000     18.38000  0.4292000     -0.5996000     0.5608000 
1 1 1 9  5  16 o 6.211000  0.4970000     6.649000  0.6602000     5.772000  0.7430000     0.8777000      0.9939000 
1 1 1 9  5  17 o 12.27000  0.2764000     12.21000  0.3890000     12.33000  0.3926000     -0.1245000     0.5527000 
1 1 1 9  5  18 o 3.579000  0.6318000     3.059000  0.9350000     4.100000  0.8501000     -1.041000      1.264000  
1 1 1 9  5  19 o 2.201000  0.6316000     1.744000  0.8056000     2.659000  0.9731000     -0.9143000     1.263000  
1 1 1 9  5  20 o 3.518000  0.7518000     3.856000  1.033000      3.181000  1.092000      0.6755000      1.504000  
1 1 1 9  5  21 o 1.892000  0.6106000     2.262000  0.9658000     1.522000  0.7475000     0.7396000      1.221000  
1 1 1 9  5  22 o 1.866000  0.5755000     2.015000  0.8472000     1.717000  0.7793000     0.2982000      1.151000  
1 1 1 9  5  23 o 1.527000  0.4850000     1.236000  0.5997000     1.819000  0.7623000     -0.5835000     0.9699000 
1 1 1 9  5  24 o 2.216000  0.5106000     3.017000  0.7796000     1.416000  0.6595000     1.601000       1.021000  
1 1 1 9  5  25 o 1.055000  0.3731000     0.9846000 0.4970000     1.126000  0.5566000     -0.1411000     0.7462000 
1 1 1 9  5  26 o 1.507000  0.4924000     1.481000  0.6920000     1.533000  0.7008000     -0.5139000E-01 0.9849000 
1 1 1 9  5  27 o 1.052000  0.3727000     0.9476000 0.4803000     1.156000  0.5700000     -0.2080000     0.7454000 
1 1 1 9  6  0  f 28.66000  0.3151000     28.66000  0.3151000     28.66000  0.3151000     -0.000000      0.000000  
1 1 1 9  6  1  o 11.95000  0.1025000     11.89000  0.1443000     12.01000  0.1458000     -0.1243000     0.2051000 
1 1 1 9  6  2  o 20.51000  0.1640000     20.47000  0.2317000     20.54000  0.2322000     -0.6997000E-01 0.3281000 
1 1 1 9  6  3  o 8.095000  0.9459000E-01 8.098000  0.1423000     8.092000  0.1247000     0.5851000E-02  0.1892000 
1 1 1 9  6  4  o 54.19000  0.5423000     54.77000  0.8471000     53.60000  0.6773000     1.161000       1.085000  
1 1 1 9  6  5  o 10.89000  0.1436000     10.87000  0.2190000     10.91000  0.1858000     -0.3760000E-01 0.2872000 
1 1 1 9  6  6  o 12.45000  0.1335000     12.62000  0.1589000     12.29000  0.2146000     0.3270000      0.2670000 
1 1 1 9  6  7  o 13.38000  0.1398000     13.53000  0.1992000     13.22000  0.1963000     0.3077000      0.2797000 
1 1 1 9  6  8  o 9.945000  0.1379000     9.954000  0.1968000     9.936000  0.1933000     0.1794000E-01  0.2758000 
1 1 1 9  6  9  o 13.08000  0.1549000     13.33000  0.2205000     12.84000  0.2177000     0.4862000      0.3098000 
1 1 1 9  6  10 o 2.989000  0.4081000     3.202000  0.5298000     2.777000  0.6208000     0.4252000      0.8161000 
1 1 1 9  6  11 o 4.452000  0.3100000     4.748000  0.3832000     4.155000  0.4873000     0.5926000      0.6199000 
1 1 1 9  6  12 o 7.489000  0.2111000     7.453000  0.2992000     7.525000  0.2979000     -0.7144000E-01 0.4222000 
1 1 1 9  6  13 o 7.609000  0.2242000     7.252000  0.3308000     7.965000  0.3026000     -0.7123000     0.4484000 
1 1 1 9  6  14 o 10.21000  0.2118000     10.62000  0.2933000     9.808000  0.3055000     0.8072000      0.4235000 
1 1 1 9  6  15 o 9.099000  0.2807000     8.903000  0.4048000     9.296000  0.3891000     -0.3938000     0.5615000 
1 1 1 9  6  16 o 6.139000  0.5024000     6.249000  0.7097000     6.028000  0.7113000     0.2213000      1.005000  
1 1 1 9  6  17 o 6.636000  0.3968000     7.216000  0.5226000     6.056000  0.5973000     1.161000       0.7936000 
1 1 1 9  6  18 o 5.186000  0.4726000     5.027000  0.6827000     5.345000  0.6538000     -0.3178000     0.9452000 
1 1 1 9  6  19 o 4.973000  0.5533000     6.125000  0.6005000     3.821000  0.9296000     2.304000       1.107000  
1 1 1 9  6  20 o 2.347000  0.6789000     2.826000  1.044000      1.869000  0.8685000     0.9563000      1.358000  
1 1 1 9  6  21 o 2.241000  0.6734000     1.893000  0.8755000     2.589000  1.023000      -0.6957000     1.347000  
1 1 1 9  6  22 o 1.874000  0.5775000     1.840000  0.8129000     1.909000  0.8205000     -0.6823000E-01 1.155000  
1 1 1 9  6  23 o 2.516000  0.5746000     2.843000  0.8047000     2.188000  0.8204000     0.6558000      1.149000  
1 1 1 9  6  24 o 1.834000  0.5345000     1.967000  0.7789000     1.701000  0.7320000     0.2654000      1.069000  
1 1 1 9  6  25 o 1.497000  0.4889000     1.573000  0.7072000     1.421000  0.6754000     0.1524000      0.9779000 
1 1 1 9  6  26 o 1.731000  0.5357000     1.777000  0.7646000     1.684000  0.7505000     0.9312000E-01  1.071000  
1 1 1 9  6  27 o 1.874000  0.5557000     1.849000  0.7792000     1.900000  0.7926000     -0.5158000E-01 1.111000  
1 1 1 9  7  0  o 35.66000  0.3904000     35.66000  0.3904000     35.66000  0.3904000     -0.000000      0.000000  
1 1 1 9  7  1  o 12.69000  0.1091000     12.62000  0.1536000     12.76000  0.1549000     -0.1477000     0.2181000 
1 1 1 9  7  2  o 14.59000  0.1235000     14.76000  0.1760000     14.43000  0.1732000     0.3315000      0.2469000 
1 1 1 9  7  3  o 7.356000  0.9350000E-01 7.393000  0.1233000     7.318000  0.1406000     0.7579000E-01  0.1870000 
1 1 1 9  7  4  o 28.59000  0.2910000     28.81000  0.3708000     28.38000  0.4486000     0.4326000      0.5820000 
1 1 1 9  7  5  o 9.568000  0.1958000     9.591000  0.3423000     9.545000  0.1904000     0.4589000E-01  0.3917000 
1 1 1 9  7  6  o 12.01000  0.1378000     11.92000  0.1730000     12.10000  0.2144000     -0.1809000     0.2755000 
1 1 1 9  7  7  o 4.373000  0.1689000     4.345000  0.1829000     4.402000  0.2839000     -0.5731000E-01 0.3377000 
1 1 1 9  7  8  o 11.43000  0.1420000     11.65000  0.2027000     11.21000  0.1989000     0.4334000      0.2840000 
1 1 1 9  7  9  o 1.725000  0.3914000     2.226000  0.5737000     1.223000  0.5326000     1.003000       0.7828000 
1 1 1 9  7  10 o 6.008000  0.2007000     5.855000  0.2906000     6.161000  0.2770000     -0.3052000     0.4015000 
1 1 1 9  7  11 o 2.706000  0.4389000     2.711000  0.6174000     2.701000  0.6240000     0.9505000E-02  0.8778000 
1 1 1 9  7  12 f 4.417000  0.3079000     3.990000  0.4711000     4.844000  0.3968000     -0.8540000     0.6159000 
1 1 1 9  7  13 o 12.37000  0.1913000     12.13000  0.2718000     12.60000  0.2693000     -0.4732000     0.3826000 
1 1 1 9  7  14 o 6.376000  0.2682000     6.263000  0.3843000     6.490000  0.3741000     -0.2263000     0.5363000 
1 1 1 9  7  15 o 12.09000  0.2538000     12.08000  0.3580000     12.09000  0.3600000     -0.1152000E-01 0.5077000 
1 1 1 9  7  16 o 7.311000  0.4003000     7.515000  0.6160000     7.107000  0.5113000     0.4076000      0.8006000 
1 1 1 9  7  17 o 7.118000  0.3857000     6.288000  0.6043000     7.948000  0.4794000     -1.661000      0.7713000 
1 1 1 9  7  18 o 6.401000  0.3911000     6.193000  0.5648000     6.608000  0.5411000     -0.4145000     0.7822000 
1 1 1 9  7  19 o 7.893000  0.3486000     8.083000  0.4718000     7.703000  0.5133000     0.3801000      0.6972000 
1 1 1 9  7  20 o 2.360000  0.6995000     2.414000  0.9946000     2.306000  0.9840000     0.1074000      1.399000  
1 1 1 9  7  21 o 2.687000  0.7217000     2.443000  0.9963000     2.930000  1.044000      -0.4872000     1.443000  
1 1 1 9  7  22 o 2.136000  0.5810000     2.666000  0.8937000     1.605000  0.7427000     1.061000       1.162000  
1 1 1 9  7  23 o 1.503000  0.4851000     1.503000  0.6899000     1.503000  0.6823000     0.6458000E-03  0.9703000 
1 1 1 9  7  24 o 1.652000  0.5076000     1.507000  0.6861000     1.798000  0.7484000     -0.2904000     1.015000  
1 1 1 9  7  25 o 1.924000  0.5527000     2.031000  0.7779000     1.818000  0.7852000     0.2129000      1.105000  
1 1 1 9  7  26 o 2.026000  0.5328000     2.682000  0.8413000     1.371000  0.6540000     1.311000       1.066000  
1 1 1 9  7  27 o 1.776000  0.5360000     1.924000  0.7921000     1.628000  0.7222000     0.2964000      1.072000  
1 1 1 9  8  0  o 11.46000  0.1453000     11.46000  0.1453000     11.46000  0.1453000     0.000000       0.000000  
1 1 1 9  8  1  o 8.800000  0.8899000E-01 8.790000  0.1253000     8.810000  0.1264000     -0.2057000E-01 0.1780000 
1 1 1 9  8  2  o 19.93000  0.1618000     19.69000  0.2263000     20.18000  0.2312000     -0.4883000     0.3235000 
1 1 1 9  8  3  o 12.07000  0.1200000     12.21000  0.1817000     11.93000  0.1569000     0.2844000      0.2400000 
1 1 1 9  8  4  o 20.61000  0.1828000     20.49000  0.2387000     20.74000  0.2769000     -0.2508000     0.3656000 
1 1 1 9  8  5  o 22.57000  0.2238000     22.56000  0.3812000     22.57000  0.2347000     -0.1160000E-01 0.4476000 
1 1 1 9  8  6  o 7.616000  0.1141000     7.717000  0.1606000     7.516000  0.1621000     0.2013000      0.2282000 
1 1 1 9  8  7  o 11.04000  0.1258000     11.03000  0.1762000     11.06000  0.1797000     -0.2739000E-01 0.2516000 
1 1 1 9  8  8  o 13.16000  0.1503000     13.05000  0.1763000     13.28000  0.2435000     -0.2332000     0.3007000 
1 1 1 9  8  9  o 9.542000  0.1576000     9.673000  0.2246000     9.412000  0.2212000     0.2618000      0.3153000 
1 1 1 9  8  10 o 5.349000  0.2357000     5.468000  0.3044000     5.231000  0.3599000     0.2368000      0.4714000 
1 1 1 9  8  11 o 5.390000  0.2395000     5.096000  0.3576000     5.685000  0.3188000     -0.5889000     0.4790000 
1 1 1 9  8  12 o 6.151000  0.2353000     6.092000  0.3321000     6.210000  0.3335000     -0.1179000     0.4706000 
1 1 1 9  8  13 o 3.744000  0.3908000     3.891000  0.5307000     3.597000  0.5738000     0.2946000      0.7816000 
1 1 1 9  8  14 o 15.87000  0.2029000     15.92000  0.2869000     15.82000  0.2870000     0.9970000E-01  0.4058000 
1 1 1 9  8  15 o 8.179000  0.2987000     8.180000  0.4250000     8.178000  0.4199000     0.1759000E-02  0.5974000 
1 1 1 9  8  16 o 5.683000  0.4756000     5.610000  0.7371000     5.755000  0.6011000     -0.1444000     0.9512000 
1 1 1 9  8  17 o 2.816000  0.6774000     3.055000  0.9588000     2.577000  0.9571000     0.4779000      1.355000  
1 1 1 9  8  18 o 4.446000  0.5539000     4.851000  0.6916000     4.040000  0.8654000     0.8118000      1.108000  
1 1 1 9  8  19 o 7.494000  0.3535000     7.686000  0.4892000     7.302000  0.5103000     0.3832000      0.7069000 
1 1 1 9  8  20 o 3.117000  0.7479000     2.687000  1.043000      3.546000  1.072000      -0.8597000     1.496000  
1 1 1 9  8  21 o 2.235000  0.6699000     2.285000  0.9441000     2.185000  0.9507000     0.1002000      1.340000  
1 1 1 9  8  22 o 2.205000  0.6031000     2.497000  0.8941000     1.913000  0.8095000     0.5843000      1.206000  
1 1 1 9  8  23 o 1.623000  0.5080000     1.589000  0.7111000     1.657000  0.7257000     -0.6837000E-01 1.016000  
1 1 1 9  8  24 o 1.726000  0.5144000     2.029000  0.7887000     1.422000  0.6607000     0.6063000      1.029000  
1 1 1 9  8  25 f 2.241000  0.5735000     2.397000  0.7952000     2.085000  0.8267000     0.3115000      1.147000  
1 1 1 9  8  26 o 1.482000  0.4828000     1.552000  0.7064000     1.412000  0.6583000     0.1395000      0.9656000 
1 1 1 9  8  27 o 1.626000  0.5100000     1.423000  0.6630000     1.830000  0.7752000     -0.4066000     1.020000  
1 1 1 9  9  0  o 0.5054000 0.3230000     0.5054000 0.3230000     0.5054000 0.3230000     -0.000000      0.000000  
1 1 1 9  9  1  o 8.711000  0.9109000E-01 8.772000  0.1289000     8.649000  0.1287000     0.1230000      0.1822000 
1 1 1 9  9  2  o 5.497000  0.8845000E-01 5.610000  0.1257000     5.383000  0.1245000     0.2274000      0.1769000 
1 1 1 9  9  3  o 13.77000  0.1504000     13.72000  0.2441000     13.81000  0.1759000     -0.8641000E-01 0.3009000 
1 1 1 9  9  4  f 23.09000  0.2435000     22.88000  0.3033000     23.30000  0.3810000     -0.4251000     0.4870000 
1 1 1 9  9  5  o 30.77000  0.2448000     30.38000  0.3420000     31.17000  0.3505000     -0.7889000     0.4897000 
1 1 1 9  9  6  o 9.116000  0.1525000     9.364000  0.2563000     8.868000  0.1651000     0.4966000      0.3049000 
1 1 1 9  9  7  o 19.43000  0.1715000     19.79000  0.2450000     19.07000  0.2399000     0.7202000      0.3429000 
1 1 1 9  9  8  o 5.841000  0.1424000     5.706000  0.2011000     5.976000  0.2016000     -0.2708000     0.2848000 
1 1 1 9  9  9  o 14.22000  0.1959000     14.17000  0.2143000     14.28000  0.3281000     -0.1021000     0.3919000 
1 1 1 9  9  10 o 4.908000  0.2719000     4.788000  0.3960000     5.028000  0.3726000     -0.2402000     0.5438000 
1 1 1 9  9  11 o 13.33000  0.1770000     13.29000  0.2509000     13.36000  0.2496000     -0.7278000E-01 0.3539000 
1 1 1 9  9  12 o 7.006000  0.2197000     7.061000  0.3125000     6.951000  0.3090000     0.1102000      0.4395000 
1 1 1 9  9  13 o 10.45000  0.1973000     10.68000  0.2754000     10.22000  0.2827000     0.4607000      0.3946000 
1 1 1 9  9  14 o 6.483000  0.2683000     6.290000  0.3850000     6.675000  0.3739000     -0.3845000     0.5367000 
1 1 1 9  9  15 o 8.610000  0.2517000     8.367000  0.3630000     8.853000  0.3488000     -0.4862000     0.5034000 
1 1 1 9  9  16 o 6.318000  0.3596000     6.457000  0.5209000     6.180000  0.4958000     0.2770000      0.7191000 
1 1 1 9  9  17 o 2.316000  0.6482000     2.579000  0.9405000     2.053000  0.8922000     0.5254000      1.296000  
1 1 1 9  9  18 o 13.41000  0.2528000     13.15000  0.3599000     13.67000  0.3551000     -0.5193000     0.5056000 
1 1 1 9  9  19 o 2.002000  0.6241000     2.022000  0.8867000     1.983000  0.8784000     0.3829000E-01  1.248000  
1 1 1 9  9  20 o 2.990000  0.6623000     4.051000  0.9998000     1.930000  0.8689000     2.121000       1.325000  
1 1 1 9  9  21 o 1.908000  0.5939000     1.523000  0.7297000     2.293000  0.9372000     -0.7705000     1.188000  
1 1 1 9  9  22 o 1.708000  0.5360000     1.752000  0.7728000     1.664000  0.7430000     0.8723000E-01  1.072000  
1 1 1 9  9  23 o 1.458000  0.4758000     1.566000  0.7068000     1.350000  0.6371000     0.2155000      0.9516000 
1 1 1 9  9  24 o 1.433000  0.4657000     1.240000  0.5961000     1.626000  0.7156000     -0.3865000     0.9314000 
1 1 1 9  9  25 o 1.365000  0.4575000     1.445000  0.6656000     1.284000  0.6279000     0.1608000      0.9150000 
1 1 1 9  9  26 o 1.870000  0.5421000     1.471000  0.6808000     2.269000  0.8437000     -0.7977000     1.084000  
1 1 1 9  9  27 o 1.219000  0.4190000     1.099000  0.5479000     1.339000  0.6341000     -0.2402000     0.8380000 
1 1 1 9  10 0  o 26.21000  0.2938000     26.21000  0.2938000     26.21000  0.2938000     0.000000       0.000000  
1 1 1 9  10 1  o 15.52000  0.1325000     15.64000  0.1884000     15.40000  0.1863000     0.2471000      0.2649000 
1 1 1 9  10 2  o 19.70000  0.1622000     19.94000  0.2320000     19.47000  0.2266000     0.4672000      0.3243000 
1 1 1 9  10 3  o 30.20000  0.3750000     30.37000  0.3391000     30.04000  0.6689000     0.3298000      0.7499000 
1 1 1 9  10 4  o 42.35000  0.4058000     42.62000  0.6658000     42.09000  0.4641000     0.5264000      0.8116000 
1 1 1 9  10 5  o 16.22000  0.1439000     16.29000  0.2046000     16.14000  0.2025000     0.1525000      0.2879000 
1 1 1 9  10 6  o 11.61000  0.1217000     11.49000  0.1721000     11.72000  0.1722000     -0.2313000     0.2434000 
1 1 1 9  10 7  o 1.616000  0.2993000     1.207000  0.4491000     2.026000  0.3957000     -0.8190000     0.5986000 
1 1 1 9  10 8  o 8.591000  0.1337000     8.478000  0.1876000     8.704000  0.1904000     -0.2265000     0.2673000 
1 1 1 9  10 9  o 7.606000  0.2040000     7.664000  0.2245000     7.549000  0.3408000     0.1150000      0.4081000 
1 1 1 9  10 10 o 16.67000  0.2287000     16.43000  0.2727000     16.91000  0.3672000     -0.4797000     0.4574000 
1 1 1 9  10 11 o 7.760000  0.2024000     7.538000  0.2252000     7.981000  0.3363000     -0.4430000     0.4047000 
1 1 1 9  10 12 f 10.86000  0.1879000     10.85000  0.2668000     10.86000  0.2646000     -0.7072000E-02 0.3758000 
1 1 1 9  10 13 o 9.689000  0.2039000     9.473000  0.2921000     9.905000  0.2845000     -0.4313000     0.4077000 
1 1 1 9  10 14 o 6.614000  0.2678000     6.874000  0.3643000     6.354000  0.3927000     0.5196000      0.5357000 
1 1 1 9  10 15 o 6.498000  0.3101000     7.151000  0.4045000     5.845000  0.4702000     1.306000       0.6202000 
1 1 1 9  10 16 o 5.103000  0.4331000     4.914000  0.6578000     5.293000  0.5635000     -0.3794000     0.8661000 
1 1 1 9  10 17 o 7.876000  0.3644000     8.651000  0.4782000     7.101000  0.5500000     1.549000       0.7288000 
1 1 1 9  10 18 o 3.601000  0.6300000     2.694000  0.9331000     4.508000  0.8468000     -1.814000      1.260000  
1 1 1 9  10 19 f 7.490000  0.3708000     7.730000  0.5168000     7.251000  0.5318000     0.4787000      0.7416000 
1 1 1 9  10 20 o 2.431000  0.6406000     3.147000  1.000000      1.715000  0.8006000     1.432000       1.281000  
1 1 1 9  10 21 o 3.800000  0.6158000     2.753000  0.9847000     4.847000  0.7398000     -2.095000      1.232000  
1 1 1 9  10 22 o 1.598000  0.5102000     1.793000  0.7726000     1.403000  0.6664000     0.3902000      1.020000  
1 1 1 9  10 23 o 1.511000  0.4840000     1.656000  0.7229000     1.365000  0.6437000     0.2907000      0.9679000 
1 1 1 9  10 24 o 1.667000  0.5161000     1.643000  0.7291000     1.692000  0.7305000     -0.4910000E-01 1.032000  
1 1 1 9  10 25 o 1.235000  0.4272000     1.321000  0.6333000     1.149000  0.5735000     0.1723000      0.8544000 
1 1 1 9  10 26 o 1.705000  0.5221000     1.916000  0.7848000     1.495000  0.6887000     0.4205000      1.044000  
1 1 1 9  10 27 o 0.9654000 0.3485000     0.9668000 0.4939000     0.9641000 0.4919000     0.2635000E-02  0.6970000 
1 1 1 9  11 0  o 8.685000  0.1347000     8.685000  0.1347000     8.685000  0.1347000     -0.000000      0.000000  
1 1 1 9  11 1  o 26.99000  0.2144000     27.07000  0.3041000     26.90000  0.3022000     0.1770000      0.4287000 
1 1 1 9  11 2  f 2.341000  0.1972000     2.524000  0.2766000     2.159000  0.2812000     0.3651000      0.3944000 
1 1 1 9  11 3  o 26.22000  0.2716000     26.67000  0.3493000     25.77000  0.4160000     0.9042000      0.5432000 
1 1 1 9  11 4  o 9.007000  0.1056000     9.028000  0.1498000     8.986000  0.1489000     0.4228000E-01  0.2112000 
1 1 1 9  11 5  o 6.443000  0.1060000     6.358000  0.1501000     6.529000  0.1496000     -0.1715000     0.2119000 
1 1 1 9  11 6  o 20.15000  0.1723000     20.08000  0.2432000     20.22000  0.2441000     -0.1414000     0.3446000 
1 1 1 9  11 7  o 2.894000  0.1986000     2.928000  0.3140000     2.860000  0.2434000     0.6789000E-01  0.3973000 
1 1 1 9  11 8  o 9.587000  0.1359000     9.721000  0.1907000     9.453000  0.1936000     0.2679000      0.2717000 
1 1 1 9  11 9  o 15.40000  0.2668000     15.71000  0.2574000     15.08000  0.4675000     0.6369000      0.5337000 
1 1 1 9  11 10 o 9.983000  0.2715000     9.987000  0.4968000     9.979000  0.2189000     0.7888000E-02  0.5429000 
1 1 1 9  11 11 o 4.384000  0.2296000     4.713000  0.3058000     4.054000  0.3426000     0.6587000      0.4592000 
1 1 1 9  11 12 o 5.786000  0.2572000     5.763000  0.2731000     5.809000  0.4359000     -0.4655000E-01 0.5144000 
1 1 1 9  11 13 o 7.487000  0.2321000     7.271000  0.3390000     7.703000  0.3171000     -0.4318000     0.4641000 
1 1 1 9  11 14 o 8.795000  0.2508000     8.201000  0.3876000     9.390000  0.3183000     -1.189000      0.5016000 
1 1 1 9  11 15 o 6.780000  0.3161000     6.480000  0.4262000     7.080000  0.4669000     -0.5998000     0.6322000 
1 1 1 9  11 16 o 7.891000  0.3056000     7.616000  0.4620000     8.165000  0.4003000     -0.5484000     0.6113000 
1 1 1 9  11 17 o 12.07000  0.2863000     12.08000  0.4044000     12.07000  0.4053000     0.1190000E-01  0.5726000 
1 1 1 9  11 18 o 5.842000  0.4599000     6.035000  0.5727000     5.649000  0.7198000     0.3857000      0.9199000 
1 1 1 9  11 19 o 3.219000  0.6814000     3.813000  0.9410000     2.625000  0.9859000     1.188000       1.363000  
1 1 1 9  11 20 o 6.826000  0.3954000     6.843000  0.5467000     6.808000  0.5714000     0.3510000E-01  0.7908000 
1 1 1 9  11 21 o 2.261000  0.6246000     1.735000  0.7993000     2.786000  0.9601000     -1.051000      1.249000  
1 1 1 9  11 22 f 1.506000  0.4833000     1.885000  0.7865000     1.128000  0.5620000     0.7571000      0.9667000 
1 1 1 9  11 23 o 1.747000  0.5141000     2.102000  0.7967000     1.392000  0.6498000     0.7101000      1.028000  
1 1 1 9  11 24 o 1.361000  0.4579000     1.336000  0.6386000     1.385000  0.6564000     -0.4935000E-01 0.9158000 
1 1 1 9  11 25 o 1.653000  0.5162000     1.175000  0.5784000     2.131000  0.8552000     -0.9561000     1.032000  
1 1 1 9  11 26 o 1.484000  0.4816000     1.585000  0.7109000     1.383000  0.6501000     0.2022000      0.9633000 
1 1 1 9  12 0  o 37.88000  0.5917000     37.88000  0.5917000     37.88000  0.5917000     0.000000       0.000000  
1 1 1 9  12 1  o 21.75000  0.3120000     21.20000  0.3474000     22.31000  0.5184000     -1.103000      0.6240000 
1 1 1 9  12 2  o 36.83000  0.4773000     36.21000  0.4636000     37.45000  0.8344000     -1.241000      0.9545000 
1 1 1 9  12 3  o 11.63000  0.1255000     11.70000  0.1923000     11.55000  0.1614000     0.1476000      0.2511000 
1 1 1 9  12 4  o 18.65000  0.1594000     18.92000  0.2284000     18.38000  0.2223000     0.5369000      0.3187000 
1 1 1 9  12 5  o 19.68000  0.1678000     19.40000  0.2346000     19.97000  0.2400000     -0.5768000     0.3356000 
1 1 1 9  12 6  o 1.156000  0.2903000     1.274000  0.4137000     1.038000  0.4073000     0.2366000      0.5805000 
1 1 1 9  12 7  o 10.22000  0.1223000     10.18000  0.1733000     10.26000  0.1725000     -0.7845000E-01 0.2446000 
1 1 1 9  12 8  o 3.058000  0.2191000     2.866000  0.3606000     3.249000  0.2488000     -0.3828000     0.4381000 
1 1 1 9  12 9  o 5.691000  0.2265000     5.419000  0.2353000     5.963000  0.3872000     -0.5442000     0.4531000 
1 1 1 9  12 10 o 7.018000  0.2404000     6.788000  0.4194000     7.249000  0.2352000     -0.4608000     0.4809000 
1 1 1 9  12 11 o 4.914000  0.2162000     5.064000  0.2850000     4.764000  0.3252000     0.2997000      0.4325000 
1 1 1 9  12 12 o 9.266000  0.1758000     9.433000  0.2449000     9.100000  0.2524000     0.3322000      0.3517000 
1 1 1 9  12 13 o 11.69000  0.2005000     11.61000  0.2235000     11.78000  0.3330000     -0.1688000     0.4010000 
1 1 1 9  12 14 o 5.130000  0.4000000     5.530000  0.5371000     4.730000  0.5928000     0.8006000      0.7999000 
1 1 1 9  12 15 o 7.784000  0.3083000     7.694000  0.4340000     7.874000  0.4379000     -0.1803000     0.6166000 
1 1 1 9  12 16 o 8.330000  0.3083000     8.529000  0.4564000     8.131000  0.4146000     0.3980000      0.6166000 
1 1 1 9  12 17 o 4.290000  0.5920000     2.727000  0.9765000     5.853000  0.6697000     -3.126000      1.184000  
1 1 1 9  12 18 o 3.089000  0.7019000     2.679000  0.9429000     3.499000  1.040000      -0.8202000     1.404000  
1 1 1 9  12 19 o 8.346000  0.3664000     9.048000  0.5274000     7.643000  0.5089000     1.405000       0.7329000 
1 1 1 9  12 20 o 4.160000  0.6626000     3.867000  0.9413000     4.452000  0.9329000     -0.5845000     1.325000  
1 1 1 9  12 21 o 2.041000  0.6149000     2.244000  0.9120000     1.837000  0.8249000     0.4073000      1.230000  
1 1 1 9  12 22 o 1.757000  0.5409000     1.741000  0.7599000     1.774000  0.7701000     -0.3248000E-01 1.082000  
1 1 1 9  12 23 o 1.831000  0.5328000     1.806000  0.7548000     1.856000  0.7521000     -0.5033000E-01 1.066000  
1 1 1 9  12 24 o 1.857000  0.5397000     1.439000  0.6717000     2.274000  0.8450000     -0.8343000     1.079000  
1 1 1 9  12 25 o 1.196000  0.4183000     1.090000  0.5437000     1.302000  0.6359000     -0.2120000     0.8366000 
1 1 1 9  12 26 o 1.278000  0.4354000     1.311000  0.6268000     1.244000  0.6046000     0.6715000E-01  0.8709000 
1 1 1 9  13 0  o 15.00000  0.2662000     15.00000  0.2662000     15.00000  0.2662000     -0.000000      0.000000  
1 1 1 9  13 1  o 20.30000  0.2171000     20.29000  0.3360000     20.31000  0.2749000     -0.2728000E-01 0.4341000 
1 1 1 9  13 2  o 14.07000  0.1387000     14.09000  0.2101000     14.05000  0.1811000     0.4679000E-01  0.2774000 
1 1 1 9  13 3  o 19.67000  0.1653000     19.68000  0.2337000     19.66000  0.2339000     0.2201000E-01  0.3306000 
1 1 1 9  13 4  o 12.69000  0.1240000     12.71000  0.1750000     12.68000  0.1756000     0.3018000E-01  0.2479000 
1 1 1 9  13 5  o 16.20000  0.1463000     16.07000  0.2060000     16.33000  0.2077000     -0.2601000     0.2925000 
1 1 1 9  13 6  o 22.27000  0.1878000     21.80000  0.2615000     22.73000  0.2696000     -0.9274000     0.3756000 
1 1 1 9  13 7  o 14.77000  0.1442000     14.81000  0.2037000     14.72000  0.2042000     0.9115000E-01  0.2884000 
1 1 1 9  13 8  o 10.81000  0.1336000     11.03000  0.1931000     10.59000  0.1846000     0.4402000      0.2671000 
1 1 1 9  13 9  o 10.68000  0.1571000     10.77000  0.2042000     10.59000  0.2389000     0.1750000      0.3143000 
1 1 1 9  13 10 o 4.521000  0.2147000     4.568000  0.2970000     4.474000  0.3100000     0.9355000E-01  0.4293000 
1 1 1 9  13 11 o 10.36000  0.1886000     10.35000  0.2265000     10.37000  0.3016000     -0.2024000E-01 0.3772000 
1 1 1 9  13 12 o 3.698000  0.2854000     3.583000  0.3925000     3.814000  0.4146000     -0.2315000     0.5709000 
1 1 1 9  13 13 f 2.442000  0.4314000     2.806000  0.5315000     2.078000  0.6797000     0.7283000      0.8628000 
1 1 1 9  13 14 o 19.32000  0.2667000     19.52000  0.2904000     19.12000  0.4473000     0.4014000      0.5333000 
1 1 1 9  13 15 o 8.014000  0.3855000     8.106000  0.5390000     7.922000  0.5512000     0.1841000      0.7709000 
1 1 1 9  13 16 o 6.385000  0.3720000     7.254000  0.5032000     5.517000  0.5481000     1.737000       0.7441000 
1 1 1 9  13 17 o 5.100000  0.5150000     5.312000  0.6870000     4.889000  0.7674000     0.4233000      1.030000  
1 1 1 9  13 18 o 4.202000  0.6201000     4.505000  0.7786000     3.898000  0.9653000     0.6065000      1.240000  
1 1 1 9  13 19 f 3.198000  0.7284000     3.784000  1.050000      2.612000  1.010000      1.172000       1.457000  
1 1 1 9  13 20 o 3.548000  0.6966000     2.889000  1.043000      4.208000  0.9243000     -1.319000      1.393000  
1 1 1 9  13 21 o 2.768000  0.5744000     1.736000  0.7918000     3.800000  0.8325000     -2.064000      1.149000  
1 1 1 9  13 22 o 1.890000  0.5621000     1.935000  0.8016000     1.844000  0.7883000     0.9024000E-01  1.124000  
1 1 1 9  13 23 o 1.384000  0.4571000     1.399000  0.6529000     1.368000  0.6397000     0.3168000E-01  0.9141000 
1 1 1 9  13 24 o 2.075000  0.5648000     1.670000  0.7452000     2.479000  0.8490000     -0.8093000     1.130000  
1 1 1 9  13 25 o 1.964000  0.5981000     1.998000  0.8672000     1.929000  0.8240000     0.6984000E-01  1.196000  
1 1 1 9  13 26 o 1.941000  0.5339000     2.446000  0.8313000     1.437000  0.6702000     1.009000       1.068000  
1 1 1 9  14 0  o 27.43000  0.3103000     27.43000  0.3103000     27.43000  0.3103000     -0.000000      0.000000  
1 1 1 9  14 1  o 3.635000  0.1233000     3.484000  0.1800000     3.786000  0.1685000     -0.3013000     0.2466000 
1 1 1 9  14 2  o 27.63000  0.2214000     27.31000  0.3095000     27.95000  0.3167000     -0.6442000     0.4429000 
1 1 1 9  14 3  o 13.57000  0.1277000     13.69000  0.1816000     13.44000  0.1797000     0.2532000      0.2555000 
1 1 1 9  14 4  o 9.130000  0.1102000     9.110000  0.1562000     9.150000  0.1556000     -0.4082000E-01 0.2205000 
1 1 1 9  14 5  o 13.17000  0.1302000     13.13000  0.1836000     13.21000  0.1847000     -0.8001000E-01 0.2604000 
1 1 1 9  14 6  o 7.985000  0.1178000     7.993000  0.1652000     7.978000  0.1680000     0.1562000E-01  0.2356000 
1 1 1 9  14 7  o 13.74000  0.1403000     13.56000  0.1962000     13.93000  0.2006000     -0.3745000     0.2806000 
1 1 1 9  14 8  o 10.48000  0.1589000     10.22000  0.2575000     10.73000  0.1863000     -0.5165000     0.3179000 
1 1 1 9  14 9  f 6.014000  0.1871000     6.037000  0.2604000     5.992000  0.2688000     0.4501000E-01  0.3742000 
1 1 1 9  14 10 o 8.222000  0.1616000     8.363000  0.2238000     8.080000  0.2333000     0.2839000      0.3233000 
1 1 1 9  14 11 o 1.898000  0.3740000     1.217000  0.5330000     2.579000  0.5249000     -1.362000      0.7481000 
1 1 1 9  14 12 o 3.052000  0.3464000     3.027000  0.4795000     3.077000  0.5001000     -0.4957000E-01 0.6928000 
1 1 1 9  14 13 o 5.706000  0.2386000     5.749000  0.3290000     5.663000  0.3458000     0.8684000E-01  0.4773000 
1 1 1 9  14 14 o 5.950000  0.4691000     5.670000  0.3983000     6.231000  0.8494000     -0.5607000     0.9382000 
1 1 1 9  14 15 o 4.968000  0.5734000     5.045000  1.057000      4.891000  0.4458000     0.1543000      1.147000  
1 1 1 9  14 16 o 11.55000  0.2847000     11.71000  0.3949000     11.39000  0.4103000     0.3273000      0.5695000 
1 1 1 9  14 17 o 5.425000  0.5232000     5.582000  0.7083000     5.268000  0.7702000     0.3148000      1.046000  
1 1 1 9  14 18 o 5.201000  0.5275000     5.323000  0.6662000     5.078000  0.8181000     0.2453000      1.055000  
1 1 1 9  14 19 o 4.314000  0.6625000     4.309000  0.9344000     4.318000  0.9395000     -0.8276000E-02 1.325000  
1 1 1 9  14 20 o 2.481000  0.7264000     2.535000  1.064000      2.426000  0.9887000     0.1091000      1.453000  
1 1 1 9  14 21 o 2.356000  0.6402000     2.358000  0.9029000     2.354000  0.9078000     0.3917000E-02  1.280000  
1 1 1 9  14 22 o 1.992000  0.5471000     2.430000  0.8388000     1.554000  0.7025000     0.8760000      1.094000  
1 1 1 9  14 23 o 1.575000  0.4947000     1.543000  0.6898000     1.607000  0.7092000     -0.6375000E-01 0.9893000 
1 1 1 9  14 24 o 2.078000  0.6535000     2.447000  1.054000      1.709000  0.7728000     0.7377000      1.307000  
1 1 1 9  14 25 o 1.227000  0.4341000     1.221000  0.6078000     1.234000  0.6200000     -0.1258000E-01 0.8682000 
1 1 1 9  14 26 o 1.822000  0.5336000     1.792000  0.7403000     1.851000  0.7687000     -0.5881000E-01 1.067000  
1 1 1 9  15 0  o 23.16000  0.2685000     23.16000  0.2685000     23.16000  0.2685000     0.000000       0.000000  
1 1 1 9  15 1  o 26.00000  0.2101000     26.44000  0.3016000     25.56000  0.2925000     0.8820000      0.4201000 
1 1 1 9  15 2  o 21.68000  0.1798000     21.79000  0.2552000     21.57000  0.2533000     0.2137000      0.3595000 
1 1 1 9  15 3  o 16.17000  0.1444000     16.39000  0.2059000     15.94000  0.2024000     0.4444000      0.2887000 
1 1 1 9  15 4  o 18.42000  0.1599000     18.33000  0.2254000     18.52000  0.2269000     -0.1933000     0.3198000 
1 1 1 9  15 5  o 10.13000  0.1181000     10.04000  0.1661000     10.22000  0.1679000     -0.1820000     0.2362000 
1 1 1 9  15 6  o 12.99000  0.1336000     13.04000  0.1891000     12.94000  0.1886000     0.9266000E-01  0.2671000 
1 1 1 9  15 7  f 11.54000  0.1399000     11.36000  0.1843000     11.73000  0.2106000     -0.3721000     0.2799000 
1 1 1 9  15 8  o 7.414000  0.1646000     7.471000  0.2042000     7.356000  0.2584000     0.1152000      0.3293000 
1 1 1 9  15 9  o 6.804000  0.1938000     7.060000  0.2865000     6.547000  0.2611000     0.5126000      0.3876000 
1 1 1 9  15 10 o 2.800000  0.3298000     2.972000  0.4241000     2.628000  0.5053000     0.3437000      0.6597000 
1 1 1 9  15 11 o 3.505000  0.2902000     3.098000  0.4488000     3.911000  0.3682000     -0.8122000     0.5805000 
1 1 1 9  15 12 o 10.86000  0.1746000     10.90000  0.2427000     10.81000  0.2512000     0.9023000E-01  0.3493000 
1 1 1 9  15 13 o 19.19000  0.2143000     19.30000  0.3200000     19.07000  0.2850000     0.2239000      0.4285000 
1 1 1 9  15 14 o 7.934000  0.2913000     7.654000  0.3036000     8.214000  0.4972000     -0.5598000     0.5825000 
1 1 1 9  15 15 o 5.590000  0.6188000     4.698000  1.182000      6.483000  0.3655000     -1.785000      1.238000  
1 1 1 9  15 16 o 5.072000  0.4965000     5.295000  0.8532000     4.848000  0.5081000     0.4464000      0.9930000 
1 1 1 9  15 17 o 4.379000  0.4445000     4.930000  0.5187000     3.828000  0.7220000     1.103000       0.8890000 
1 1 1 9  15 18 o 4.392000  0.6447000     4.799000  0.5083000     3.985000  1.185000      0.8135000      1.289000  
1 1 1 9  15 19 o 3.784000  0.7975000     3.828000  1.146000      3.741000  1.109000      0.8715000E-01  1.595000  
1 1 1 9  15 20 o 3.104000  0.7738000     3.410000  1.123000      2.799000  1.065000      0.6112000      1.548000  
1 1 1 9  15 21 o 2.731000  0.6456000     2.973000  0.9307000     2.490000  0.8950000     0.4830000      1.291000  
1 1 1 9  15 22 o 2.933000  0.5471000     2.633000  0.7970000     3.233000  0.7496000     -0.6000000     1.094000  
1 1 1 9  15 23 o 1.633000  0.4918000     2.000000  0.7759000     1.266000  0.6044000     0.7341000      0.9836000 
1 1 1 9  15 24 o 1.802000  0.5541000     1.545000  0.7137000     2.058000  0.8479000     -0.5122000     1.108000  
1 1 1 9  15 25 o 1.731000  0.5547000     1.700000  0.7563000     1.763000  0.8116000     -0.6294000E-01 1.109000  
1 1 1 9  15 26 o 1.454000  0.4638000     0.9340000 0.4719000     1.974000  0.7986000     -1.040000      0.9276000 
1 1 1 9  16 0  o 8.692000  0.1513000     8.692000  0.1513000     8.692000  0.1513000     -0.000000      0.000000  
1 1 1 9  16 1  o 4.104000  0.1237000     3.998000  0.1768000     4.210000  0.1731000     -0.2120000     0.2474000 
1 1 1 9  16 2  o 18.83000  0.1614000     18.76000  0.2276000     18.90000  0.2289000     -0.1418000     0.3228000 
1 1 1 9  16 3  o 25.98000  0.2113000     25.93000  0.2983000     26.02000  0.2994000     -0.8542000E-01 0.4227000 
1 1 1 9  16 4  o 11.13000  0.1201000     11.23000  0.1697000     11.03000  0.1699000     0.1951000      0.2402000 
1 1 1 9  16 5  f 11.40000  0.1254000     11.71000  0.1785000     11.09000  0.1763000     0.6201000      0.2509000 
1 1 1 9  16 6  o 10.38000  0.1257000     10.35000  0.1770000     10.42000  0.1785000     -0.7328000E-01 0.2514000 
1 1 1 9  16 7  o 8.006000  0.1414000     7.865000  0.2184000     8.148000  0.1796000     -0.2834000     0.2828000 
1 1 1 9  16 8  o 7.567000  0.1421000     7.789000  0.1891000     7.345000  0.2120000     0.4439000      0.2841000 
1 1 1 9  16 9  o 9.794000  0.1560000     9.874000  0.2401000     9.713000  0.1992000     0.1606000      0.3120000 
1 1 1 9  16 10 o 13.60000  0.1651000     13.34000  0.2611000     13.87000  0.2021000     -0.5294000     0.3302000 
1 1 1 9  16 11 o 12.96000  0.1682000     12.69000  0.2341000     13.23000  0.2416000     -0.5389000     0.3364000 
1 1 1 9  16 12 o 11.21000  0.1760000     11.04000  0.2429000     11.38000  0.2547000     -0.3412000     0.3520000 
1 1 1 9  16 13 o 11.48000  0.1844000     11.57000  0.2557000     11.39000  0.2657000     0.1789000      0.3688000 
1 1 1 9  16 14 o 6.115000  0.2531000     6.085000  0.3563000     6.146000  0.3595000     -0.6119000E-01 0.5061000 
1 1 1 9  16 15 f 8.154000  0.3207000     8.393000  0.5445000     7.914000  0.3392000     0.4782000      0.6415000 
1 1 1 9  16 16 f 1.732000  0.5550000     1.796000  0.8445000     1.668000  0.7203000     0.1280000      1.110000  
1 1 1 9  16 17 o 3.923000  0.4984000     4.525000  0.5688000     3.321000  0.8184000     1.204000       0.9967000 
1 1 1 9  16 18 o 4.848000  0.4033000     4.673000  0.5697000     5.023000  0.5712000     -0.3499000     0.8067000 
1 1 1 9  16 19 o 2.388000  0.6081000     2.924000  0.8333000     1.852000  0.8860000     1.072000       1.216000  
1 1 1 9  16 20 o 2.123000  0.6527000     1.819000  0.8438000     2.427000  0.9961000     -0.6076000     1.305000  
1 1 1 9  16 21 o 2.436000  0.5919000     1.701000  0.7701000     3.172000  0.8991000     -1.471000      1.184000  
1 1 1 9  16 22 o 3.064000  0.5173000     2.316000  0.7961000     3.812000  0.6608000     -1.496000      1.035000  
1 1 1 9  16 23 o 1.578000  0.4772000     2.033000  0.7799000     1.123000  0.5501000     0.9107000      0.9544000 
1 1 1 9  16 24 o 1.789000  0.5449000     1.657000  0.7531000     1.920000  0.7877000     -0.2631000     1.090000  
1 1 1 9  16 25 o 1.426000  0.4856000     1.289000  0.6221000     1.562000  0.7459000     -0.2735000     0.9712000 
1 1 1 9  16 26 o 1.479000  0.4735000     1.651000  0.7124000     1.306000  0.6240000     0.3453000      0.9470000 
1 1 1 9  17 0  o 0.9891000 0.4867000     0.9891000 0.4867000     0.9891000 0.4867000     -0.000000      0.000000  
1 1 1 9  17 1  o 8.637000  0.1089000     8.621000  0.1544000     8.654000  0.1536000     -0.3238000E-01 0.2178000 
1 1 1 9  17 2  o 2.667000  0.1750000     2.521000  0.2602000     2.812000  0.2342000     -0.2912000     0.3501000 
1 1 1 9  17 3  o 12.18000  0.1242000     12.20000  0.1754000     12.15000  0.1760000     0.5564000E-01  0.2484000 
1 1 1 9  17 4  o 12.67000  0.1287000     12.68000  0.1816000     12.67000  0.1823000     0.5712000E-02  0.2573000 
1 1 1 9  17 5  o 5.950000  0.1252000     5.995000  0.1742000     5.905000  0.1799000     0.8972000E-01  0.2504000 
1 1 1 9  17 6  o 5.610000  0.1348000     5.804000  0.1869000     5.416000  0.1943000     0.3874000      0.2697000 
1 1 1 9  17 7  o 7.299000  0.1595000     7.283000  0.2592000     7.315000  0.1858000     -0.3217000E-01 0.3189000 
1 1 1 9  17 8  o 11.59000  0.1812000     11.78000  0.2216000     11.40000  0.2868000     0.3792000      0.3625000 
1 1 1 9  17 9  o 12.02000  0.1454000     12.06000  0.2052000     11.97000  0.2061000     0.9207000E-01  0.2908000 
1 1 1 9  17 10 o 4.526000  0.1933000     4.365000  0.2783000     4.687000  0.2683000     -0.3215000     0.3866000 
1 1 1 9  17 11 o 3.612000  0.2918000     3.290000  0.4408000     3.935000  0.3825000     -0.6451000     0.5836000 
1 1 1 9  17 12 o 14.78000  0.1801000     14.71000  0.2521000     14.85000  0.2574000     -0.1320000     0.3602000 
1 1 1 9  17 13 o 8.486000  0.2192000     8.285000  0.3077000     8.687000  0.3122000     -0.4016000     0.4383000 
1 1 1 9  17 14 f 17.60000  0.2300000     17.46000  0.3184000     17.75000  0.3319000     -0.2883000     0.4599000 
1 1 1 9  17 15 o 5.074000  0.4374000     5.474000  0.7191000     4.674000  0.4982000     0.7998000      0.8749000 
1 1 1 9  17 16 o 10.63000  0.3113000     10.28000  0.5360000     10.97000  0.3168000     -0.6915000     0.6226000 
1 1 1 9  17 17 o 2.787000  0.5865000     2.885000  0.7902000     2.689000  0.8668000     0.1960000      1.173000  
1 1 1 9  17 18 o 6.023000  0.3583000     6.264000  0.4654000     5.783000  0.5450000     0.4811000      0.7167000 
1 1 1 9  17 19 o 8.182000  0.3947000     8.340000  0.3719000     8.024000  0.6963000     0.3166000      0.7894000 
1 1 1 9  17 20 o 4.690000  0.5988000     3.308000  1.094000      6.072000  0.4879000     -2.764000      1.198000  
1 1 1 9  17 21 o 2.313000  0.5625000     2.698000  0.7965000     1.928000  0.7945000     0.7705000      1.125000  
1 1 1 9  17 22 o 1.385000  0.4649000     0.9468000 0.4714000     1.823000  0.8014000     -0.8758000     0.9297000 
1 1 1 9  17 23 o 1.687000  0.5180000     1.301000  0.5946000     2.073000  0.8483000     -0.7727000     1.036000  
1 1 1 9  17 24 o 1.941000  0.5565000     2.256000  0.8508000     1.627000  0.7178000     0.6288000      1.113000  
1 1 1 9  17 25 o 1.259000  0.4404000     0.9948000 0.4980000     1.522000  0.7266000     -0.5274000     0.8809000 
1 1 1 9  17 26 o 1.442000  0.4719000     1.397000  0.6443000     1.487000  0.6898000     -0.8995000E-01 0.9439000 
1 1 1 9  18 0  o 14.72000  0.1937000     14.72000  0.1937000     14.72000  0.1937000     0.000000       0.000000  
1 1 1 9  18 1  o 23.46000  0.1939000     23.28000  0.2723000     23.65000  0.2760000     -0.3759000     0.3878000 
1 1 1 9  18 2  o 20.29000  0.1727000     20.24000  0.2435000     20.34000  0.2449000     -0.9471000E-01 0.3454000 
1 1 1 9  18 3  o 19.85000  0.1705000     19.83000  0.2406000     19.87000  0.2416000     -0.4304000E-01 0.3410000 
1 1 1 9  18 4  o 15.46000  0.1452000     15.12000  0.2029000     15.80000  0.2079000     -0.6776000     0.2905000 
1 1 1 9  18 5  o 6.457000  0.1247000     6.518000  0.1764000     6.395000  0.1763000     0.1224000      0.2494000 
1 1 1 9  18 6  o 12.36000  0.1356000     12.16000  0.1901000     12.57000  0.1935000     -0.4026000     0.2712000 
1 1 1 9  18 7  o 5.153000  0.1756000     5.241000  0.2087000     5.066000  0.2825000     0.1749000      0.3512000 
1 1 1 9  18 8  o 3.192000  0.2773000     3.154000  0.4561000     3.230000  0.3156000     -0.7608000E-01 0.5546000 
1 1 1 9  18 9  o 6.852000  0.1530000     6.809000  0.2185000     6.895000  0.2143000     -0.8574000E-01 0.3061000 
1 1 1 9  18 10 o 2.186000  0.3395000     1.617000  0.5458000     2.754000  0.4039000     -1.138000      0.6790000 
1 1 1 9  18 11 o 3.543000  0.2832000     3.586000  0.4525000     3.499000  0.3406000     0.8706000E-01  0.5663000 
1 1 1 9  18 12 o 4.800000  0.2607000     5.162000  0.3271000     4.438000  0.4059000     0.7238000      0.5213000 
1 1 1 9  18 13 o 9.154000  0.2735000     9.255000  0.3054000     9.052000  0.4538000     0.2034000      0.5470000 
1 1 1 9  18 14 o 5.146000  0.3478000     4.774000  0.5361000     5.518000  0.4432000     -0.7439000     0.6955000 
1 1 1 9  18 15 o 9.528000  0.2835000     9.933000  0.4705000     9.124000  0.3167000     0.8091000      0.5671000 
1 1 1 9  18 16 o 6.256000  0.4077000     7.147000  0.6493000     5.365000  0.4934000     1.782000       0.8155000 
1 1 1 9  18 17 o 3.789000  0.5154000     3.394000  0.7478000     4.184000  0.7095000     -0.7896000     1.031000  
1 1 1 9  18 18 o 4.083000  0.5044000     3.870000  0.7022000     4.296000  0.7243000     -0.4259000     1.009000  
1 1 1 9  18 19 o 2.688000  0.5849000     2.192000  0.8257000     3.183000  0.8285000     -0.9911000     1.170000  
1 1 1 9  18 20 o 1.676000  0.5205000     1.548000  0.6815000     1.804000  0.7870000     -0.2559000     1.041000  
1 1 1 9  18 21 o 3.311000  0.5010000     2.218000  0.7972000     4.405000  0.6070000     -2.186000      1.002000  
1 1 1 9  18 22 o 4.132000  0.4041000     4.425000  0.5126000     3.840000  0.6249000     0.5846000      0.8082000 
1 1 1 9  18 23 o 1.147000  0.3914000     1.165000  0.5583000     1.129000  0.5486000     0.3528000E-01  0.7827000 
1 1 1 9  18 24 o 1.931000  0.4995000     1.964000  0.6881000     1.898000  0.7243000     0.6585000E-01  0.9991000 
1 1 1 9  18 25 o 1.323000  0.4472000     1.191000  0.5546000     1.455000  0.7017000     -0.2637000     0.8944000 
1 1 1 9  18 26 o 1.299000  0.4440000     1.175000  0.5509000     1.424000  0.6964000     -0.2484000     0.8880000 
1 1 1 9  19 0  o 8.657000  0.1594000     8.657000  0.1594000     8.657000  0.1594000     -0.000000      0.000000  
1 1 1 9  19 1  o 10.70000  0.1187000     10.60000  0.1670000     10.80000  0.1689000     -0.1967000     0.2375000 
1 1 1 9  19 2  f 12.59000  0.1276000     12.59000  0.1803000     12.60000  0.1806000     -0.6841000E-02 0.2552000 
1 1 1 9  19 3  o 4.239000  0.1405000     4.391000  0.1949000     4.086000  0.2024000     0.3056000      0.2810000 
1 1 1 9  19 4  o 8.239000  0.1202000     8.279000  0.1694000     8.200000  0.1706000     0.7925000E-01  0.2404000 
1 1 1 9  19 5  o 10.11000  0.1261000     10.19000  0.1791000     10.04000  0.1777000     0.1531000      0.2523000 
1 1 1 9  19 6  o 7.601000  0.1584000     7.593000  0.2562000     7.610000  0.1863000     -0.1663000E-01 0.3168000 
1 1 1 9  19 7  o 5.589000  0.1939000     5.719000  0.2056000     5.458000  0.3288000     0.2610000      0.3878000 
1 1 1 9  19 8  o 10.68000  0.1413000     10.73000  0.1998000     10.63000  0.1998000     0.9568000E-01  0.2825000 
1 1 1 9  19 9  o 9.389000  0.1453000     9.357000  0.2070000     9.422000  0.2041000     -0.6423000E-01 0.2906000 
1 1 1 9  19 10 o 11.31000  0.1509000     11.05000  0.2127000     11.56000  0.2140000     -0.5065000     0.3017000 
1 1 1 9  19 11 o 3.141000  0.2851000     3.349000  0.3762000     2.932000  0.4285000     0.4162000      0.5702000 
1 1 1 9  19 12 o 11.89000  0.1803000     11.89000  0.2503000     11.89000  0.2597000     0.3961000E-02  0.3606000 
1 1 1 9  19 13 o 20.96000  0.2733000     21.04000  0.3013000     20.87000  0.4561000     0.1753000      0.5466000 
1 1 1 9  19 14 o 14.75000  0.3419000     14.59000  0.6227000     14.90000  0.2828000     -0.3127000     0.6839000 
1 1 1 9  19 15 o 5.793000  0.3962000     5.827000  0.6616000     5.758000  0.4362000     0.6917000E-01  0.7925000 
1 1 1 9  19 16 o 2.230000  0.6164000     2.103000  0.9293000     2.358000  0.8101000     -0.2548000     1.233000  
1 1 1 9  19 17 f 10.74000  0.2540000     10.18000  0.3489000     11.29000  0.3693000     -1.107000      0.5080000 
1 1 1 9  19 18 o 8.147000  0.2961000     8.072000  0.3947000     8.222000  0.4416000     -0.1504000     0.5923000 
1 1 1 9  19 19 o 6.193000  0.3525000     5.648000  0.5100000     6.738000  0.4868000     -1.090000      0.7050000 
1 1 1 9  19 20 o 2.090000  0.5312000     2.613000  0.7808000     1.568000  0.7205000     1.045000       1.062000  
1 1 1 9  19 21 o 2.594000  0.5663000     2.816000  0.7841000     2.372000  0.8172000     0.4444000      1.133000  
1 1 1 9  19 22 o 1.826000  0.5116000     2.025000  0.7462000     1.627000  0.7001000     0.3984000      1.023000  
1 1 1 9  19 23 o 1.268000  0.4227000     1.201000  0.5757000     1.336000  0.6192000     -0.1347000     0.8455000 
1 1 1 9  19 24 f 1.605000  0.4897000     1.498000  0.6522000     1.711000  0.7306000     -0.2126000     0.9794000 
1 1 1 9  19 25 o 1.925000  0.5717000     1.569000  0.6742000     2.281000  0.9235000     -0.7122000     1.143000  
1 1 1 9  19 26 o 1.190000  0.4228000     0.9569000 0.4787000     1.423000  0.6971000     -0.4664000     0.8456000 
1 1 1 9  20 0  o 4.684000  0.1853000     4.684000  0.1853000     4.684000  0.1853000     -0.000000      0.000000  
1 1 1 9  20 1  o 2.496000  0.2039000     2.696000  0.2738000     2.296000  0.3023000     0.4004000      0.4078000 
1 1 1 9  20 2  o 12.49000  0.1296000     12.59000  0.1837000     12.40000  0.1829000     0.1847000      0.2592000 
1 1 1 9  20 3  o 14.36000  0.1405000     14.29000  0.1973000     14.44000  0.2001000     -0.1474000     0.2810000 
1 1 1 9  20 4  o 13.57000  0.1385000     13.63000  0.1962000     13.51000  0.1954000     0.1167000      0.2769000 
1 1 1 9  20 5  o 5.142000  0.1426000     5.387000  0.1985000     4.896000  0.2047000     0.4910000      0.2851000 
1 1 1 9  20 6  o 2.505000  0.3140000     2.601000  0.3765000     2.408000  0.5026000     0.1928000      0.6280000 
1 1 1 9  20 7  o 7.175000  0.1817000     7.236000  0.2741000     7.113000  0.2388000     0.1227000      0.3635000 
1 1 1 9  20 8  o 7.244000  0.1454000     7.348000  0.2030000     7.140000  0.2083000     0.2082000      0.2908000 
1 1 1 9  20 9  o 10.44000  0.1449000     10.53000  0.2050000     10.35000  0.2049000     0.1826000      0.2898000 
1 1 1 9  20 10 o 1.246000  0.3627000     1.183000  0.5048000     1.309000  0.5210000     -0.1262000     0.7255000 
1 1 1 9  20 11 o 2.401000  0.3641000     2.257000  0.5351000     2.545000  0.4938000     -0.2882000     0.7281000 
1 1 1 9  20 12 o 14.05000  0.1809000     14.02000  0.2861000     14.08000  0.2214000     -0.6434000E-01 0.3618000 
1 1 1 9  20 13 f 10.57000  0.2075000     10.58000  0.2700000     10.57000  0.3151000     0.1356000E-01  0.4149000 
1 1 1 9  20 14 o 13.52000  0.2329000     13.04000  0.3663000     14.00000  0.2876000     -0.9598000     0.4657000 
1 1 1 9  20 15 o 3.596000  0.5719000     3.347000  0.9722000     3.845000  0.6027000     -0.4974000     1.144000  
1 1 1 9  20 16 o 7.443000  0.3587000     7.619000  0.5981000     7.266000  0.3963000     0.3537000      0.7175000 
1 1 1 9  20 17 o 8.296000  0.2864000     7.925000  0.3885000     8.667000  0.4209000     -0.7427000     0.5728000 
1 1 1 9  20 18 o 1.824000  0.5757000     1.770000  0.7884000     1.878000  0.8392000     -0.1088000     1.151000  
1 1 1 9  20 19 o 2.416000  0.6075000     2.729000  0.8589000     2.103000  0.8595000     0.6255000      1.215000  
1 1 1 9  20 20 o 3.603000  0.5140000     3.184000  0.7511000     4.022000  0.7018000     -0.8381000     1.028000  
1 1 1 9  20 21 o 1.475000  0.4755000     1.425000  0.6589000     1.524000  0.6858000     -0.9850000E-01 0.9510000 
1 1 1 9  20 22 o 1.793000  0.4725000     2.380000  0.7453000     1.205000  0.5809000     1.176000       0.9449000 
1 1 1 9  20 23 f 1.513000  0.4752000     1.361000  0.6311000     1.666000  0.7106000     -0.3057000     0.9503000 
1 1 1 9  20 24 o 1.556000  0.4896000     1.504000  0.6793000     1.609000  0.7052000     -0.1044000     0.9792000 
1 1 1 9  20 25 o 1.305000  0.4512000     1.102000  0.5378000     1.507000  0.7247000     -0.4050000     0.9024000 
1 1 1 9  20 26 o 1.674000  0.5690000     1.523000  0.7314000     1.825000  0.8720000     -0.3020000     1.138000  
1 1 1 9  21 0  o 5.989000  0.1738000     5.989000  0.1738000     5.989000  0.1738000     -0.000000      0.000000  
1 1 1 9  21 1  o 4.125000  0.1488000     4.279000  0.2085000     3.971000  0.2124000     0.3084000      0.2976000 
1 1 1 9  21 2  o 6.359000  0.1243000     6.487000  0.1752000     6.231000  0.1764000     0.2565000      0.2486000 
1 1 1 9  21 3  o 9.281000  0.1230000     9.518000  0.1741000     9.044000  0.1738000     0.4744000      0.2460000 
1 1 1 9  21 4  o 1.770000  0.2994000     2.167000  0.3709000     1.373000  0.4700000     0.7939000      0.5988000 
1 1 1 9  21 5  o 14.37000  0.1799000     14.35000  0.2930000     14.39000  0.2087000     -0.4481000E-01 0.3598000 
1 1 1 9  21 6  o 16.00000  0.2040000     15.90000  0.2504000     16.10000  0.3221000     -0.1976000     0.4079000 
1 1 1 9  21 7  o 1.048000  0.3234000     1.033000  0.4529000     1.063000  0.4616000     -0.2950000E-01 0.6467000 
1 1 1 9  21 8  o 9.268000  0.1425000     9.392000  0.2009000     9.145000  0.2022000     0.2467000      0.2851000 
1 1 1 9  21 9  o 12.58000  0.1510000     12.48000  0.2134000     12.68000  0.2138000     -0.2056000     0.3021000 
1 1 1 9  21 10 o 3.869000  0.2295000     3.626000  0.3394000     4.111000  0.3090000     -0.4850000     0.4590000 
1 1 1 9  21 11 o 14.00000  0.1655000     13.94000  0.2333000     14.06000  0.2348000     -0.1245000     0.3310000 
1 1 1 9  21 12 o 10.10000  0.2056000     10.02000  0.3353000     10.19000  0.2378000     -0.1740000     0.4111000 
1 1 1 9  21 13 o 11.23000  0.2140000     11.39000  0.2970000     11.08000  0.3083000     0.3196000      0.4281000 
1 1 1 9  21 14 o 5.235000  0.3031000     4.795000  0.4470000     5.675000  0.4095000     -0.8808000     0.6062000 
1 1 1 9  21 15 o 2.810000  0.6473000     3.054000  1.027000      2.566000  0.7881000     0.4882000      1.295000  
1 1 1 9  21 16 o 3.973000  0.5866000     3.079000  1.049000      4.867000  0.5253000     -1.788000      1.173000  
1 1 1 9  21 17 o 3.748000  0.5530000     3.767000  0.7392000     3.730000  0.8226000     0.3715000E-01  1.106000  
1 1 1 9  21 18 o 7.810000  0.4474000     7.810000  0.4474000     ?         ?             ?              ?         
1 1 1 9  21 19 o 2.254000  0.7018000     2.802000  1.179000      1.706000  0.7617000     1.097000       1.404000  
1 1 1 9  21 20 o 2.483000  0.5904000     2.326000  0.7975000     2.640000  0.8707000     -0.3136000     1.181000  
1 1 1 9  21 21 o 1.432000  0.4621000     1.423000  0.6522000     1.442000  0.6548000     -0.1912000E-01 0.9242000 
1 1 1 9  21 22 o 3.080000  0.4687000     3.998000  0.5459000     2.163000  0.7621000     1.835000       0.9375000 
1 1 1 9  21 23 o 2.091000  0.6004000     1.378000  0.6413000     2.804000  1.015000      -1.426000      1.201000  
1 1 1 9  21 24 o 1.784000  0.5944000     2.151000  0.9911000     1.417000  0.6564000     0.7340000      1.189000  
1 1 1 9  21 25 o 1.183000  0.4180000     0.9893000 0.4894000     1.377000  0.6777000     -0.3880000     0.8359000 
1 1 1 9  22 0  o 16.49000  0.2167000     16.49000  0.2167000     16.49000  0.2167000     0.000000       0.000000  
1 1 1 9  22 1  o 7.583000  0.1217000     7.603000  0.1711000     7.564000  0.1732000     0.3938000E-01  0.2435000 
1 1 1 9  22 2  o 17.17000  0.1577000     17.21000  0.2232000     17.14000  0.2227000     0.6639000E-01  0.3153000 
1 1 1 9  22 3  o 15.97000  0.1517000     16.11000  0.2155000     15.83000  0.2136000     0.2850000      0.3034000 
1 1 1 9  22 4  o 8.813000  0.1556000     8.946000  0.2524000     8.680000  0.1820000     0.2661000      0.3112000 
1 1 1 9  22 5  o 10.89000  0.1896000     10.89000  0.1896000     ?         ?             ?              ?         
1 1 1 9  22 6  o 8.289000  0.1666000     8.269000  0.2727000     8.308000  0.1915000     -0.3900000E-01 0.3332000 
1 1 1 9  22 7  o 12.54000  0.1466000     12.57000  0.2064000     12.52000  0.2082000     0.5007000E-01  0.2931000 
1 1 1 9  22 8  o 5.613000  0.1646000     5.746000  0.2293000     5.479000  0.2363000     0.2670000      0.3293000 
1 1 1 9  22 9  o 7.917000  0.1505000     8.047000  0.2137000     7.787000  0.2120000     0.2604000      0.3010000 
1 1 1 9  22 10 o 10.48000  0.1699000     10.29000  0.2174000     10.68000  0.2612000     -0.3938000     0.3398000 
1 1 1 9  22 11 o 12.36000  0.1615000     12.38000  0.2279000     12.34000  0.2289000     0.4700000E-01  0.3230000 
1 1 1 9  22 12 o 18.98000  0.2699000     19.09000  0.3849000     18.87000  0.3785000     0.2246000      0.5398000 
1 1 1 9  22 13 o 11.99000  0.3490000     11.77000  0.6205000     12.20000  0.3199000     -0.4246000     0.6981000 
1 1 1 9  22 14 o 11.06000  0.2075000     11.09000  0.2917000     11.03000  0.2951000     0.5521000E-01  0.4149000 
1 1 1 9  22 15 o 5.996000  0.4045000     6.372000  0.6621000     5.621000  0.4649000     0.7503000      0.8091000 
1 1 1 9  22 16 o 5.254000  0.4740000     5.341000  0.7947000     5.167000  0.5170000     0.1738000      0.9481000 
1 1 1 9  22 17 o 3.833000  0.5466000     3.759000  0.7244000     3.907000  0.8188000     -0.1483000     1.093000  
1 1 1 9  22 18 o 5.455000  0.5610000     5.255000  0.5345000     5.655000  0.9865000     -0.3998000     1.122000  
1 1 1 9  22 19 o 3.489000  0.7309000     3.460000  1.231000      3.519000  0.7878000     -0.5945000E-01 1.462000  
1 1 1 9  22 20 o 2.031000  0.5557000     1.665000  0.7227000     2.397000  0.8443000     -0.7319000     1.111000  
1 1 1 9  22 21 o 2.403000  0.5382000     2.974000  0.7691000     1.833000  0.7532000     1.141000       1.076000  
1 1 1 9  22 22 o 2.198000  0.5289000     2.508000  0.7638000     1.887000  0.7318000     0.6215000      1.058000  
1 1 1 9  22 23 o 2.635000  0.6625000     2.761000  0.7707000     2.509000  1.078000      0.2516000      1.325000  
1 1 1 9  22 24 o 1.400000  0.4833000     1.444000  0.7242000     1.357000  0.6403000     0.8746000E-01  0.9666000 
1 1 1 9  22 25 o 1.730000  0.5331000     1.658000  0.6860000     1.802000  0.8161000     -0.1442000     1.066000  
1 1 1 9  23 0  o 0.7063000 0.4567000     0.7063000 0.4567000     0.7063000 0.4567000     -0.000000      0.000000  
1 1 1 9  23 1  o 4.773000  0.1471000     4.613000  0.2130000     4.934000  0.2029000     -0.3210000     0.2942000 
1 1 1 9  23 2  o 7.895000  0.1257000     8.078000  0.1766000     7.712000  0.1788000     0.3652000      0.2513000 
1 1 1 9  23 3  o 12.09000  0.1648000     11.84000  0.2678000     12.34000  0.1919000     -0.4946000     0.3295000 
1 1 1 9  23 4  o 2.021000  0.4884000     2.021000  0.4884000     ?         ?             ?              ?         
1 1 1 9  23 5  o 3.852000  0.2419000     3.969000  0.3545000     3.736000  0.3293000     0.2332000      0.4838000 
1 1 1 9  23 6  o 8.343000  0.1400000     8.035000  0.1990000     8.650000  0.1970000     -0.6155000     0.2800000 
1 1 1 9  23 7  o 4.065000  0.1977000     3.960000  0.2830000     4.171000  0.2761000     -0.2113000     0.3953000 
1 1 1 9  23 8  o 13.11000  0.1521000     13.04000  0.2152000     13.17000  0.2150000     -0.1335000     0.3042000 
1 1 1 9  23 9  o 4.041000  0.2172000     4.501000  0.2774000     3.582000  0.3342000     0.9190000      0.4343000 
1 1 1 9  23 10 o 7.609000  0.1613000     7.567000  0.2265000     7.651000  0.2298000     -0.8441000E-01 0.3227000 
1 1 1 9  23 11 o 14.29000  0.1683000     14.38000  0.2372000     14.20000  0.2387000     0.1846000      0.3366000 
1 1 1 9  23 12 o 12.38000  0.2042000     12.31000  0.2388000     12.44000  0.3312000     -0.1291000     0.4084000 
1 1 1 9  23 13 o 15.71000  0.2222000     15.98000  0.3635000     15.43000  0.2558000     0.5499000      0.4445000 
1 1 1 9  23 14 o 14.16000  0.2059000     14.03000  0.2896000     14.29000  0.2927000     -0.2605000     0.4118000 
1 1 1 9  23 15 o 4.551000  0.5328000     4.382000  0.9323000     4.719000  0.5160000     -0.3367000     1.066000  
1 1 1 9  23 16 o 9.682000  0.3172000     9.939000  0.5262000     9.426000  0.3546000     0.5134000      0.6345000 
1 1 1 9  23 17 o 7.526000  0.3122000     8.077000  0.3839000     6.975000  0.4923000     1.102000       0.6243000 
1 1 1 9  23 18 o 2.378000  0.5272000     3.284000  0.7954000     1.471000  0.6922000     1.812000       1.054000  
1 1 1 9  23 19 o 2.849000  0.5868000     2.907000  0.7683000     2.791000  0.8871000     0.1155000      1.174000  
1 1 1 9  23 20 o 1.620000  0.5052000     1.280000  0.6139000     1.960000  0.8025000     -0.6793000     1.010000  
1 1 1 9  23 21 f 2.530000  0.5540000     2.609000  0.7788000     2.451000  0.7882000     0.1575000      1.108000  
1 1 1 9  23 22 f 1.609000  0.4943000     1.480000  0.6684000     1.738000  0.7284000     -0.2578000     0.9886000 
1 1 1 9  23 23 o 1.683000  0.5206000     1.847000  0.7376000     1.518000  0.7350000     0.3285000      1.041000  
1 1 1 9  23 24 o 1.313000  0.4482000     1.298000  0.6431000     1.329000  0.6246000     -0.3107000E-01 0.8965000 
1 1 1 9  23 25 o 1.623000  0.4918000     1.847000  0.7056000     1.399000  0.6854000     0.4484000      0.9837000 
1 1 1 9  24 0  o 4.592000  0.2165000     4.592000  0.2165000     4.592000  0.2165000     -0.000000      0.000000  
1 1 1 9  24 1  o 15.12000  0.1610000     15.32000  0.2454000     14.91000  0.2085000     0.4028000      0.3220000 
1 1 1 9  24 2  o 9.614000  0.1677000     9.634000  0.2597000     9.595000  0.2124000     0.3924000E-01  0.3355000 
1 1 1 9  24 3  o 14.76000  0.2434000     14.76000  0.2434000     ?         ?             ?              ?         
1 1 1 9  24 4  o 3.842000  0.2432000     3.870000  0.3627000     3.814000  0.3242000     0.5574000E-01  0.4865000 
1 1 1 9  24 5  o 19.92000  0.1809000     19.77000  0.2542000     20.06000  0.2573000     -0.2890000     0.3617000 
1 1 1 9  24 6  o 4.973000  0.1722000     5.143000  0.2364000     4.804000  0.2503000     0.3387000      0.3443000 
1 1 1 9  24 7  o 10.05000  0.1448000     9.799000  0.2056000     10.29000  0.2041000     -0.4936000     0.2896000 
1 1 1 9  24 8  o 17.37000  0.1722000     17.08000  0.2424000     17.65000  0.2447000     -0.5773000     0.3444000 
1 1 1 9  24 9  o 3.151000  0.2752000     3.196000  0.3845000     3.106000  0.3938000     0.8987000E-01  0.5504000 
1 1 1 9  24 10 o 21.91000  0.2023000     21.96000  0.2860000     21.86000  0.2861000     0.9634000E-01  0.4045000 
1 1 1 9  24 11 o 9.480000  0.2009000     9.482000  0.3254000     9.477000  0.2359000     0.4823000E-02  0.4019000 
1 1 1 9  24 12 o 5.198000  0.2911000     5.373000  0.3099000     5.022000  0.4928000     0.3512000      0.5822000 
1 1 1 9  24 13 o 9.626000  0.1781000     9.721000  0.2513000     9.531000  0.2524000     0.1900000      0.3562000 
1 1 1 9  24 14 o 1.885000  0.4997000     2.404000  0.7960000     1.367000  0.6044000     1.038000       0.9995000 
1 1 1 9  24 15 o 2.677000  0.6185000     3.631000  0.9960000     1.722000  0.7337000     1.909000       1.237000  
1 1 1 9  24 16 o 4.448000  0.6044000     4.297000  0.9871000     4.600000  0.6979000     -0.3031000     1.209000  
1 1 1 9  24 17 o 3.584000  0.5946000     3.385000  0.8282000     3.784000  0.8533000     -0.3982000     1.189000  
1 1 1 9  24 18 o 2.702000  0.6042000     2.125000  0.8067000     3.279000  0.8996000     -1.154000      1.208000  
1 1 1 9  24 19 o 2.311000  0.5687000     2.563000  0.7720000     2.059000  0.8354000     0.5042000      1.137000  
1 1 1 9  24 20 o 5.423000  0.3390000     5.728000  0.4368000     5.119000  0.5185000     0.6089000      0.6779000 
1 1 1 9  24 21 o 2.161000  0.5558000     2.244000  0.7913000     2.079000  0.7806000     0.1644000      1.112000  
1 1 1 9  24 22 o 1.797000  0.5201000     1.628000  0.7088000     1.967000  0.7614000     -0.3387000     1.040000  
1 1 1 9  24 23 o 1.683000  0.4718000     2.193000  0.7523000     1.174000  0.5694000     1.019000       0.9435000 
1 1 1 9  24 24 o 1.308000  0.4358000     1.218000  0.5797000     1.398000  0.6508000     -0.1803000     0.8715000 
1 1 1 9  24 25 o 1.516000  0.5073000     1.143000  0.5520000     1.888000  0.8513000     -0.7448000     1.015000  
1 1 1 9  25 0  o 15.90000  0.4429000     15.90000  0.4429000     15.90000  0.4429000     -0.000000      0.000000  
1 1 1 9  25 1  o 7.166000  0.2681000     7.166000  0.2681000     ?         ?             ?              ?         
1 1 1 9  25 2  o 14.92000  0.2624000     14.87000  0.2977000     14.98000  0.4321000     -0.1112000     0.5247000 
1 1 1 9  25 3  o 1.866000  0.3765000     2.160000  0.5627000     1.572000  0.5004000     0.5887000      0.7530000 
1 1 1 9  25 4  o 1.153000  0.3348000     1.199000  0.4763000     1.106000  0.4707000     0.9268000E-01  0.6697000 
1 1 1 9  25 5  o 14.16000  0.1512000     14.24000  0.2141000     14.08000  0.2137000     0.1603000      0.3025000 
1 1 1 9  25 6  o 5.528000  0.1615000     5.528000  0.2297000     5.528000  0.2271000     -0.7195000E-03 0.3230000 
1 1 1 9  25 7  o 13.25000  0.1514000     13.00000  0.2133000     13.50000  0.2148000     -0.5002000     0.3027000 
1 1 1 9  25 8  o 22.38000  0.2015000     22.41000  0.2852000     22.35000  0.2847000     0.5416000E-01  0.4030000 
1 1 1 9  25 9  o 32.22000  0.2688000     32.12000  0.3796000     32.32000  0.3807000     -0.2061000     0.5376000 
1 1 1 9  25 10 o 1.790000  0.3992000     1.288000  0.5566000     2.293000  0.5724000     -1.004000      0.7984000 
1 1 1 9  25 11 o 6.201000  0.2731000     5.629000  0.4148000     6.773000  0.3555000     -1.144000      0.5463000 
1 1 1 9  25 12 o 9.626000  0.2539000     9.854000  0.3447000     9.398000  0.3730000     0.4564000      0.5079000 
1 1 1 9  25 13 o 2.246000  0.4488000     2.716000  0.5970000     1.777000  0.6703000     0.9387000      0.8976000 
1 1 1 9  25 14 o 3.315000  0.4046000     2.902000  0.6346000     3.729000  0.5021000     -0.8265000     0.8092000 
1 1 1 9  25 15 o 8.640000  0.3322000     8.859000  0.5653000     8.420000  0.3489000     0.4386000      0.6644000 
1 1 1 9  25 16 o 4.717000  0.5510000     5.437000  0.8080000     3.997000  0.7493000     1.440000       1.102000  
1 1 1 9  25 17 o 6.919000  0.6495000     7.765000  0.4265000     6.073000  1.227000      1.692000       1.299000  
1 1 1 9  25 18 o 5.404000  0.4147000     5.224000  0.5864000     5.584000  0.5866000     -0.3599000     0.8294000 
1 1 1 9  25 19 o 1.713000  0.5642000     1.874000  0.8743000     1.551000  0.7133000     0.3228000      1.128000  
1 1 1 9  25 20 o 5.526000  0.3228000     5.436000  0.4475000     5.616000  0.4652000     -0.1795000     0.6455000 
1 1 1 9  25 21 o 4.002000  0.4242000     3.834000  0.6116000     4.169000  0.5879000     -0.3359000     0.8484000 
1 1 1 9  25 22 o 1.441000  0.4577000     1.712000  0.7184000     1.169000  0.5672000     0.5437000      0.9153000 
1 1 1 9  25 23 o 1.907000  0.5221000     2.015000  0.7349000     1.800000  0.7417000     0.2155000      1.044000  
1 1 1 9  25 24 o 2.193000  0.5395000     1.696000  0.7051000     2.689000  0.8167000     -0.9935000     1.079000  
1 1 1 9  25 25 o 1.452000  0.4621000     1.710000  0.7006000     1.194000  0.6028000     0.5155000      0.9242000 
1 1 1 9  26 0  o 4.480000  0.2733000     4.480000  0.2733000     4.480000  0.2733000     0.000000       0.000000  
1 1 1 9  26 1  o 7.550000  0.1459000     7.476000  0.2195000     7.625000  0.1921000     -0.1491000     0.2917000 
1 1 1 9  26 2  o 13.79000  0.1468000     13.77000  0.2070000     13.80000  0.2081000     -0.2486000E-01 0.2935000 
1 1 1 9  26 3  o 9.226000  0.1350000     9.335000  0.1900000     9.117000  0.1919000     0.2179000      0.2701000 
1 1 1 9  26 4  o 8.024000  0.1390000     7.850000  0.1951000     8.198000  0.1979000     -0.3478000     0.2779000 
1 1 1 9  26 5  o 10.61000  0.1414000     10.65000  0.2002000     10.56000  0.1997000     0.8786000E-01  0.2828000 
1 1 1 9  26 6  o 11.82000  0.1460000     11.85000  0.2067000     11.79000  0.2062000     0.5854000E-01  0.2920000 
1 1 1 9  26 7  o 9.764000  0.1544000     9.628000  0.2319000     9.899000  0.2040000     -0.2709000     0.3089000 
1 1 1 9  26 8  o 6.341000  0.1878000     6.494000  0.2345000     6.187000  0.2933000     0.3070000      0.3755000 
1 1 1 9  26 9  o 11.05000  0.1566000     10.87000  0.2209000     11.23000  0.2221000     -0.3617000     0.3133000 
1 1 1 9  26 10 o 9.331000  0.1835000     9.336000  0.2846000     9.326000  0.2316000     0.9323000E-02  0.3670000 
1 1 1 9  26 11 o 16.29000  0.2248000     16.47000  0.2850000     16.12000  0.3477000     0.3511000      0.4496000 
1 1 1 9  26 12 o 7.108000  0.2415000     7.323000  0.3915000     6.892000  0.2831000     0.4318000      0.4831000 
1 1 1 9  26 13 o 4.362000  0.2865000     4.014000  0.4255000     4.710000  0.3836000     -0.6964000     0.5729000 
1 1 1 9  26 14 o 2.830000  0.4635000     1.943000  0.7733000     3.717000  0.5111000     -1.774000      0.9269000 
1 1 1 9  26 15 o 10.43000  0.2852000     10.34000  0.5077000     10.52000  0.2599000     -0.1805000     0.5703000 
1 1 1 9  26 16 o 8.156000  0.3042000     8.208000  0.4211000     8.104000  0.4392000     0.1047000      0.6085000 
1 1 1 9  26 17 o 5.377000  0.7984000     4.608000  0.5848000     6.145000  1.486000      -1.538000      1.597000  
1 1 1 9  26 18 o 2.776000  0.7515000     2.865000  1.228000      2.688000  0.8663000     0.1772000      1.503000  
1 1 1 9  26 19 o 1.488000  0.4780000     1.237000  0.5898000     1.739000  0.7524000     -0.5023000     0.9560000 
1 1 1 9  26 20 o 3.446000  0.4769000     3.229000  0.6926000     3.663000  0.6558000     -0.4340000     0.9539000 
1 1 1 9  26 21 o 2.009000  0.5421000     1.868000  0.7517000     2.151000  0.7813000     -0.2829000     1.084000  
1 1 1 9  26 22 o 2.055000  0.5318000     2.553000  0.7978000     1.558000  0.7032000     0.9946000      1.064000  
1 1 1 9  26 23 o 2.139000  0.5351000     2.614000  0.7913000     1.664000  0.7206000     0.9505000      1.070000  
1 1 1 9  26 24 o 1.654000  0.5069000     1.497000  0.6682000     1.811000  0.7624000     -0.3142000     1.014000  
1 1 1 9  26 25 o 1.506000  0.5125000     1.346000  0.6274000     1.666000  0.8105000     -0.3199000     1.025000  
1 1 1 9  27 0  f 3.290000  0.3055000     3.290000  0.3055000     3.290000  0.3055000     0.000000       0.000000  
1 1 1 9  27 1  o 12.03000  0.1405000     12.19000  0.1992000     11.88000  0.1982000     0.3073000      0.2810000 
1 1 1 9  27 2  f 8.686000  0.1381000     8.988000  0.1933000     8.384000  0.1973000     0.6033000      0.2762000 
1 1 1 9  27 3  f 10.90000  0.1404000     11.03000  0.1987000     10.78000  0.1983000     0.2540000      0.2807000 
1 1 1 9  27 4  o 12.91000  0.1480000     12.86000  0.2080000     12.96000  0.2106000     -0.9904000E-01 0.2960000 
1 1 1 9  27 5  o 8.679000  0.1432000     8.754000  0.2033000     8.603000  0.2017000     0.1507000      0.2863000 
1 1 1 9  27 6  o 19.39000  0.1814000     19.33000  0.2569000     19.45000  0.2560000     -0.1175000     0.3627000 
1 1 1 9  27 7  o 4.772000  0.1876000     4.709000  0.2695000     4.836000  0.2610000     -0.1275000     0.3752000 
1 1 1 9  27 8  o 2.383000  0.3524000     2.589000  0.4606000     2.178000  0.5336000     0.4115000      0.7049000 
1 1 1 9  27 9  f 7.694000  0.1661000     7.693000  0.2363000     7.694000  0.2333000     -0.7582000E-03 0.3321000 
1 1 1 9  27 10 o 8.592000  0.2045000     8.671000  0.3310000     8.513000  0.2402000     0.1575000      0.4090000 
1 1 1 9  27 11 o 11.63000  0.2131000     11.52000  0.2400000     11.74000  0.3522000     -0.2279000     0.4262000 
1 1 1 9  27 12 o 14.19000  0.1781000     14.19000  0.2515000     14.19000  0.2523000     0.5856000E-03  0.3562000 
1 1 1 9  27 13 o 1.853000  0.4526000     1.374000  0.6005000     2.333000  0.6773000     -0.9596000     0.9052000 
1 1 1 9  27 14 o 9.158000  0.2191000     8.960000  0.3465000     9.357000  0.2683000     -0.3975000     0.4382000 
1 1 1 9  27 15 o 8.255000  0.2435000     8.012000  0.3836000     8.498000  0.3002000     -0.4869000     0.4871000 
1 1 1 9  27 16 o 2.252000  0.5846000     1.676000  0.7466000     2.827000  0.8997000     -1.152000      1.169000  
1 1 1 9  27 17 o 1.741000  0.5548000     1.671000  0.7395000     1.812000  0.8272000     -0.1415000     1.110000  
1 1 1 9  27 18 o 5.014000  0.3886000     4.570000  0.5816000     5.459000  0.5155000     -0.8891000     0.7771000 
1 1 1 9  27 19 o 2.168000  0.5499000     2.379000  0.7721000     1.958000  0.7831000     0.4213000      1.100000  
1 1 1 9  27 20 o 1.838000  0.4944000     2.326000  0.7594000     1.349000  0.6333000     0.9770000      0.9888000 
1 1 1 9  27 21 o 4.217000  0.4017000     4.194000  0.5698000     4.239000  0.5662000     -0.4426000E-01 0.8033000 
1 1 1 9  27 22 o 1.627000  0.5448000     1.492000  0.6790000     1.763000  0.8521000     -0.2704000     1.090000  
1 1 1 9  27 23 o 1.469000  0.5127000     1.775000  0.8583000     1.162000  0.5612000     0.6132000      1.025000  
1 1 1 9  27 24 o 1.613000  0.4966000     1.694000  0.7016000     1.532000  0.7030000     0.1614000      0.9932000 
1 1 1 9  28 0  o 7.838000  0.2008000     7.838000  0.2008000     7.838000  0.2008000     0.000000       0.000000  
1 1 1 9  28 1  o 14.79000  0.1538000     14.83000  0.2181000     14.74000  0.2170000     0.9380000E-01  0.3076000 
1 1 1 9  28 2  o 19.92000  0.1820000     19.70000  0.2557000     20.13000  0.2590000     -0.4209000     0.3640000 
1 1 1 9  28 3  o 9.076000  0.1409000     9.310000  0.1986000     8.842000  0.1997000     0.4674000      0.2817000 
1 1 1 9  28 4  o 5.296000  0.1673000     5.301000  0.2326000     5.292000  0.2406000     0.8210000E-02  0.3346000 
1 1 1 9  28 5  o 13.36000  0.1516000     13.50000  0.2148000     13.22000  0.2141000     0.2817000      0.3033000 
1 1 1 9  28 6  f 15.41000  0.1611000     15.51000  0.2285000     15.32000  0.2271000     0.1935000      0.3222000 
1 1 1 9  28 7  o 11.78000  0.1516000     11.94000  0.2145000     11.62000  0.2143000     0.3155000      0.3032000 
1 1 1 9  28 8  o 22.48000  0.2049000     22.37000  0.2892000     22.59000  0.2904000     -0.2204000     0.4098000 
1 1 1 9  28 9  o 8.656000  0.1624000     8.771000  0.2300000     8.542000  0.2295000     0.2288000      0.3249000 
1 1 1 9  28 10 o 11.17000  0.1990000     11.52000  0.2325000     10.82000  0.3231000     0.6929000      0.3980000 
1 1 1 9  28 11 o 2.658000  0.4850000     2.923000  0.7490000     2.394000  0.6163000     0.5296000      0.9700000 
1 1 1 9  28 12 o 2.151000  0.4723000     2.094000  0.6771000     2.208000  0.6586000     -0.1132000     0.9445000 
1 1 1 9  28 13 f 4.767000  0.2689000     4.760000  0.3837000     4.774000  0.3767000     -0.1491000E-01 0.5377000 
1 1 1 9  28 14 o 3.995000  0.3976000     3.759000  0.6500000     4.230000  0.4580000     -0.4706000     0.7952000 
1 1 1 9  28 15 o 6.586000  0.2821000     6.473000  0.4434000     6.698000  0.3487000     -0.2249000     0.5641000 
1 1 1 9  28 16 o 1.931000  0.5562000     2.548000  0.9229000     1.314000  0.6209000     1.234000       1.112000  
1 1 1 9  28 17 o 12.27000  0.2587000     12.35000  0.3548000     12.19000  0.3765000     0.1618000      0.5174000 
1 1 1 9  28 18 o 2.003000  0.5564000     2.150000  0.7926000     1.856000  0.7813000     0.2943000      1.113000  
1 1 1 9  28 19 o 2.069000  0.5506000     2.233000  0.7822000     1.906000  0.7751000     0.3264000      1.101000  
1 1 1 9  28 20 o 1.825000  0.5091000     2.186000  0.7745000     1.465000  0.6610000     0.7211000      1.018000  
1 1 1 9  28 21 o 1.530000  0.4793000     1.591000  0.6941000     1.468000  0.6613000     0.1234000      0.9587000 
1 1 1 9  28 22 o 1.775000  0.5171000     2.106000  0.7583000     1.445000  0.7033000     0.6611000      1.034000  
1 1 1 9  28 23 o 1.966000  0.5722000     2.484000  0.9395000     1.448000  0.6533000     1.036000       1.144000  
1 1 1 9  28 24 o 1.182000  0.4042000     1.174000  0.5628000     1.190000  0.5802000     -0.1564000E-01 0.8083000 
1 1 1 9  29 0  o 2.753000  0.4060000     2.753000  0.4060000     2.753000  0.4060000     -0.000000      0.000000  
1 1 1 9  29 1  o 16.19000  0.1620000     15.89000  0.2274000     16.50000  0.2306000     -0.6086000     0.3239000 
1 1 1 9  29 2  o 9.246000  0.1425000     9.306000  0.2018000     9.187000  0.2014000     0.1198000      0.2851000 
1 1 1 9  29 3  o 15.51000  0.1595000     15.24000  0.2241000     15.78000  0.2270000     -0.5411000     0.3190000 
1 1 1 9  29 4  o 18.20000  0.1736000     18.32000  0.2466000     18.08000  0.2445000     0.2408000      0.3472000 
1 1 1 9  29 5  o 7.985000  0.1483000     8.310000  0.2061000     7.661000  0.2133000     0.6499000      0.2966000 
1 1 1 9  29 6  o 19.54000  0.1843000     19.58000  0.2612000     19.50000  0.2601000     0.8802000E-01  0.3686000 
1 1 1 9  29 7  o 1.542000  0.3961000     1.663000  0.5694000     1.421000  0.5507000     0.2416000      0.7921000 
1 1 1 9  29 8  o 7.255000  0.1690000     7.196000  0.2404000     7.315000  0.2375000     -0.1190000     0.3379000 
1 1 1 9  29 9  o 2.930000  0.4235000     2.530000  0.7334000     3.330000  0.4236000     -0.8001000     0.8470000 
1 1 1 9  29 10 o 9.994000  0.2111000     10.19000  0.2336000     9.796000  0.3516000     0.3970000      0.4221000 
1 1 1 9  29 11 o 20.89000  0.2034000     20.53000  0.2848000     21.26000  0.2905000     -0.7337000     0.4068000 
1 1 1 9  29 12 o 6.392000  0.2165000     6.625000  0.2981000     6.159000  0.3142000     0.4663000      0.4331000 
1 1 1 9  29 13 o 3.654000  0.3649000     3.680000  0.5205000     3.628000  0.5114000     0.5256000E-01  0.7297000 
1 1 1 9  29 14 o 7.805000  0.2406000     7.621000  0.3722000     7.989000  0.3049000     -0.3684000     0.4811000 
1 1 1 9  29 15 o 3.545000  0.4764000     3.878000  0.7097000     3.211000  0.6358000     0.6670000      0.9529000 
1 1 1 9  29 16 o 6.271000  0.4292000     6.409000  0.5500000     6.133000  0.6590000     0.2759000      0.8583000 
1 1 1 9  29 17 o 3.368000  0.7658000     3.292000  1.276000      3.443000  0.8472000     -0.1510000     1.532000  
1 1 1 9  29 18 o 2.315000  0.5809000     2.421000  0.8021000     2.209000  0.8406000     0.2115000      1.162000  
1 1 1 9  29 19 o 2.335000  0.5336000     2.865000  0.7590000     1.804000  0.7503000     1.061000       1.067000  
1 1 1 9  29 20 o 1.822000  0.5173000     1.669000  0.7115000     1.974000  0.7512000     -0.3048000     1.035000  
1 1 1 9  29 21 o 3.279000  0.4830000     3.485000  0.6609000     3.072000  0.7047000     0.4126000      0.9661000 
1 1 1 9  29 22 o 1.328000  0.4352000     1.481000  0.6603000     1.174000  0.5670000     0.3066000      0.8703000 
1 1 1 9  29 23 o 1.151000  0.3934000     1.194000  0.5709000     1.108000  0.5413000     0.8537000E-01  0.7867000 
1 1 1 9  29 24 o 1.043000  0.3654000     1.133000  0.5495000     0.9519000 0.4819000     0.1814000      0.7309000 
1 1 1 9  30 0  o 11.48000  0.2058000     11.48000  0.2058000     11.48000  0.2058000     -0.000000      0.000000  
1 1 1 9  30 1  o 2.835000  0.2754000     2.995000  0.3660000     2.676000  0.4115000     0.3194000      0.5507000 
1 1 1 9  30 2  o 23.71000  0.2072000     23.52000  0.2914000     23.90000  0.2946000     -0.3839000     0.4144000 
1 1 1 9  30 3  o 12.09000  0.1471000     12.01000  0.2079000     12.16000  0.2083000     -0.1450000     0.2943000 
1 1 1 9  30 4  o 18.88000  0.1929000     18.82000  0.2521000     18.94000  0.2921000     -0.1185000     0.3859000 
1 1 1 9  30 5  o 9.494000  0.1489000     9.670000  0.2089000     9.318000  0.2122000     0.3515000      0.2978000 
1 1 1 9  30 6  o 14.73000  0.1623000     14.85000  0.2304000     14.62000  0.2286000     0.2286000      0.3246000 
1 1 1 9  30 7  o 10.00000  0.1550000     10.15000  0.2189000     9.857000  0.2196000     0.2918000      0.3100000 
1 1 1 9  30 8  o 12.28000  0.1614000     12.06000  0.2293000     12.51000  0.2270000     -0.4466000     0.3227000 
1 1 1 9  30 9  o 23.98000  0.2662000     23.84000  0.3069000     24.13000  0.4351000     -0.2957000     0.5325000 
1 1 1 9  30 10 f 7.241000  0.2307000     7.095000  0.3784000     7.386000  0.2639000     -0.2907000     0.4613000 
1 1 1 9  30 11 o 6.996000  0.2001000     6.880000  0.2834000     7.113000  0.2827000     -0.2327000     0.4003000 
1 1 1 9  30 12 o 15.88000  0.1857000     15.74000  0.2622000     16.03000  0.2630000     -0.2885000     0.3714000 
1 1 1 9  30 13 o 1.523000  0.4379000     1.154000  0.5461000     1.891000  0.6847000     -0.7371000     0.8758000 
1 1 1 9  30 14 o 7.437000  0.2591000     7.150000  0.4118000     7.724000  0.3146000     -0.5738000     0.5182000 
1 1 1 9  30 15 o 2.232000  0.5577000     2.098000  0.8130000     2.366000  0.7637000     -0.2676000     1.115000  
1 1 1 9  30 16 o 2.696000  0.5483000     1.407000  0.6434000     3.984000  0.8880000     -2.577000      1.097000  
1 1 1 9  30 17 o 5.642000  0.6655000     5.223000  1.267000      6.061000  0.4075000     -0.8379000     1.331000  
1 1 1 9  30 18 o 2.188000  0.5722000     2.067000  0.7777000     2.309000  0.8395000     -0.2427000     1.144000  
1 1 1 9  30 19 o 2.050000  0.5257000     1.656000  0.7099000     2.445000  0.7755000     -0.7886000     1.051000  
1 1 1 9  30 20 o 2.032000  0.5411000     2.276000  0.7861000     1.787000  0.7438000     0.4891000      1.082000  
1 1 1 9  30 21 o 2.037000  0.5320000     1.817000  0.7517000     2.256000  0.7530000     -0.4390000     1.064000  
1 1 1 9  30 22 o 1.961000  0.5114000     1.446000  0.6514000     2.476000  0.7886000     -1.030000      1.023000  
1 1 1 9  30 23 o 1.296000  0.4284000     1.259000  0.5925000     1.334000  0.6189000     -0.7408000E-01 0.8568000 
1 1 1 9  30 24 o 1.632000  0.5051000     1.501000  0.6608000     1.762000  0.7642000     -0.2604000     1.010000  
1 1 1 9  31 0  o 10.76000  0.2038000     10.76000  0.2038000     10.76000  0.2038000     0.000000       0.000000  
1 1 1 9  31 1  o 4.801000  0.1841000     4.859000  0.2620000     4.742000  0.2589000     0.1176000      0.3683000 
1 1 1 9  31 2  o 18.91000  0.1784000     19.13000  0.2540000     18.69000  0.2507000     0.4399000      0.3569000 
1 1 1 9  31 3  o 16.01000  0.1641000     16.22000  0.2337000     15.80000  0.2305000     0.4201000      0.3283000 
1 1 1 9  31 4  o 12.78000  0.1521000     12.67000  0.2154000     12.88000  0.2148000     -0.2161000     0.3042000 
1 1 1 9  31 5  o 7.535000  0.1590000     7.668000  0.2215000     7.401000  0.2281000     0.2673000      0.3180000 
1 1 1 9  31 6  o 19.49000  0.1867000     19.40000  0.2635000     19.57000  0.2647000     -0.1724000     0.3735000 
1 1 1 9  31 7  o 13.25000  0.1610000     13.24000  0.2284000     13.26000  0.2268000     -0.2272000E-01 0.3219000 
1 1 1 9  31 8  o 5.427000  0.2644000     5.617000  0.3974000     5.238000  0.3487000     0.3787000      0.5288000 
1 1 1 9  31 9  o 7.645000  0.2367000     7.652000  0.2778000     7.638000  0.3832000     0.1362000E-01  0.4733000 
1 1 1 9  31 10 o 18.16000  0.2018000     17.84000  0.3014000     18.48000  0.2684000     -0.6378000     0.4036000 
1 1 1 9  31 11 o 6.350000  0.2411000     6.395000  0.3076000     6.304000  0.3713000     0.9070000E-01  0.4822000 
1 1 1 9  31 12 o 8.716000  0.1955000     8.565000  0.2784000     8.867000  0.2745000     -0.3013000     0.3909000 
1 1 1 9  31 13 o 6.762000  0.2283000     6.741000  0.3274000     6.783000  0.3181000     -0.4238000E-01 0.4565000 
1 1 1 9  31 14 o 4.617000  0.3964000     3.830000  0.6893000     5.405000  0.3919000     -1.576000      0.7929000 
1 1 1 9  31 15 o 4.777000  0.6555000     3.627000  1.252000      5.928000  0.3904000     -2.301000      1.311000  
1 1 1 9  31 16 o 1.960000  0.5686000     1.582000  0.6852000     2.339000  0.9076000     -0.7570000     1.137000  
1 1 1 9  31 17 o 5.897000  0.2916000     5.911000  0.3627000     5.884000  0.4567000     0.2718000E-01  0.5832000 
1 1 1 9  31 18 f 1.721000  0.5209000     1.429000  0.6574000     2.013000  0.8081000     -0.5838000     1.042000  
1 1 1 9  31 19 o 3.781000  0.4328000     3.921000  0.5810000     3.640000  0.6416000     0.2810000      0.8656000 
1 1 1 9  31 20 o 1.925000  0.5085000     1.501000  0.6692000     2.350000  0.7658000     -0.8493000     1.017000  
1 1 1 9  31 21 f 2.223000  0.6071000     2.221000  0.7832000     2.224000  0.9279000     -0.2283000E-02 1.214000  
1 1 1 9  31 22 o 2.219000  0.5859000     2.329000  0.8655000     2.110000  0.7898000     0.2183000      1.172000  
1 1 1 9  31 23 o 1.333000  0.4343000     1.432000  0.6417000     1.234000  0.5855000     0.1980000      0.8686000 
1 1 1 9  31 24 f 1.641000  0.4881000     1.908000  0.7284000     1.374000  0.6501000     0.5340000      0.9763000 
1 1 1 9  32 0  f 23.84000  0.2954000     23.84000  0.2954000     23.84000  0.2954000     0.000000       0.000000  
1 1 1 9  32 1  o 16.53000  0.1666000     16.55000  0.2359000     16.50000  0.2353000     0.4459000E-01  0.3332000 
1 1 1 9  32 2  f 14.75000  0.1591000     14.82000  0.2250000     14.69000  0.2250000     0.1341000      0.3181000 
1 1 1 9  32 3  o 7.582000  0.1563000     7.460000  0.2224000     7.704000  0.2198000     -0.2440000     0.3127000 
1 1 1 9  32 4  o 19.47000  0.1848000     19.48000  0.2611000     19.45000  0.2614000     0.2287000E-01  0.3695000 
1 1 1 9  32 5  o 9.131000  0.1535000     9.046000  0.2174000     9.216000  0.2167000     -0.1705000     0.3069000 
1 1 1 9  32 6  o 8.810000  0.1594000     8.891000  0.2261000     8.729000  0.2247000     0.1621000      0.3188000 
1 1 1 9  32 7  o 9.344000  0.1996000     9.218000  0.3283000     9.470000  0.2271000     -0.2519000     0.3992000 
1 1 1 9  32 8  o 5.087000  0.3002000     5.087000  0.3002000     ?         ?             ?              ?         
1 1 1 9  32 9  o 15.32000  0.2121000     14.89000  0.3434000     15.74000  0.2490000     -0.8583000     0.4242000 
1 1 1 9  32 10 o 12.43000  0.1726000     12.20000  0.2448000     12.66000  0.2434000     -0.4572000     0.3452000 
1 1 1 9  32 11 o 7.045000  0.2061000     7.380000  0.2834000     6.709000  0.2994000     0.6706000      0.4122000 
1 1 1 9  32 12 o 4.248000  0.3062000     4.250000  0.4297000     4.245000  0.4365000     0.5290000E-02  0.6125000 
1 1 1 9  32 13 o 3.858000  0.3638000     3.982000  0.5144000     3.735000  0.5146000     0.2469000      0.7276000 
1 1 1 9  32 14 o 3.062000  0.5165000     2.965000  0.8212000     3.159000  0.6268000     -0.1935000     1.033000  
1 1 1 9  32 15 o 3.110000  0.7383000     4.199000  1.216000      2.021000  0.8385000     2.177000       1.477000  
1 1 1 9  32 16 o 2.746000  0.6423000     3.092000  0.8942000     2.399000  0.9224000     0.6930000      1.285000  
1 1 1 9  32 17 o 4.810000  0.3359000     4.584000  0.4450000     5.036000  0.5032000     -0.4528000     0.6717000 
1 1 1 9  32 18 o 3.902000  0.4764000     4.162000  0.6511000     3.642000  0.6957000     0.5197000      0.9529000 
1 1 1 9  32 19 f 1.787000  0.5094000     2.004000  0.7451000     1.571000  0.6947000     0.4339000      1.019000  
1 1 1 9  32 20 o 1.245000  0.4175000     1.236000  0.5882000     1.253000  0.5927000     -0.1675000E-01 0.8350000 
1 1 1 9  32 21 o 1.373000  0.4624000     1.358000  0.6254000     1.388000  0.6812000     -0.2971000E-01 0.9247000 
1 1 1 9  32 22 o 1.496000  0.5212000     1.848000  0.8845000     1.143000  0.5517000     0.7049000      1.042000  
1 1 1 9  32 23 o 1.385000  0.4463000     1.410000  0.6420000     1.361000  0.6203000     0.4933000E-01  0.8927000 
1 1 1 9  33 0  o 33.05000  0.3854000     33.05000  0.3854000     33.05000  0.3854000     -0.000000      0.000000  
1 1 1 9  33 1  o 13.74000  0.1567000     13.85000  0.2221000     13.63000  0.2210000     0.2224000      0.3133000 
1 1 1 9  33 2  o 10.54000  0.1505000     10.60000  0.2113000     10.49000  0.2143000     0.1047000      0.3010000 
1 1 1 9  33 3  o 10.90000  0.1518000     10.80000  0.2140000     11.00000  0.2154000     -0.2060000     0.3036000 
1 1 1 9  33 4  o 13.63000  0.1594000     13.79000  0.2263000     13.47000  0.2246000     0.3212000      0.3188000 
1 1 1 9  33 5  o 10.83000  0.1564000     11.00000  0.2201000     10.65000  0.2223000     0.3434000      0.3128000 
1 1 1 9  33 6  o 20.79000  0.2139000     20.86000  0.3258000     20.72000  0.2773000     0.1315000      0.4279000 
1 1 1 9  33 7  o 7.436000  0.2607000     7.088000  0.2814000     7.784000  0.4391000     -0.6957000     0.5215000 
1 1 1 9  33 8  o 3.740000  0.3632000     4.186000  0.4963000     3.293000  0.5304000     0.8932000      0.7264000 
1 1 1 9  33 9  o 11.73000  0.1684000     11.99000  0.2400000     11.46000  0.2362000     0.5316000      0.3368000 
1 1 1 9  33 10 o 9.757000  0.1774000     9.637000  0.2529000     9.878000  0.2489000     -0.2411000     0.3548000 
1 1 1 9  33 11 o 2.843000  0.4352000     3.008000  0.5813000     2.677000  0.6480000     0.3315000      0.8705000 
1 1 1 9  33 12 o 2.607000  0.4699000     2.752000  0.6290000     2.462000  0.6983000     0.2900000      0.9398000 
1 1 1 9  33 13 o 5.038000  0.2934000     4.955000  0.4209000     5.122000  0.4089000     -0.1669000     0.5869000 
1 1 1 9  33 14 o 4.124000  0.4283000     3.853000  0.7173000     4.394000  0.4682000     -0.5414000     0.8566000 
1 1 1 9  33 15 o 2.050000  0.5817000     2.198000  0.8286000     1.901000  0.8167000     0.2967000      1.163000  
1 1 1 9  33 16 o 4.769000  0.3910000     5.042000  0.5737000     4.495000  0.5313000     0.5475000      0.7819000 
1 1 1 9  33 17 o 1.763000  0.5130000     1.517000  0.6560000     2.009000  0.7888000     -0.4916000     1.026000  
1 1 1 9  33 18 o 2.760000  0.5219000     2.342000  0.8416000     3.178000  0.6174000     -0.8368000     1.044000  
1 1 1 9  33 19 o 2.249000  0.5095000     2.876000  0.7381000     1.622000  0.7026000     1.254000       1.019000  
1 1 1 9  33 20 o 1.614000  0.4858000     1.674000  0.7010000     1.554000  0.6728000     0.1203000      0.9716000 
1 1 1 9  33 21 o 2.864000  0.5092000     2.983000  0.6607000     2.746000  0.7751000     0.2369000      1.018000  
1 1 1 9  33 22 o 1.860000  0.5157000     1.680000  0.7092000     2.040000  0.7490000     -0.3605000     1.031000  
1 1 1 9  33 23 f 0.9516000 0.3377000     1.046000  0.5165000     0.8573000 0.4350000     0.1884000      0.6753000 
1 1 1 9  34 0  o 26.47000  0.3230000     26.47000  0.3230000     26.47000  0.3230000     -0.000000      0.000000  
1 1 1 9  34 1  o 25.10000  0.2197000     24.73000  0.3072000     25.48000  0.3143000     -0.7544000     0.4395000 
1 1 1 9  34 2  o 21.13000  0.1953000     20.94000  0.2749000     21.33000  0.2776000     -0.3840000     0.3907000 
1 1 1 9  34 3  o 6.753000  0.1694000     6.885000  0.2356000     6.621000  0.2434000     0.2642000      0.3388000 
1 1 1 9  34 4  o 4.707000  0.2086000     4.556000  0.3014000     4.858000  0.2886000     -0.3017000     0.4173000 
1 1 1 9  34 5  f 19.56000  0.2053000     19.65000  0.3123000     19.47000  0.2667000     0.1745000      0.4107000 
1 1 1 9  34 6  o 9.901000  0.2758000     9.880000  0.3352000     9.922000  0.4380000     -0.4223000E-01 0.5515000 
1 1 1 9  34 7  o 6.788000  0.2371000     6.871000  0.3549000     6.704000  0.3146000     0.1671000      0.4743000 
1 1 1 9  34 8  o 9.600000  0.1684000     9.555000  0.2372000     9.646000  0.2391000     -0.9142000E-01 0.3368000 
1 1 1 9  34 9  o 2.739000  0.3904000     2.742000  0.5567000     2.736000  0.5476000     0.6273000E-02  0.7809000 
1 1 1 9  34 10 o 3.963000  0.3009000     4.140000  0.4192000     3.787000  0.4317000     0.3535000      0.6018000 
1 1 1 9  34 11 o 5.746000  0.2412000     5.700000  0.3463000     5.792000  0.3358000     -0.9141000E-01 0.4824000 
1 1 1 9  34 12 o 2.218000  0.4984000     2.224000  0.7144000     2.212000  0.6950000     0.1145000E-01  0.9967000 
1 1 1 9  34 13 o 4.304000  0.3314000     4.569000  0.4602000     4.039000  0.4769000     0.5300000      0.6627000 
1 1 1 9  34 14 o 6.441000  0.5003000     7.145000  0.9221000     5.736000  0.3883000     1.409000       1.001000  
1 1 1 9  34 15 o 4.713000  0.4796000     5.335000  0.5496000     4.091000  0.7861000     1.244000       0.9592000 
1 1 1 9  34 16 o 4.491000  0.3651000     4.677000  0.4296000     4.305000  0.5905000     0.3726000      0.7302000 
1 1 1 9  34 17 o 3.276000  0.4613000     4.308000  0.4868000     2.245000  0.7836000     2.064000       0.9225000 
1 1 1 9  34 18 o 5.718000  0.2795000     5.634000  0.3925000     5.802000  0.3980000     -0.1679000     0.5590000 
1 1 1 9  34 19 o 2.294000  0.5330000     1.934000  0.7436000     2.653000  0.7639000     -0.7188000     1.066000  
1 1 1 9  34 20 o 2.468000  0.5355000     1.976000  0.7569000     2.960000  0.7577000     -0.9841000     1.071000  
1 1 1 9  34 21 o 1.649000  0.5058000     1.501000  0.6764000     1.796000  0.7523000     -0.2953000     1.012000  
1 1 1 9  34 22 o 1.504000  0.4647000     1.291000  0.6046000     1.718000  0.7059000     -0.4274000     0.9294000 
1 1 1 9  34 23 o 0.9856000 0.3478000     1.040000  0.5151000     0.9314000 0.4676000     0.1085000      0.6957000 
1 1 1 9  35 0  o 6.811000  0.2394000     6.811000  0.2394000     6.811000  0.2394000     0.000000       0.000000  
1 1 1 9  35 1  o 11.96000  0.1558000     12.11000  0.2200000     11.82000  0.2206000     0.2833000      0.3116000 
1 1 1 9  35 2  o 14.89000  0.1650000     15.17000  0.2347000     14.60000  0.2321000     0.5694000      0.3301000 
1 1 1 9  35 3  o 9.226000  0.1582000     9.475000  0.2215000     8.977000  0.2260000     0.4980000      0.3164000 
1 1 1 9  35 4  o 14.16000  0.2042000     14.43000  0.3366000     13.89000  0.2314000     0.5344000      0.4084000 
1 1 1 9  35 5  o 2.377000  0.7102000     2.377000  0.7102000     ?         ?             ?              ?         
1 1 1 9  35 6  f 8.538000  0.2241000     8.426000  0.3339000     8.650000  0.2990000     -0.2238000     0.4482000 
1 1 1 9  35 7  o 6.874000  0.1875000     6.933000  0.2723000     6.816000  0.2579000     0.1166000      0.3751000 
1 1 1 9  35 8  o 11.57000  0.1693000     11.24000  0.2410000     11.90000  0.2378000     -0.6559000     0.3386000 
1 1 1 9  35 9  o 5.623000  0.2226000     5.284000  0.3325000     5.962000  0.2962000     -0.6774000     0.4453000 
1 1 1 9  35 10 o 6.857000  0.2063000     7.004000  0.2900000     6.710000  0.2934000     0.2946000      0.4125000 
1 1 1 9  35 11 o 1.639000  0.4653000     1.500000  0.6403000     1.779000  0.6754000     -0.2795000     0.9307000 
1 1 1 9  35 12 o 4.333000  0.3299000     4.179000  0.4753000     4.488000  0.4577000     -0.3096000     0.6598000 
1 1 1 9  35 13 o 1.998000  0.5358000     1.894000  0.7744000     2.103000  0.7406000     -0.2090000     1.072000  
1 1 1 9  35 14 o 4.235000  0.5337000     5.188000  0.6261000     3.283000  0.8644000     1.905000       1.067000  
1 1 1 9  35 15 o 3.235000  0.5567000     3.291000  0.8759000     3.179000  0.6873000     0.1121000      1.113000  
1 1 1 9  35 16 o 2.084000  0.5350000     1.943000  0.7213000     2.224000  0.7904000     -0.2812000     1.070000  
1 1 1 9  35 17 o 4.246000  0.3790000     4.161000  0.4981000     4.331000  0.5714000     -0.1701000     0.7580000 
1 1 1 9  35 18 f 3.413000  0.4233000     3.600000  0.5816000     3.226000  0.6153000     0.3737000      0.8467000 
1 1 1 9  35 19 o 1.770000  0.5125000     1.963000  0.7960000     1.577000  0.6458000     0.3864000      1.025000  
1 1 1 9  35 20 o 2.764000  0.6766000     2.823000  0.7659000     2.704000  1.116000      0.1188000      1.353000  
1 1 1 9  35 21 o 1.806000  0.5978000     2.363000  1.040000      1.250000  0.5894000     1.113000       1.196000  
1 1 1 9  35 22 o 1.047000  0.3644000     1.190000  0.5687000     0.9048000 0.4557000     0.2852000      0.7287000 
1 1 1 9  35 23 o 2.795000  0.4947000     2.098000  0.7607000     3.491000  0.6326000     -1.394000      0.9894000 
1 1 1 9  36 0  f 9.421000  0.2248000     9.421000  0.2248000     9.421000  0.2248000     0.000000       0.000000  
1 1 1 9  36 1  o 9.340000  0.1574000     9.520000  0.2232000     9.161000  0.2219000     0.3592000      0.3147000 
1 1 1 9  36 2  o 24.86000  0.2385000     25.11000  0.3635000     24.62000  0.3089000     0.4912000      0.4770000 
1 1 1 9  36 3  o 22.86000  0.2713000     23.34000  0.4249000     22.38000  0.3376000     0.9647000      0.5427000 
1 1 1 9  36 4  o 29.82000  0.4170000     29.82000  0.4170000     ?         ?             ?              ?         
1 1 1 9  36 5  o 11.47000  0.2093000     11.59000  0.3174000     11.34000  0.2729000     0.2421000      0.4185000 
1 1 1 9  36 6  o 17.16000  0.1814000     17.32000  0.2583000     16.99000  0.2548000     0.3294000      0.3629000 
1 1 1 9  36 7  o 16.79000  0.1818000     16.74000  0.2569000     16.84000  0.2573000     -0.9634000E-01 0.3636000 
1 1 1 9  36 8  o 4.269000  0.2616000     4.393000  0.3674000     4.144000  0.3726000     0.2489000      0.5233000 
1 1 1 9  36 9  o 5.624000  0.2256000     5.445000  0.3291000     5.802000  0.3086000     -0.3565000     0.4511000 
1 1 1 9  36 10 o 2.714000  0.4334000     2.644000  0.6246000     2.784000  0.6011000     -0.1395000     0.8668000 
1 1 1 9  36 11 o 5.693000  0.2501000     5.675000  0.3576000     5.711000  0.3498000     -0.3639000E-01 0.5002000 
1 1 1 9  36 12 o 7.608000  0.2240000     7.627000  0.3159000     7.590000  0.3177000     0.3739000E-01  0.4480000 
1 1 1 9  36 13 o 5.935000  0.5558000     5.772000  1.047000      6.098000  0.3741000     -0.3258000     1.112000  
1 1 1 9  36 14 o 3.853000  0.5288000     3.388000  0.7566000     4.319000  0.7389000     -0.9308000     1.058000  
1 1 1 9  36 15 o 4.173000  0.3778000     4.308000  0.5135000     4.039000  0.5543000     0.2689000      0.7556000 
1 1 1 9  36 16 o 2.017000  0.5316000     1.930000  0.7018000     2.105000  0.7986000     -0.1750000     1.063000  
1 1 1 9  36 17 o 2.850000  0.5198000     2.353000  0.7517000     3.347000  0.7180000     -0.9945000     1.040000  
1 1 1 9  36 18 o 1.853000  0.4948000     1.583000  0.6675000     2.122000  0.7306000     -0.5381000     0.9896000 
1 1 1 9  36 19 o 4.018000  0.3552000     3.844000  0.5189000     4.192000  0.4851000     -0.3486000     0.7103000 
1 1 1 9  36 20 f 1.478000  0.4734000     1.652000  0.6954000     1.303000  0.6426000     0.3484000      0.9469000 
1 1 1 9  36 21 o 1.515000  0.4892000     1.688000  0.7564000     1.341000  0.6205000     0.3477000      0.9783000 
1 1 1 9  36 22 o 1.286000  0.4260000     1.328000  0.6142000     1.243000  0.5905000     0.8478000E-01  0.8520000 
1 1 1 9  37 0  o 4.471000  0.6839000     4.471000  0.6839000     4.471000  0.6839000     0.000000       0.000000  
1 1 1 9  37 1  o 13.49000  0.3334000     13.76000  0.4667000     13.22000  0.4764000     0.5400000      0.6669000 
1 1 1 9  37 2  o 9.695000  0.3148000     9.695000  0.3148000     ?         ?             ?              ?         
1 1 1 9  37 3  o 8.769000  0.2886000     8.931000  0.3220000     8.607000  0.4789000     0.3243000      0.5771000 
1 1 1 9  37 4  o 13.90000  0.2024000     13.79000  0.3283000     14.02000  0.2367000     -0.2312000     0.4048000 
1 1 1 9  37 5  o 8.966000  0.1672000     9.199000  0.2355000     8.733000  0.2375000     0.4659000      0.3345000 
1 1 1 9  37 6  o 2.454000  0.4099000     2.464000  0.5819000     2.444000  0.5775000     0.2051000E-01  0.8198000 
1 1 1 9  37 7  o 6.232000  0.2059000     6.363000  0.2924000     6.101000  0.2900000     0.2615000      0.4118000 
1 1 1 9  37 8  f 2.763000  0.4080000     2.411000  0.6278000     3.115000  0.5214000     -0.7033000     0.8161000 
1 1 1 9  37 9  o 5.809000  0.2280000     5.575000  0.3319000     6.043000  0.3127000     -0.4683000     0.4560000 
1 1 1 9  37 10 o 4.902000  0.2701000     4.356000  0.4165000     5.449000  0.3438000     -1.093000      0.5401000 
1 1 1 9  37 11 o 6.905000  0.2272000     7.098000  0.3176000     6.712000  0.3249000     0.3854000      0.4544000 
1 1 1 9  37 12 o 4.968000  0.3067000     4.907000  0.4356000     5.030000  0.4320000     -0.1228000     0.6135000 
1 1 1 9  37 13 o 6.461000  0.5361000     6.195000  0.9522000     6.727000  0.4931000     -0.5323000     1.072000  
1 1 1 9  37 14 o 6.338000  0.3489000     6.754000  0.4963000     5.921000  0.4905000     0.8333000      0.6978000 
1 1 1 9  37 15 o 3.815000  0.3976000     3.644000  0.5568000     3.986000  0.5677000     -0.3424000     0.7952000 
1 1 1 9  37 16 o 3.736000  0.4403000     4.200000  0.4919000     3.272000  0.7305000     0.9274000      0.8807000 
1 1 1 9  37 17 o 5.117000  0.3178000     4.841000  0.4462000     5.394000  0.4526000     -0.5536000     0.6356000 
1 1 1 9  37 18 o 4.068000  0.3526000     4.021000  0.5040000     4.115000  0.4931000     -0.9371000E-01 0.7051000 
1 1 1 9  37 19 o 1.600000  0.4712000     1.283000  0.6236000     1.918000  0.7065000     -0.6357000     0.9423000 
1 1 1 9  37 20 o 1.728000  0.5064000     1.871000  0.7318000     1.586000  0.7001000     0.2852000      1.013000  
1 1 1 9  37 21 o 1.646000  0.4684000     1.176000  0.5632000     2.115000  0.7487000     -0.9390000     0.9368000 
1 1 1 9  37 22 o 1.114000  0.3826000     1.133000  0.5491000     1.094000  0.5330000     0.3827000E-01  0.7652000 
1 1 1 9  38 0  o 10.21000  0.3156000     10.21000  0.3156000     10.21000  0.3156000     -0.000000      0.000000  
1 1 1 9  38 1  o 5.178000  0.2649000     5.267000  0.3991000     5.088000  0.3483000     0.1783000      0.5297000 
1 1 1 9  38 2  o 6.350000  0.2055000     6.409000  0.3103000     6.292000  0.2695000     0.1170000      0.4110000 
1 1 1 9  38 3  o 27.04000  0.2366000     27.24000  0.3362000     26.84000  0.3330000     0.4064000      0.4732000 
1 1 1 9  38 4  o 10.11000  0.1646000     10.30000  0.2314000     9.921000  0.2343000     0.3771000      0.3293000 
1 1 1 9  38 5  o 13.15000  0.1696000     13.06000  0.2397000     13.24000  0.2399000     -0.1889000     0.3391000 
1 1 1 9  38 6  o 15.66000  0.1779000     15.61000  0.2517000     15.71000  0.2514000     -0.9717000E-01 0.3557000 
1 1 1 9  38 7  o 16.57000  0.1838000     16.63000  0.2602000     16.50000  0.2595000     0.1365000      0.3675000 
1 1 1 9  38 8  o 8.647000  0.1868000     8.465000  0.2685000     8.829000  0.2597000     -0.3646000     0.3736000 
1 1 1 9  38 9  o 10.43000  0.1829000     10.50000  0.2590000     10.36000  0.2584000     0.1320000      0.3659000 
1 1 1 9  38 10 o 8.849000  0.1941000     8.839000  0.2747000     8.858000  0.2743000     -0.1882000E-01 0.3882000 
1 1 1 9  38 11 o 1.774000  0.4789000     1.484000  0.6456000     2.065000  0.7077000     -0.5806000     0.9579000 
1 1 1 9  38 12 o 3.962000  0.4947000     3.034000  0.8925000     4.890000  0.4270000     -1.856000      0.9894000 
1 1 1 9  38 13 o 6.822000  0.4038000     7.122000  0.4205000     6.523000  0.6896000     0.5988000      0.8077000 
1 1 1 9  38 14 o 1.969000  0.5244000     1.564000  0.7069000     2.374000  0.7748000     -0.8095000     1.049000  
1 1 1 9  38 15 o 2.295000  0.5126000     2.596000  0.6944000     1.993000  0.7544000     0.6033000      1.025000  
1 1 1 9  38 16 o 2.050000  0.5352000     1.868000  0.7140000     2.232000  0.7975000     -0.3643000     1.070000  
1 1 1 9  38 17 o 6.806000  0.2608000     6.734000  0.3594000     6.878000  0.3781000     -0.1443000     0.5217000 
1 1 1 9  38 18 o 4.010000  0.3634000     3.751000  0.5427000     4.269000  0.4836000     -0.5178000     0.7269000 
1 1 1 9  38 19 o 2.610000  0.5674000     2.236000  0.8644000     2.984000  0.7352000     -0.7478000     1.135000  
1 1 1 9  38 20 o 1.365000  0.4776000     1.582000  0.7726000     1.148000  0.5619000     0.4338000      0.9553000 
1 1 1 9  38 21 o 1.834000  0.5094000     1.738000  0.7029000     1.931000  0.7376000     -0.1936000     1.019000  
1 1 1 9  38 22 o 1.041000  0.3637000     0.9834000 0.4905000     1.098000  0.5372000     -0.1148000     0.7275000 
1 1 1 9  39 0  o 26.21000  0.3268000     26.21000  0.3268000     26.21000  0.3268000     0.000000       0.000000  
1 1 1 9  39 1  o 5.258000  0.2166000     5.719000  0.2888000     4.797000  0.3229000     0.9228000      0.4332000 
1 1 1 9  39 2  o 15.73000  0.1754000     15.54000  0.2467000     15.91000  0.2494000     -0.3655000     0.3508000 
1 1 1 9  39 3  o 9.264000  0.1692000     9.426000  0.2367000     9.102000  0.2417000     0.3235000      0.3383000 
1 1 1 9  39 4  o 5.538000  0.2125000     5.694000  0.2970000     5.382000  0.3041000     0.3126000      0.4250000 
1 1 1 9  39 5  o 12.49000  0.1694000     12.72000  0.2408000     12.25000  0.2383000     0.4651000      0.3388000 
1 1 1 9  39 6  o 15.85000  0.1804000     15.72000  0.2535000     15.97000  0.2567000     -0.2498000     0.3608000 
1 1 1 9  39 7  o 9.781000  0.1798000     9.734000  0.2565000     9.829000  0.2521000     -0.9514000E-01 0.3597000 
1 1 1 9  39 8  o 5.367000  0.2455000     5.757000  0.3347000     4.976000  0.3591000     0.7813000      0.4909000 
1 1 1 9  39 9  o 15.69000  0.1877000     15.56000  0.2656000     15.83000  0.2654000     -0.2771000     0.3755000 
1 1 1 9  39 10 o 1.595000  0.4675000     1.647000  0.6692000     1.543000  0.6530000     0.1041000      0.9350000 
1 1 1 9  39 11 f 2.432000  0.4508000     1.588000  0.6692000     3.277000  0.6043000     -1.689000      0.9016000 
1 1 1 9  39 12 o 7.067000  0.3432000     6.825000  0.5186000     7.308000  0.4497000     -0.4835000     0.6864000 
1 1 1 9  39 13 o 1.578000  0.5094000     1.665000  0.7538000     1.490000  0.6853000     0.1742000      1.019000  
1 1 1 9  39 14 o 2.627000  0.5516000     2.465000  0.8254000     2.790000  0.7320000     -0.3244000     1.103000  
1 1 1 9  39 15 o 5.266000  0.2989000     5.252000  0.4039000     5.280000  0.4408000     -0.2813000E-01 0.5978000 
1 1 1 9  39 16 o 2.963000  0.4935000     2.528000  0.7176000     3.398000  0.6777000     -0.8700000     0.9870000 
1 1 1 9  39 17 o 1.327000  0.4365000     1.193000  0.5670000     1.462000  0.6637000     -0.2692000     0.8729000 
1 1 1 9  39 18 o 1.636000  0.4754000     1.700000  0.6795000     1.572000  0.6651000     0.1281000      0.9508000 
1 1 1 9  39 19 o 1.462000  0.4593000     1.411000  0.6220000     1.513000  0.6760000     -0.1018000     0.9187000 
1 1 1 9  39 20 o 2.454000  0.5403000     2.565000  0.8182000     2.343000  0.7058000     0.2227000      1.081000  
1 1 1 9  39 21 o 1.117000  0.3817000     1.302000  0.6030000     0.9323000 0.4681000     0.3699000      0.7633000 
1 1 1 9  39 22 o 1.204000  0.4324000     1.288000  0.6492000     1.119000  0.5713000     0.1688000      0.8648000 
1 1 1 9  40 0  o 6.248000  0.2826000     6.248000  0.2826000     6.248000  0.2826000     0.000000       0.000000  
1 1 1 9  40 1  o 5.989000  0.2024000     5.586000  0.2983000     6.391000  0.2737000     -0.8050000     0.4049000 
1 1 1 9  40 2  o 10.44000  0.1687000     10.20000  0.2396000     10.67000  0.2376000     -0.4727000     0.3374000 
1 1 1 9  40 3  o 6.629000  0.1935000     6.683000  0.2731000     6.574000  0.2740000     0.1087000      0.3869000 
1 1 1 9  40 4  o 13.61000  0.1720000     13.66000  0.2429000     13.55000  0.2437000     0.1107000      0.3441000 
1 1 1 9  40 5  o 10.30000  0.1743000     10.09000  0.2475000     10.52000  0.2455000     -0.4245000     0.3486000 
1 1 1 9  40 6  o 4.057000  0.2872000     4.053000  0.4078000     4.062000  0.4046000     -0.9223000E-02 0.5745000 
1 1 1 9  40 7  o 4.028000  0.3070000     4.057000  0.4384000     3.998000  0.4298000     0.5943000E-01  0.6139000 
1 1 1 9  40 8  o 6.989000  0.2107000     6.886000  0.3079000     7.091000  0.2877000     -0.2045000     0.4214000 
1 1 1 9  40 9  o 10.86000  0.1876000     10.92000  0.2639000     10.80000  0.2668000     0.1243000      0.3753000 
1 1 1 9  40 10 o 6.672000  0.2315000     6.950000  0.3180000     6.394000  0.3364000     0.5561000      0.4630000 
1 1 1 9  40 11 o 8.650000  0.2612000     8.989000  0.4219000     8.310000  0.3082000     0.6790000      0.5225000 
1 1 1 9  40 12 o 6.528000  0.4009000     7.152000  0.3443000     5.905000  0.7241000     1.246000       0.8017000 
1 1 1 9  40 13 o 3.538000  0.4858000     2.722000  0.8321000     4.353000  0.5015000     -1.631000      0.9715000 
1 1 1 9  40 14 o 2.177000  0.5558000     2.511000  0.8275000     1.844000  0.7422000     0.6670000      1.112000  
1 1 1 9  40 15 o 2.186000  0.5142000     2.427000  0.7110000     1.945000  0.7431000     0.4824000      1.028000  
1 1 1 9  40 16 o 3.815000  0.4371000     3.069000  0.6950000     4.560000  0.5302000     -1.490000      0.8741000 
1 1 1 9  40 17 o 2.080000  0.5219000     1.813000  0.7007000     2.347000  0.7737000     -0.5340000     1.044000  
1 1 1 9  40 18 o 2.178000  0.5529000     2.724000  0.8708000     1.632000  0.6816000     1.092000       1.106000  
1 1 1 9  40 19 o 1.649000  0.5036000     1.297000  0.5878000     2.002000  0.8178000     -0.7045000     1.007000  
1 1 1 9  40 20 f 1.221000  0.4019000     1.184000  0.5553000     1.258000  0.5812000     -0.7397000E-01 0.8038000 
1 1 1 9  40 21 o 1.376000  0.4332000     1.265000  0.6051000     1.488000  0.6201000     -0.2224000     0.8664000 
1 1 1 9  41 0  o 16.69000  0.2565000     16.69000  0.2565000     16.69000  0.2565000     0.000000       0.000000  
1 1 1 9  41 1  o 5.429000  0.2210000     5.049000  0.3245000     5.810000  0.3002000     -0.7614000     0.4421000 
1 1 1 9  41 2  o 5.916000  0.2132000     5.664000  0.3098000     6.169000  0.2930000     -0.5047000     0.4264000 
1 1 1 9  41 3  o 7.546000  0.1866000     7.334000  0.2635000     7.759000  0.2642000     -0.4252000     0.3731000 
1 1 1 9  41 4  o 7.307000  0.1908000     7.430000  0.2668000     7.183000  0.2728000     0.2466000      0.3816000 
1 1 1 9  41 5  o 7.721000  0.1882000     7.660000  0.2680000     7.782000  0.2643000     -0.1215000     0.3764000 
1 1 1 9  41 6  o 4.900000  0.2579000     4.867000  0.3647000     4.932000  0.3648000     -0.6523000E-01 0.5158000 
1 1 1 9  41 7  o 14.97000  0.1850000     14.76000  0.2631000     15.19000  0.2601000     -0.4246000     0.3699000 
1 1 1 9  41 8  o 2.888000  0.4329000     2.485000  0.6892000     3.291000  0.5240000     -0.8062000     0.8658000 
1 1 1 9  41 9  o 4.123000  0.3305000     3.914000  0.4837000     4.332000  0.4504000     -0.4180000     0.6610000 
1 1 1 9  41 10 o 3.242000  0.4340000     3.484000  0.5693000     2.999000  0.6553000     0.4848000      0.8680000 
1 1 1 9  41 11 o 1.808000  0.5172000     2.081000  0.7316000     1.535000  0.7313000     0.5466000      1.034000  
1 1 1 9  41 12 o 5.617000  0.3493000     6.370000  0.5237000     4.863000  0.4624000     1.507000       0.6986000 
1 1 1 9  41 13 o 3.750000  0.4789000     2.897000  0.8202000     4.603000  0.4947000     -1.705000      0.9578000 
1 1 1 9  41 14 o 4.026000  0.4122000     4.321000  0.5679000     3.731000  0.5975000     0.5900000      0.8243000 
1 1 1 9  41 15 o 6.262000  0.2642000     6.142000  0.3708000     6.382000  0.3764000     -0.2400000     0.5284000 
1 1 1 9  41 16 o 4.432000  0.3652000     4.354000  0.4932000     4.510000  0.5389000     -0.1557000     0.7305000 
1 1 1 9  41 17 o 1.484000  0.4596000     1.536000  0.6558000     1.433000  0.6442000     0.1037000      0.9193000 
1 1 1 9  41 18 o 1.776000  0.5405000     1.745000  0.7642000     1.806000  0.7645000     -0.6139000E-01 1.081000  
1 1 1 9  41 19 o 1.975000  0.5389000     1.570000  0.6988000     2.381000  0.8205000     -0.8104000     1.078000  
1 1 1 9  41 20 o 2.078000  0.4956000     1.987000  0.6943000     2.168000  0.7074000     -0.1809000     0.9912000 
1 1 1 9  41 21 o 1.035000  0.3618000     1.144000  0.5606000     0.9254000 0.4576000     0.2190000      0.7237000 
1 1 1 9  42 0  o 2.794000  0.6331000     2.794000  0.6331000     2.794000  0.6331000     0.000000       0.000000  
1 1 1 9  42 1  o 10.42000  0.1723000     10.49000  0.2425000     10.34000  0.2449000     0.1496000      0.3447000 
1 1 1 9  42 2  o 13.62000  0.1741000     13.74000  0.2469000     13.51000  0.2457000     0.2316000      0.3483000 
1 1 1 9  42 3  o 10.67000  0.1746000     10.73000  0.2465000     10.61000  0.2475000     0.1135000      0.3493000 
1 1 1 9  42 4  o 3.386000  0.3384000     3.325000  0.4823000     3.447000  0.4748000     -0.1218000     0.6768000 
1 1 1 9  42 5  f 15.50000  0.1831000     15.41000  0.2588000     15.58000  0.2590000     -0.1770000     0.3662000 
1 1 1 9  42 6  f 5.785000  0.2369000     5.883000  0.3358000     5.687000  0.3343000     0.1960000      0.4739000 
1 1 1 9  42 7  o 3.638000  0.3549000     3.546000  0.5134000     3.729000  0.4903000     -0.1832000     0.7099000 
1 1 1 9  42 8  o 10.66000  0.1899000     10.54000  0.2719000     10.78000  0.2652000     -0.2422000     0.3798000 
1 1 1 9  42 9  o 10.47000  0.1934000     10.25000  0.2733000     10.69000  0.2738000     -0.4372000     0.3868000 
1 1 1 9  42 10 o 1.797000  0.5304000     1.610000  0.7444000     1.984000  0.7557000     -0.3749000     1.061000  
1 1 1 9  42 11 o 1.247000  0.4307000     0.9580000 0.4813000     1.535000  0.7144000     -0.5774000     0.8614000 
1 1 1 9  42 12 o 1.783000  0.4815000     1.297000  0.6047000     2.269000  0.7494000     -0.9725000     0.9629000 
1 1 1 9  42 13 o 4.544000  0.3905000     4.152000  0.6344000     4.936000  0.4557000     -0.7835000     0.7811000 
1 1 1 9  42 14 o 2.983000  0.5238000     3.414000  0.7149000     2.553000  0.7657000     0.8608000      1.048000  
1 1 1 9  42 15 o 6.209000  0.2710000     6.028000  0.3920000     6.390000  0.3743000     -0.3624000     0.5420000 
1 1 1 9  42 16 o 1.820000  0.5094000     1.622000  0.6826000     2.018000  0.7564000     -0.3957000     1.019000  
1 1 1 9  42 17 o 1.872000  0.5174000     1.806000  0.7041000     1.938000  0.7584000     -0.1323000     1.035000  
1 1 1 9  42 18 o 1.663000  0.5157000     1.175000  0.5536000     2.151000  0.8702000     -0.9762000     1.031000  
1 1 1 9  42 19 o 1.620000  0.4613000     1.202000  0.5777000     2.038000  0.7194000     -0.8359000     0.9226000 
1 1 1 9  42 20 o 1.136000  0.3827000     1.203000  0.5634000     1.070000  0.5182000     0.1328000      0.7655000 
1 1 1 9  42 21 f 1.645000  0.5549000     1.738000  0.8140000     1.553000  0.7542000     0.1845000      1.110000  
1 1 1 9  43 0  o 2.809000  0.6337000     2.809000  0.6337000     2.809000  0.6337000     0.000000       0.000000  
1 1 1 9  43 1  o 8.160000  0.1906000     8.176000  0.2686000     8.144000  0.2707000     0.3233000E-01  0.3813000 
1 1 1 9  43 2  o 13.18000  0.1764000     13.21000  0.2484000     13.15000  0.2504000     0.5696000E-01  0.3527000 
1 1 1 9  43 3  o 11.72000  0.1904000     11.35000  0.2881000     12.08000  0.2489000     -0.7313000     0.3807000 
1 1 1 9  43 4  o 1.720000  0.4524000     2.073000  0.6762000     1.366000  0.6011000     0.7062000      0.9048000 
1 1 1 9  43 5  o 9.077000  0.1888000     8.994000  0.2706000     9.161000  0.2634000     -0.1668000     0.3777000 
1 1 1 9  43 6  o 2.069000  0.4895000     2.068000  0.6909000     2.070000  0.6936000     -0.2292000E-02 0.9790000 
1 1 1 9  43 7  f 3.008000  0.4375000     2.851000  0.6469000     3.165000  0.5891000     -0.3140000     0.8749000 
1 1 1 9  43 8  o 7.016000  0.2272000     6.737000  0.3303000     7.295000  0.3121000     -0.5582000     0.4544000 
1 1 1 9  43 9  o 2.080000  0.5236000     1.734000  0.7722000     2.425000  0.7073000     -0.6914000     1.047000  
1 1 1 9  43 10 o 4.079000  0.5167000     4.079000  0.5167000     ?         ?             ?              ?         
1 1 1 9  43 11 f 1.632000  0.4827000     2.173000  0.8066000     1.090000  0.5303000     1.082000       0.9653000 
1 1 1 9  43 12 o 3.071000  0.4949000     2.377000  0.8201000     3.764000  0.5543000     -1.387000      0.9899000 
1 1 1 9  43 13 o 2.345000  0.5309000     2.934000  0.7866000     1.756000  0.7132000     1.178000       1.062000  
1 1 1 9  43 14 o 3.581000  0.4186000     3.500000  0.5939000     3.661000  0.5899000     -0.1606000     0.8371000 
1 1 1 9  43 15 o 2.997000  0.4828000     2.697000  0.7186000     3.296000  0.6451000     -0.5992000     0.9656000 
1 1 1 9  43 16 o 1.516000  0.4738000     1.315000  0.6095000     1.718000  0.7256000     -0.4034000     0.9476000 
1 1 1 9  43 17 o 2.636000  0.5750000     2.350000  0.8894000     2.923000  0.7289000     -0.5734000     1.150000  
1 1 1 9  43 18 o 1.354000  0.4584000     1.104000  0.5378000     1.605000  0.7424000     -0.5007000     0.9167000 
1 1 1 9  43 19 o 1.969000  0.4864000     2.179000  0.6981000     1.759000  0.6774000     0.4198000      0.9728000 
1 1 1 9  43 20 o 1.586000  0.4629000     1.671000  0.6677000     1.500000  0.6412000     0.1711000      0.9257000 
1 1 1 9  44 0  o 16.20000  0.2633000     16.20000  0.2633000     16.20000  0.2633000     0.000000       0.000000  
1 1 1 9  44 1  o 4.893000  0.2545000     4.765000  0.3708000     5.021000  0.3486000     -0.2559000     0.5089000 
1 1 1 9  44 2  f 9.460000  0.1831000     9.399000  0.2610000     9.521000  0.2570000     -0.1219000     0.3663000 
1 1 1 9  44 3  o 5.661000  0.2358000     5.509000  0.3443000     5.812000  0.3223000     -0.3027000     0.4716000 
1 1 1 9  44 4  o 8.449000  0.1951000     8.459000  0.2754000     8.440000  0.2764000     0.1866000E-01  0.3902000 
1 1 1 9  44 5  o 7.557000  0.2101000     7.568000  0.2977000     7.545000  0.2967000     0.2273000E-01  0.4203000 
1 1 1 9  44 6  o 10.32000  0.1900000     10.49000  0.2658000     10.14000  0.2715000     0.3519000      0.3799000 
1 1 1 9  44 7  o 9.748000  0.1961000     10.03000  0.2749000     9.468000  0.2798000     0.5584000      0.3923000 
1 1 1 9  44 8  o 11.69000  0.2453000     11.46000  0.4088000     11.92000  0.2711000     -0.4627000     0.4906000 
1 1 1 9  44 9  o 1.742000  0.7008000     1.742000  0.7008000     ?         ?             ?              ?         
1 1 1 9  44 10 o 7.924000  0.2742000     7.430000  0.4556000     8.419000  0.3053000     -0.9892000     0.5484000 
1 1 1 9  44 11 o 5.582000  0.2719000     5.249000  0.3965000     5.916000  0.3722000     -0.6671000     0.5439000 
1 1 1 9  44 12 o 3.249000  0.4944000     3.357000  0.7090000     3.141000  0.6893000     0.2162000      0.9888000 
1 1 1 9  44 13 o 1.768000  0.5141000     1.960000  0.7705000     1.576000  0.6809000     0.3839000      1.028000  
1 1 1 9  44 14 o 3.272000  0.4553000     3.882000  0.5365000     2.662000  0.7359000     1.220000       0.9107000 
1 1 1 9  44 15 o 1.823000  0.4938000     1.477000  0.6552000     2.168000  0.7391000     -0.6904000     0.9877000 
1 1 1 9  44 16 o 1.467000  0.4578000     1.357000  0.6151000     1.577000  0.6781000     -0.2199000     0.9156000 
1 1 1 9  44 17 o 2.227000  0.5751000     2.156000  0.7265000     2.297000  0.8917000     -0.1408000     1.150000  
1 1 1 9  44 18 o 2.012000  0.5324000     1.842000  0.7786000     2.183000  0.7263000     -0.3405000     1.065000  
1 1 1 9  44 19 o 1.520000  0.4532000     1.831000  0.7079000     1.210000  0.5661000     0.6203000      0.9064000 
1 1 1 9  44 20 o 1.194000  0.3971000     1.215000  0.5673000     1.173000  0.5557000     0.4198000E-01  0.7941000 
1 1 1 9  45 0  o 27.38000  0.3466000     27.38000  0.3466000     27.38000  0.3466000     -0.000000      0.000000  
1 1 1 9  45 1  o 11.49000  0.1816000     11.57000  0.2561000     11.41000  0.2574000     0.1673000      0.3631000 
1 1 1 9  45 2  o 8.074000  0.1972000     7.982000  0.2816000     8.166000  0.2761000     -0.1843000     0.3944000 
1 1 1 9  45 3  o 10.98000  0.1857000     11.14000  0.2630000     10.83000  0.2623000     0.3040000      0.3714000 
1 1 1 9  45 4  o 9.753000  0.1891000     9.457000  0.2718000     10.05000  0.2630000     -0.5925000     0.3782000 
1 1 1 9  45 5  o 8.597000  0.1997000     8.356000  0.2860000     8.838000  0.2788000     -0.4813000     0.3994000 
1 1 1 9  45 6  o 5.084000  0.2802000     4.858000  0.4137000     5.310000  0.3781000     -0.4517000     0.5604000 
1 1 1 9  45 7  o 15.15000  0.2423000     14.98000  0.3988000     15.31000  0.2754000     -0.3301000     0.4847000 
1 1 1 9  45 8  o 3.705000  0.6591000     3.705000  0.6591000     ?         ?             ?              ?         
1 1 1 9  45 9  o 6.109000  0.3363000     5.908000  0.5268000     6.310000  0.4181000     -0.4018000     0.6726000 
1 1 1 9  45 10 o 8.272000  0.2197000     8.257000  0.3092000     8.288000  0.3121000     -0.3093000E-01 0.4393000 
1 1 1 9  45 11 o 4.051000  0.3521000     3.911000  0.5121000     4.192000  0.4834000     -0.2813000     0.7042000 
1 1 1 9  45 12 o 1.695000  0.4956000     2.102000  0.7870000     1.287000  0.6025000     0.8144000      0.9911000 
1 1 1 9  45 13 o 4.104000  0.3887000     4.100000  0.5846000     4.107000  0.5125000     -0.7338000E-02 0.7775000 
1 1 1 9  45 14 o 2.038000  0.5215000     1.877000  0.7286000     2.200000  0.7464000     -0.3232000     1.043000  
1 1 1 9  45 15 o 1.524000  0.4701000     1.449000  0.6453000     1.600000  0.6837000     -0.1515000     0.9401000 
1 1 1 9  45 16 o 1.571000  0.4965000     1.507000  0.7055000     1.634000  0.6989000     -0.1271000     0.9931000 
1 1 1 9  45 17 o 1.986000  0.5020000     2.436000  0.7037000     1.536000  0.7162000     0.9002000      1.004000  
1 1 1 9  45 18 o 1.983000  0.4989000     1.954000  0.7037000     2.013000  0.7075000     -0.5859000E-01 0.9979000 
1 1 1 9  45 19 o 1.257000  0.4066000     1.406000  0.6144000     1.108000  0.5326000     0.2983000      0.8131000 
1 1 1 9  46 0  o 6.800000  0.3114000     6.800000  0.3114000     6.800000  0.3114000     -0.000000      0.000000  
1 1 1 9  46 1  o 6.917000  0.2149000     7.040000  0.3045000     6.793000  0.3034000     0.2470000      0.4298000 
1 1 1 9  46 2  o 3.476000  0.3662000     3.602000  0.4975000     3.350000  0.5374000     0.2523000      0.7323000 
1 1 1 9  46 3  o 6.000000  0.2432000     5.633000  0.3603000     6.366000  0.3267000     -0.7327000     0.4864000 
1 1 1 9  46 4  o 9.442000  0.1940000     9.553000  0.2726000     9.332000  0.2761000     0.2213000      0.3880000 
1 1 1 9  46 5  f 1.395000  0.4194000     0.9173000 0.4569000     1.873000  0.7034000     -0.9559000     0.8388000 
1 1 1 9  46 6  o 2.544000  0.5678000     2.530000  0.8877000     2.557000  0.7081000     -0.2707000E-01 1.136000  
1 1 1 9  46 7  o 5.594000  0.4444000     5.594000  0.4444000     ?         ?             ?              ?         
1 1 1 9  46 8  o 5.731000  0.3432000     5.959000  0.5068000     5.503000  0.4630000     0.4558000      0.6865000 
1 1 1 9  46 9  o 2.655000  0.4915000     2.971000  0.6679000     2.338000  0.7213000     0.6331000      0.9830000 
1 1 1 9  46 10 o 2.032000  0.4531000     2.809000  0.6884000     1.254000  0.5894000     1.555000       0.9062000 
1 1 1 9  46 11 o 1.745000  0.4886000     1.912000  0.7104000     1.577000  0.6709000     0.3352000      0.9772000 
1 1 1 9  46 12 o 4.977000  0.3313000     4.850000  0.5106000     5.104000  0.4223000     -0.2540000     0.6627000 
1 1 1 9  46 13 o 2.059000  0.5209000     1.788000  0.7459000     2.331000  0.7273000     -0.5433000     1.042000  
1 1 1 9  46 14 o 1.413000  0.4447000     1.235000  0.5830000     1.591000  0.6716000     -0.3565000     0.8893000 
1 1 1 9  46 15 o 1.513000  0.4648000     1.397000  0.6325000     1.629000  0.6814000     -0.2315000     0.9297000 
1 1 1 9  46 16 o 2.592000  0.5411000     3.136000  0.6494000     2.048000  0.8657000     1.089000       1.082000  
1 1 1 9  46 17 o 2.141000  0.5311000     1.985000  0.7877000     2.298000  0.7125000     -0.3132000     1.062000  
1 1 1 9  46 18 o 1.597000  0.4632000     1.312000  0.6039000     1.881000  0.7025000     -0.5682000     0.9264000 
1 1 1 9  46 19 o 1.232000  0.4066000     1.259000  0.5820000     1.205000  0.5679000     0.5465000E-01  0.8132000 
1 1 1 9  47 0  o 11.88000  0.2636000     11.88000  0.2636000     11.88000  0.2636000     0.000000       0.000000  
1 1 1 9  47 1  o 3.700000  0.3518000     3.584000  0.5061000     3.815000  0.4887000     -0.2309000     0.7036000 
1 1 1 9  47 2  o 12.01000  0.1876000     11.57000  0.2669000     12.44000  0.2636000     -0.8719000     0.3752000 
1 1 1 9  47 3  o 8.796000  0.2013000     8.733000  0.2844000     8.858000  0.2848000     -0.1254000     0.4025000 
1 1 1 9  47 4  o 6.959000  0.2481000     7.166000  0.3764000     6.752000  0.3233000     0.4141000      0.4962000 
1 1 1 9  47 5  o 1.707000  0.5250000     2.000000  0.8297000     1.414000  0.6434000     0.5859000      1.050000  
1 1 1 9  47 6  o 5.262000  0.4453000     5.262000  0.4453000     ?         ?             ?              ?         
1 1 1 9  47 7  o 8.476000  0.2534000     8.548000  0.4051000     8.405000  0.3045000     0.1430000      0.5068000 
1 1 1 9  47 8  o 2.380000  0.4955000     1.946000  0.7279000     2.815000  0.6725000     -0.8693000     0.9910000 
1 1 1 9  47 9  o 3.721000  0.3946000     3.829000  0.5272000     3.614000  0.5873000     0.2141000      0.7892000 
1 1 1 9  47 10 o 2.678000  0.4736000     2.023000  0.7135000     3.333000  0.6229000     -1.311000      0.9472000 
1 1 1 9  47 11 o 2.845000  0.4780000     2.873000  0.6710000     2.817000  0.6811000     0.5603000E-01  0.9561000 
1 1 1 9  47 12 o 2.652000  0.5422000     2.800000  0.7879000     2.503000  0.7450000     0.2971000      1.084000  
1 1 1 9  47 13 o 2.963000  0.4821000     2.116000  0.7963000     3.809000  0.5438000     -1.693000      0.9643000 
1 1 1 9  47 14 o 1.681000  0.4860000     1.532000  0.6633000     1.829000  0.7105000     -0.2969000     0.9720000 
1 1 1 9  47 15 o 1.798000  0.5414000     2.105000  0.8573000     1.491000  0.6614000     0.6141000      1.083000  
1 1 1 9  47 16 o 1.496000  0.4883000     1.116000  0.5363000     1.875000  0.8161000     -0.7595000     0.9765000 
1 1 1 9  47 17 o 1.425000  0.4422000     1.590000  0.6613000     1.260000  0.5873000     0.3300000      0.8845000 
1 1 1 9  47 18 o 1.799000  0.4781000     1.474000  0.6363000     2.123000  0.7138000     -0.6493000     0.9562000 
1 1 1 9  47 19 o 3.002000  0.4873000     2.903000  0.7057000     3.101000  0.6722000     -0.1980000     0.9746000 
1 1 1 9  48 0  f 1.412000  0.7919000     1.412000  0.7919000     1.412000  0.7919000     -0.000000      0.000000  
1 1 1 9  48 1  o 9.611000  0.1957000     9.643000  0.2792000     9.579000  0.2744000     0.6387000E-01  0.3915000 
1 1 1 9  48 2  o 10.52000  0.2137000     10.52000  0.3259000     10.51000  0.2764000     0.1483000E-01  0.4273000 
1 1 1 9  48 3  o 4.818000  0.3891000     5.359000  0.5562000     4.278000  0.5443000     1.081000       0.7782000 
1 1 1 9  48 4  o 2.120000  0.8378000     2.120000  0.8378000     ?         ?             ?              ?         
1 1 1 9  48 5  f 3.918000  0.6283000     3.659000  0.7642000     4.178000  0.9975000     -0.5193000     1.257000  
1 1 1 9  48 6  o 10.50000  0.2188000     10.30000  0.3375000     10.70000  0.2786000     -0.3991000     0.4377000 
1 1 1 9  48 7  o 3.504000  0.4040000     3.356000  0.5830000     3.653000  0.5594000     -0.2970000     0.8080000 
1 1 1 9  48 8  o 4.347000  0.3398000     4.080000  0.4950000     4.614000  0.4656000     -0.5335000     0.6796000 
1 1 1 9  48 9  o 4.285000  0.3410000     4.093000  0.4919000     4.477000  0.4724000     -0.3840000     0.6820000 
1 1 1 9  48 10 o 2.829000  0.4797000     3.085000  0.6301000     2.572000  0.7236000     0.5134000      0.9595000 
1 1 1 9  48 11 o 3.945000  0.3928000     4.442000  0.4964000     3.449000  0.6088000     0.9936000      0.7855000 
1 1 1 9  48 12 o 4.790000  0.3547000     4.751000  0.5517000     4.830000  0.4458000     -0.7922000E-01 0.7093000 
1 1 1 9  48 13 o 1.740000  0.5109000     1.689000  0.7268000     1.792000  0.7182000     -0.1029000     1.022000  
1 1 1 9  48 14 o 1.686000  0.4839000     1.543000  0.6637000     1.829000  0.7044000     -0.2864000     0.9678000 
1 1 1 9  48 15 o 2.286000  0.5731000     2.287000  0.7233000     2.286000  0.8892000     0.7269000E-03  1.146000  
1 1 1 9  48 16 o 2.692000  0.5436000     3.169000  0.7782000     2.216000  0.7591000     0.9533000      1.087000  
1 1 1 9  48 17 o 1.703000  0.4725000     2.060000  0.7198000     1.346000  0.6123000     0.7141000      0.9450000 
1 1 1 9  48 18 o 1.597000  0.4759000     1.663000  0.6893000     1.531000  0.6564000     0.1320000      0.9518000 
1 1 1 9  49 0  o 1.100000  0.7843000     1.100000  0.7843000     1.100000  0.7843000     -0.000000      0.000000  
1 1 1 9  49 1  o 2.390000  0.9895000     2.390000  0.9895000     ?         ?             ?              ?         
1 1 1 9  49 2  o 2.857000  0.9972000     2.857000  0.9972000     ?         ?             ?              ?         
1 1 1 9  49 3  f 6.556000  0.4243000     6.406000  0.4721000     6.706000  0.7051000     -0.3000000     0.8485000 
1 1 1 9  49 4  o 5.119000  0.3535000     4.956000  0.5855000     5.282000  0.3962000     -0.3261000     0.7069000 
1 1 1 9  49 5  o 3.109000  0.4503000     2.899000  0.6653000     3.319000  0.6069000     -0.4197000     0.9005000 
1 1 1 9  49 6  o 1.902000  0.5029000     2.075000  0.7278000     1.728000  0.6942000     0.3470000      1.006000  
1 1 1 9  49 7  o 6.172000  0.2621000     6.193000  0.3685000     6.151000  0.3728000     0.4241000E-01  0.5242000 
1 1 1 9  49 8  o 1.401000  0.4460000     1.496000  0.6538000     1.307000  0.6068000     0.1890000      0.8920000 
1 1 1 9  49 9  o 3.934000  0.3719000     3.749000  0.5494000     4.119000  0.5014000     -0.3703000     0.7438000 
1 1 1 9  49 10 o 4.132000  0.3690000     4.494000  0.4730000     3.770000  0.5665000     0.7236000      0.7380000 
1 1 1 9  49 11 o 2.025000  0.5286000     1.945000  0.7610000     2.104000  0.7337000     -0.1586000     1.057000  
1 1 1 9  49 12 o 4.122000  0.4292000     3.414000  0.7354000     4.830000  0.4426000     -1.415000      0.8584000 
1 1 1 9  49 13 o 2.508000  0.5095000     2.182000  0.7478000     2.834000  0.6922000     -0.6527000     1.019000  
1 1 1 9  49 14 o 2.080000  0.5582000     2.587000  0.8930000     1.572000  0.6699000     1.015000       1.116000  
1 1 1 9  49 15 o 1.510000  0.4768000     1.722000  0.7125000     1.298000  0.6339000     0.4233000      0.9537000 
1 1 1 9  49 16 o 1.566000  0.4750000     1.694000  0.6851000     1.439000  0.6581000     0.2558000      0.9500000 
1 1 1 9  49 17 o 1.376000  0.4392000     1.239000  0.5778000     1.513000  0.6616000     -0.2746000     0.8784000 
1 1 1 9  49 18 o 1.629000  0.4588000     1.220000  0.5729000     2.038000  0.7168000     -0.8174000     0.9177000 
1 1 1 9  50 0  o 3.862000  0.6291000     3.862000  0.6291000     3.862000  0.6291000     0.000000       0.000000  
1 1 1 9  50 1  o 1.832000  0.5123000     1.953000  0.7509000     1.710000  0.6970000     0.2430000      1.025000  
1 1 1 9  50 2  o 3.285000  0.4314000     3.148000  0.6400000     3.421000  0.5786000     -0.2731000     0.8628000 
1 1 1 9  50 3  o 2.527000  0.4993000     2.573000  0.7006000     2.480000  0.7116000     0.9255000E-01  0.9986000 
1 1 1 9  50 4  o 4.634000  0.3070000     4.749000  0.4181000     4.519000  0.4496000     0.2295000      0.6140000 
1 1 1 9  50 5  o 2.464000  0.4965000     2.681000  0.6806000     2.248000  0.7232000     0.4334000      0.9931000 
1 1 1 9  50 6  o 1.958000  0.5063000     1.805000  0.6982000     2.111000  0.7333000     -0.3063000     1.013000  
1 1 1 9  50 7  o 2.847000  0.4849000     2.528000  0.7174000     3.166000  0.6526000     -0.6380000     0.9698000 
1 1 1 9  50 8  o 2.978000  0.4697000     2.953000  0.6652000     3.003000  0.6633000     -0.4929000E-01 0.9394000 
1 1 1 9  50 9  o 4.976000  0.3036000     4.839000  0.4362000     5.114000  0.4224000     -0.2747000     0.6072000 
1 1 1 9  50 10 o 1.531000  0.4657000     1.312000  0.6088000     1.749000  0.7049000     -0.4365000     0.9314000 
1 1 1 9  50 11 o 2.760000  0.5260000     3.138000  0.7386000     2.382000  0.7490000     0.7558000      1.052000  
1 1 1 9  50 12 o 2.366000  0.5341000     2.585000  0.7773000     2.146000  0.7327000     0.4389000      1.068000  
1 1 1 9  50 13 o 1.404000  0.4568000     1.449000  0.6740000     1.360000  0.6167000     0.8893000E-01  0.9136000 
1 1 1 9  50 14 o 1.407000  0.4643000     1.415000  0.6328000     1.399000  0.6797000     0.1537000E-01  0.9286000 
1 1 1 9  50 15 o 1.171000  0.4054000     1.340000  0.6387000     1.001000  0.4994000     0.3391000      0.8108000 
1 1 1 9  50 16 o 1.662000  0.4818000     1.850000  0.7060000     1.474000  0.6558000     0.3760000      0.9636000 
1 1 1 9  50 17 o 2.768000  0.4509000     3.609000  0.5445000     1.928000  0.7189000     1.681000       0.9018000 
1 1 1 9  51 0  o 7.086000  0.3252000     7.086000  0.3252000     7.086000  0.3252000     -0.000000      0.000000  
1 1 1 9  51 1  o 2.415000  0.4973000     2.710000  0.6877000     2.119000  0.7184000     0.5913000      0.9945000 
1 1 1 9  51 2  o 4.940000  0.2929000     5.127000  0.4051000     4.754000  0.4230000     0.3721000      0.5857000 
1 1 1 9  51 3  o 5.066000  0.2910000     4.648000  0.4352000     5.484000  0.3864000     -0.8358000     0.5820000 
1 1 1 9  51 4  o 4.530000  0.3239000     5.011000  0.4006000     4.049000  0.5091000     0.9619000      0.6478000 
1 1 1 9  51 5  o 6.229000  0.2516000     6.096000  0.3576000     6.362000  0.3540000     -0.2661000     0.5032000 
1 1 1 9  51 6  o 3.484000  0.4264000     4.258000  0.4604000     2.709000  0.7178000     1.549000       0.8527000 
1 1 1 9  51 7  o 5.268000  0.2832000     5.467000  0.3781000     5.069000  0.4218000     0.3975000      0.5665000 
1 1 1 9  51 8  o 5.113000  0.3003000     5.307000  0.3993000     4.919000  0.4486000     0.3883000      0.6006000 
1 1 1 9  51 9  o 4.588000  0.3375000     4.509000  0.4881000     4.667000  0.4663000     -0.1582000     0.6751000 
1 1 1 9  51 10 o 1.229000  0.4090000     1.047000  0.5146000     1.411000  0.6359000     -0.3639000     0.8181000 
1 1 1 9  51 11 o 2.348000  0.5099000     3.104000  0.7586000     1.593000  0.6815000     1.511000       1.020000  
1 1 1 9  51 12 o 4.188000  0.3878000     4.211000  0.5820000     4.165000  0.5127000     0.4555000E-01  0.7757000 
1 1 1 9  51 13 o 2.965000  0.5886000     2.473000  0.9097000     3.456000  0.7472000     -0.9827000     1.177000  
1 1 1 9  51 14 f 1.571000  0.5046000     1.599000  0.7233000     1.543000  0.7037000     0.5605000E-01  1.009000  
1 1 1 9  51 15 o 1.959000  0.5202000     1.903000  0.7204000     2.014000  0.7506000     -0.1104000     1.040000  
1 1 1 9  51 16 f 3.115000  0.4779000     3.024000  0.6670000     3.206000  0.6847000     -0.1819000     0.9558000 
1 1 1 9  51 17 o 2.139000  0.4986000     2.445000  0.7134000     1.833000  0.6968000     0.6122000      0.9972000 
1 1 1 9  52 0  o 1.268000  0.7715000     1.268000  0.7715000     1.268000  0.7715000     -0.000000      0.000000  
1 1 1 9  52 1  o 8.010000  0.2181000     7.835000  0.3125000     8.185000  0.3045000     -0.3499000     0.4363000 
1 1 1 9  52 2  o 6.154000  0.2550000     6.103000  0.3623000     6.205000  0.3591000     -0.1021000     0.5101000 
1 1 1 9  52 3  o 5.436000  0.2798000     5.004000  0.4165000     5.868000  0.3736000     -0.8638000     0.5595000 
1 1 1 9  52 4  o 3.951000  0.3663000     4.097000  0.4982000     3.805000  0.5372000     0.2919000      0.7326000 
1 1 1 9  52 5  o 3.000000  0.4551000     2.358000  0.7140000     3.643000  0.5644000     -1.285000      0.9102000 
1 1 1 9  52 6  o 7.510000  0.2249000     7.508000  0.3148000     7.511000  0.3215000     -0.2445000E-02 0.4499000 
1 1 1 9  52 7  o 5.767000  0.2711000     5.442000  0.3909000     6.092000  0.3756000     -0.6505000     0.5421000 
1 1 1 9  52 8  o 4.192000  0.3620000     4.433000  0.4781000     3.952000  0.5438000     0.4812000      0.7240000 
1 1 1 9  52 9  o 4.095000  0.3617000     4.188000  0.5080000     4.003000  0.5150000     0.1848000      0.7234000 
1 1 1 9  52 10 o 1.511000  0.4633000     1.506000  0.6510000     1.516000  0.6593000     -0.9088000E-02 0.9266000 
1 1 1 9  52 11 o 1.486000  0.4597000     1.255000  0.6032000     1.716000  0.6937000     -0.4617000     0.9193000 
1 1 1 9  52 12 o 1.443000  0.4987000     1.724000  0.8292000     1.162000  0.5544000     0.5619000      0.9974000 
1 1 1 9  52 13 o 1.357000  0.4629000     1.348000  0.6260000     1.367000  0.6819000     -0.1969000E-01 0.9257000 
1 1 1 9  52 14 o 2.205000  0.5367000     2.172000  0.7895000     2.238000  0.7273000     -0.6536000E-01 1.073000  
1 1 1 9  52 15 o 1.144000  0.3885000     1.235000  0.5782000     1.053000  0.5191000     0.1817000      0.7771000 
1 1 1 9  52 16 o 1.418000  0.4471000     1.542000  0.6574000     1.294000  0.6062000     0.2476000      0.8942000 
1 1 1 9  53 0  o 7.340000  0.3196000     7.340000  0.3196000     7.340000  0.3196000     0.000000       0.000000  
1 1 1 9  53 1  o 1.964000  0.5048000     2.021000  0.7143000     1.908000  0.7134000     0.1133000      1.010000  
1 1 1 9  53 2  o 6.972000  0.2356000     7.123000  0.3252000     6.820000  0.3410000     0.3031000      0.4712000 
1 1 1 9  53 3  o 4.166000  0.3431000     4.101000  0.4938000     4.232000  0.4764000     -0.1316000     0.6862000 
1 1 1 9  53 4  o 3.899000  0.3642000     3.874000  0.5107000     3.923000  0.5194000     -0.4905000E-01 0.7284000 
1 1 1 9  53 5  o 4.636000  0.3138000     4.540000  0.4422000     4.732000  0.4453000     -0.1913000     0.6276000 
1 1 1 9  53 6  o 3.438000  0.4221000     2.983000  0.6607000     3.894000  0.5256000     -0.9111000     0.8442000 
1 1 1 9  53 7  o 3.169000  0.4569000     2.304000  0.7487000     4.034000  0.5238000     -1.730000      0.9137000 
1 1 1 9  53 8  o 2.632000  0.4742000     1.838000  0.7228000     3.426000  0.6139000     -1.587000      0.9484000 
1 1 1 9  53 9  o 2.144000  0.4741000     1.496000  0.6523000     2.792000  0.6881000     -1.296000      0.9481000 
1 1 1 9  53 10 o 2.747000  0.4920000     2.759000  0.6982000     2.735000  0.6933000     0.2455000E-01  0.9840000 
1 1 1 9  53 11 o 1.591000  0.5102000     1.526000  0.7523000     1.657000  0.6894000     -0.1318000     1.020000  
1 1 1 9  53 12 o 4.028000  0.5867000     4.028000  0.5867000     ?         ?             ?              ?         
1 1 1 9  53 13 o 1.978000  0.5195000     1.663000  0.7353000     2.293000  0.7339000     -0.6304000     1.039000  
1 1 1 9  53 14 o 1.537000  0.4649000     1.382000  0.6203000     1.692000  0.6925000     -0.3107000     0.9297000 
1 1 1 9  53 15 o 1.931000  0.5093000     2.301000  0.7517000     1.560000  0.6873000     0.7404000      1.019000  
1 1 1 9  53 16 o 2.500000  0.5255000     2.352000  0.7194000     2.648000  0.7662000     -0.2959000     1.051000  
1 1 1 9  54 0  o 3.183000  0.6482000     3.183000  0.6482000     3.183000  0.6482000     0.000000       0.000000  
1 1 1 9  54 1  o 6.619000  0.2417000     6.407000  0.3441000     6.831000  0.3396000     -0.4239000     0.4834000 
1 1 1 9  54 2  o 6.559000  0.2457000     6.796000  0.3386000     6.322000  0.3561000     0.4743000      0.4914000 
1 1 1 9  54 3  f 3.122000  0.4430000     3.739000  0.5238000     2.505000  0.7146000     1.234000       0.8860000 
1 1 1 9  54 4  o 4.340000  0.3349000     4.163000  0.4826000     4.516000  0.4645000     -0.3531000     0.6698000 
1 1 1 9  54 5  o 4.108000  0.3505000     4.278000  0.4643000     3.937000  0.5251000     0.3411000      0.7009000 
1 1 1 9  54 6  o 2.163000  0.4771000     2.786000  0.6919000     1.540000  0.6570000     1.246000       0.9542000 
1 1 1 9  54 7  o 5.677000  0.2844000     5.937000  0.3844000     5.417000  0.4193000     0.5204000      0.5688000 
1 1 1 9  54 8  o 3.578000  0.4312000     2.991000  0.6931000     4.164000  0.5132000     -1.173000      0.8624000 
1 1 1 9  54 9  o 3.420000  0.4297000     3.695000  0.5706000     3.146000  0.6427000     0.5490000      0.8594000 
1 1 1 9  54 10 o 3.680000  0.4601000     3.923000  0.6870000     3.437000  0.6122000     0.4859000      0.9202000 
1 1 1 9  54 11 o 3.197000  0.6694000     2.998000  0.8606000     3.396000  1.025000      -0.3974000     1.339000  
1 1 1 9  54 12 o 2.003000  0.5616000     2.246000  0.8388000     1.760000  0.7470000     0.4858000      1.123000  
1 1 1 9  54 13 o 2.242000  0.5084000     2.534000  0.7203000     1.949000  0.7176000     0.5852000      1.017000  
1 1 1 9  54 14 o 1.907000  0.5066000     1.821000  0.7071000     1.992000  0.7258000     -0.1711000     1.013000  
1 1 1 9  54 15 o 2.523000  0.5373000     2.483000  0.7269000     2.563000  0.7914000     -0.8067000E-01 1.075000  
1 1 1 9  55 0  o 1.258000  0.7680000     1.258000  0.7680000     1.258000  0.7680000     -0.000000      0.000000  
1 1 1 9  55 1  o 5.768000  0.2678000     6.128000  0.3618000     5.408000  0.3949000     0.7200000      0.5355000 
1 1 1 9  55 2  o 9.612000  0.2127000     9.648000  0.3020000     9.577000  0.2995000     0.7029000E-01  0.4253000 
1 1 1 9  55 3  o 2.460000  0.5074000     2.157000  0.7306000     2.764000  0.7043000     -0.6068000     1.015000  
1 1 1 9  55 4  o 8.375000  0.2223000     8.263000  0.3147000     8.488000  0.3139000     -0.2244000     0.4445000 
1 1 1 9  55 5  o 2.874000  0.4737000     2.501000  0.7188000     3.246000  0.6171000     -0.7449000     0.9473000 
1 1 1 9  55 6  o 1.866000  0.5058000     1.800000  0.7093000     1.931000  0.7214000     -0.1317000     1.012000  
1 1 1 9  55 7  o 2.122000  0.5158000     1.830000  0.7037000     2.415000  0.7543000     -0.5851000     1.032000  
1 1 1 9  55 8  o 2.387000  0.4977000     2.961000  0.6895000     1.812000  0.7180000     1.149000       0.9955000 
1 1 1 9  55 9  o 1.721000  0.4969000     1.629000  0.6987000     1.813000  0.7066000     -0.1841000     0.9937000 
1 1 1 9  55 10 o 2.064000  0.6346000     2.612000  1.040000      1.516000  0.7268000     1.097000       1.269000  
1 1 1 9  55 11 o 2.038000  0.5550000     1.619000  0.7299000     2.457000  0.8364000     -0.8386000     1.110000  
1 1 1 9  55 12 o 2.882000  0.4619000     3.642000  0.5627000     2.123000  0.7327000     1.519000       0.9238000 
1 1 1 9  55 13 o 1.855000  0.5044000     1.966000  0.7256000     1.743000  0.7007000     0.2236000      1.009000  
1 1 1 9  55 14 o 1.564000  0.4711000     1.609000  0.6712000     1.519000  0.6613000     0.8992000E-01  0.9423000 
1 1 1 9  55 15 o 1.334000  0.4721000     1.377000  0.6861000     1.292000  0.6487000     0.8447000E-01  0.9442000 
1 1 1 9  56 0  o 1.345000  0.7929000     1.345000  0.7929000     1.345000  0.7929000     -0.000000      0.000000  
1 1 1 9  56 1  o 2.355000  0.5059000     2.068000  0.7381000     2.642000  0.6921000     -0.5735000     1.012000  
1 1 1 9  56 2  o 5.231000  0.2973000     4.937000  0.4421000     5.524000  0.3976000     -0.5871000     0.5946000 
1 1 1 9  56 3  o 3.081000  0.4545000     3.400000  0.5857000     2.763000  0.6952000     0.6376000      0.9090000 
1 1 1 9  56 4  o 3.147000  0.4371000     2.786000  0.6693000     3.508000  0.5623000     -0.7227000     0.8742000 
1 1 1 9  56 5  o 4.259000  0.3610000     5.025000  0.4168000     3.493000  0.5895000     1.532000       0.7220000 
1 1 1 9  56 6  o 1.371000  0.4324000     1.650000  0.6825000     1.091000  0.5312000     0.5581000      0.8648000 
1 1 1 9  56 7  o 2.158000  0.5188000     2.260000  0.7192000     2.057000  0.7479000     0.2026000      1.038000  
1 1 1 9  56 8  o 1.708000  0.5050000     1.883000  0.7598000     1.534000  0.6655000     0.3493000      1.010000  
1 1 1 9  56 9  o 1.419000  0.4867000     1.288000  0.6331000     1.550000  0.7393000     -0.2616000     0.9734000 
1 1 1 9  56 10 o 1.906000  0.5600000     1.920000  0.8087000     1.891000  0.7748000     0.2829000E-01  1.120000  
1 1 1 9  56 11 o 1.600000  0.4741000     1.319000  0.6173000     1.881000  0.7198000     -0.5620000     0.9482000 
1 1 1 9  56 12 o 1.978000  0.5169000     1.976000  0.7345000     1.980000  0.7274000     -0.4014000E-02 1.034000  
1 1 1 9  56 13 o 2.566000  0.5074000     2.908000  0.6960000     2.225000  0.7385000     0.6826000      1.015000  
1 1 1 9  56 14 o 2.125000  0.5210000     2.028000  0.7322000     2.223000  0.7414000     -0.1957000     1.042000  
1 1 1 9  57 0  o 1.102000  0.7094000     1.102000  0.7094000     1.102000  0.7094000     -0.000000      0.000000  
1 1 1 9  57 1  o 4.765000  0.3197000     4.809000  0.4539000     4.722000  0.4502000     0.8721000E-01  0.6393000 
1 1 1 9  57 2  o 2.548000  0.5068000     2.423000  0.7275000     2.673000  0.7057000     -0.2507000     1.014000  
1 1 1 9  57 3  o 5.967000  0.2674000     6.055000  0.3735000     5.880000  0.3828000     0.1754000      0.5348000 
1 1 1 9  57 4  o 4.180000  0.3472000     4.497000  0.4485000     3.862000  0.5300000     0.6351000      0.6943000 
1 1 1 9  57 5  o 2.343000  0.5013000     2.011000  0.7143000     2.674000  0.7035000     -0.6633000     1.003000  
1 1 1 9  57 6  o 4.702000  0.3245000     4.698000  0.4507000     4.706000  0.4669000     -0.7889000E-02 0.6489000 
1 1 1 9  57 7  o 1.610000  0.5071000     1.869000  0.8020000     1.351000  0.6208000     0.5175000      1.014000  
1 1 1 9  57 8  o 5.809000  0.4762000     5.809000  0.4762000     ?         ?             ?              ?         
1 1 1 9  57 9  o 3.756000  0.5238000     4.257000  0.7066000     3.256000  0.7734000     1.001000       1.048000  
1 1 1 9  57 10 o 3.936000  0.4176000     3.770000  0.6534000     4.102000  0.5203000     -0.3322000     0.8352000 
1 1 1 9  57 11 o 2.766000  0.5318000     2.683000  0.8076000     2.850000  0.6923000     -0.1678000     1.064000  
1 1 1 9  57 12 o 1.391000  0.4434000     1.480000  0.6520000     1.301000  0.6012000     0.1785000      0.8869000 
1 1 1 9  57 13 o 1.319000  0.4230000     1.620000  0.6818000     1.017000  0.5009000     0.6027000      0.8460000 
1 1 1 9  58 0  o 1.073000  0.7018000     1.073000  0.7018000     1.073000  0.7018000     0.000000       0.000000  
1 1 1 9  58 1  o 4.404000  0.3416000     4.184000  0.5048000     4.624000  0.4605000     -0.4397000     0.6833000 
1 1 1 9  58 2  o 7.884000  0.2320000     7.893000  0.3293000     7.874000  0.3270000     0.1832000E-01  0.4640000 
1 1 1 9  58 3  o 4.979000  0.2988000     5.132000  0.4078000     4.825000  0.4370000     0.3073000      0.5977000 
1 1 1 9  58 4  o 1.519000  0.4630000     1.444000  0.6358000     1.594000  0.6732000     -0.1504000     0.9260000 
1 1 1 9  58 5  o 4.626000  0.3367000     5.028000  0.4449000     4.223000  0.5056000     0.8054000      0.6735000 
1 1 1 9  58 6  o 1.396000  0.4654000     1.385000  0.6644000     1.407000  0.6518000     -0.2235000E-01 0.9308000 
1 1 1 9  58 7  o 3.478000  0.6037000     3.478000  0.6037000     ?         ?             ?              ?         
1 1 1 9  58 8  o 4.030000  0.4927000     3.690000  0.8291000     4.370000  0.5324000     -0.6803000     0.9853000 
1 1 1 9  58 9  o 2.467000  0.5207000     2.717000  0.7189000     2.217000  0.7535000     0.5002000      1.041000  
1 1 1 9  58 10 o 1.254000  0.4207000     1.301000  0.6157000     1.207000  0.5736000     0.9380000E-01  0.8415000 
1 1 1 9  58 11 o 1.418000  0.4401000     1.061000  0.5241000     1.776000  0.7071000     -0.7145000     0.8802000 
1 1 1 9  58 12 f 1.155000  0.3918000     1.168000  0.5591000     1.143000  0.5489000     0.2459000E-01  0.7835000 
1 1 1 9  59 0  o 1.089000  0.7072000     1.089000  0.7072000     1.089000  0.7072000     0.000000       0.000000  
1 1 1 9  59 1  o 3.337000  0.4459000     3.400000  0.6102000     3.274000  0.6504000     0.1260000      0.8918000 
1 1 1 9  59 2  o 2.703000  0.5123000     2.695000  0.7105000     2.711000  0.7383000     -0.1653000E-01 1.025000  
1 1 1 9  59 3  o 2.801000  0.5192000     3.312000  0.7364000     2.290000  0.7320000     1.022000       1.038000  
1 1 1 9  59 4  o 1.173000  0.4064000     1.173000  0.5809000     1.174000  0.5684000     -0.1037000E-03 0.8127000 
1 1 1 9  59 5  o 4.454000  0.7053000     4.454000  0.7053000     ?         ?             ?              ?         
1 1 1 9  59 6  o 1.689000  0.5597000     1.523000  0.7078000     1.855000  0.8672000     -0.3324000     1.119000  
1 1 1 9  59 7  o 1.907000  0.5224000     1.629000  0.7318000     2.185000  0.7457000     -0.5566000     1.045000  
1 1 1 9  59 8  o 1.458000  0.4581000     1.402000  0.6352000     1.514000  0.6602000     -0.1123000     0.9161000 
1 1 1 9  59 9  o 2.302000  0.5110000     2.839000  0.7221000     1.765000  0.7232000     1.074000       1.022000  
1 1 1 9  59 10 o 1.523000  0.4729000     1.447000  0.6653000     1.599000  0.6722000     -0.1519000     0.9458000 
1 1 1 9  59 11 o 1.823000  0.5166000     1.860000  0.7525000     1.785000  0.7079000     0.7484000E-01  1.033000  
1 1 1 9  59 12 o 1.370000  0.4461000     1.152000  0.5541000     1.588000  0.6992000     -0.4360000     0.8922000 
1 1 1 9  60 0  o 2.196000  1.079000      2.196000  1.079000      2.196000  1.079000      0.000000       0.000000  
1 1 1 9  60 1  o 2.668000  0.6132000     3.230000  0.8716000     2.106000  0.8628000     1.124000       1.226000  
1 1 1 9  60 2  o 6.857000  0.5013000     7.124000  0.5322000     6.590000  0.8498000     0.5337000      1.003000  
1 1 1 9  60 3  o 6.214000  0.5597000     6.214000  0.5597000     ?         ?             ?              ?         
1 1 1 9  60 4  o 1.795000  0.5735000     1.810000  0.7864000     1.780000  0.8351000     0.2994000E-01  1.147000  
1 1 1 9  60 5  o 3.394000  0.5093000     2.579000  0.8745000     4.209000  0.5223000     -1.630000      1.019000  
1 1 1 9  60 6  o 2.880000  0.4910000     2.953000  0.6799000     2.807000  0.7084000     0.1453000      0.9819000 
1 1 1 9  60 7  o 3.622000  0.4272000     2.962000  0.6909000     4.282000  0.5027000     -1.320000      0.8544000 
1 1 1 9  60 8  o 1.348000  0.4383000     1.223000  0.5784000     1.473000  0.6587000     -0.2508000     0.8766000 
1 1 1 9  60 9  o 1.882000  0.5168000     1.705000  0.7309000     2.059000  0.7307000     -0.3544000     1.034000  
1 1 1 9  60 10 o 1.547000  0.4803000     1.834000  0.7594000     1.260000  0.5882000     0.5737000      0.9605000 
1 1 1 9  60 11 o 1.504000  0.4520000     1.164000  0.5604000     1.844000  0.7093000     -0.6795000     0.9039000 
1 1 1 9  61 0  o 1.685000  0.9827000     1.685000  0.9827000     1.685000  0.9827000     -0.000000      0.000000  
1 1 1 9  61 1  o 3.918000  0.5663000     3.772000  0.8052000     4.064000  0.7965000     -0.2918000     1.133000  
1 1 1 9  61 2  o 6.816000  0.3089000     7.082000  0.4386000     6.551000  0.4350000     0.5309000      0.6177000 
1 1 1 9  61 3  o 3.346000  0.4968000     3.053000  0.7928000     3.640000  0.5990000     -0.5875000     0.9937000 
1 1 1 9  61 4  o 2.576000  0.4941000     1.954000  0.7319000     3.197000  0.6639000     -1.243000      0.9881000 
1 1 1 9  61 5  o 2.399000  0.5129000     2.026000  0.7334000     2.772000  0.7173000     -0.7456000     1.026000  
1 1 1 9  61 6  o 1.617000  0.4781000     1.405000  0.6288000     1.829000  0.7203000     -0.4248000     0.9561000 
1 1 1 9  61 7  o 1.530000  0.4685000     1.443000  0.6449000     1.617000  0.6799000     -0.1741000     0.9371000 
1 1 1 9  61 8  o 3.493000  0.4444000     3.071000  0.6848000     3.914000  0.5664000     -0.8429000     0.8887000 
1 1 1 9  61 9  o 1.479000  0.4698000     1.773000  0.7503000     1.185000  0.5655000     0.5883000      0.9395000 
1 1 1 9  61 10 o 1.010000  0.3551000     0.9882000 0.4961000     1.033000  0.5082000     -0.4439000E-01 0.7102000 
1 1 1 9  62 0  o 5.663000  0.4115000     5.663000  0.4115000     5.663000  0.4115000     -0.000000      0.000000  
1 1 1 9  62 1  o 4.351000  0.3681000     4.034000  0.5608000     4.668000  0.4771000     -0.6344000     0.7363000 
1 1 1 9  62 2  o 5.856000  0.2850000     5.553000  0.4195000     6.159000  0.3858000     -0.6051000     0.5700000 
1 1 1 9  62 3  o 3.211000  0.4705000     3.219000  0.6547000     3.204000  0.6758000     0.1459000E-01  0.9409000 
1 1 1 9  62 4  o 1.506000  0.4651000     1.541000  0.6667000     1.472000  0.6486000     0.6897000E-01  0.9301000 
1 1 1 9  62 5  o 2.497000  0.5102000     2.845000  0.6870000     2.150000  0.7545000     0.6951000      1.020000  
1 1 1 9  62 6  o 1.689000  0.4678000     1.217000  0.5763000     2.161000  0.7371000     -0.9442000     0.9356000 
1 1 1 9  62 7  o 2.733000  0.5131000     2.551000  0.7377000     2.916000  0.7132000     -0.3649000     1.026000  
1 1 1 9  62 8  o 1.010000  0.3537000     1.167000  0.5600000     0.8525000 0.4321000     0.3141000      0.7073000 
1 1 1 9  62 9  o 2.762000  0.5460000     3.171000  0.7707000     2.353000  0.7736000     0.8180000      1.092000  
1 1 1 9  63 0  o 4.066000  0.5570000     4.066000  0.5570000     4.066000  0.5570000     -0.000000      0.000000  
1 1 1 9  63 1  o 1.705000  0.4964000     1.606000  0.6859000     1.803000  0.7177000     -0.1974000     0.9927000 
1 1 1 9  63 2  o 1.382000  0.4464000     1.328000  0.6157000     1.436000  0.6465000     -0.1077000     0.8928000 
1 1 1 9  63 3  o 2.334000  0.5010000     1.799000  0.7242000     2.869000  0.6926000     -1.070000      1.002000  
1 1 1 9  63 4  o 3.332000  0.4452000     3.042000  0.6710000     3.622000  0.5852000     -0.5806000     0.8904000 
1 1 1 9  63 5  o 1.248000  0.4133000     1.015000  0.5008000     1.482000  0.6577000     -0.4668000     0.8266000 
1 1 1 9  63 6  o 1.805000  0.4989000     2.030000  0.7362000     1.580000  0.6736000     0.4503000      0.9979000 
1 1 1 9  63 7  o 2.608000  0.5168000     2.510000  0.7457000     2.705000  0.7156000     -0.1944000     1.034000  
1 1 1 9  64 0  o 0.9725000 0.6604000     0.9725000 0.6604000     0.9725000 0.6604000     0.000000       0.000000  
1 1 1 9  64 1  o 1.953000  0.5132000     2.130000  0.7459000     1.776000  0.7051000     0.3539000      1.026000  
1 1 1 9  64 2  o 2.468000  0.4991000     3.061000  0.6827000     1.875000  0.7283000     1.186000       0.9982000 
1 1 1 9  64 3  o 4.712000  0.3501000     5.205000  0.4542000     4.219000  0.5329000     0.9864000      0.7002000 
1 1 1 9  64 4  o 1.622000  0.4846000     1.783000  0.7183000     1.461000  0.6506000     0.3218000      0.9692000 
1 1 1 9  64 5  o 1.322000  0.4296000     1.233000  0.5814000     1.412000  0.6326000     -0.1790000     0.8592000 
1 1 1 9  64 6  o 5.259000  0.3054000     5.451000  0.4229000     5.068000  0.4408000     0.3831000      0.6109000 
1 1 1 9  65 0  o 3.024000  0.7999000     3.024000  0.7999000     3.024000  0.7999000     0.000000       0.000000  
1 1 1 9  65 1  o 4.035000  0.4008000     3.959000  0.5927000     4.111000  0.5399000     -0.1522000     0.8017000 
1 1 1 9  65 2  o 4.391000  0.3698000     4.153000  0.5452000     4.628000  0.4997000     -0.4754000     0.7395000 
1 1 1 9  65 3  o 1.259000  0.4163000     1.409000  0.6351000     1.110000  0.5382000     0.2987000      0.8325000 
1 1 1 9  65 4  o 2.377000  0.5377000     2.359000  0.7653000     2.395000  0.7555000     -0.3588000E-01 1.075000  
1 1 1 10 0  1  o 14.17000  0.2299000     14.17000  0.2299000     14.17000  0.2299000     0.000000       0.000000  
1 1 1 10 0  2  o 4.212000  0.1077000     4.212000  0.1077000     4.212000  0.1077000     -0.000000      0.000000  
1 1 1 10 0  3  o 36.65000  0.4021000     36.65000  0.4021000     36.65000  0.4021000     -0.000000      0.000000  
1 1 1 10 0  4  o 60.87000  0.6631000     60.87000  0.6631000     60.87000  0.6631000     0.000000       0.000000  
1 1 1 10 0  5  o 9.591000  0.1792000     9.591000  0.1792000     9.591000  0.1792000     0.000000       0.000000  
1 1 1 10 0  6  o 9.267000  0.1958000     9.267000  0.1958000     9.267000  0.1958000     -0.000000      0.000000  
1 1 1 10 0  7  o 1.263000  0.6178000     1.263000  0.6178000     1.263000  0.6178000     0.000000       0.000000  
1 1 1 10 0  8  o 9.962000  0.1952000     9.962000  0.1952000     9.962000  0.1952000     0.000000       0.000000  
1 1 1 10 0  9  o 6.031000  0.2838000     6.031000  0.2838000     6.031000  0.2838000     -0.000000      0.000000  
1 1 1 10 0  10 o 10.67000  0.4379000     10.67000  0.4379000     10.67000  0.4379000     0.000000       0.000000  
1 1 1 10 0  11 o 6.261000  0.4449000     6.261000  0.4449000     6.261000  0.4449000     0.000000       0.000000  
1 1 1 10 0  12 o 4.257000  0.4322000     4.257000  0.4322000     4.257000  0.4322000     0.000000       0.000000  
1 1 1 10 0  13 o 6.920000  0.3318000     6.920000  0.3318000     6.920000  0.3318000     0.000000       0.000000  
1 1 1 10 0  14 o 11.64000  0.2836000     11.64000  0.2836000     11.64000  0.2836000     0.000000       0.000000  
1 1 1 10 0  15 f 5.489000  0.6521000     5.489000  0.6521000     5.489000  0.6521000     0.000000       0.000000  
1 1 1 10 0  16 o 3.298000  1.017000      3.298000  1.017000      3.298000  1.017000      0.000000       0.000000  
1 1 1 10 0  17 o 6.068000  0.4940000     6.068000  0.4940000     6.068000  0.4940000     -0.000000      0.000000  
1 1 1 10 0  18 o 1.223000  0.8316000     1.223000  0.8316000     1.223000  0.8316000     -0.000000      0.000000  
1 1 1 10 0  19 o 3.662000  1.005000      3.662000  1.005000      3.662000  1.005000      -0.000000      0.000000  
1 1 1 10 0  20 o 2.344000  1.226000      2.344000  1.226000      2.344000  1.226000      -0.000000      0.000000  
1 1 1 10 0  21 o 1.197000  0.8493000     1.197000  0.8493000     1.197000  0.8493000     0.000000       0.000000  
1 1 1 10 0  22 o 1.217000  0.8179000     1.217000  0.8179000     1.217000  0.8179000     0.000000       0.000000  
1 1 1 10 0  23 o 1.283000  0.8128000     1.283000  0.8128000     1.283000  0.8128000     0.000000       0.000000  
1 1 1 10 0  24 o 1.756000  0.9332000     1.756000  0.9332000     1.756000  0.9332000     0.000000       0.000000  
1 1 1 10 0  25 o 1.535000  0.8829000     1.535000  0.8829000     1.535000  0.8829000     0.000000       0.000000  
1 1 1 10 0  26 o 1.435000  0.8921000     1.435000  0.8921000     1.435000  0.8921000     -0.000000      0.000000  
1 1 1 10 0  27 o 0.8443000 0.5977000     0.8443000 0.5977000     0.8443000 0.5977000     -0.000000      0.000000  
1 1 1 10 1  0  o 40.99000  0.8983000     40.99000  0.8983000     40.99000  0.8983000     0.000000       0.000000  
1 1 1 10 1  1  o 23.13000  0.2082000     23.28000  0.2967000     22.97000  0.2922000     0.3108000      0.4164000 
1 1 1 10 1  2  o 3.962000  0.8678000E-01 3.921000  0.1117000     4.004000  0.1328000     -0.8353000E-01 0.1736000 
1 1 1 10 1  3  o 28.07000  0.2204000     28.07000  0.3117000     28.07000  0.3116000     0.3441000E-02  0.4407000 
1 1 1 10 1  4  o 22.30000  0.1808000     22.33000  0.2560000     22.27000  0.2554000     0.6286000E-01  0.3616000 
1 1 1 10 1  5  o 19.21000  0.1876000     19.25000  0.2657000     19.18000  0.2649000     0.6856000E-01  0.3752000 
1 1 1 10 1  6  o 11.58000  0.1463000     11.51000  0.2065000     11.65000  0.2072000     -0.1385000     0.2925000 
1 1 1 10 1  7  o 15.01000  0.1468000     15.11000  0.2083000     14.92000  0.2068000     0.1888000      0.2935000 
1 1 1 10 1  8  o 19.53000  0.1768000     19.47000  0.2491000     19.60000  0.2509000     -0.1360000     0.3536000 
1 1 1 10 1  9  o 13.17000  0.1777000     13.12000  0.2516000     13.22000  0.2511000     -0.1015000     0.3554000 
1 1 1 10 1  10 o 4.766000  0.3336000     4.610000  0.4894000     4.921000  0.4534000     -0.3101000     0.6671000 
1 1 1 10 1  11 o 5.822000  0.3252000     5.812000  0.4695000     5.831000  0.4500000     -0.1915000E-01 0.6504000 
1 1 1 10 1  12 o 1.444000  0.4292000     1.786000  0.6760000     1.102000  0.5292000     0.6836000      0.8585000 
1 1 1 10 1  13 o 6.447000  0.2445000     6.318000  0.3506000     6.576000  0.3409000     -0.2571000     0.4890000 
1 1 1 10 1  14 o 11.20000  0.2017000     11.01000  0.2872000     11.39000  0.2834000     -0.3812000     0.4035000 
1 1 1 10 1  15 o 9.490000  0.3172000     9.464000  0.4519000     9.516000  0.4453000     -0.5223000E-01 0.6344000 
1 1 1 10 1  16 o 2.365000  0.6266000     1.859000  0.8544000     2.871000  0.9168000     -1.013000      1.253000  
1 1 1 10 1  17 o 10.26000  0.2530000     10.86000  0.3508000     9.665000  0.3646000     1.198000       0.5060000 
1 1 1 10 1  18 o 4.049000  0.5528000     2.740000  0.9270000     5.358000  0.6025000     -2.618000      1.106000  
1 1 1 10 1  19 o 6.065000  0.4165000     5.699000  0.6312000     6.431000  0.5434000     -0.7312000     0.8329000 
1 1 1 10 1  20 o 2.971000  0.7091000     3.517000  1.023000      2.425000  0.9823000     1.091000       1.418000  
1 1 1 10 1  21 o 3.324000  0.8003000     3.084000  1.128000      3.564000  1.136000      -0.4801000     1.601000  
1 1 1 10 1  22 o 2.521000  0.6218000     2.715000  0.8815000     2.328000  0.8771000     0.3871000      1.244000  
1 1 1 10 1  23 o 1.676000  0.5055000     1.964000  0.7751000     1.387000  0.6491000     0.5765000      1.011000  
1 1 1 10 1  24 o 1.795000  0.5230000     1.850000  0.7449000     1.740000  0.7343000     0.1098000      1.046000  
1 1 1 10 1  25 o 1.471000  0.4698000     1.705000  0.7277000     1.237000  0.5944000     0.4680000      0.9396000 
1 1 1 10 1  26 o 1.537000  0.5042000     1.372000  0.6565000     1.702000  0.7655000     -0.3291000     1.008000  
1 1 1 10 1  27 o 1.299000  0.4343000     1.404000  0.6473000     1.194000  0.5792000     0.2098000      0.8686000 
1 1 1 10 2  0  o 0.9690000 0.2559000     0.9690000 0.2559000     0.9690000 0.2559000     0.000000       0.000000  
1 1 1 10 2  1  o 15.72000  0.1628000     16.20000  0.2570000     15.24000  0.1998000     0.9647000      0.3255000 
1 1 1 10 2  2  o 25.31000  0.2048000     25.19000  0.2485000     25.42000  0.3257000     -0.2287000     0.4097000 
1 1 1 10 2  3  o 46.13000  0.3564000     45.82000  0.5007000     46.44000  0.5073000     -0.6182000     0.7128000 
1 1 1 10 2  4  o 7.532000  0.9859000E-01 7.522000  0.1396000     7.543000  0.1393000     -0.2102000E-01 0.1972000 
1 1 1 10 2  5  o 18.24000  0.1805000     18.18000  0.2548000     18.31000  0.2556000     -0.1386000     0.3610000 
1 1 1 10 2  6  o 9.379000  0.1407000     9.338000  0.1974000     9.420000  0.2006000     -0.8145000E-01 0.2814000 
1 1 1 10 2  7  o 9.678000  0.1288000     9.645000  0.1817000     9.712000  0.1825000     -0.6770000E-01 0.2575000 
1 1 1 10 2  8  o 12.58000  0.1433000     12.67000  0.2018000     12.49000  0.2033000     0.1786000      0.2865000 
1 1 1 10 2  9  o 5.337000  0.2198000     5.459000  0.3031000     5.214000  0.3183000     0.2450000      0.4395000 
1 1 1 10 2  10 o 7.739000  0.2434000     7.367000  0.3482000     8.111000  0.3402000     -0.7444000     0.4868000 
1 1 1 10 2  11 o 1.962000  0.5299000     1.509000  0.6775000     2.415000  0.8150000     -0.9057000     1.060000  
1 1 1 10 2  12 o 7.624000  0.2049000     7.609000  0.2868000     7.639000  0.2926000     -0.2973000E-01 0.4097000 
1 1 1 10 2  13 o 15.44000  0.1925000     15.58000  0.2723000     15.30000  0.2723000     0.2778000      0.3850000 
1 1 1 10 2  14 f 10.08000  0.2064000     10.01000  0.2938000     10.16000  0.2899000     -0.1543000     0.4127000 
1 1 1 10 2  15 o 7.829000  0.3561000     7.550000  0.5118000     8.109000  0.4954000     -0.5592000     0.7123000 
1 1 1 10 2  16 o 5.965000  0.4926000     5.531000  0.7625000     6.399000  0.6240000     -0.8677000     0.9853000 
1 1 1 10 2  17 o 3.994000  0.5324000     4.791000  0.6312000     3.198000  0.8574000     1.593000       1.065000  
1 1 1 10 2  18 f 2.685000  0.6478000     2.917000  0.9276000     2.454000  0.9045000     0.4637000      1.296000  
1 1 1 10 2  19 o 3.622000  0.6458000     3.786000  0.8985000     3.457000  0.9279000     0.3292000      1.292000  
1 1 1 10 2  20 o 3.086000  0.7412000     2.890000  1.047000      3.281000  1.050000      -0.3914000     1.482000  
1 1 1 10 2  21 f 1.985000  0.6471000     2.015000  0.9258000     1.956000  0.9045000     0.5844000E-01  1.294000  
1 1 1 10 2  22 o 1.857000  0.5486000     1.402000  0.6719000     2.312000  0.8674000     -0.9097000     1.097000  
1 1 1 10 2  23 f 1.613000  0.4981000     1.369000  0.6411000     1.858000  0.7626000     -0.4895000     0.9963000 
1 1 1 10 2  24 o 2.261000  0.5624000     2.326000  0.7928000     2.196000  0.7979000     0.1298000      1.125000  
1 1 1 10 2  25 f 1.925000  0.5427000     1.937000  0.7670000     1.914000  0.7680000     0.2360000E-01  1.085000  
1 1 1 10 2  26 o 1.328000  0.4529000     1.271000  0.6179000     1.386000  0.6623000     -0.1147000     0.9058000 
1 1 1 10 2  27 o 1.409000  0.4613000     1.447000  0.6643000     1.371000  0.6401000     0.7625000E-01  0.9225000 
1 1 1 10 3  0  o 22.12000  0.2434000     22.12000  0.2434000     22.12000  0.2434000     0.000000       0.000000  
1 1 1 10 3  1  o 34.11000  0.2632000     34.01000  0.3715000     34.20000  0.3731000     -0.1918000     0.5265000 
1 1 1 10 3  2  o 7.796000  0.8560000E-01 7.847000  0.1266000     7.745000  0.1153000     0.1022000      0.1712000 
1 1 1 10 3  3  o 37.02000  0.2974000     36.95000  0.3624000     37.09000  0.4716000     -0.1353000     0.5948000 
1 1 1 10 3  4  o 19.92000  0.1647000     19.94000  0.2330000     19.91000  0.2328000     0.2906000E-01  0.3293000 
1 1 1 10 3  5  o 20.51000  0.1721000     20.65000  0.2448000     20.37000  0.2419000     0.2726000      0.3441000 
1 1 1 10 3  6  o 7.339000  0.1429000     7.180000  0.2044000     7.497000  0.1996000     -0.3166000     0.2857000 
1 1 1 10 3  7  o 9.808000  0.1297000     9.757000  0.1832000     9.860000  0.1836000     -0.1022000     0.2594000 
1 1 1 10 3  8  o 6.179000  0.1568000     6.180000  0.2214000     6.178000  0.2222000     0.2415000E-02  0.3137000 
1 1 1 10 3  9  o 20.77000  0.2202000     20.85000  0.3130000     20.68000  0.3097000     0.1689000      0.4403000 
1 1 1 10 3  10 o 4.529000  0.3343000     4.636000  0.4653000     4.422000  0.4801000     0.2138000      0.6686000 
1 1 1 10 3  11 o 6.729000  0.3014000     6.405000  0.4432000     7.054000  0.4085000     -0.6486000     0.6028000 
1 1 1 10 3  12 o 1.590000  0.4330000     2.105000  0.6933000     1.074000  0.5191000     1.031000       0.8661000 
1 1 1 10 3  13 o 8.802000  0.2086000     8.838000  0.2920000     8.766000  0.2980000     0.7215000E-01  0.4172000 
1 1 1 10 3  14 o 6.671000  0.2596000     5.973000  0.3922000     7.368000  0.3403000     -1.395000      0.5192000 
1 1 1 10 3  15 o 2.408000  0.6644000     2.288000  0.9237000     2.529000  0.9553000     -0.2415000     1.329000  
1 1 1 10 3  16 o 7.026000  0.4259000     6.178000  0.6556000     7.875000  0.5438000     -1.697000      0.8517000 
1 1 1 10 3  17 o 2.145000  0.6000000     1.859000  0.7997000     2.431000  0.8947000     -0.5719000     1.200000  
1 1 1 10 3  18 o 9.427000  0.2854000     9.653000  0.3925000     9.201000  0.4144000     0.4524000      0.5708000 
1 1 1 10 3  19 o 3.209000  0.6486000     2.479000  0.9511000     3.940000  0.8822000     -1.461000      1.297000  
1 1 1 10 3  20 o 2.799000  0.7146000     3.322000  1.041000      2.276000  0.9797000     1.047000       1.429000  
1 1 1 10 3  21 o 4.690000  0.7412000     4.714000  1.046000      4.665000  1.051000      0.4942000E-01  1.482000  
1 1 1 10 3  22 o 2.051000  0.5980000     1.930000  0.8251000     2.172000  0.8660000     -0.2417000     1.196000  
1 1 1 10 3  23 o 1.738000  0.5145000     1.388000  0.6474000     2.088000  0.7998000     -0.6998000     1.029000  
1 1 1 10 3  24 o 1.565000  0.4935000     1.411000  0.6594000     1.719000  0.7344000     -0.3079000     0.9870000 
1 1 1 10 3  25 f 2.574000  0.5409000     3.114000  0.7531000     2.033000  0.7766000     1.081000       1.082000  
1 1 1 10 3  26 o 1.862000  0.5262000     2.283000  0.7993000     1.442000  0.6847000     0.8411000      1.052000  
1 1 1 10 3  27 o 1.207000  0.4129000     1.219000  0.5879000     1.196000  0.5799000     0.2276000E-01  0.8258000 
1 1 1 10 4  0  o 24.04000  0.2644000     24.04000  0.2644000     24.04000  0.2644000     -0.000000      0.000000  
1 1 1 10 4  1  o 29.63000  0.2298000     29.68000  0.3257000     29.58000  0.3242000     0.1056000      0.4596000 
1 1 1 10 4  2  o 16.27000  0.1372000     16.34000  0.2177000     16.20000  0.1670000     0.1360000      0.2744000 
1 1 1 10 4  3  o 50.10000  0.4178000     49.70000  0.6275000     50.50000  0.5518000     -0.8017000     0.8356000 
1 1 1 10 4  4  o 28.91000  0.2368000     29.00000  0.2897000     28.83000  0.3746000     0.1726000      0.4735000 
1 1 1 10 4  5  o 31.57000  0.2506000     31.52000  0.3539000     31.62000  0.3550000     -0.1072000     0.5012000 
1 1 1 10 4  6  o 7.231000  0.1233000     7.246000  0.1746000     7.217000  0.1740000     0.2858000E-01  0.2465000 
1 1 1 10 4  7  o 15.28000  0.1487000     15.31000  0.2111000     15.25000  0.2095000     0.5854000E-01  0.2974000 
1 1 1 10 4  8  o 3.466000  0.2369000     3.576000  0.3300000     3.356000  0.3399000     0.2202000      0.4737000 
1 1 1 10 4  9  o 5.655000  0.2161000     5.894000  0.2959000     5.416000  0.3150000     0.4784000      0.4322000 
1 1 1 10 4  10 o 10.59000  0.2318000     10.53000  0.3304000     10.65000  0.3253000     -0.1205000     0.4637000 
1 1 1 10 4  11 o 8.271000  0.2333000     8.349000  0.3244000     8.193000  0.3354000     0.1559000      0.4666000 
1 1 1 10 4  12 o 9.628000  0.1900000     9.676000  0.2667000     9.581000  0.2706000     0.9458000E-01  0.3800000 
1 1 1 10 4  13 o 10.83000  0.1979000     11.26000  0.2764000     10.40000  0.2833000     0.8549000      0.3958000 
1 1 1 10 4  14 o 6.539000  0.2690000     6.824000  0.3692000     6.253000  0.3914000     0.5709000      0.5381000 
1 1 1 10 4  15 o 6.423000  0.3508000     6.703000  0.4786000     6.144000  0.5130000     0.5586000      0.7016000 
1 1 1 10 4  16 o 7.093000  0.4300000     7.399000  0.5968000     6.787000  0.6193000     0.6126000      0.8600000 
1 1 1 10 4  17 o 1.795000  0.5526000     1.504000  0.7094000     2.085000  0.8474000     -0.5815000     1.105000  
1 1 1 10 4  18 o 11.00000  0.2677000     11.16000  0.3799000     10.83000  0.3773000     0.3363000      0.5354000 
1 1 1 10 4  19 o 7.904000  0.3453000     7.936000  0.4953000     7.871000  0.4812000     0.6544000E-01  0.6906000 
1 1 1 10 4  20 f 3.797000  0.6855000     2.789000  1.048000      4.804000  0.8833000     -2.015000      1.371000  
1 1 1 10 4  21 o 2.735000  0.7042000     3.519000  1.097000      1.950000  0.8839000     1.569000       1.408000  
1 1 1 10 4  22 o 2.502000  0.6389000     2.443000  0.9018000     2.562000  0.9051000     -0.1182000     1.278000  
1 1 1 10 4  23 o 1.920000  0.5442000     2.141000  0.8063000     1.699000  0.7311000     0.4428000      1.088000  
1 1 1 10 4  24 o 1.338000  0.4410000     1.021000  0.5112000     1.655000  0.7187000     -0.6347000     0.8820000 
1 1 1 10 4  25 o 1.277000  0.4307000     1.253000  0.6014000     1.301000  0.6168000     -0.4762000E-01 0.8615000 
1 1 1 10 4  26 o 1.385000  0.4483000     1.072000  0.5310000     1.698000  0.7225000     -0.6263000     0.8967000 
1 1 1 10 4  27 o 1.549000  0.4887000     1.387000  0.6458000     1.710000  0.7336000     -0.3229000     0.9773000 
1 1 1 10 5  0  o 17.71000  0.1993000     17.71000  0.1993000     17.71000  0.1993000     0.000000       0.000000  
1 1 1 10 5  1  o 27.58000  0.2146000     27.80000  0.3059000     27.35000  0.3011000     0.4521000      0.4292000 
1 1 1 10 5  2  o 17.22000  0.1397000     17.15000  0.1971000     17.29000  0.1981000     -0.1348000     0.2795000 
1 1 1 10 5  3  o 15.80000  0.1375000     15.83000  0.2179000     15.76000  0.1677000     0.6618000E-01  0.2749000 
1 1 1 10 5  4  o 16.04000  0.1579000     16.12000  0.2223000     15.96000  0.2244000     0.1516000      0.3159000 
1 1 1 10 5  5  f 4.442000  0.1661000     4.381000  0.1477000     4.502000  0.2976000     -0.1208000     0.3322000 
1 1 1 10 5  6  o 8.306000  0.1222000     8.383000  0.1739000     8.229000  0.1717000     0.1544000      0.2444000 
1 1 1 10 5  7  o 5.563000  0.1475000     5.575000  0.2100000     5.551000  0.2073000     0.2459000E-01  0.2951000 
1 1 1 10 5  8  o 12.56000  0.1438000     12.65000  0.2044000     12.47000  0.2025000     0.1754000      0.2877000 
1 1 1 10 5  9  o 9.076000  0.1799000     9.072000  0.2563000     9.079000  0.2524000     -0.6964000E-02 0.3598000 
1 1 1 10 5  10 o 4.261000  0.3757000     4.545000  0.5057000     3.977000  0.5559000     0.5680000      0.7515000 
1 1 1 10 5  11 o 6.525000  0.2571000     6.423000  0.3675000     6.627000  0.3595000     -0.2043000     0.5141000 
1 1 1 10 5  12 o 8.519000  0.1986000     8.424000  0.2873000     8.614000  0.2742000     -0.1907000     0.3972000 
1 1 1 10 5  13 f 9.357000  0.2081000     9.120000  0.2986000     9.595000  0.2899000     -0.4750000     0.4162000 
1 1 1 10 5  14 o 13.75000  0.1999000     13.63000  0.2824000     13.87000  0.2830000     -0.2427000     0.3998000 
1 1 1 10 5  15 o 2.761000  0.6206000     1.952000  0.8198000     3.570000  0.9319000     -1.618000      1.241000  
1 1 1 10 5  16 o 5.117000  0.5813000     5.879000  0.7111000     4.355000  0.9198000     1.524000       1.163000  
1 1 1 10 5  17 o 7.778000  0.3004000     7.412000  0.4359000     8.144000  0.4134000     -0.7319000     0.6008000 
1 1 1 10 5  18 o 2.439000  0.6518000     2.575000  0.9358000     2.302000  0.9074000     0.2729000      1.304000  
1 1 1 10 5  19 o 3.431000  0.6379000     4.288000  0.8269000     2.573000  0.9716000     1.715000       1.276000  
1 1 1 10 5  20 o 3.211000  0.7459000     3.567000  1.057000      2.856000  1.052000      0.7115000      1.492000  
1 1 1 10 5  21 o 4.335000  0.6686000     3.752000  1.028000      4.917000  0.8553000     -1.165000      1.337000  
1 1 1 10 5  22 o 1.923000  0.5791000     2.113000  0.8543000     1.733000  0.7819000     0.3802000      1.158000  
1 1 1 10 5  23 f 1.856000  0.5434000     1.812000  0.7598000     1.900000  0.7771000     -0.8828000E-01 1.087000  
1 1 1 10 5  24 o 1.609000  0.4992000     1.472000  0.6738000     1.746000  0.7368000     -0.2739000     0.9984000 
1 1 1 10 5  25 o 1.565000  0.4742000     1.168000  0.5703000     1.962000  0.7578000     -0.7937000     0.9485000 
1 1 1 10 5  26 o 1.563000  0.4824000     1.155000  0.5620000     1.972000  0.7841000     -0.8177000     0.9648000 
1 1 1 10 5  27 o 1.476000  0.4669000     1.069000  0.5315000     1.883000  0.7677000     -0.8142000     0.9337000 
1 1 1 10 6  0  o 24.12000  0.2674000     24.12000  0.2674000     24.12000  0.2674000     -0.000000      0.000000  
1 1 1 10 6  1  o 35.21000  0.2729000     35.35000  0.3873000     35.08000  0.3846000     0.2717000      0.5458000 
1 1 1 10 6  2  o 22.72000  0.1954000     23.08000  0.2993000     22.36000  0.2513000     0.7270000      0.3909000 
1 1 1 10 6  3  o 37.49000  0.2914000     37.57000  0.4131000     37.42000  0.4111000     0.1483000      0.5828000 
1 1 1 10 6  4  o 23.35000  0.2430000     23.30000  0.3745000     23.39000  0.3096000     -0.8975000E-01 0.4859000 
1 1 1 10 6  5  o 24.66000  0.2315000     24.92000  0.3300000     24.41000  0.3248000     0.5066000      0.4630000 
1 1 1 10 6  6  o 10.56000  0.1282000     10.59000  0.1490000     10.53000  0.2087000     0.5828000E-01  0.2564000 
1 1 1 10 6  7  o 12.28000  0.1363000     12.20000  0.1920000     12.36000  0.1936000     -0.1613000     0.2727000 
1 1 1 10 6  8  o 10.27000  0.1409000     10.01000  0.2003000     10.54000  0.1983000     -0.5299000     0.2819000 
1 1 1 10 6  9  o 7.786000  0.1867000     7.610000  0.2674000     7.961000  0.2607000     -0.3506000     0.3734000 
1 1 1 10 6  10 o 3.916000  0.3301000     3.780000  0.4788000     4.053000  0.4545000     -0.2728000     0.6602000 
1 1 1 10 6  11 o 2.184000  0.5035000     1.765000  0.7090000     2.603000  0.7152000     -0.8380000     1.007000  
1 1 1 10 6  12 o 5.049000  0.2751000     5.046000  0.3905000     5.051000  0.3875000     -0.5748000E-02 0.5502000 
1 1 1 10 6  13 o 12.59000  0.1932000     12.86000  0.2725000     12.32000  0.2739000     0.5450000      0.3864000 
1 1 1 10 6  14 o 6.572000  0.2658000     6.308000  0.3882000     6.836000  0.3632000     -0.5279000     0.5316000 
1 1 1 10 6  15 o 6.628000  0.3467000     6.577000  0.4917000     6.680000  0.4888000     -0.1031000     0.6933000 
1 1 1 10 6  16 o 5.427000  0.4424000     5.241000  0.6626000     5.614000  0.5863000     -0.3734000     0.8848000 
1 1 1 10 6  17 o 16.73000  0.2310000     17.06000  0.3277000     16.40000  0.3256000     0.6646000      0.4619000 
1 1 1 10 6  18 o 7.524000  0.3395000     7.433000  0.4779000     7.615000  0.4824000     -0.1817000     0.6791000 
1 1 1 10 6  19 o 5.048000  0.5013000     4.853000  0.7356000     5.243000  0.6812000     -0.3899000     1.003000  
1 1 1 10 6  20 o 4.318000  0.6623000     5.426000  0.7759000     3.209000  1.074000      2.217000       1.325000  
1 1 1 10 6  21 o 1.893000  0.6123000     1.629000  0.7848000     2.158000  0.9399000     -0.5289000     1.225000  
1 1 1 10 6  22 f 2.147000  0.5989000     1.801000  0.7958000     2.493000  0.8951000     -0.6923000     1.198000  
1 1 1 10 6  23 o 1.957000  0.5475000     1.717000  0.7333000     2.196000  0.8131000     -0.4789000     1.095000  
1 1 1 10 6  24 o 2.216000  0.5511000     2.671000  0.7965000     1.760000  0.7619000     0.9113000      1.102000  
1 1 1 10 6  25 o 1.443000  0.4675000     1.569000  0.6958000     1.317000  0.6244000     0.2515000      0.9349000 
1 1 1 10 6  26 o 1.438000  0.4645000     1.222000  0.5902000     1.653000  0.7175000     -0.4311000     0.9290000 
1 1 1 10 6  27 o 1.357000  0.4551000     1.522000  0.6995000     1.192000  0.5824000     0.3299000      0.9102000 
1 1 1 10 7  0  o 13.84000  0.1645000     13.84000  0.1645000     13.84000  0.1645000     -0.000000      0.000000  
1 1 1 10 7  1  o 15.17000  0.1261000     15.12000  0.1777000     15.21000  0.1789000     -0.9058000E-01 0.2521000 
1 1 1 10 7  2  o 14.30000  0.1217000     14.25000  0.1715000     14.35000  0.1728000     -0.1024000     0.2434000 
1 1 1 10 7  3  o 20.33000  0.1656000     20.31000  0.2342000     20.35000  0.2342000     -0.3713000E-01 0.3312000 
1 1 1 10 7  4  o 15.89000  0.1674000     15.71000  0.1941000     16.06000  0.2728000     -0.3494000     0.3348000 
1 1 1 10 7  5  o 24.10000  0.3234000     24.62000  0.5852000     23.58000  0.2756000     1.044000       0.6469000 
1 1 1 10 7  6  o 11.80000  0.1247000     11.73000  0.1749000     11.87000  0.1778000     -0.1433000     0.2494000 
1 1 1 10 7  7  o 8.597000  0.1373000     8.476000  0.1653000     8.718000  0.2192000     -0.2424000     0.2746000 
1 1 1 10 7  8  o 12.36000  0.1456000     12.31000  0.2076000     12.40000  0.2043000     -0.9071000E-01 0.2913000 
1 1 1 10 7  9  o 16.02000  0.1927000     16.08000  0.2737000     15.96000  0.2712000     0.1226000      0.3853000 
1 1 1 10 7  10 o 14.21000  0.1946000     14.33000  0.2760000     14.08000  0.2743000     0.2537000      0.3891000 
1 1 1 10 7  11 o 4.003000  0.3273000     4.219000  0.4277000     3.787000  0.4955000     0.4324000      0.6545000 
1 1 1 10 7  12 o 5.171000  0.2699000     5.494000  0.3648000     4.847000  0.3979000     0.6475000      0.5398000 
1 1 1 10 7  13 o 15.27000  0.1927000     15.42000  0.2743000     15.12000  0.2706000     0.3040000      0.3854000 
1 1 1 10 7  14 o 14.26000  0.2014000     13.84000  0.2850000     14.67000  0.2848000     -0.8385000     0.4029000 
1 1 1 10 7  15 o 8.814000  0.2844000     8.604000  0.4109000     9.024000  0.3934000     -0.4204000     0.5688000 
1 1 1 10 7  16 o 2.093000  0.6199000     2.095000  0.8860000     2.092000  0.8671000     0.3404000E-02  1.240000  
1 1 1 10 7  17 o 9.208000  0.2744000     9.037000  0.3954000     9.379000  0.3805000     -0.3414000     0.5488000 
1 1 1 10 7  18 o 8.633000  0.3090000     8.214000  0.4549000     9.051000  0.4183000     -0.8378000     0.6180000 
1 1 1 10 7  19 o 6.618000  0.3873000     6.364000  0.5566000     6.872000  0.5388000     -0.5077000     0.7747000 
1 1 1 10 7  20 o 2.953000  0.7117000     2.295000  0.9621000     3.611000  1.049000      -1.317000      1.423000  
1 1 1 10 7  21 o 2.687000  0.6639000     1.797000  0.8440000     3.578000  1.025000      -1.781000      1.328000  
1 1 1 10 7  22 o 2.070000  0.5924000     1.902000  0.8202000     2.238000  0.8549000     -0.3366000     1.185000  
1 1 1 10 7  23 o 1.637000  0.5059000     1.562000  0.6991000     1.711000  0.7313000     -0.1490000     1.012000  
1 1 1 10 7  24 o 1.634000  0.5050000     1.569000  0.7023000     1.699000  0.7259000     -0.1308000     1.010000  
1 1 1 10 7  25 o 1.107000  0.3851000     0.9890000 0.4966000     1.225000  0.5888000     -0.2362000     0.7703000 
1 1 1 10 7  26 o 1.470000  0.4689000     1.360000  0.6350000     1.579000  0.6901000     -0.2194000     0.9378000 
1 1 1 10 7  27 o 1.219000  0.4265000     1.276000  0.6253000     1.161000  0.5802000     0.1156000      0.8531000 
1 1 1 10 8  0  o 5.724000  0.1124000     5.724000  0.1124000     5.724000  0.1124000     -0.000000      0.000000  
1 1 1 10 8  1  f 16.86000  0.1390000     16.94000  0.1971000     16.78000  0.1961000     0.1538000      0.2780000 
1 1 1 10 8  2  o 13.79000  0.1201000     13.92000  0.1713000     13.66000  0.1685000     0.2642000      0.2402000 
1 1 1 10 8  3  o 19.40000  0.1732000     19.44000  0.2631000     19.36000  0.2254000     0.7973000E-01  0.3464000 
1 1 1 10 8  4  o 10.22000  0.1115000     10.26000  0.1488000     10.18000  0.1661000     0.8353000E-01  0.2230000 
1 1 1 10 8  5  o 18.33000  0.2543000     18.56000  0.4690000     18.11000  0.1968000     0.4433000      0.5086000 
1 1 1 10 8  6  o 9.941000  0.1193000     9.981000  0.1665000     9.902000  0.1709000     0.7838000E-01  0.2386000 
1 1 1 10 8  7  o 7.612000  0.1231000     7.563000  0.1738000     7.660000  0.1744000     -0.9638000E-01 0.2462000 
1 1 1 10 8  8  o 3.891000  0.2258000     4.095000  0.2274000     3.687000  0.3903000     0.4080000      0.4517000 
1 1 1 10 8  9  o 10.62000  0.2164000     10.47000  0.3060000     10.78000  0.3060000     -0.3159000     0.4328000 
1 1 1 10 8  10 o 2.341000  0.4745000     2.698000  0.6525000     1.985000  0.6893000     0.7137000      0.9491000 
1 1 1 10 8  11 o 7.521000  0.2007000     7.467000  0.2851000     7.575000  0.2827000     -0.1073000     0.4015000 
1 1 1 10 8  12 o 6.834000  0.2277000     7.284000  0.3041000     6.383000  0.3390000     0.9010000      0.4554000 
1 1 1 10 8  13 o 19.09000  0.2049000     19.20000  0.2908000     18.99000  0.2888000     0.2138000      0.4099000 
1 1 1 10 8  14 f 3.734000  0.4457000     3.227000  0.7083000     4.241000  0.5412000     -1.014000      0.8914000 
1 1 1 10 8  15 o 10.45000  0.2632000     10.86000  0.3667000     10.03000  0.3776000     0.8256000      0.5264000 
1 1 1 10 8  16 o 14.34000  0.2609000     14.42000  0.3689000     14.25000  0.3691000     0.1616000      0.5219000 
1 1 1 10 8  17 o 8.203000  0.3274000     8.296000  0.4127000     8.110000  0.5084000     0.1862000      0.6548000 
1 1 1 10 8  18 o 2.511000  0.6577000     2.304000  0.9075000     2.718000  0.9521000     -0.4143000     1.315000  
1 1 1 10 8  19 o 7.587000  0.3546000     7.170000  0.5143000     8.004000  0.4883000     -0.8339000     0.7092000 
1 1 1 10 8  20 o 3.444000  0.7007000     4.285000  0.9419000     2.604000  1.038000      1.681000       1.401000  
1 1 1 10 8  21 o 1.845000  0.6013000     1.615000  0.7768000     2.074000  0.9180000     -0.4593000     1.203000  
1 1 1 10 8  22 o 3.418000  0.5503000     2.721000  0.8743000     4.116000  0.6685000     -1.395000      1.101000  
1 1 1 10 8  23 o 2.020000  0.5480000     2.218000  0.7905000     1.822000  0.7593000     0.3958000      1.096000  
1 1 1 10 8  24 o 1.804000  0.5266000     1.859000  0.7533000     1.750000  0.7359000     0.1082000      1.053000  
1 1 1 10 8  25 o 2.357000  0.5257000     2.984000  0.7540000     1.730000  0.7327000     1.255000       1.051000  
1 1 1 10 8  26 o 1.574000  0.4857000     1.837000  0.7470000     1.311000  0.6208000     0.5262000      0.9713000 
1 1 1 10 8  27 o 1.180000  0.6029000     1.180000  0.6029000     ?         ?             ?              ?         
1 1 1 10 9  0  o 8.314000  0.1263000     8.314000  0.1263000     8.314000  0.1263000     0.000000       0.000000  
1 1 1 10 9  1  o 22.99000  0.1838000     23.00000  0.2599000     22.97000  0.2599000     0.2230000E-01  0.3675000 
1 1 1 10 9  2  o 14.29000  0.1247000     14.34000  0.1769000     14.25000  0.1759000     0.8735000E-01  0.2494000 
1 1 1 10 9  3  o 10.32000  0.1344000     10.12000  0.2056000     10.52000  0.1732000     -0.4012000     0.2688000 
1 1 1 10 9  4  f 27.65000  0.2710000     27.71000  0.3129000     27.60000  0.4425000     0.1133000      0.5420000 
1 1 1 10 9  5  o 16.69000  0.1463000     16.67000  0.2069000     16.71000  0.2069000     -0.3947000E-01 0.2926000 
1 1 1 10 9  6  f 18.22000  0.1659000     18.12000  0.2625000     18.32000  0.2031000     -0.2002000     0.3319000 
1 1 1 10 9  7  o 4.602000  0.1487000     4.529000  0.2097000     4.675000  0.2107000     -0.1460000     0.2973000 
1 1 1 10 9  8  o 8.489000  0.1358000     8.702000  0.1914000     8.277000  0.1927000     0.4249000      0.2716000 
1 1 1 10 9  9  o 18.94000  0.3222000     18.66000  0.3589000     19.22000  0.5352000     -0.5580000     0.6444000 
1 1 1 10 9  10 o 4.439000  0.3686000     4.919000  0.4016000     3.958000  0.6181000     0.9603000      0.7371000 
1 1 1 10 9  11 o 7.537000  0.2037000     7.538000  0.2866000     7.536000  0.2897000     0.2202000E-02  0.4075000 
1 1 1 10 9  12 o 5.060000  0.2777000     5.062000  0.3948000     5.059000  0.3908000     0.2705000E-02  0.5555000 
1 1 1 10 9  13 o 11.08000  0.1955000     11.06000  0.2756000     11.10000  0.2773000     -0.4324000E-01 0.3910000 
1 1 1 10 9  14 o 13.25000  0.2039000     13.22000  0.2877000     13.27000  0.2890000     -0.5453000E-01 0.4078000 
1 1 1 10 9  15 o 3.875000  0.4856000     4.862000  0.5185000     2.887000  0.8211000     1.974000       0.9711000 
1 1 1 10 9  16 f 15.08000  0.2427000     14.92000  0.3166000     15.23000  0.3679000     -0.3122000     0.4854000 
1 1 1 10 9  17 o 6.344000  0.3968000     6.621000  0.5811000     6.067000  0.5406000     0.5536000      0.7937000 
1 1 1 10 9  18 f 2.744000  0.6454000     2.228000  0.8985000     3.260000  0.9268000     -1.032000      1.291000  
1 1 1 10 9  19 f 3.539000  0.6665000     3.514000  0.9483000     3.564000  0.9367000     -0.4985000E-01 1.333000  
1 1 1 10 9  20 o 5.782000  0.4563000     5.690000  0.6584000     5.873000  0.6320000     -0.1822000     0.9126000 
1 1 1 10 9  21 o 2.792000  0.7071000     2.495000  0.9678000     3.088000  1.031000      -0.5926000     1.414000  
1 1 1 10 9  22 o 1.877000  0.5221000     2.506000  0.8503000     1.248000  0.6060000     1.258000       1.044000  
1 1 1 10 9  23 o 1.620000  0.5035000     1.627000  0.7147000     1.613000  0.7093000     0.1452000E-01  1.007000  
1 1 1 10 9  24 o 1.548000  0.4914000     1.393000  0.6564000     1.704000  0.7314000     -0.3115000     0.9827000 
1 1 1 10 9  25 o 1.858000  0.5300000     1.681000  0.7199000     2.036000  0.7781000     -0.3547000     1.060000  
1 1 1 10 9  26 o 1.363000  0.4468000     1.170000  0.5687000     1.557000  0.6892000     -0.3867000     0.8936000 
1 1 1 10 10 0  o 18.65000  0.2173000     18.65000  0.2173000     18.65000  0.2173000     0.000000       0.000000  
1 1 1 10 10 1  o 27.83000  0.2200000     27.91000  0.3118000     27.75000  0.3105000     0.1565000      0.4400000 
1 1 1 10 10 2  o 25.91000  0.2232000     25.90000  0.3375000     25.92000  0.2922000     -0.2364000E-01 0.4464000 
1 1 1 10 10 3  o 27.14000  0.2665000     26.70000  0.3015000     27.58000  0.4394000     -0.8818000     0.5329000 
1 1 1 10 10 4  o 15.89000  0.1822000     15.89000  0.2814000     15.89000  0.2317000     -0.5528000E-02 0.3645000 
1 1 1 10 10 5  o 26.12000  0.2118000     26.13000  0.3000000     26.10000  0.2989000     0.3314000E-01  0.4235000 
1 1 1 10 10 6  o 9.627000  0.1140000     9.729000  0.1635000     9.525000  0.1589000     0.2038000      0.2280000 
1 1 1 10 10 7  o 13.43000  0.1393000     13.34000  0.1944000     13.51000  0.1996000     -0.1717000     0.2787000 
1 1 1 10 10 8  o 11.01000  0.1597000     10.76000  0.2524000     11.27000  0.1957000     -0.5080000     0.3194000 
1 1 1 10 10 9  o 6.752000  0.4780000     6.752000  0.4780000     ?         ?             ?              ?         
1 1 1 10 10 10 o 10.17000  0.1913000     10.33000  0.2897000     10.01000  0.2499000     0.3143000      0.3826000 
1 1 1 10 10 11 o 10.20000  0.2209000     10.53000  0.2084000     9.867000  0.3895000     0.6655000      0.4417000 
1 1 1 10 10 12 o 14.95000  0.1871000     14.99000  0.2663000     14.90000  0.2629000     0.9107000E-01  0.3742000 
1 1 1 10 10 13 o 8.819000  0.2121000     8.688000  0.3040000     8.949000  0.2957000     -0.2604000     0.4241000 
1 1 1 10 10 14 o 6.895000  0.2634000     7.013000  0.3724000     6.776000  0.3727000     0.2374000      0.5269000 
1 1 1 10 10 15 o 8.148000  0.2637000     8.102000  0.3799000     8.193000  0.3660000     -0.9086000E-01 0.5275000 
1 1 1 10 10 16 o 3.901000  0.5131000     3.689000  0.7656000     4.112000  0.6834000     -0.4230000     1.026000  
1 1 1 10 10 17 o 2.109000  0.6032000     1.863000  0.8130000     2.354000  0.8913000     -0.4910000     1.206000  
1 1 1 10 10 18 o 4.350000  0.5511000     4.603000  0.7410000     4.097000  0.8160000     0.5065000      1.102000  
1 1 1 10 10 19 o 10.22000  0.2978000     10.85000  0.4034000     9.585000  0.4383000     1.260000       0.5956000 
1 1 1 10 10 20 o 2.641000  0.6189000     3.524000  0.9351000     1.758000  0.8111000     1.765000       1.238000  
1 1 1 10 10 21 o 3.148000  0.6703000     3.056000  0.9496000     3.240000  0.9464000     -0.1836000     1.341000  
1 1 1 10 10 22 o 2.047000  0.5752000     2.135000  0.8303000     1.959000  0.7963000     0.1758000      1.150000  
1 1 1 10 10 23 o 2.075000  0.5444000     1.764000  0.7408000     2.387000  0.7979000     -0.6231000     1.089000  
1 1 1 10 10 24 o 1.575000  0.5014000     1.467000  0.6768000     1.682000  0.7401000     -0.2147000     1.003000  
1 1 1 10 10 25 o 2.007000  0.5266000     2.472000  0.7821000     1.543000  0.7054000     0.9284000      1.053000  
1 1 1 10 10 26 o 1.832000  0.5273000     1.697000  0.7214000     1.967000  0.7692000     -0.2699000     1.055000  
1 1 1 10 11 0  o 15.41000  0.1885000     15.41000  0.1885000     15.41000  0.1885000     0.000000       0.000000  
1 1 1 10 11 1  o 16.98000  0.1439000     17.13000  0.2050000     16.83000  0.2020000     0.2935000      0.2878000 
1 1 1 10 11 2  f 21.58000  0.2484000     21.74000  0.3540000     21.42000  0.3485000     0.3129000      0.4967000 
1 1 1 10 11 3  o 20.77000  0.2221000     20.83000  0.2798000     20.71000  0.3449000     0.1216000      0.4441000 
1 1 1 10 11 4  o 5.950000  0.1030000     5.986000  0.1448000     5.913000  0.1464000     0.7261000E-01  0.2059000 
1 1 1 10 11 5  o 21.10000  0.1771000     21.15000  0.2510000     21.06000  0.2500000     0.9298000E-01  0.3543000 
1 1 1 10 11 6  o 23.21000  0.1934000     23.35000  0.2752000     23.08000  0.2719000     0.2773000      0.3868000 
1 1 1 10 11 7  o 3.974000  0.1610000     4.225000  0.2504000     3.724000  0.2024000     0.5007000      0.3219000 
1 1 1 10 11 8  o 4.630000  0.2440000     4.901000  0.4128000     4.359000  0.2603000     0.5422000      0.4880000 
1 1 1 10 11 9  o 6.191000  0.3551000     6.209000  0.3952000     6.174000  0.5902000     0.3544000E-01  0.7103000 
1 1 1 10 11 10 o 6.065000  0.3476000     5.811000  0.6341000     6.319000  0.2850000     -0.5088000     0.6952000 
1 1 1 10 11 11 o 7.190000  0.1921000     7.350000  0.2475000     7.029000  0.2939000     0.3212000      0.3842000 
1 1 1 10 11 12 o 5.772000  0.2815000     5.909000  0.2909000     5.635000  0.4820000     0.2742000      0.5630000 
1 1 1 10 11 13 o 10.22000  0.2077000     10.06000  0.2947000     10.38000  0.2929000     -0.3234000     0.4155000 
1 1 1 10 11 14 o 9.235000  0.2574000     9.265000  0.3707000     9.204000  0.3573000     0.6102000E-01  0.5149000 
1 1 1 10 11 15 o 6.437000  0.3313000     6.046000  0.4452000     6.827000  0.4908000     -0.7814000     0.6626000 
1 1 1 10 11 16 o 7.491000  0.2895000     7.542000  0.4078000     7.441000  0.4111000     0.1017000      0.5790000 
1 1 1 10 11 17 o 5.672000  0.3968000     5.707000  0.5625000     5.636000  0.5599000     0.7052000E-01  0.7937000 
1 1 1 10 11 18 o 9.757000  0.2896000     9.360000  0.4183000     10.15000  0.4008000     -0.7952000     0.5793000 
1 1 1 10 11 19 o 5.423000  0.4929000     5.964000  0.6128000     4.882000  0.7721000     1.082000       0.9857000 
1 1 1 10 11 20 o 3.046000  0.6467000     3.866000  0.9129000     2.226000  0.9161000     1.640000       1.293000  
1 1 1 10 11 21 o 4.125000  0.5737000     3.714000  0.8934000     4.535000  0.7201000     -0.8213000     1.147000  
1 1 1 10 11 22 o 1.602000  0.5064000     1.343000  0.6429000     1.860000  0.7825000     -0.5164000     1.013000  
1 1 1 10 11 23 o 2.057000  0.5358000     1.721000  0.7288000     2.393000  0.7856000     -0.6721000     1.072000  
1 1 1 10 11 24 o 1.758000  0.5345000     1.505000  0.6921000     2.011000  0.8147000     -0.5060000     1.069000  
1 1 1 10 11 25 o 1.463000  0.4791000     1.519000  0.6963000     1.407000  0.6584000     0.1123000      0.9583000 
1 1 1 10 11 26 o 1.961000  0.5229000     2.385000  0.7932000     1.537000  0.6817000     0.8478000      1.046000  
1 1 1 10 12 0  o 34.30000  0.5386000     34.30000  0.5386000     34.30000  0.5386000     0.000000       0.000000  
1 1 1 10 12 1  o 22.48000  0.3216000     22.17000  0.3613000     22.79000  0.5322000     -0.6146000     0.6433000 
1 1 1 10 12 2  o 24.49000  0.3231000     24.43000  0.3212000     24.55000  0.5608000     -0.1202000     0.6463000 
1 1 1 10 12 3  o 12.51000  0.1473000     12.45000  0.2406000     12.56000  0.1699000     -0.1046000     0.2945000 
1 1 1 10 12 4  o 19.75000  0.1668000     19.84000  0.2370000     19.66000  0.2349000     0.1738000      0.3337000 
1 1 1 10 12 5  o 7.292000  0.1130000     7.418000  0.1681000     7.165000  0.1511000     0.2535000      0.2260000 
1 1 1 10 12 6  o 1.932000  0.2498000     1.585000  0.3972000     2.280000  0.3031000     -0.6948000     0.4997000 
1 1 1 10 12 7  o 11.27000  0.1263000     11.22000  0.1791000     11.32000  0.1780000     -0.1045000     0.2525000 
1 1 1 10 12 8  o 8.717000  0.1835000     8.691000  0.3093000     8.743000  0.1975000     -0.5199000E-01 0.3670000 
1 1 1 10 12 9  o 9.441000  0.2183000     9.202000  0.3278000     9.680000  0.2885000     -0.4777000     0.4367000 
1 1 1 10 12 10 o 7.795000  0.2990000     7.903000  0.5372000     7.686000  0.2628000     0.2168000      0.5980000 
1 1 1 10 12 11 o 7.695000  0.1858000     7.643000  0.2458000     7.747000  0.2787000     -0.1040000     0.3716000 
1 1 1 10 12 12 o 17.17000  0.1858000     16.99000  0.2605000     17.35000  0.2649000     -0.3691000     0.3715000 
1 1 1 10 12 13 o 12.53000  0.2158000     12.57000  0.2760000     12.49000  0.3319000     0.8168000E-01  0.4317000 
1 1 1 10 12 14 o 9.276000  0.2639000     9.136000  0.2782000     9.415000  0.4485000     -0.2788000     0.5278000 
1 1 1 10 12 15 o 7.571000  0.3143000     7.357000  0.4509000     7.785000  0.4379000     -0.4283000     0.6286000 
1 1 1 10 12 16 f 4.379000  0.4559000     4.268000  0.6604000     4.490000  0.6286000     -0.2221000     0.9118000 
1 1 1 10 12 17 o 2.259000  0.6275000     2.226000  0.8790000     2.292000  0.8958000     -0.6507000E-01 1.255000  
1 1 1 10 12 18 o 7.573000  0.3408000     7.307000  0.4980000     7.838000  0.4654000     -0.5308000     0.6817000 
1 1 1 10 12 19 o 2.430000  0.6523000     3.297000  1.060000      1.564000  0.7604000     1.734000       1.305000  
1 1 1 10 12 20 o 1.892000  0.5952000     1.396000  0.6845000     2.387000  0.9739000     -0.9901000     1.190000  
1 1 1 10 12 21 o 2.093000  0.5915000     1.599000  0.7464000     2.587000  0.9177000     -0.9881000     1.183000  
1 1 1 10 12 22 o 1.497000  0.4850000     1.483000  0.6801000     1.511000  0.6916000     -0.2812000E-01 0.9700000 
1 1 1 10 12 23 o 1.880000  0.5244000     1.519000  0.6815000     2.241000  0.7972000     -0.7218000     1.049000  
1 1 1 10 12 24 o 1.278000  0.4361000     1.210000  0.5913000     1.346000  0.6412000     -0.1364000     0.8722000 
1 1 1 10 12 25 o 1.574000  0.5022000     1.532000  0.7008000     1.616000  0.7197000     -0.8393000E-01 1.004000  
1 1 1 10 12 26 f 1.186000  0.4061000     1.097000  0.5400000     1.275000  0.6067000     -0.1776000     0.8122000 
1 1 1 10 13 0  o 8.406000  0.2007000     8.406000  0.2007000     8.406000  0.2007000     0.000000       0.000000  
1 1 1 10 13 1  o 11.74000  0.1478000     11.71000  0.2275000     11.76000  0.1886000     -0.4559000E-01 0.2955000 
1 1 1 10 13 2  o 5.694000  0.1112000     5.632000  0.1687000     5.756000  0.1449000     -0.1241000     0.2223000 
1 1 1 10 13 3  o 8.701000  0.1051000     8.685000  0.1487000     8.716000  0.1486000     -0.3127000E-01 0.2103000 
1 1 1 10 13 4  o 11.14000  0.1165000     11.19000  0.1648000     11.10000  0.1648000     0.9318000E-01  0.2331000 
1 1 1 10 13 5  o 12.14000  0.1242000     12.12000  0.1759000     12.15000  0.1754000     -0.3344000E-01 0.2484000 
1 1 1 10 13 6  f 3.659000  0.1511000     3.658000  0.2115000     3.659000  0.2158000     -0.1639000E-02 0.3022000 
1 1 1 10 13 7  o 1.992000  0.2691000     2.155000  0.3536000     1.828000  0.4057000     0.3264000      0.5382000 
1 1 1 10 13 8  o 15.90000  0.2041000     15.89000  0.3450000     15.92000  0.2181000     -0.3644000E-01 0.4082000 
1 1 1 10 13 9  o 3.387000  0.3628000     3.394000  0.6067000     3.380000  0.3981000     0.1489000E-01  0.7256000 
1 1 1 10 13 10 o 3.401000  0.3155000     4.003000  0.3430000     2.799000  0.5296000     1.205000       0.6310000 
1 1 1 10 13 11 f 8.344000  0.1789000     8.390000  0.2406000     8.298000  0.2648000     0.9123000E-01  0.3578000 
1 1 1 10 13 12 o 22.55000  0.2135000     22.67000  0.3003000     22.43000  0.3035000     0.2451000      0.4269000 
1 1 1 10 13 13 o 7.548000  0.2001000     7.427000  0.2788000     7.669000  0.2871000     -0.2423000     0.4002000 
1 1 1 10 13 14 o 11.60000  0.3381000     11.95000  0.2931000     11.24000  0.6093000     0.7047000      0.6761000 
1 1 1 10 13 15 o 6.118000  0.3806000     5.649000  0.3928000     6.588000  0.6519000     -0.9391000     0.7611000 
1 1 1 10 13 16 o 4.737000  0.4472000     4.651000  0.6380000     4.822000  0.6267000     -0.1710000     0.8943000 
1 1 1 10 13 17 o 8.055000  0.3060000     8.004000  0.4349000     8.106000  0.4306000     -0.1028000     0.6120000 
1 1 1 10 13 18 o 3.423000  0.6397000     2.883000  0.9576000     3.962000  0.8485000     -1.078000      1.279000  
1 1 1 10 13 19 o 3.702000  0.7237000     3.876000  1.015000      3.527000  1.032000      0.3488000      1.447000  
1 1 1 10 13 20 o 2.622000  0.6800000     2.166000  0.9218000     3.077000  0.9999000     -0.9110000     1.360000  
1 1 1 10 13 21 o 2.166000  0.5985000     2.693000  0.9254000     1.638000  0.7593000     1.054000       1.197000  
1 1 1 10 13 22 o 1.927000  0.5528000     2.070000  0.7996000     1.784000  0.7636000     0.2864000      1.106000  
1 1 1 10 13 23 f 2.553000  0.5561000     2.504000  0.7986000     2.603000  0.7741000     -0.9908000E-01 1.112000  
1 1 1 10 13 24 o 1.742000  0.5293000     2.088000  0.8183000     1.397000  0.6716000     0.6904000      1.059000  
1 1 1 10 13 25 o 1.268000  0.4344000     1.115000  0.5563000     1.422000  0.6675000     -0.3070000     0.8689000 
1 1 1 10 13 26 o 1.325000  0.4393000     1.492000  0.6745000     1.158000  0.5631000     0.3339000      0.8787000 
1 1 1 10 14 0  o 15.82000  0.1969000     15.82000  0.1969000     15.82000  0.1969000     0.000000       0.000000  
1 1 1 10 14 1  o 12.09000  0.1176000     12.00000  0.1654000     12.18000  0.1671000     -0.1871000     0.2351000 
1 1 1 10 14 2  o 12.61000  0.1214000     12.60000  0.1712000     12.63000  0.1720000     -0.2862000E-01 0.2427000 
1 1 1 10 14 3  o 11.59000  0.1178000     11.62000  0.1670000     11.56000  0.1661000     0.6174000E-01  0.2355000 
1 1 1 10 14 4  o 12.95000  0.1267000     12.85000  0.1787000     13.05000  0.1796000     -0.1965000     0.2533000 
1 1 1 10 14 5  o 13.21000  0.1396000     13.06000  0.2085000     13.37000  0.1857000     -0.3108000     0.2792000 
1 1 1 10 14 6  o 3.083000  0.1770000     2.824000  0.2618000     3.343000  0.2382000     -0.5189000     0.3539000 
1 1 1 10 14 7  o 10.30000  0.1277000     10.27000  0.1812000     10.34000  0.1799000     -0.7046000E-01 0.2553000 
1 1 1 10 14 8  o 3.035000  0.4369000     3.133000  0.7896000     2.937000  0.3744000     0.1959000      0.8739000 
1 1 1 10 14 9  o 6.651000  0.2324000     6.413000  0.3857000     6.889000  0.2595000     -0.4760000     0.4648000 
1 1 1 10 14 10 o 8.694000  0.1738000     8.307000  0.2302000     9.081000  0.2604000     -0.7744000     0.3475000 
1 1 1 10 14 11 o 10.52000  0.1770000     10.70000  0.2329000     10.33000  0.2666000     0.3659000      0.3540000 
1 1 1 10 14 12 o 4.068000  0.2785000     4.149000  0.3783000     3.986000  0.4088000     0.1627000      0.5570000 
1 1 1 10 14 13 o 7.653000  0.2020000     7.667000  0.2828000     7.640000  0.2886000     0.2718000E-01  0.4041000 
1 1 1 10 14 14 o 2.495000  0.5827000     1.645000  0.6633000     3.345000  0.9581000     -1.700000      1.165000  
1 1 1 10 14 15 o 3.058000  0.6308000     2.725000  1.098000      3.390000  0.6222000     -0.6656000     1.262000  
1 1 1 10 14 16 o 5.178000  0.3726000     4.863000  0.4212000     5.492000  0.6146000     -0.6288000     0.7451000 
1 1 1 10 14 17 o 2.305000  0.6106000     1.668000  0.7072000     2.943000  0.9956000     -1.275000      1.221000  
1 1 1 10 14 18 o 2.224000  0.6394000     2.352000  0.9243000     2.096000  0.8836000     0.2562000      1.279000  
1 1 1 10 14 19 o 2.630000  0.7305000     3.081000  1.082000      2.179000  0.9821000     0.9021000      1.461000  
1 1 1 10 14 20 o 2.800000  0.7070000     2.849000  1.011000      2.750000  0.9884000     0.9907000E-01  1.414000  
1 1 1 10 14 21 o 1.389000  0.4755000     1.323000  0.6505000     1.454000  0.6936000     -0.1311000     0.9509000 
1 1 1 10 14 22 o 1.585000  0.4909000     1.390000  0.6470000     1.780000  0.7384000     -0.3899000     0.9818000 
1 1 1 10 14 23 o 1.877000  0.5096000     2.337000  0.7812000     1.417000  0.6546000     0.9199000      1.019000  
1 1 1 10 14 24 o 1.412000  0.4786000     1.396000  0.6692000     1.429000  0.6844000     -0.3302000E-01 0.9572000 
1 1 1 10 14 25 o 1.829000  0.5768000     1.524000  0.7249000     2.134000  0.8974000     -0.6105000     1.154000  
1 1 1 10 14 26 o 1.917000  0.5315000     2.002000  0.7647000     1.832000  0.7384000     0.1702000      1.063000  
1 1 1 10 15 0  f 12.88000  0.1742000     12.88000  0.1742000     12.88000  0.1742000     -0.000000      0.000000  
1 1 1 10 15 1  o 12.84000  0.1231000     12.89000  0.1744000     12.79000  0.1738000     0.1034000      0.2462000 
1 1 1 10 15 2  o 16.29000  0.1444000     16.23000  0.2034000     16.34000  0.2049000     -0.1054000     0.2887000 
1 1 1 10 15 3  o 9.785000  0.1117000     9.962000  0.1588000     9.609000  0.1571000     0.3528000      0.2234000 
1 1 1 10 15 4  o 13.88000  0.1326000     13.59000  0.1861000     14.16000  0.1890000     -0.5668000     0.2653000 
1 1 1 10 15 5  o 7.423000  0.1145000     7.288000  0.1625000     7.557000  0.1614000     -0.2690000     0.2291000 
1 1 1 10 15 6  o 15.50000  0.1472000     15.54000  0.2082000     15.47000  0.2080000     0.7952000E-01  0.2943000 
1 1 1 10 15 7  o 9.492000  0.1268000     9.598000  0.1791000     9.386000  0.1796000     0.2123000      0.2536000 
1 1 1 10 15 8  o 2.067000  0.3804000     1.914000  0.5494000     2.220000  0.5264000     -0.3063000     0.7609000 
1 1 1 10 15 9  o 4.136000  0.2752000     4.457000  0.3552000     3.815000  0.4203000     0.6420000      0.5503000 
1 1 1 10 15 10 o 11.33000  0.1732000     11.19000  0.2271000     11.48000  0.2615000     -0.2938000     0.3463000 
1 1 1 10 15 11 o 14.46000  0.1849000     14.63000  0.2424000     14.29000  0.2792000     0.3374000      0.3697000 
1 1 1 10 15 12 o 13.97000  0.1771000     14.33000  0.2496000     13.61000  0.2513000     0.7278000      0.3542000 
1 1 1 10 15 13 o 2.688000  0.4236000     2.277000  0.6680000     3.099000  0.5212000     -0.8219000     0.8473000 
1 1 1 10 15 14 o 4.985000  0.4694000     5.903000  0.3430000     4.068000  0.8739000     1.835000       0.9388000 
1 1 1 10 15 15 o 20.50000  0.2790000     20.34000  0.4631000     20.65000  0.3114000     -0.3070000     0.5581000 
1 1 1 10 15 16 o 2.341000  0.5315000     2.075000  0.7505000     2.606000  0.7527000     -0.5307000     1.063000  
1 1 1 10 15 17 o 5.205000  0.3266000     5.313000  0.4510000     5.096000  0.4726000     0.2170000      0.6533000 
1 1 1 10 15 18 o 2.236000  0.6286000     1.995000  0.7794000     2.478000  0.9865000     -0.4828000     1.257000  
1 1 1 10 15 19 o 2.580000  0.7216000     2.442000  0.8240000     2.717000  1.185000      -0.2756000     1.443000  
1 1 1 10 15 20 o 1.963000  0.6370000     2.171000  0.9512000     1.755000  0.8475000     0.4167000      1.274000  
1 1 1 10 15 21 o 1.588000  0.5209000     1.631000  0.7507000     1.545000  0.7222000     0.8645000E-01  1.042000  
1 1 1 10 15 22 o 2.226000  0.5604000     2.128000  0.7900000     2.325000  0.7950000     -0.1975000     1.121000  
1 1 1 10 15 23 o 1.899000  0.5205000     1.540000  0.6873000     2.258000  0.7819000     -0.7178000     1.041000  
1 1 1 10 15 24 o 1.240000  0.4296000     1.347000  0.6499000     1.132000  0.5619000     0.2144000      0.8591000 
1 1 1 10 15 25 o 1.355000  0.4637000     1.473000  0.7044000     1.236000  0.6032000     0.2375000      0.9274000 
1 1 1 10 15 26 o 1.252000  0.4221000     1.336000  0.6260000     1.167000  0.5663000     0.1687000      0.8441000 
1 1 1 10 16 0  o 17.50000  0.2153000     17.50000  0.2153000     17.50000  0.2153000     0.000000       0.000000  
1 1 1 10 16 1  f 4.966000  0.1140000     5.072000  0.1603000     4.860000  0.1622000     0.2121000      0.2280000 
1 1 1 10 16 2  o 10.11000  0.1126000     10.18000  0.1594000     10.05000  0.1592000     0.1278000      0.2253000 
1 1 1 10 16 3  o 14.08000  0.1330000     14.23000  0.1891000     13.93000  0.1871000     0.3029000      0.2660000 
1 1 1 10 16 4  o 9.350000  0.1151000     9.329000  0.1639000     9.371000  0.1617000     -0.4171000E-01 0.2303000 
1 1 1 10 16 5  f 7.641000  0.1187000     7.662000  0.1667000     7.620000  0.1689000     0.4218000E-01  0.2373000 
1 1 1 10 16 6  o 1.527000  0.3192000     1.593000  0.4398000     1.460000  0.4626000     0.1327000      0.6383000 
1 1 1 10 16 7  o 6.561000  0.1492000     6.386000  0.2354000     6.737000  0.1834000     -0.3504000     0.2983000 
1 1 1 10 16 8  o 13.98000  0.1713000     13.94000  0.2494000     14.03000  0.2349000     -0.9032000E-01 0.3426000 
1 1 1 10 16 9  o 7.927000  0.1681000     7.817000  0.2503000     8.036000  0.2244000     -0.2182000     0.3362000 
1 1 1 10 16 10 o 8.294000  0.1720000     8.197000  0.2644000     8.391000  0.2200000     -0.1943000     0.3440000 
1 1 1 10 16 11 o 7.550000  0.1969000     7.339000  0.2607000     7.760000  0.2952000     -0.4216000     0.3938000 
1 1 1 10 16 12 o 8.261000  0.1976000     8.286000  0.2571000     8.235000  0.3002000     0.5084000E-01  0.3953000 
1 1 1 10 16 13 o 19.70000  0.2045000     20.10000  0.2904000     19.29000  0.2879000     0.8177000      0.4089000 
1 1 1 10 16 14 o 8.322000  0.2101000     8.391000  0.2912000     8.254000  0.3030000     0.1368000      0.4202000 
1 1 1 10 16 15 o 5.989000  0.2725000     6.090000  0.3809000     5.888000  0.3897000     0.2024000      0.5449000 
1 1 1 10 16 16 o 5.559000  0.3164000     5.867000  0.4185000     5.252000  0.4745000     0.6143000      0.6327000 
1 1 1 10 16 17 o 1.732000  0.5090000     1.229000  0.5929000     2.234000  0.8276000     -1.005000      1.018000  
1 1 1 10 16 18 o 3.431000  0.5319000     3.253000  0.7723000     3.610000  0.7317000     -0.3577000     1.064000  
1 1 1 10 16 19 o 3.161000  0.7192000     2.268000  0.8329000     4.054000  1.173000      -1.786000      1.438000  
1 1 1 10 16 20 o 2.420000  0.6839000     1.839000  0.8623000     3.001000  1.062000      -1.162000      1.368000  
1 1 1 10 16 21 o 2.774000  0.5729000     3.268000  0.6700000     2.281000  0.9294000     0.9874000      1.146000  
1 1 1 10 16 22 o 1.647000  0.4856000     2.153000  0.7925000     1.142000  0.5613000     1.010000       0.9711000 
1 1 1 10 16 23 o 1.704000  0.5079000     1.620000  0.7028000     1.787000  0.7335000     -0.1668000     1.016000  
1 1 1 10 16 24 o 1.759000  0.5229000     1.399000  0.6650000     2.120000  0.8071000     -0.7216000     1.046000  
1 1 1 10 16 25 o 2.140000  0.5845000     2.065000  0.8059000     2.216000  0.8467000     -0.1510000     1.169000  
1 1 1 10 16 26 o 1.350000  0.4447000     1.415000  0.6529000     1.284000  0.6039000     0.1308000      0.8894000 
1 1 1 10 17 0  o 9.508000  0.1584000     9.508000  0.1584000     9.508000  0.1584000     0.000000       0.000000  
1 1 1 10 17 1  o 1.181000  0.2830000     1.351000  0.4058000     1.010000  0.3946000     0.3414000      0.5660000 
1 1 1 10 17 2  o 15.34000  0.1404000     15.63000  0.2009000     15.04000  0.1963000     0.5853000      0.2809000 
1 1 1 10 17 3  o 14.37000  0.1362000     14.49000  0.1933000     14.26000  0.1920000     0.2264000      0.2724000 
1 1 1 10 17 4  o 9.323000  0.1181000     9.123000  0.1680000     9.523000  0.1660000     -0.4003000     0.2362000 
1 1 1 10 17 5  o 11.39000  0.1274000     11.35000  0.1794000     11.43000  0.1809000     -0.7944000E-01 0.2547000 
1 1 1 10 17 6  o 9.342000  0.1264000     9.143000  0.1800000     9.541000  0.1775000     -0.3976000     0.2528000 
1 1 1 10 17 7  o 2.652000  0.3165000     2.862000  0.4446000     2.441000  0.4507000     0.4209000      0.6331000 
1 1 1 10 17 8  o 5.933000  0.2041000     5.534000  0.2711000     6.332000  0.3053000     -0.7979000     0.4083000 
1 1 1 10 17 9  o 13.52000  0.1750000     13.51000  0.2532000     13.53000  0.2416000     -0.2438000E-01 0.3500000 
1 1 1 10 17 10 o 1.942000  0.3814000     1.774000  0.5302000     2.109000  0.5485000     -0.3355000     0.7629000 
1 1 1 10 17 11 o 6.207000  0.2288000     6.040000  0.3166000     6.374000  0.3305000     -0.3343000     0.4576000 
1 1 1 10 17 12 o 18.71000  0.1948000     18.70000  0.2723000     18.73000  0.2786000     -0.2743000E-01 0.3895000 
1 1 1 10 17 13 o 7.975000  0.2218000     7.914000  0.3078000     8.036000  0.3194000     -0.1228000     0.4435000 
1 1 1 10 17 14 o 1.626000  0.4843000     1.674000  0.6798000     1.578000  0.6899000     0.9557000E-01  0.9685000 
1 1 1 10 17 15 o 3.858000  0.3822000     4.073000  0.4925000     3.642000  0.5845000     0.4315000      0.7643000 
1 1 1 10 17 16 o 3.895000  0.4344000     3.967000  0.5762000     3.824000  0.6503000     0.1425000      0.8688000 
1 1 1 10 17 17 o 4.088000  0.4304000     3.999000  0.5885000     4.177000  0.6282000     -0.1783000     0.8608000 
1 1 1 10 17 18 o 2.975000  0.5501000     2.191000  0.8198000     3.758000  0.7337000     -1.567000      1.100000  
1 1 1 10 17 19 o 6.304000  0.3414000     5.718000  0.4773000     6.891000  0.4884000     -1.173000      0.6828000 
1 1 1 10 17 20 o 4.271000  0.6233000     2.927000  1.139000      5.615000  0.5067000     -2.688000      1.247000  
1 1 1 10 17 21 o 4.868000  0.3734000     4.337000  0.5700000     5.400000  0.4823000     -1.064000      0.7467000 
1 1 1 10 17 22 o 3.041000  0.5575000     2.831000  0.6696000     3.251000  0.8915000     -0.4193000     1.115000  
1 1 1 10 17 23 f 2.022000  0.5289000     2.206000  0.6984000     1.838000  0.7946000     0.3682000      1.058000  
1 1 1 10 17 24 o 1.426000  0.4382000     1.682000  0.6557000     1.170000  0.5816000     0.5115000      0.8764000 
1 1 1 10 17 25 f 1.455000  0.4733000     1.591000  0.6957000     1.319000  0.6418000     0.2714000      0.9465000 
1 1 1 10 17 26 o 1.179000  0.4032000     1.383000  0.6409000     0.9755000 0.4893000     0.4078000      0.8063000 
1 1 1 10 18 0  o 15.34000  0.1993000     15.34000  0.1993000     15.34000  0.1993000     0.000000       0.000000  
1 1 1 10 18 1  o 5.336000  0.1180000     5.234000  0.1688000     5.438000  0.1649000     -0.2042000     0.2359000 
1 1 1 10 18 2  o 5.709000  0.1168000     5.600000  0.1661000     5.818000  0.1642000     -0.2181000     0.2336000 
1 1 1 10 18 3  o 10.96000  0.1217000     10.92000  0.1712000     11.00000  0.1730000     -0.7663000E-01 0.2434000 
1 1 1 10 18 4  o 19.89000  0.1728000     19.92000  0.2445000     19.87000  0.2442000     0.5445000E-01  0.3456000 
1 1 1 10 18 5  o 7.244000  0.1242000     7.305000  0.1752000     7.183000  0.1760000     0.1223000      0.2484000 
1 1 1 10 18 6  o 14.95000  0.1480000     15.06000  0.2094000     14.84000  0.2093000     0.2189000      0.2961000 
1 1 1 10 18 7  o 1.752000  0.3655000     1.735000  0.4789000     1.769000  0.5522000     -0.3367000E-01 0.7310000 
1 1 1 10 18 8  o 15.76000  0.2081000     15.95000  0.3192000     15.58000  0.2671000     0.3743000      0.4162000 
1 1 1 10 18 9  o 2.903000  0.3233000     2.975000  0.4714000     2.830000  0.4427000     0.1450000      0.6467000 
1 1 1 10 18 10 o 10.06000  0.1558000     9.988000  0.2095000     10.13000  0.2306000     -0.1469000     0.3115000 
1 1 1 10 18 11 o 15.07000  0.1843000     15.12000  0.2813000     15.03000  0.2381000     0.8940000E-01  0.3686000 
1 1 1 10 18 12 o 8.828000  0.1830000     9.015000  0.2555000     8.640000  0.2619000     0.3746000      0.3659000 
1 1 1 10 18 13 o 4.075000  0.5552000     4.102000  0.4664000     4.047000  1.008000      0.5488000E-01  1.110000  
1 1 1 10 18 14 f 4.678000  0.3615000     4.671000  0.5075000     4.685000  0.5148000     -0.1434000E-01 0.7229000 
1 1 1 10 18 15 o 2.677000  0.5073000     2.992000  0.6714000     2.363000  0.7607000     0.6292000      1.015000  
1 1 1 10 18 16 o 5.340000  0.3291000     5.454000  0.4535000     5.226000  0.4769000     0.2287000      0.6581000 
1 1 1 10 18 17 o 4.537000  0.4363000     5.004000  0.5334000     4.070000  0.6906000     0.9345000      0.8726000 
1 1 1 10 18 18 o 4.953000  0.3931000     4.534000  0.5891000     5.373000  0.5207000     -0.8389000     0.7863000 
1 1 1 10 18 19 o 2.160000  0.5294000     2.923000  0.8281000     1.398000  0.6597000     1.525000       1.059000  
1 1 1 10 18 20 o 4.265000  0.4484000     3.766000  0.6728000     4.764000  0.5930000     -0.9980000     0.8968000 
1 1 1 10 18 21 o 2.655000  0.5544000     3.077000  0.7587000     2.232000  0.8087000     0.8454000      1.109000  
1 1 1 10 18 22 o 2.144000  0.5194000     2.545000  0.7433000     1.743000  0.7258000     0.8021000      1.039000  
1 1 1 10 18 23 o 2.104000  0.4799000     2.753000  0.7104000     1.455000  0.6454000     1.297000       0.9598000 
1 1 1 10 18 24 o 1.435000  0.4526000     1.591000  0.6785000     1.279000  0.5994000     0.3120000      0.9053000 
1 1 1 10 18 25 o 1.711000  0.4651000     2.131000  0.6853000     1.290000  0.6288000     0.8412000      0.9301000 
1 1 1 10 18 26 o 1.748000  0.5239000     1.772000  0.6737000     1.725000  0.8024000     0.4743000E-01  1.048000  
1 1 1 10 19 0  o 4.603000  0.1832000     4.603000  0.1832000     4.603000  0.1832000     0.000000       0.000000  
1 1 1 10 19 1  o 4.676000  0.1300000     4.728000  0.1820000     4.623000  0.1855000     0.1051000      0.2599000 
1 1 1 10 19 2  o 15.74000  0.1457000     15.93000  0.2074000     15.55000  0.2048000     0.3761000      0.2914000 
1 1 1 10 19 3  o 15.86000  0.1477000     15.96000  0.2092000     15.76000  0.2084000     0.2026000      0.2953000 
1 1 1 10 19 4  o 4.231000  0.1510000     4.223000  0.2168000     4.239000  0.2102000     -0.1592000E-01 0.3020000 
1 1 1 10 19 5  o 6.005000  0.1321000     6.211000  0.1850000     5.798000  0.1887000     0.4124000      0.2643000 
1 1 1 10 19 6  o 10.61000  0.1613000     10.76000  0.2628000     10.46000  0.1873000     0.2982000      0.3227000 
1 1 1 10 19 7  o 16.61000  0.2006000     16.59000  0.2290000     16.64000  0.3296000     -0.5065000E-01 0.4013000 
1 1 1 10 19 8  o 2.840000  0.2947000     2.719000  0.4684000     2.961000  0.3576000     -0.2417000     0.5893000 
1 1 1 10 19 9  o 12.21000  0.1749000     12.55000  0.2553000     11.86000  0.2390000     0.6826000      0.3497000 
1 1 1 10 19 10 o 5.905000  0.1818000     5.969000  0.2419000     5.842000  0.2716000     0.1267000      0.3637000 
1 1 1 10 19 11 o 8.842000  0.1665000     9.138000  0.2232000     8.547000  0.2472000     0.5903000      0.3331000 
1 1 1 10 19 12 o 11.70000  0.1795000     11.58000  0.2509000     11.82000  0.2566000     -0.2449000     0.3589000 
1 1 1 10 19 13 o 11.22000  0.2556000     11.08000  0.2643000     11.36000  0.4375000     -0.2757000     0.5111000 
1 1 1 10 19 14 o 2.847000  0.6648000     3.029000  1.119000      2.665000  0.7185000     0.3641000      1.330000  
1 1 1 10 19 15 o 8.750000  0.2215000     8.755000  0.3078000     8.744000  0.3186000     0.1058000E-01  0.4430000 
1 1 1 10 19 16 o 3.906000  0.4524000     3.114000  0.7397000     4.697000  0.5210000     -1.584000      0.9048000 
1 1 1 10 19 17 o 3.507000  0.5245000     3.555000  0.7242000     3.459000  0.7589000     0.9579000E-01  1.049000  
1 1 1 10 19 18 o 7.729000  0.3029000     7.692000  0.4431000     7.766000  0.4131000     -0.7464000E-01 0.6058000 
1 1 1 10 19 19 o 4.687000  0.4485000     5.280000  0.5147000     4.093000  0.7347000     1.187000       0.8971000 
1 1 1 10 19 20 o 5.009000  0.3696000     5.048000  0.5096000     4.971000  0.5354000     0.7697000E-01  0.7392000 
1 1 1 10 19 21 o 1.944000  0.5416000     1.826000  0.7443000     2.063000  0.7870000     -0.2371000     1.083000  
1 1 1 10 19 22 o 1.623000  0.4887000     1.506000  0.6623000     1.740000  0.7187000     -0.2339000     0.9773000 
1 1 1 10 19 23 o 1.776000  0.4865000     1.358000  0.6291000     2.195000  0.7424000     -0.8371000     0.9731000 
1 1 1 10 19 24 o 1.439000  0.4558000     1.242000  0.5825000     1.636000  0.7013000     -0.3941000     0.9116000 
1 1 1 10 19 25 o 1.250000  0.4142000     1.261000  0.5851000     1.240000  0.5863000     0.2089000E-01  0.8283000 
1 1 1 10 20 0  o 9.017000  0.1654000     9.017000  0.1654000     9.017000  0.1654000     0.000000       0.000000  
1 1 1 10 20 1  o 6.744000  0.1181000     6.647000  0.1680000     6.841000  0.1660000     -0.1949000     0.2362000 
1 1 1 10 20 2  o 10.18000  0.1220000     10.17000  0.1719000     10.19000  0.1733000     -0.2557000E-01 0.2441000 
1 1 1 10 20 3  o 12.00000  0.1302000     11.92000  0.1827000     12.09000  0.1856000     -0.1623000     0.2604000 
1 1 1 10 20 4  o 11.83000  0.1314000     11.78000  0.1861000     11.89000  0.1855000     -0.1157000     0.2628000 
1 1 1 10 20 5  o 11.25000  0.1322000     11.12000  0.1870000     11.37000  0.1869000     -0.2562000     0.2644000 
1 1 1 10 20 6  o 4.441000  0.1955000     4.271000  0.2400000     4.610000  0.3087000     -0.3393000     0.3910000 
1 1 1 10 20 7  o 4.698000  0.2265000     4.505000  0.3437000     4.891000  0.2952000     -0.3855000     0.4530000 
1 1 1 10 20 8  o 1.382000  0.3753000     1.241000  0.5300000     1.523000  0.5314000     -0.2824000     0.7505000 
1 1 1 10 20 9  o 5.123000  0.2090000     5.220000  0.3034000     5.026000  0.2877000     0.1945000      0.4181000 
1 1 1 10 20 10 o 11.60000  0.1743000     11.11000  0.2129000     12.10000  0.2762000     -0.9907000     0.3487000 
1 1 1 10 20 11 o 19.07000  0.1877000     18.90000  0.2618000     19.24000  0.2691000     -0.3408000     0.3754000 
1 1 1 10 20 12 o 1.676000  0.4382000     1.945000  0.6638000     1.407000  0.5723000     0.5379000      0.8764000 
1 1 1 10 20 13 o 12.49000  0.2003000     12.68000  0.2636000     12.30000  0.3016000     0.3827000      0.4005000 
1 1 1 10 20 14 o 6.595000  0.3436000     6.586000  0.5971000     6.604000  0.3402000     -0.1786000E-01 0.6873000 
1 1 1 10 20 15 o 8.402000  0.2293000     8.271000  0.3225000     8.532000  0.3261000     -0.2614000     0.4586000 
1 1 1 10 20 16 o 8.401000  0.2450000     8.577000  0.3439000     8.225000  0.3491000     0.3522000      0.4900000 
1 1 1 10 20 17 o 3.444000  0.5369000     2.812000  0.8288000     4.076000  0.6827000     -1.264000      1.074000  
1 1 1 10 20 18 o 6.238000  0.3719000     6.612000  0.4771000     5.864000  0.5706000     0.7474000      0.7438000 
1 1 1 10 20 19 o 3.951000  0.5174000     3.575000  0.7808000     4.326000  0.6792000     -0.7513000     1.035000  
1 1 1 10 20 20 o 1.816000  0.5301000     2.109000  0.7985000     1.523000  0.6974000     0.5861000      1.060000  
1 1 1 10 20 21 o 2.465000  0.5477000     2.463000  0.7707000     2.467000  0.7786000     -0.3272000E-02 1.095000  
1 1 1 10 20 22 o 1.727000  0.4929000     1.936000  0.7244000     1.517000  0.6686000     0.4190000      0.9858000 
1 1 1 10 20 23 o 2.916000  0.5015000     3.598000  0.6185000     2.234000  0.7897000     1.363000       1.003000  
1 1 1 10 20 24 o 1.344000  0.4425000     1.260000  0.6036000     1.427000  0.6473000     -0.1676000     0.8850000 
1 1 1 10 20 25 o 1.407000  0.4465000     1.620000  0.6875000     1.194000  0.5700000     0.4266000      0.8931000 
1 1 1 10 21 0  o 3.652000  0.2301000     3.652000  0.2301000     3.652000  0.2301000     0.000000       0.000000  
1 1 1 10 21 1  o 8.192000  0.1205000     8.323000  0.1701000     8.061000  0.1707000     0.2629000      0.2410000 
1 1 1 10 21 2  o 12.24000  0.1313000     12.27000  0.1856000     12.21000  0.1858000     0.6324000E-01  0.2627000 
1 1 1 10 21 3  o 21.52000  0.1856000     21.52000  0.2621000     21.51000  0.2629000     0.1777000E-01  0.3712000 
1 1 1 10 21 4  o 12.93000  0.1373000     12.84000  0.1938000     13.02000  0.1946000     -0.1816000     0.2746000 
1 1 1 10 21 5  o 5.788000  0.1818000     6.089000  0.2728000     5.486000  0.2403000     0.6028000      0.3636000 
1 1 1 10 21 6  o 5.620000  0.1890000     5.361000  0.2221000     5.879000  0.3057000     -0.5182000     0.3779000 
1 1 1 10 21 7  o 15.65000  0.1729000     15.45000  0.2622000     15.85000  0.2254000     -0.3981000     0.3457000 
1 1 1 10 21 8  o 12.83000  0.1646000     12.77000  0.2512000     12.89000  0.2128000     -0.1187000     0.3292000 
1 1 1 10 21 9  o 4.218000  0.2352000     4.288000  0.3508000     4.147000  0.3133000     0.1411000      0.4703000 
1 1 1 10 21 10 o 22.82000  0.2215000     22.68000  0.2902000     22.96000  0.3347000     -0.2869000     0.4430000 
1 1 1 10 21 11 o 2.928000  0.3232000     2.712000  0.4659000     3.145000  0.4480000     -0.4332000     0.6463000 
1 1 1 10 21 12 o 12.42000  0.2008000     12.28000  0.3258000     12.56000  0.2349000     -0.2797000     0.4016000 
1 1 1 10 21 13 o 6.698000  0.2533000     6.869000  0.3193000     6.527000  0.3934000     0.3412000      0.5067000 
1 1 1 10 21 14 f 8.736000  0.2149000     8.501000  0.3008000     8.971000  0.3070000     -0.4699000     0.4298000 
1 1 1 10 21 15 o 8.164000  0.2977000     8.623000  0.3268000     7.704000  0.4976000     0.9182000      0.5953000 
1 1 1 10 21 16 o 7.815000  0.2558000     7.571000  0.3636000     8.058000  0.3598000     -0.4867000     0.5115000 
1 1 1 10 21 17 o 2.353000  0.5863000     2.246000  0.8198000     2.459000  0.8385000     -0.2133000     1.173000  
1 1 1 10 21 18 o 5.699000  0.6388000     5.609000  0.5554000     5.788000  1.151000      -0.1789000     1.278000  
1 1 1 10 21 19 o 3.606000  0.7378000     3.095000  1.276000      4.116000  0.7414000     -1.022000      1.476000  
1 1 1 10 21 20 o 3.038000  0.5567000     3.027000  0.7589000     3.049000  0.8147000     -0.2171000E-01 1.113000  
1 1 1 10 21 21 o 1.647000  0.5023000     1.718000  0.7252000     1.576000  0.6953000     0.1414000      1.005000  
1 1 1 10 21 22 o 2.212000  0.5239000     1.993000  0.7424000     2.431000  0.7395000     -0.4381000     1.048000  
1 1 1 10 21 23 o 1.391000  0.4850000     1.245000  0.5966000     1.536000  0.7649000     -0.2910000     0.9700000 
1 1 1 10 21 24 o 1.483000  0.4603000     1.120000  0.5537000     1.847000  0.7354000     -0.7272000     0.9205000 
1 1 1 10 21 25 o 1.162000  0.3944000     1.136000  0.5477000     1.187000  0.5678000     -0.5051000E-01 0.7889000 
1 1 1 10 22 0  o 7.640000  0.1732000     7.640000  0.1732000     7.640000  0.1732000     0.000000       0.000000  
1 1 1 10 22 1  o 11.17000  0.1283000     11.19000  0.1819000     11.15000  0.1812000     0.3782000E-01  0.2567000 
1 1 1 10 22 2  f 10.85000  0.1284000     10.63000  0.1804000     11.07000  0.1826000     -0.4371000     0.2567000 
1 1 1 10 22 3  o 2.462000  0.2544000     1.955000  0.4146000     2.970000  0.2949000     -1.015000      0.5088000 
1 1 1 10 22 4  o 4.575000  0.1918000     4.502000  0.3130000     4.649000  0.2219000     -0.1474000     0.3837000 
1 1 1 10 22 5  o 9.465000  0.1869000     9.465000  0.1869000     ?         ?             ?              ?         
1 1 1 10 22 6  o 14.39000  0.1843000     14.48000  0.3003000     14.31000  0.2137000     0.1727000      0.3686000 
1 1 1 10 22 7  o 5.631000  0.1824000     5.837000  0.2660000     5.424000  0.2496000     0.4128000      0.3648000 
1 1 1 10 22 8  o 5.311000  0.1947000     5.319000  0.3013000     5.302000  0.2468000     0.1774000E-01  0.3895000 
1 1 1 10 22 9  o 6.473000  0.1929000     6.343000  0.2888000     6.602000  0.2559000     -0.2595000     0.3858000 
1 1 1 10 22 10 o 14.33000  0.1741000     14.44000  0.2296000     14.22000  0.2618000     0.2215000      0.3482000 
1 1 1 10 22 11 f 13.65000  0.1751000     13.59000  0.2296000     13.71000  0.2644000     -0.1151000     0.3502000 
1 1 1 10 22 12 f 8.662000  0.2380000     9.106000  0.3337000     8.219000  0.3395000     0.8864000      0.4760000 
1 1 1 10 22 13 o 8.321000  0.2497000     8.166000  0.3647000     8.476000  0.3412000     -0.3100000     0.4994000 
1 1 1 10 22 14 o 3.399000  0.4338000     3.471000  0.5643000     3.326000  0.6591000     0.1455000      0.8677000 
1 1 1 10 22 15 o 8.311000  0.2406000     8.015000  0.3407000     8.606000  0.3400000     -0.5912000     0.4813000 
1 1 1 10 22 16 o 4.395000  0.4042000     4.744000  0.5098000     4.045000  0.6274000     0.6991000      0.8084000 
1 1 1 10 22 17 o 2.058000  0.5586000     1.602000  0.7188000     2.513000  0.8552000     -0.9105000     1.117000  
1 1 1 10 22 18 o 3.831000  0.6790000     3.926000  0.7042000     3.735000  1.161000      0.1910000      1.358000  
1 1 1 10 22 19 o 4.018000  0.6446000     3.077000  1.155000      4.959000  0.5726000     -1.882000      1.289000  
1 1 1 10 22 20 o 2.332000  0.5821000     2.151000  0.8017000     2.513000  0.8441000     -0.3617000     1.164000  
1 1 1 10 22 21 o 2.555000  0.5556000     2.586000  0.7856000     2.524000  0.7857000     0.6190000E-01  1.111000  
1 1 1 10 22 22 o 1.551000  0.4772000     1.528000  0.6710000     1.575000  0.6789000     -0.4660000E-01 0.9545000 
1 1 1 10 22 23 o 2.016000  0.6276000     1.403000  0.6341000     2.629000  1.083000      -1.226000      1.255000  
1 1 1 10 22 24 o 1.578000  0.5452000     1.964000  0.9308000     1.192000  0.5680000     0.7719000      1.090000  
1 1 1 10 22 25 o 1.225000  0.4077000     1.163000  0.5541000     1.287000  0.5981000     -0.1234000     0.8153000 
1 1 1 10 23 0  o 1.834000  0.5024000     1.834000  0.5024000     1.834000  0.5024000     0.000000       0.000000  
1 1 1 10 23 1  o 5.771000  0.1355000     5.565000  0.1967000     5.977000  0.1865000     -0.4120000     0.2711000 
1 1 1 10 23 2  o 8.540000  0.1273000     8.458000  0.1793000     8.621000  0.1806000     -0.1623000     0.2545000 
1 1 1 10 23 3  o 4.432000  0.1983000     4.403000  0.3218000     4.461000  0.2318000     -0.5773000E-01 0.3966000 
1 1 1 10 23 4  o 2.550000  0.3657000     2.550000  0.3657000     ?         ?             ?              ?         
1 1 1 10 23 5  o 9.333000  0.1750000     9.213000  0.2659000     9.453000  0.2276000     -0.2395000     0.3500000 
1 1 1 10 23 6  o 3.076000  0.2360000     2.994000  0.3496000     3.158000  0.3172000     -0.1632000     0.4720000 
1 1 1 10 23 7  o 1.686000  0.3946000     1.783000  0.5830000     1.588000  0.5318000     0.1951000      0.7891000 
1 1 1 10 23 8  o 6.925000  0.1734000     6.895000  0.2674000     6.955000  0.2210000     -0.6042000E-01 0.3469000 
1 1 1 10 23 9  o 10.70000  0.1769000     10.55000  0.2568000     10.85000  0.2434000     -0.2960000     0.3538000 
1 1 1 10 23 10 o 12.81000  0.1699000     12.52000  0.2250000     13.09000  0.2547000     -0.5761000     0.3399000 
1 1 1 10 23 11 o 12.09000  0.1638000     12.22000  0.2290000     11.96000  0.2343000     0.2555000      0.3276000 
1 1 1 10 23 12 o 11.38000  0.2038000     11.39000  0.2356000     11.37000  0.3327000     0.2943000E-01  0.4077000 
1 1 1 10 23 13 o 5.175000  0.2963000     5.084000  0.4908000     5.267000  0.3320000     -0.1826000     0.5925000 
1 1 1 10 23 14 o 2.933000  0.4883000     3.229000  0.6361000     2.637000  0.7411000     0.5921000      0.9766000 
1 1 1 10 23 15 o 5.040000  0.3735000     5.492000  0.4375000     4.587000  0.6055000     0.9050000      0.7470000 
1 1 1 10 23 16 o 9.663000  0.2494000     9.338000  0.3649000     9.987000  0.3401000     -0.6486000     0.4988000 
1 1 1 10 23 17 o 6.607000  0.3083000     6.403000  0.4374000     6.811000  0.4346000     -0.4080000     0.6166000 
1 1 1 10 23 18 o 6.937000  0.3033000     6.724000  0.4363000     7.150000  0.4215000     -0.4266000     0.6066000 
1 1 1 10 23 19 o 4.817000  0.4097000     4.999000  0.5492000     4.636000  0.6080000     0.3628000      0.8193000 
1 1 1 10 23 20 o 1.799000  0.5167000     1.287000  0.6138000     2.311000  0.8314000     -1.024000      1.033000  
1 1 1 10 23 21 o 1.792000  0.5200000     1.841000  0.7421000     1.742000  0.7285000     0.9840000E-01  1.040000  
1 1 1 10 23 22 o 2.246000  0.5424000     2.047000  0.7656000     2.445000  0.7686000     -0.3978000     1.085000  
1 1 1 10 23 23 o 1.523000  0.5053000     1.232000  0.5828000     1.815000  0.8255000     -0.5835000     1.011000  
1 1 1 10 23 24 o 1.875000  0.5613000     2.271000  0.9110000     1.478000  0.6558000     0.7928000      1.123000  
1 1 1 10 23 25 f 1.486000  0.4564000     1.310000  0.6027000     1.662000  0.6855000     -0.3517000     0.9128000 
1 1 1 10 24 0  o 1.381000  0.5841000     1.381000  0.5841000     1.381000  0.5841000     0.000000       0.000000  
1 1 1 10 24 1  o 11.35000  0.1446000     11.47000  0.2198000     11.24000  0.1879000     0.2313000      0.2892000 
1 1 1 10 24 2  o 1.282000  0.3678000     1.363000  0.5419000     1.201000  0.4975000     0.1623000      0.7357000 
1 1 1 10 24 3  o 18.12000  0.2389000     18.12000  0.2389000     ?         ?             ?              ?         
1 1 1 10 24 4  o 18.19000  0.2199000     18.45000  0.3412000     17.92000  0.2775000     0.5381000      0.4398000 
1 1 1 10 24 5  o 12.06000  0.1419000     12.15000  0.2012000     11.96000  0.2001000     0.1917000      0.2838000 
1 1 1 10 24 6  o 11.97000  0.1441000     11.91000  0.2032000     12.04000  0.2043000     -0.1231000     0.2881000 
1 1 1 10 24 7  o 3.229000  0.2734000     3.012000  0.4408000     3.446000  0.3237000     -0.4340000     0.5469000 
1 1 1 10 24 8  o 9.131000  0.1648000     9.187000  0.2539000     9.076000  0.2101000     0.1109000      0.3296000 
1 1 1 10 24 9  o 9.558000  0.1633000     9.531000  0.2192000     9.585000  0.2422000     -0.5358000E-01 0.3267000 
1 1 1 10 24 10 o 4.804000  0.2179000     5.079000  0.2794000     4.530000  0.3343000     0.5492000      0.4357000 
1 1 1 10 24 11 o 10.50000  0.2010000     10.48000  0.3252000     10.53000  0.2362000     -0.4173000E-01 0.4019000 
1 1 1 10 24 12 o 7.227000  0.2017000     7.220000  0.2639000     7.235000  0.3052000     -0.1508000E-01 0.4034000 
1 1 1 10 24 13 o 13.75000  0.1769000     13.66000  0.2489000     13.83000  0.2514000     -0.1739000     0.3538000 
1 1 1 10 24 14 o 6.576000  0.2466000     6.710000  0.3855000     6.443000  0.3075000     0.2669000      0.4931000 
1 1 1 10 24 15 o 5.049000  0.3428000     4.773000  0.5014000     5.325000  0.4676000     -0.5519000     0.6856000 
1 1 1 10 24 16 o 6.360000  0.3039000     6.471000  0.4115000     6.248000  0.4472000     0.2232000      0.6077000 
1 1 1 10 24 17 o 8.466000  0.2913000     8.603000  0.4170000     8.329000  0.4068000     0.2742000      0.5826000 
1 1 1 10 24 18 o 4.769000  0.4322000     5.027000  0.5342000     4.511000  0.6797000     0.5159000      0.8645000 
1 1 1 10 24 19 o 2.613000  0.5811000     2.398000  0.8048000     2.828000  0.8383000     -0.4302000     1.162000  
1 1 1 10 24 20 o 1.738000  0.5076000     2.055000  0.7723000     1.420000  0.6591000     0.6345000      1.015000  
1 1 1 10 24 21 o 1.848000  0.5222000     1.702000  0.7139000     1.993000  0.7622000     -0.2914000     1.044000  
1 1 1 10 24 22 o 1.548000  0.4811000     1.667000  0.7065000     1.429000  0.6532000     0.2383000      0.9622000 
1 1 1 10 24 23 o 1.501000  0.4681000     1.548000  0.6700000     1.453000  0.6540000     0.9435000E-01  0.9362000 
1 1 1 10 24 24 o 1.396000  0.4441000     1.546000  0.6671000     1.246000  0.5865000     0.3002000      0.8883000 
1 1 1 10 24 25 o 1.275000  0.4210000     1.310000  0.6047000     1.240000  0.5860000     0.7015000E-01  0.8421000 
1 1 1 10 25 0  o 4.719000  0.4809000     4.719000  0.4809000     4.719000  0.4809000     0.000000       0.000000  
1 1 1 10 25 1  o 7.875000  0.2654000     7.875000  0.2654000     ?         ?             ?              ?         
1 1 1 10 25 2  o 8.896000  0.2284000     8.519000  0.2613000     9.273000  0.3746000     -0.7533000     0.4567000 
1 1 1 10 25 3  o 7.477000  0.1655000     7.541000  0.2667000     7.413000  0.1960000     0.1279000      0.3310000 
1 1 1 10 25 4  o 10.28000  0.1379000     10.33000  0.1942000     10.24000  0.1957000     0.9525000E-01  0.2757000 
1 1 1 10 25 5  o 3.834000  0.2019000     3.608000  0.2998000     4.061000  0.2705000     -0.4536000     0.4039000 
1 1 1 10 25 6  o 11.62000  0.1446000     11.40000  0.2037000     11.84000  0.2052000     -0.4337000     0.2891000 
1 1 1 10 25 7  o 10.39000  0.1597000     10.43000  0.2436000     10.35000  0.2066000     0.7079000E-01  0.3194000 
1 1 1 10 25 8  o 6.725000  0.1788000     6.764000  0.2725000     6.687000  0.2316000     0.7682000E-01  0.3576000 
1 1 1 10 25 9  o 8.749000  0.1747000     8.659000  0.2476000     8.840000  0.2467000     -0.1812000     0.3495000 
1 1 1 10 25 10 o 14.57000  0.1795000     14.42000  0.2353000     14.72000  0.2711000     -0.3023000     0.3590000 
1 1 1 10 25 11 o 8.961000  0.2406000     9.528000  0.3384000     8.394000  0.3421000     1.134000       0.4812000 
1 1 1 10 25 12 o 6.770000  0.2590000     6.889000  0.3049000     6.651000  0.4187000     0.2383000      0.5179000 
1 1 1 10 25 13 o 3.999000  0.3018000     4.207000  0.3975000     3.791000  0.4543000     0.4162000      0.6036000 
1 1 1 10 25 14 o 9.222000  0.1933000     9.473000  0.2685000     8.970000  0.2781000     0.5026000      0.3865000 
1 1 1 10 25 15 f 9.508000  0.2280000     9.304000  0.3217000     9.711000  0.3231000     -0.4067000     0.4559000 
1 1 1 10 25 16 f 7.027000  0.2830000     6.888000  0.3952000     7.165000  0.4052000     -0.2775000     0.5660000 
1 1 1 10 25 17 o 4.542000  0.7065000     4.601000  0.6487000     4.484000  1.255000      0.1166000      1.413000  
1 1 1 10 25 18 o 1.994000  0.5633000     2.434000  0.8691000     1.553000  0.7169000     0.8805000      1.127000  
1 1 1 10 25 19 o 1.663000  0.5058000     1.825000  0.7354000     1.502000  0.6946000     0.3227000      1.012000  
1 1 1 10 25 20 o 6.596000  0.2769000     6.596000  0.3861000     6.597000  0.3969000     -0.1133000E-02 0.5537000 
1 1 1 10 25 21 o 1.437000  0.4626000     1.380000  0.6362000     1.494000  0.6719000     -0.1136000     0.9253000 
1 1 1 10 25 22 o 1.729000  0.4923000     1.255000  0.6034000     2.202000  0.7781000     -0.9469000     0.9846000 
1 1 1 10 25 23 o 2.084000  0.5403000     1.982000  0.7333000     2.186000  0.7936000     -0.2036000     1.081000  
1 1 1 10 25 24 f 1.447000  0.4548000     1.350000  0.6158000     1.544000  0.6696000     -0.1941000     0.9097000 
1 1 1 10 25 25 o 1.639000  0.4911000     1.401000  0.6414000     1.876000  0.7440000     -0.4743000     0.9823000 
1 1 1 10 26 0  o 10.52000  0.2222000     10.52000  0.2222000     10.52000  0.2222000     -0.000000      0.000000  
1 1 1 10 26 1  f 4.422000  0.1886000     4.202000  0.2937000     4.642000  0.2368000     -0.4396000     0.3772000 
1 1 1 10 26 2  o 8.779000  0.1349000     8.822000  0.1900000     8.737000  0.1916000     0.8566000E-01  0.2698000 
1 1 1 10 26 3  o 12.45000  0.1436000     12.33000  0.2022000     12.56000  0.2040000     -0.2317000     0.2872000 
1 1 1 10 26 4  o 11.29000  0.1413000     11.33000  0.1991000     11.25000  0.2006000     0.7994000E-01  0.2826000 
1 1 1 10 26 5  o 10.98000  0.1425000     11.11000  0.2015000     10.85000  0.2014000     0.2562000      0.2849000 
1 1 1 10 26 6  o 10.68000  0.1437000     10.66000  0.2033000     10.70000  0.2032000     -0.3384000E-01 0.2874000 
1 1 1 10 26 7  o 5.745000  0.1874000     5.732000  0.2882000     5.757000  0.2396000     -0.2512000E-01 0.3748000 
1 1 1 10 26 8  f 18.20000  0.1944000     17.98000  0.2945000     18.42000  0.2537000     -0.4411000     0.3888000 
1 1 1 10 26 9  o 6.100000  0.1904000     6.405000  0.2477000     5.796000  0.2893000     0.6090000      0.3809000 
1 1 1 10 26 10 o 17.89000  0.1966000     17.88000  0.2600000     17.90000  0.2951000     -0.2376000E-01 0.3933000 
1 1 1 10 26 11 o 12.45000  0.2149000     12.36000  0.2630000     12.54000  0.3400000     -0.1830000     0.4298000 
1 1 1 10 26 12 o 7.368000  0.2404000     7.731000  0.3928000     7.005000  0.2773000     0.7259000      0.4808000 
1 1 1 10 26 13 o 2.762000  0.4224000     3.109000  0.5277000     2.415000  0.6596000     0.6945000      0.8448000 
1 1 1 10 26 14 o 1.536000  0.4497000     1.778000  0.6793000     1.294000  0.5894000     0.4840000      0.8993000 
1 1 1 10 26 15 o 7.010000  0.2605000     6.862000  0.4139000     7.158000  0.3165000     -0.2967000     0.5210000 
1 1 1 10 26 16 o 2.569000  0.5833000     2.757000  0.8185000     2.381000  0.8313000     0.3760000      1.167000  
1 1 1 10 26 17 o 3.698000  0.6768000     4.127000  0.6539000     3.269000  1.185000      0.8581000      1.354000  
1 1 1 10 26 18 o 2.500000  0.7211000     2.624000  1.160000      2.375000  0.8570000     0.2492000      1.442000  
1 1 1 10 26 19 f 1.918000  0.5145000     2.357000  0.7734000     1.479000  0.6787000     0.8782000      1.029000  
1 1 1 10 26 20 o 2.565000  0.5428000     2.599000  0.7627000     2.530000  0.7727000     0.6862000E-01  1.086000  
1 1 1 10 26 21 o 2.410000  0.5191000     2.920000  0.7176000     1.899000  0.7502000     1.021000       1.038000  
1 1 1 10 26 22 o 1.780000  0.5227000     2.037000  0.7786000     1.523000  0.6978000     0.5133000      1.045000  
1 1 1 10 26 23 o 2.005000  0.5402000     2.193000  0.7801000     1.818000  0.7475000     0.3747000      1.080000  
1 1 1 10 26 24 o 1.097000  0.3768000     1.176000  0.5618000     1.018000  0.5024000     0.1585000      0.7537000 
1 1 1 10 27 0  o 12.69000  0.2038000     12.69000  0.2038000     12.69000  0.2038000     0.000000       0.000000  
1 1 1 10 27 1  o 7.908000  0.1396000     7.916000  0.1970000     7.901000  0.1977000     0.1487000E-01  0.2791000 
1 1 1 10 27 2  o 10.39000  0.1390000     10.47000  0.1961000     10.32000  0.1971000     0.1478000      0.2780000 
1 1 1 10 27 3  o 16.41000  0.1623000     16.45000  0.2291000     16.37000  0.2300000     0.7816000E-01  0.3246000 
1 1 1 10 27 4  o 3.816000  0.2065000     4.096000  0.2675000     3.536000  0.3147000     0.5606000      0.4130000 
1 1 1 10 27 5  o 14.96000  0.1574000     15.05000  0.2227000     14.87000  0.2226000     0.1777000      0.3148000 
1 1 1 10 27 6  o 11.57000  0.1475000     11.46000  0.2095000     11.68000  0.2076000     -0.2113000     0.2950000 
1 1 1 10 27 7  o 2.041000  0.4061000     2.012000  0.6237000     2.070000  0.5201000     -0.5826000E-01 0.8121000 
1 1 1 10 27 8  o 13.10000  0.1732000     13.23000  0.2648000     12.96000  0.2232000     0.2693000      0.3463000 
1 1 1 10 27 9  o 7.541000  0.1799000     7.555000  0.2419000     7.527000  0.2664000     0.2713000E-01  0.3598000 
1 1 1 10 27 10 o 3.693000  0.3937000     3.520000  0.5601000     3.866000  0.5534000     -0.3462000     0.7874000 
1 1 1 10 27 11 o 10.29000  0.2143000     10.44000  0.2395000     10.15000  0.3554000     0.2851000      0.4286000 
1 1 1 10 27 12 o 5.303000  0.2299000     5.397000  0.3179000     5.208000  0.3321000     0.1884000      0.4597000 
1 1 1 10 27 13 o 8.870000  0.1893000     8.485000  0.2670000     9.256000  0.2686000     -0.7708000     0.3787000 
1 1 1 10 27 14 o 8.505000  0.2014000     8.663000  0.2782000     8.348000  0.2912000     0.3152000      0.4027000 
1 1 1 10 27 15 f 6.037000  0.2606000     6.204000  0.3602000     5.871000  0.3767000     0.3328000      0.5212000 
1 1 1 10 27 16 o 2.817000  0.5628000     3.414000  0.7464000     2.220000  0.8425000     1.194000       1.126000  
1 1 1 10 27 17 o 2.740000  0.5939000     3.305000  0.8542000     2.176000  0.8254000     1.129000       1.188000  
1 1 1 10 27 18 o 4.247000  0.5779000     2.937000  1.036000      5.557000  0.5130000     -2.619000      1.156000  
1 1 1 10 27 19 o 1.790000  0.5197000     1.508000  0.6790000     2.071000  0.7870000     -0.5630000     1.039000  
1 1 1 10 27 20 o 3.932000  0.4039000     3.900000  0.5779000     3.964000  0.5645000     -0.6365000E-01 0.8079000 
1 1 1 10 27 21 o 2.186000  0.5449000     1.859000  0.7533000     2.512000  0.7875000     -0.6524000     1.090000  
1 1 1 10 27 22 o 1.728000  0.5567000     1.709000  0.7305000     1.746000  0.8403000     -0.3706000E-01 1.113000  
1 1 1 10 27 23 o 2.041000  0.6449000     2.455000  1.079000      1.628000  0.7064000     0.8276000      1.290000  
1 1 1 10 27 24 o 1.374000  0.4445000     1.338000  0.6180000     1.409000  0.6389000     -0.7101000E-01 0.8889000 
1 1 1 10 28 0  o 7.105000  0.2067000     7.105000  0.2067000     7.105000  0.2067000     0.000000       0.000000  
1 1 1 10 28 1  o 14.58000  0.1536000     14.70000  0.2175000     14.46000  0.2169000     0.2447000      0.3072000 
1 1 1 10 28 2  o 7.348000  0.1445000     7.329000  0.2015000     7.366000  0.2071000     -0.3667000E-01 0.2890000 
1 1 1 10 28 3  o 14.65000  0.1549000     14.58000  0.2183000     14.73000  0.2199000     -0.1480000     0.3098000 
1 1 1 10 28 4  o 21.19000  0.1911000     20.87000  0.2669000     21.51000  0.2735000     -0.6377000     0.3821000 
1 1 1 10 28 5  o 14.73000  0.1573000     14.91000  0.2236000     14.55000  0.2213000     0.3562000      0.3146000 
1 1 1 10 28 6  o 13.32000  0.1539000     13.67000  0.2201000     12.97000  0.2151000     0.7029000      0.3078000 
1 1 1 10 28 7  o 1.390000  0.3926000     1.351000  0.5665000     1.428000  0.5436000     -0.7677000E-01 0.7851000 
1 1 1 10 28 8  o 11.42000  0.1726000     11.18000  0.2651000     11.65000  0.2210000     -0.4746000     0.3452000 
1 1 1 10 28 9  o 15.99000  0.1859000     15.76000  0.2445000     16.21000  0.2801000     -0.4573000     0.3717000 
1 1 1 10 28 10 o 6.912000  0.2563000     6.892000  0.2652000     6.932000  0.4387000     -0.4013000E-01 0.5126000 
1 1 1 10 28 11 o 7.847000  0.2482000     7.933000  0.3727000     7.760000  0.3279000     0.1734000      0.4964000 
1 1 1 10 28 12 f 3.224000  0.3651000     3.368000  0.4879000     3.081000  0.5432000     0.2874000      0.7301000 
1 1 1 10 28 13 o 5.611000  0.2741000     5.469000  0.3581000     5.753000  0.4150000     -0.2840000     0.5482000 
1 1 1 10 28 14 o 7.350000  0.2208000     7.322000  0.3149000     7.379000  0.3095000     -0.5695000E-01 0.4415000 
1 1 1 10 28 15 o 3.498000  0.4177000     3.713000  0.5426000     3.284000  0.6352000     0.4294000      0.8354000 
1 1 1 10 28 16 o 9.067000  0.2636000     8.889000  0.4356000     9.245000  0.2971000     -0.3564000     0.5273000 
1 1 1 10 28 17 o 2.291000  0.5917000     2.449000  0.8107000     2.134000  0.8620000     0.3146000      1.183000  
1 1 1 10 28 18 o 2.280000  0.5699000     2.505000  0.8000000     2.056000  0.8118000     0.4493000      1.140000  
1 1 1 10 28 19 o 2.506000  0.5433000     1.978000  0.7658000     3.034000  0.7708000     -1.056000      1.087000  
1 1 1 10 28 20 o 3.422000  0.4670000     4.193000  0.5467000     2.650000  0.7573000     1.543000       0.9340000 
1 1 1 10 28 21 o 2.248000  0.5327000     1.934000  0.7453000     2.562000  0.7612000     -0.6280000     1.065000  
1 1 1 10 28 22 o 1.800000  0.5384000     1.841000  0.7160000     1.759000  0.8044000     0.8208000E-01  1.077000  
1 1 1 10 28 23 o 1.567000  0.5131000     1.802000  0.8221000     1.331000  0.6141000     0.4706000      1.026000  
1 1 1 10 28 24 o 1.793000  0.5018000     1.547000  0.6714000     2.039000  0.7460000     -0.4926000     1.004000  
1 1 1 10 29 0  o 17.24000  0.2380000     17.24000  0.2380000     17.24000  0.2380000     0.000000       0.000000  
1 1 1 10 29 1  o 10.74000  0.1427000     10.73000  0.2008000     10.76000  0.2029000     -0.3661000E-01 0.2855000 
1 1 1 10 29 2  o 12.75000  0.1478000     12.79000  0.2081000     12.70000  0.2098000     0.9527000E-01  0.2955000 
1 1 1 10 29 3  o 5.944000  0.1589000     5.978000  0.2259000     5.910000  0.2236000     0.6783000E-01  0.3178000 
1 1 1 10 29 4  o 12.89000  0.1495000     12.85000  0.2121000     12.92000  0.2108000     -0.6687000E-01 0.2990000 
1 1 1 10 29 5  o 18.73000  0.1782000     18.72000  0.2517000     18.75000  0.2523000     -0.3003000E-01 0.3564000 
1 1 1 10 29 6  o 6.353000  0.1687000     6.340000  0.2417000     6.366000  0.2353000     -0.2565000E-01 0.3373000 
1 1 1 10 29 7  o 16.63000  0.1863000     16.28000  0.2805000     16.98000  0.2451000     -0.7001000     0.3725000 
1 1 1 10 29 8  o 10.97000  0.1737000     11.03000  0.2667000     10.91000  0.2227000     0.1143000      0.3474000 
1 1 1 10 29 9  o 11.56000  0.2092000     11.44000  0.3257000     11.67000  0.2627000     -0.2290000     0.4184000 
1 1 1 10 29 10 o 12.83000  0.2108000     12.81000  0.2371000     12.85000  0.3486000     -0.3963000E-01 0.4216000 
1 1 1 10 29 11 o 2.030000  0.4515000     2.270000  0.6286000     1.790000  0.6482000     0.4797000      0.9029000 
1 1 1 10 29 12 o 3.510000  0.3631000     2.924000  0.5925000     4.096000  0.4200000     -1.172000      0.7263000 
1 1 1 10 29 13 o 4.954000  0.2714000     5.194000  0.3619000     4.714000  0.4045000     0.4798000      0.5427000 
1 1 1 10 29 14 o 6.931000  0.2300000     7.433000  0.3043000     6.429000  0.3450000     1.004000       0.4600000 
1 1 1 10 29 15 o 3.356000  0.4287000     3.734000  0.5442000     2.979000  0.6626000     0.7553000      0.8574000 
1 1 1 10 29 16 o 3.744000  0.5434000     2.397000  0.9066000     5.091000  0.5995000     -2.694000      1.087000  
1 1 1 10 29 17 o 2.119000  0.6404000     1.975000  0.9534000     2.263000  0.8553000     -0.2875000     1.281000  
1 1 1 10 29 18 o 4.438000  0.4057000     4.437000  0.5465000     4.439000  0.5998000     -0.1703000E-02 0.8114000 
1 1 1 10 29 19 o 1.752000  0.5150000     1.705000  0.7220000     1.799000  0.7346000     -0.9393000E-01 1.030000  
1 1 1 10 29 20 o 1.661000  0.5018000     1.657000  0.7073000     1.665000  0.7120000     -0.8043000E-02 1.004000  
1 1 1 10 29 21 o 1.387000  0.4436000     1.176000  0.5640000     1.599000  0.6848000     -0.4222000     0.8872000 
1 1 1 10 29 22 o 1.271000  0.4208000     1.276000  0.5968000     1.266000  0.5933000     0.1013000E-01  0.8415000 
1 1 1 10 29 23 o 1.089000  0.3763000     1.316000  0.6129000     0.8618000 0.4369000     0.4539000      0.7526000 
1 1 1 10 29 24 o 1.078000  0.3732000     0.9865000 0.4909000     1.169000  0.5621000     -0.1827000     0.7463000 
1 1 1 10 30 0  o 2.983000  0.3831000     2.983000  0.3831000     2.983000  0.3831000     0.000000       0.000000  
1 1 1 10 30 1  o 10.87000  0.1433000     10.76000  0.2027000     10.98000  0.2025000     -0.2257000     0.2865000 
1 1 1 10 30 2  o 6.910000  0.1530000     6.698000  0.2204000     7.122000  0.2124000     -0.4240000     0.3060000 
1 1 1 10 30 3  o 1.556000  0.3810000     1.436000  0.5373000     1.675000  0.5404000     -0.2392000     0.7621000 
1 1 1 10 30 4  o 2.432000  0.3228000     2.605000  0.4249000     2.259000  0.4861000     0.3463000      0.6456000 
1 1 1 10 30 5  o 6.115000  0.1693000     6.252000  0.2369000     5.978000  0.2421000     0.2742000      0.3387000 
1 1 1 10 30 6  o 14.96000  0.1785000     14.96000  0.2721000     14.96000  0.2313000     -0.8120000E-02 0.3571000 
1 1 1 10 30 7  o 8.332000  0.1763000     8.151000  0.2705000     8.513000  0.2261000     -0.3626000     0.3526000 
1 1 1 10 30 8  o 12.76000  0.1809000     12.98000  0.2790000     12.55000  0.2304000     0.4318000      0.3618000 
1 1 1 10 30 9  o 11.55000  0.2390000     11.66000  0.2323000     11.45000  0.4178000     0.2030000      0.4780000 
1 1 1 10 30 10 o 17.43000  0.2377000     17.52000  0.3663000     17.34000  0.3030000     0.1750000      0.4754000 
1 1 1 10 30 11 o 12.46000  0.1754000     12.46000  0.2465000     12.45000  0.2495000     0.8436000E-02  0.3507000 
1 1 1 10 30 12 o 5.327000  0.2476000     5.565000  0.3397000     5.089000  0.3602000     0.4765000      0.4951000 
1 1 1 10 30 13 o 3.299000  0.4054000     3.690000  0.5072000     2.907000  0.6325000     0.7828000      0.8108000 
1 1 1 10 30 14 o 4.228000  0.3506000     4.787000  0.4102000     3.670000  0.5688000     1.117000       0.7013000 
1 1 1 10 30 15 o 3.798000  0.3930000     3.600000  0.5837000     3.995000  0.5263000     -0.3949000     0.7859000 
1 1 1 10 30 16 o 3.529000  0.5160000     3.888000  0.5589000     3.169000  0.8676000     0.7188000      1.032000  
1 1 1 10 30 17 o 2.660000  0.5064000     1.700000  0.8437000     3.621000  0.5604000     -1.921000      1.013000  
1 1 1 10 30 18 o 2.645000  0.5356000     3.480000  0.6790000     1.809000  0.8285000     1.671000       1.071000  
1 1 1 10 30 19 f 1.926000  0.5262000     1.934000  0.7406000     1.918000  0.7477000     0.1560000E-01  1.052000  
1 1 1 10 30 20 o 1.975000  0.5356000     1.942000  0.7591000     2.007000  0.7557000     -0.6445000E-01 1.071000  
1 1 1 10 30 21 o 1.453000  0.4704000     1.501000  0.6794000     1.404000  0.6507000     0.9755000E-01  0.9408000 
1 1 1 10 30 22 o 1.631000  0.4670000     2.091000  0.7418000     1.171000  0.5676000     0.9194000      0.9341000 
1 1 1 10 30 23 o 1.476000  0.4498000     1.102000  0.5333000     1.850000  0.7245000     -0.7488000     0.8997000 
1 1 1 10 30 24 o 1.692000  0.4957000     1.756000  0.7075000     1.628000  0.6945000     0.1272000      0.9914000 
1 1 1 10 31 0  o 15.63000  0.2279000     15.63000  0.2279000     15.63000  0.2279000     0.000000       0.000000  
1 1 1 10 31 1  o 13.36000  0.1517000     13.48000  0.2145000     13.24000  0.2145000     0.2400000      0.3033000 
1 1 1 10 31 2  o 21.75000  0.1956000     21.82000  0.2771000     21.67000  0.2762000     0.1516000      0.3913000 
1 1 1 10 31 3  o 23.94000  0.2100000     23.96000  0.2968000     23.91000  0.2972000     0.4881000E-01  0.4201000 
1 1 1 10 31 4  o 12.91000  0.1534000     12.77000  0.2165000     13.05000  0.2174000     -0.2763000     0.3068000 
1 1 1 10 31 5  f 5.103000  0.1905000     5.369000  0.2560000     4.838000  0.2821000     0.5309000      0.3809000 
1 1 1 10 31 6  o 5.834000  0.2045000     5.387000  0.3265000     6.282000  0.2465000     -0.8950000     0.4091000 
1 1 1 10 31 7  o 17.10000  0.1927000     17.14000  0.2930000     17.06000  0.2503000     0.7174000E-01  0.3853000 
1 1 1 10 31 8  o 11.39000  0.2957000     11.69000  0.5245000     11.09000  0.2731000     0.6003000      0.5914000 
1 1 1 10 31 9  o 11.02000  0.2167000     11.18000  0.2613000     10.86000  0.3457000     0.3199000      0.4333000 
1 1 1 10 31 10 o 9.377000  0.1864000     9.322000  0.2484000     9.432000  0.2779000     -0.1105000     0.3728000 
1 1 1 10 31 11 o 4.520000  0.2649000     4.453000  0.3761000     4.588000  0.3730000     -0.1352000     0.5297000 
1 1 1 10 31 12 o 4.696000  0.2803000     4.254000  0.4247000     5.139000  0.3657000     -0.8851000     0.5605000 
1 1 1 10 31 13 o 5.164000  0.2715000     5.341000  0.3732000     4.986000  0.3943000     0.3553000      0.5429000 
1 1 1 10 31 14 o 2.201000  0.5047000     2.472000  0.6958000     1.930000  0.7313000     0.5422000      1.009000  
1 1 1 10 31 15 o 9.072000  0.2647000     8.857000  0.4358000     9.286000  0.3004000     -0.4293000     0.5293000 
1 1 1 10 31 16 o 2.303000  0.5969000     2.039000  0.7498000     2.567000  0.9290000     -0.5281000     1.194000  
1 1 1 10 31 17 o 4.118000  0.4548000     3.054000  0.8055000     5.182000  0.4226000     -2.127000      0.9097000 
1 1 1 10 31 18 o 2.003000  0.5454000     2.055000  0.7673000     1.950000  0.7753000     0.1056000      1.091000  
1 1 1 10 31 19 o 1.868000  0.5218000     1.691000  0.7096000     2.046000  0.7651000     -0.3550000     1.044000  
1 1 1 10 31 20 o 1.345000  0.4391000     1.300000  0.6052000     1.389000  0.6365000     -0.8980000E-01 0.8783000 
1 1 1 10 31 21 o 1.510000  0.5190000     1.270000  0.6050000     1.749000  0.8435000     -0.4791000     1.038000  
1 1 1 10 31 22 f 1.407000  0.4643000     1.440000  0.6735000     1.375000  0.6393000     0.6520000E-01  0.9286000 
1 1 1 10 31 23 o 1.973000  0.5234000     1.810000  0.7204000     2.136000  0.7595000     -0.3256000     1.047000  
1 1 1 10 32 0  o 2.738000  0.4482000     2.738000  0.4482000     2.738000  0.4482000     0.000000       0.000000  
1 1 1 10 32 1  o 13.87000  0.1553000     13.95000  0.2194000     13.80000  0.2199000     0.1497000      0.3107000 
1 1 1 10 32 2  o 9.566000  0.1485000     9.533000  0.2084000     9.600000  0.2116000     -0.6680000E-01 0.2970000 
1 1 1 10 32 3  o 13.95000  0.1577000     13.88000  0.2225000     14.02000  0.2235000     -0.1473000     0.3154000 
1 1 1 10 32 4  o 10.27000  0.1523000     10.08000  0.2144000     10.47000  0.2164000     -0.3878000     0.3046000 
1 1 1 10 32 5  o 25.15000  0.2209000     25.19000  0.3125000     25.11000  0.3123000     0.8151000E-01  0.4418000 
1 1 1 10 32 6  o 13.18000  0.1947000     13.18000  0.3166000     13.18000  0.2269000     -0.3547000E-02 0.3895000 
1 1 1 10 32 7  o 9.316000  0.2849000     9.225000  0.5219000     9.407000  0.2285000     -0.1818000     0.5698000 
1 1 1 10 32 8  o 18.62000  0.2680000     18.62000  0.2680000     ?         ?             ?              ?         
1 1 1 10 32 9  o 8.956000  0.2203000     9.022000  0.3448000     8.890000  0.2743000     0.1323000      0.4406000 
1 1 1 10 32 10 o 12.10000  0.1855000     11.87000  0.2457000     12.33000  0.2779000     -0.4583000     0.3709000 
1 1 1 10 32 11 o 16.63000  0.1879000     17.03000  0.2664000     16.24000  0.2650000     0.7883000      0.3757000 
1 1 1 10 32 12 o 1.779000  0.4733000     1.508000  0.6362000     2.051000  0.7008000     -0.5438000     0.9465000 
1 1 1 10 32 13 o 10.12000  0.1962000     10.27000  0.2757000     9.969000  0.2792000     0.3026000      0.3923000 
1 1 1 10 32 14 o 4.724000  0.3170000     5.075000  0.4159000     4.373000  0.4785000     0.7017000      0.6340000 
1 1 1 10 32 15 o 6.384000  0.3520000     6.732000  0.4971000     6.037000  0.4986000     0.6947000      0.7040000 
1 1 1 10 32 16 o 3.252000  0.6170000     3.488000  0.8512000     3.015000  0.8935000     0.4732000      1.234000  
1 1 1 10 32 17 o 6.109000  0.2671000     5.697000  0.3759000     6.521000  0.3795000     -0.8244000     0.5342000 
1 1 1 10 32 18 o 1.808000  0.5245000     1.927000  0.7583000     1.689000  0.7248000     0.2375000      1.049000  
1 1 1 10 32 19 o 2.589000  0.5327000     2.529000  0.7511000     2.649000  0.7555000     -0.1194000     1.065000  
1 1 1 10 32 20 o 1.699000  0.4895000     1.977000  0.7393000     1.421000  0.6418000     0.5557000      0.9790000 
1 1 1 10 32 21 o 1.728000  0.5196000     1.903000  0.7293000     1.553000  0.7403000     0.3495000      1.039000  
1 1 1 10 32 22 f 1.510000  0.5250000     1.820000  0.8783000     1.200000  0.5756000     0.6196000      1.050000  
1 1 1 10 32 23 o 1.503000  0.4672000     1.470000  0.6488000     1.535000  0.6724000     -0.6442000E-01 0.9343000 
1 1 1 10 33 0  o 16.75000  0.2403000     16.75000  0.2403000     16.75000  0.2403000     0.000000       0.000000  
1 1 1 10 33 1  o 12.04000  0.1528000     12.05000  0.2155000     12.02000  0.2166000     0.2848000E-01  0.3055000 
1 1 1 10 33 2  o 27.32000  0.2340000     27.61000  0.3332000     27.02000  0.3287000     0.5881000      0.4681000 
1 1 1 10 33 3  o 13.02000  0.1568000     12.77000  0.2201000     13.27000  0.2235000     -0.4997000     0.3136000 
1 1 1 10 33 4  o 26.80000  0.2316000     26.73000  0.3265000     26.87000  0.3286000     -0.1478000     0.4633000 
1 1 1 10 33 5  o 3.290000  0.2899000     3.629000  0.3641000     2.951000  0.4511000     0.6774000      0.5797000 
1 1 1 10 33 6  o 14.02000  0.2123000     13.91000  0.3542000     14.13000  0.2342000     -0.2221000     0.4246000 
1 1 1 10 33 7  o 4.171000  0.3891000     4.278000  0.4131000     4.063000  0.6595000     0.2155000      0.7782000 
1 1 1 10 33 8  o 5.412000  0.2720000     5.547000  0.3978000     5.276000  0.3711000     0.2710000      0.5441000 
1 1 1 10 33 9  o 8.807000  0.1891000     9.088000  0.2442000     8.526000  0.2889000     0.5625000      0.3783000 
1 1 1 10 33 10 o 7.450000  0.2062000     7.592000  0.2691000     7.308000  0.3125000     0.2834000      0.4124000 
1 1 1 10 33 11 f 7.840000  0.2015000     8.092000  0.2782000     7.587000  0.2916000     0.5050000      0.4031000 
1 1 1 10 33 12 o 5.577000  0.2524000     5.657000  0.3508000     5.497000  0.3629000     0.1600000      0.5047000 
1 1 1 10 33 13 o 4.542000  0.3174000     4.881000  0.4100000     4.203000  0.4847000     0.6776000      0.6349000 
1 1 1 10 33 14 o 4.669000  0.3171000     4.339000  0.4657000     4.998000  0.4306000     -0.6591000     0.6343000 
1 1 1 10 33 15 o 2.423000  0.5692000     2.437000  0.7510000     2.409000  0.8556000     0.2774000E-01  1.138000  
1 1 1 10 33 16 o 6.729000  0.3044000     6.483000  0.5005000     6.976000  0.3467000     -0.4929000     0.6088000 
1 1 1 10 33 17 o 2.192000  0.4772000     2.778000  0.6589000     1.605000  0.6904000     1.173000       0.9544000 
1 1 1 10 33 18 o 3.044000  0.4916000     2.531000  0.8306000     3.557000  0.5261000     -1.026000      0.9832000 
1 1 1 10 33 19 o 1.771000  0.5070000     1.644000  0.6900000     1.898000  0.7429000     -0.2542000     1.014000  
1 1 1 10 33 20 o 1.689000  0.4791000     2.082000  0.7455000     1.295000  0.6018000     0.7869000      0.9581000 
1 1 1 10 33 21 o 1.823000  0.5076000     2.018000  0.7430000     1.627000  0.6917000     0.3912000      1.015000  
1 1 1 10 33 22 o 1.701000  0.5081000     1.584000  0.7202000     1.818000  0.7169000     -0.2343000     1.016000  
1 1 1 10 33 23 o 1.698000  0.4976000     1.935000  0.7482000     1.460000  0.6563000     0.4753000      0.9953000 
1 1 1 10 34 0  o 5.674000  0.2620000     5.674000  0.2620000     5.674000  0.2620000     -0.000000      0.000000  
1 1 1 10 34 1  o 8.997000  0.1549000     8.947000  0.2177000     9.048000  0.2203000     -0.1008000     0.3097000 
1 1 1 10 34 2  o 13.13000  0.1582000     13.00000  0.2226000     13.26000  0.2249000     -0.2533000     0.3164000 
1 1 1 10 34 3  o 23.89000  0.2131000     24.06000  0.3024000     23.72000  0.3004000     0.3378000      0.4262000 
1 1 1 10 34 4  o 9.803000  0.1571000     9.961000  0.2225000     9.644000  0.2217000     0.3168000      0.3141000 
1 1 1 10 34 5  o 17.16000  0.1929000     17.09000  0.2924000     17.24000  0.2516000     -0.1560000     0.3858000 
1 1 1 10 34 6  o 24.33000  0.3742000     24.27000  0.4378000     24.40000  0.6069000     -0.1258000     0.7484000 
1 1 1 10 34 7  o 2.302000  0.4906000     2.452000  0.6940000     2.153000  0.6934000     0.2995000      0.9811000 
1 1 1 10 34 8  o 8.642000  0.1733000     8.895000  0.2438000     8.389000  0.2464000     0.5064000      0.3467000 
1 1 1 10 34 9  o 5.979000  0.2258000     5.883000  0.2975000     6.075000  0.3399000     -0.1921000     0.4516000 
1 1 1 10 34 10 o 10.07000  0.1910000     10.01000  0.2537000     10.14000  0.2856000     -0.1288000     0.3821000 
1 1 1 10 34 11 o 2.103000  0.4836000     2.113000  0.6782000     2.093000  0.6897000     0.1984000E-01  0.9673000 
1 1 1 10 34 12 o 1.431000  0.4470000     1.434000  0.6338000     1.427000  0.6303000     0.6341000E-02  0.8939000 
1 1 1 10 34 13 o 2.418000  0.5025000     2.668000  0.6945000     2.169000  0.7266000     0.4987000      1.005000  
1 1 1 10 34 14 o 3.041000  0.5528000     3.374000  0.8227000     2.707000  0.7385000     0.6677000      1.106000  
1 1 1 10 34 15 o 2.353000  0.5092000     2.982000  0.6543000     1.724000  0.7805000     1.259000       1.018000  
1 1 1 10 34 16 o 1.986000  0.5241000     1.926000  0.7176000     2.046000  0.7640000     -0.1209000     1.048000  
1 1 1 10 34 17 o 2.673000  0.5052000     2.527000  0.7006000     2.820000  0.7282000     -0.2934000     1.010000  
1 1 1 10 34 18 o 2.446000  0.4555000     3.308000  0.6043000     1.584000  0.6817000     1.724000       0.9110000 
1 1 1 10 34 19 o 1.924000  0.5240000     2.031000  0.7477000     1.817000  0.7342000     0.2136000      1.048000  
1 1 1 10 34 20 o 2.951000  0.5186000     2.843000  0.7483000     3.058000  0.7182000     -0.2152000     1.037000  
1 1 1 10 34 21 o 2.277000  0.5331000     2.617000  0.7443000     1.937000  0.7635000     0.6806000      1.066000  
1 1 1 10 34 22 o 1.766000  0.4928000     2.149000  0.7574000     1.383000  0.6305000     0.7659000      0.9855000 
1 1 1 10 34 23 o 1.270000  0.4201000     1.491000  0.6627000     1.049000  0.5165000     0.4416000      0.8402000 
1 1 1 10 35 0  o 22.01000  0.2851000     22.01000  0.2851000     22.01000  0.2851000     -0.000000      0.000000  
1 1 1 10 35 1  o 9.397000  0.1556000     9.465000  0.2208000     9.328000  0.2193000     0.1372000      0.3112000 
1 1 1 10 35 2  o 7.396000  0.1661000     7.402000  0.2351000     7.390000  0.2347000     0.1210000E-01  0.3322000 
1 1 1 10 35 3  o 10.85000  0.1574000     10.86000  0.2230000     10.85000  0.2220000     0.5501000E-02  0.3147000 
1 1 1 10 35 4  f 4.798000  0.2651000     4.734000  0.4414000     4.861000  0.2937000     -0.1272000     0.5301000 
1 1 1 10 35 5  o 16.20000  0.2797000     15.89000  0.2813000     16.50000  0.4834000     -0.6117000     0.5593000 
1 1 1 10 35 6  o 14.80000  0.2207000     14.34000  0.3324000     15.26000  0.2904000     -0.9230000     0.4414000 
1 1 1 10 35 7  o 8.588000  0.1886000     8.562000  0.2899000     8.614000  0.2413000     -0.5272000E-01 0.3772000 
1 1 1 10 35 8  o 14.47000  0.1749000     14.72000  0.2487000     14.21000  0.2459000     0.5072000      0.3497000 
1 1 1 10 35 9  o 16.67000  0.1992000     16.71000  0.2616000     16.63000  0.3004000     0.7728000E-01  0.3983000 
1 1 1 10 35 10 o 11.42000  0.1939000     11.59000  0.2547000     11.24000  0.2925000     0.3493000      0.3878000 
1 1 1 10 35 11 o 2.810000  0.4387000     3.411000  0.5345000     2.209000  0.6957000     1.202000       0.8773000 
1 1 1 10 35 12 f 3.341000  0.4173000     3.371000  0.5734000     3.311000  0.6066000     0.5989000E-01  0.8347000 
1 1 1 10 35 13 o 2.236000  0.5180000     2.472000  0.7216000     2.000000  0.7434000     0.4713000      1.036000  
1 1 1 10 35 14 o 1.929000  0.5264000     2.171000  0.7349000     1.688000  0.7540000     0.4824000      1.053000  
1 1 1 10 35 15 o 2.392000  0.6176000     2.219000  0.8767000     2.565000  0.8701000     -0.3463000     1.235000  
1 1 1 10 35 16 o 1.971000  0.5220000     1.966000  0.7163000     1.977000  0.7593000     -0.1082000E-01 1.044000  
1 1 1 10 35 17 o 4.806000  0.3163000     4.737000  0.4372000     4.876000  0.4573000     -0.1393000     0.6326000 
1 1 1 10 35 18 o 2.177000  0.5041000     1.805000  0.7038000     2.549000  0.7220000     -0.7442000     1.008000  
1 1 1 10 35 19 o 1.561000  0.4791000     1.715000  0.7376000     1.407000  0.6116000     0.3083000      0.9582000 
1 1 1 10 35 20 f 1.809000  0.5697000     1.821000  0.7389000     1.798000  0.8673000     0.2263000E-01  1.139000  
1 1 1 10 35 21 o 1.565000  0.5337000     1.797000  0.8643000     1.332000  0.6264000     0.4651000      1.067000  
1 1 1 10 35 22 o 2.181000  0.4703000     2.916000  0.6804000     1.445000  0.6495000     1.471000       0.9406000 
1 1 1 10 36 0  o 7.568000  0.2349000     7.568000  0.2349000     7.568000  0.2349000     0.000000       0.000000  
1 1 1 10 36 1  o 10.88000  0.1572000     10.64000  0.2218000     11.11000  0.2228000     -0.4674000     0.3144000 
1 1 1 10 36 2  o 3.984000  0.2730000     3.751000  0.4330000     4.217000  0.3326000     -0.4659000     0.5460000 
1 1 1 10 36 3  o 11.72000  0.2287000     12.11000  0.3238000     11.32000  0.3229000     0.7933000      0.4573000 
1 1 1 10 36 4  f 16.24000  0.2883000     16.24000  0.2883000     ?         ?             ?              ?         
1 1 1 10 36 5  o 10.13000  0.2136000     10.56000  0.3223000     9.696000  0.2804000     0.8635000      0.4272000 
1 1 1 10 36 6  o 16.12000  0.1919000     15.94000  0.2906000     16.31000  0.2508000     -0.3774000     0.3839000 
1 1 1 10 36 7  o 6.650000  0.2128000     6.504000  0.3310000     6.797000  0.2676000     -0.2931000     0.4256000 
1 1 1 10 36 8  o 2.580000  0.4251000     2.670000  0.5863000     2.490000  0.6156000     0.1800000      0.8502000 
1 1 1 10 36 9  o 7.859000  0.2040000     7.606000  0.2791000     8.112000  0.2975000     -0.5055000     0.4079000 
1 1 1 10 36 10 o 2.389000  0.4808000     2.695000  0.6273000     2.082000  0.7290000     0.6130000      0.9617000 
1 1 1 10 36 11 o 6.050000  0.2442000     6.359000  0.3349000     5.741000  0.3556000     0.6181000      0.4885000 
1 1 1 10 36 12 o 6.099000  0.2575000     6.826000  0.3285000     5.373000  0.3966000     1.453000       0.5150000 
1 1 1 10 36 13 o 2.793000  0.5538000     2.448000  0.8904000     3.137000  0.6587000     -0.6892000     1.108000  
1 1 1 10 36 14 o 8.390000  0.2831000     8.545000  0.3036000     8.234000  0.4779000     0.3102000      0.5661000 
1 1 1 10 36 15 o 3.429000  0.4890000     4.004000  0.6623000     2.854000  0.7195000     1.150000       0.9779000 
1 1 1 10 36 16 o 2.707000  0.4908000     3.134000  0.6276000     2.281000  0.7547000     0.8526000      0.9816000 
1 1 1 10 36 17 o 1.787000  0.4867000     1.440000  0.6386000     2.134000  0.7346000     -0.6936000     0.9734000 
1 1 1 10 36 18 o 1.515000  0.4598000     1.427000  0.6282000     1.604000  0.6715000     -0.1772000     0.9195000 
1 1 1 10 36 19 o 1.757000  0.4775000     1.508000  0.6885000     2.005000  0.6618000     -0.4964000     0.9550000 
1 1 1 10 36 20 o 1.218000  0.4161000     1.247000  0.5846000     1.188000  0.5923000     0.5867000E-01  0.8322000 
1 1 1 10 36 21 o 1.370000  0.4552000     1.324000  0.6499000     1.416000  0.6377000     -0.9206000E-01 0.9105000 
1 1 1 10 36 22 o 2.545000  0.4876000     1.784000  0.7226000     3.306000  0.6551000     -1.522000      0.9753000 
1 1 1 10 37 0  o 1.343000  0.8569000     1.343000  0.8569000     1.343000  0.8569000     -0.000000      0.000000  
1 1 1 10 37 1  o 3.598000  0.5727000     3.549000  0.8279000     3.647000  0.7915000     -0.9822000E-01 1.145000  
1 1 1 10 37 2  o 2.350000  0.7052000     2.350000  0.7052000     ?         ?             ?              ?         
1 1 1 10 37 3  o 5.908000  0.3489000     6.050000  0.3665000     5.767000  0.5938000     0.2824000      0.6978000 
1 1 1 10 37 4  o 7.054000  0.2185000     7.261000  0.3521000     6.846000  0.2587000     0.4152000      0.4369000 
1 1 1 10 37 5  o 4.706000  0.2358000     4.531000  0.3482000     4.882000  0.3181000     -0.3515000     0.4716000 
1 1 1 10 37 6  o 4.025000  0.2927000     4.094000  0.4370000     3.956000  0.3894000     0.1384000      0.5853000 
1 1 1 10 37 7  o 5.459000  0.2514000     5.058000  0.4026000     5.861000  0.3010000     -0.8034000     0.5027000 
1 1 1 10 37 8  o 11.37000  0.1747000     11.45000  0.2478000     11.30000  0.2464000     0.1550000      0.3494000 
1 1 1 10 37 9  o 10.36000  0.1936000     10.07000  0.2556000     10.65000  0.2908000     -0.5738000     0.3871000 
1 1 1 10 37 10 o 7.382000  0.2238000     7.615000  0.2911000     7.148000  0.3399000     0.4670000      0.4475000 
1 1 1 10 37 11 o 13.68000  0.1887000     13.59000  0.2652000     13.77000  0.2684000     -0.1772000     0.3773000 
1 1 1 10 37 12 o 7.200000  0.2336000     7.072000  0.3336000     7.329000  0.3270000     -0.2573000     0.4671000 
1 1 1 10 37 13 o 10.37000  0.2594000     10.80000  0.3221000     9.950000  0.4067000     0.8457000      0.5188000 
1 1 1 10 37 14 o 4.517000  0.4755000     4.396000  0.7052000     4.639000  0.6381000     -0.2428000     0.9511000 
1 1 1 10 37 15 o 5.172000  0.3053000     5.455000  0.3849000     4.889000  0.4739000     0.5653000      0.6105000 
1 1 1 10 37 16 o 1.740000  0.4822000     1.355000  0.6185000     2.125000  0.7399000     -0.7701000     0.9644000 
1 1 1 10 37 17 o 3.356000  0.4294000     3.078000  0.6401000     3.635000  0.5726000     -0.5572000     0.8589000 
1 1 1 10 37 18 o 1.463000  0.4398000     1.154000  0.5487000     1.773000  0.6874000     -0.6187000     0.8795000 
1 1 1 10 37 19 o 1.704000  0.4606000     1.279000  0.6213000     2.129000  0.6801000     -0.8507000     0.9211000 
1 1 1 10 37 20 o 1.483000  0.4581000     1.768000  0.7100000     1.199000  0.5791000     0.5692000      0.9162000 
1 1 1 10 37 21 o 1.714000  0.4931000     1.702000  0.6919000     1.726000  0.7027000     -0.2398000E-01 0.9861000 
1 1 1 10 37 22 o 1.645000  0.4827000     1.452000  0.6443000     1.839000  0.7188000     -0.3870000     0.9653000 
1 1 1 10 38 0  o 5.626000  0.3353000     5.626000  0.3353000     5.626000  0.3353000     0.000000       0.000000  
1 1 1 10 38 1  o 5.688000  0.2339000     5.484000  0.3471000     5.892000  0.3137000     -0.4083000     0.4678000 
1 1 1 10 38 2  o 15.91000  0.1883000     15.78000  0.2840000     16.03000  0.2472000     -0.2547000     0.3765000 
1 1 1 10 38 3  o 8.966000  0.1671000     9.104000  0.2347000     8.827000  0.2380000     0.2773000      0.3343000 
1 1 1 10 38 4  o 5.922000  0.2035000     6.278000  0.2768000     5.566000  0.2984000     0.7121000      0.4070000 
1 1 1 10 38 5  o 2.666000  0.4168000     2.424000  0.6653000     2.908000  0.5023000     -0.4838000     0.8336000 
1 1 1 10 38 6  o 8.828000  0.1923000     8.847000  0.2927000     8.809000  0.2494000     0.3747000E-01  0.3845000 
1 1 1 10 38 7  o 9.826000  0.1948000     9.596000  0.2970000     10.06000  0.2521000     -0.4597000     0.3895000 
1 1 1 10 38 8  o 4.387000  0.2820000     4.453000  0.3945000     4.322000  0.4031000     0.1314000      0.5640000 
1 1 1 10 38 9  o 9.162000  0.2001000     9.444000  0.2630000     8.881000  0.3017000     0.5625000      0.4003000 
1 1 1 10 38 10 o 11.75000  0.1990000     12.00000  0.2630000     11.50000  0.2987000     0.5071000      0.3980000 
1 1 1 10 38 11 o 3.436000  0.4091000     3.262000  0.6049000     3.609000  0.5510000     -0.3474000     0.8182000 
1 1 1 10 38 12 o 8.926000  0.2581000     9.299000  0.4179000     8.553000  0.3029000     0.7465000      0.5161000 
1 1 1 10 38 13 o 4.894000  0.3561000     5.376000  0.4101000     4.411000  0.5823000     0.9651000      0.7122000 
1 1 1 10 38 14 o 5.431000  0.3324000     5.408000  0.5084000     5.455000  0.4284000     -0.4707000E-01 0.6648000 
1 1 1 10 38 15 o 3.554000  0.4108000     3.238000  0.5911000     3.871000  0.5707000     -0.6338000     0.8216000 
1 1 1 10 38 16 o 2.732000  0.4940000     2.481000  0.7261000     2.982000  0.6701000     -0.5014000     0.9881000 
1 1 1 10 38 17 o 2.921000  0.4793000     3.059000  0.6497000     2.782000  0.7049000     0.2774000      0.9586000 
1 1 1 10 38 18 o 2.151000  0.5000000     1.914000  0.7058000     2.387000  0.7084000     -0.4729000     1.000000  
1 1 1 10 38 19 o 1.440000  0.4727000     1.500000  0.6926000     1.380000  0.6435000     0.1205000      0.9454000 
1 1 1 10 38 20 o 1.540000  0.4958000     1.817000  0.7868000     1.263000  0.6036000     0.5538000      0.9916000 
1 1 1 10 38 21 o 1.836000  0.4845000     1.301000  0.6028000     2.371000  0.7586000     -1.070000      0.9689000 
1 1 1 10 38 22 o 1.043000  0.3668000     1.027000  0.5132000     1.059000  0.5242000     -0.3151000E-01 0.7336000 
1 1 1 10 39 0  o 15.06000  0.2433000     15.06000  0.2433000     15.06000  0.2433000     -0.000000      0.000000  
1 1 1 10 39 1  o 2.299000  0.4012000     2.717000  0.5249000     1.880000  0.6069000     0.8377000      0.8024000 
1 1 1 10 39 2  o 15.77000  0.1757000     15.95000  0.2489000     15.59000  0.2482000     0.3583000      0.3515000 
1 1 1 10 39 3  o 11.08000  0.1670000     11.15000  0.2337000     11.02000  0.2385000     0.1313000      0.3339000 
1 1 1 10 39 4  o 10.30000  0.1691000     10.56000  0.2376000     10.04000  0.2406000     0.5235000      0.3381000 
1 1 1 10 39 5  o 10.38000  0.1857000     10.49000  0.2819000     10.28000  0.2418000     0.2118000      0.3714000 
1 1 1 10 39 6  o 9.364000  0.1924000     9.481000  0.2910000     9.248000  0.2520000     0.2331000      0.3849000 
1 1 1 10 39 7  o 10.02000  0.1961000     10.21000  0.2972000     9.825000  0.2560000     0.3858000      0.3923000 
1 1 1 10 39 8  o 6.573000  0.2163000     6.596000  0.3035000     6.550000  0.3084000     0.4668000E-01  0.4326000 
1 1 1 10 39 9  o 2.081000  0.4981000     2.253000  0.6813000     1.910000  0.7268000     0.3433000      0.9962000 
1 1 1 10 39 10 o 9.318000  0.2090000     9.370000  0.2773000     9.266000  0.3128000     0.1041000      0.4180000 
1 1 1 10 39 11 o 2.135000  0.4559000     1.421000  0.6313000     2.849000  0.6579000     -1.428000      0.9118000 
1 1 1 10 39 12 o 6.604000  0.3053000     6.695000  0.3881000     6.512000  0.4713000     0.1835000      0.6105000 
1 1 1 10 39 13 o 1.899000  0.5738000     1.916000  0.8196000     1.883000  0.8033000     0.3350000E-01  1.148000  
1 1 1 10 39 14 o 3.962000  0.3817000     3.860000  0.5052000     4.064000  0.5723000     -0.2041000     0.7634000 
1 1 1 10 39 15 o 1.990000  0.4960000     1.612000  0.6743000     2.367000  0.7276000     -0.7553000     0.9920000 
1 1 1 10 39 16 o 3.184000  0.4590000     3.055000  0.6658000     3.312000  0.6321000     -0.2578000     0.9181000 
1 1 1 10 39 17 o 5.670000  0.2689000     5.521000  0.3826000     5.819000  0.3781000     -0.2978000     0.5379000 
1 1 1 10 39 18 o 3.982000  0.4103000     4.750000  0.4286000     3.214000  0.6998000     1.536000       0.8206000 
1 1 1 10 39 19 o 2.125000  0.4610000     2.793000  0.6354000     1.456000  0.6681000     1.337000       0.9220000 
1 1 1 10 39 20 o 2.179000  0.5303000     2.624000  0.8170000     1.734000  0.6763000     0.8905000      1.061000  
1 1 1 10 39 21 o 1.575000  0.4727000     1.824000  0.7196000     1.327000  0.6131000     0.4968000      0.9453000 
1 1 1 10 40 0  f 7.410000  0.2586000     7.410000  0.2586000     7.410000  0.2586000     0.000000       0.000000  
1 1 1 10 40 1  o 4.917000  0.2294000     4.726000  0.3376000     5.108000  0.3108000     -0.3826000     0.4588000 
1 1 1 10 40 2  o 6.934000  0.1886000     6.641000  0.2723000     7.226000  0.2609000     -0.5853000     0.3772000 
1 1 1 10 40 3  o 6.135000  0.2035000     5.985000  0.2928000     6.285000  0.2829000     -0.3003000     0.4071000 
1 1 1 10 40 4  o 3.369000  0.3407000     3.948000  0.4026000     2.789000  0.5498000     1.159000       0.6815000 
1 1 1 10 40 5  o 14.27000  0.1919000     14.23000  0.2902000     14.32000  0.2511000     -0.9716000E-01 0.3837000 
1 1 1 10 40 6  o 5.417000  0.3011000     4.862000  0.5178000     5.972000  0.3075000     -1.110000      0.6022000 
1 1 1 10 40 7  o 16.16000  0.1866000     16.60000  0.2660000     15.71000  0.2619000     0.8924000      0.3733000 
1 1 1 10 40 8  o 9.669000  0.1874000     9.566000  0.2641000     9.772000  0.2661000     -0.2057000     0.3749000 
1 1 1 10 40 9  o 4.631000  0.3122000     4.400000  0.4250000     4.862000  0.4575000     -0.4618000     0.6245000 
1 1 1 10 40 10 o 7.585000  0.2308000     7.518000  0.3085000     7.652000  0.3433000     -0.1347000     0.4616000 
1 1 1 10 40 11 o 7.426000  0.2789000     7.481000  0.4540000     7.371000  0.3243000     0.1104000      0.5579000 
1 1 1 10 40 12 o 5.128000  0.3796000     5.016000  0.4254000     5.240000  0.6288000     -0.2239000     0.7592000 
1 1 1 10 40 13 o 3.087000  0.5318000     3.353000  0.7626000     2.822000  0.7413000     0.5311000      1.064000  
1 1 1 10 40 14 o 1.806000  0.4948000     2.058000  0.7178000     1.554000  0.6811000     0.5040000      0.9895000 
1 1 1 10 40 15 o 3.365000  0.4282000     3.496000  0.5815000     3.234000  0.6286000     0.2618000      0.8563000 
1 1 1 10 40 16 o 3.376000  0.4300000     3.348000  0.5908000     3.403000  0.6249000     -0.5438000E-01 0.8599000 
1 1 1 10 40 17 o 3.482000  0.4063000     3.243000  0.6072000     3.722000  0.5400000     -0.4791000     0.8126000 
1 1 1 10 40 18 o 1.821000  0.5266000     1.897000  0.8102000     1.746000  0.6730000     0.1508000      1.053000  
1 1 1 10 40 19 o 1.937000  0.5380000     1.547000  0.6515000     2.328000  0.8563000     -0.7814000     1.076000  
1 1 1 10 40 20 o 1.854000  0.4854000     1.769000  0.6839000     1.940000  0.6890000     -0.1714000     0.9708000 
1 1 1 10 40 21 o 1.286000  0.4264000     1.175000  0.5718000     1.396000  0.6328000     -0.2212000     0.8529000 
1 1 1 10 41 0  f 19.06000  0.2729000     19.06000  0.2729000     19.06000  0.2729000     0.000000       0.000000  
1 1 1 10 41 1  o 15.23000  0.1780000     14.68000  0.2504000     15.78000  0.2531000     -1.107000      0.3560000 
1 1 1 10 41 2  o 7.533000  0.1902000     7.764000  0.2626000     7.303000  0.2752000     0.4607000      0.3803000 
1 1 1 10 41 3  o 11.36000  0.1737000     11.30000  0.2435000     11.43000  0.2479000     -0.1305000     0.3475000 
1 1 1 10 41 4  o 7.232000  0.1963000     6.836000  0.2844000     7.628000  0.2708000     -0.7917000     0.3927000 
1 1 1 10 41 5  o 11.13000  0.1912000     11.15000  0.2908000     11.10000  0.2483000     0.5113000E-01  0.3824000 
1 1 1 10 41 6  o 11.61000  0.1927000     11.38000  0.2927000     11.84000  0.2507000     -0.4668000     0.3854000 
1 1 1 10 41 7  o 8.068000  0.1979000     8.069000  0.2802000     8.067000  0.2796000     0.1578000E-02  0.3958000 
1 1 1 10 41 8  o 2.216000  0.4795000     2.718000  0.6554000     1.713000  0.7001000     1.004000       0.9590000 
1 1 1 10 41 9  o 7.093000  0.2364000     7.176000  0.3136000     7.009000  0.3538000     0.1673000      0.4727000 
1 1 1 10 41 10 o 8.542000  0.2261000     8.869000  0.2967000     8.215000  0.3412000     0.6540000      0.4521000 
1 1 1 10 41 11 o 11.06000  0.2454000     10.61000  0.2845000     11.50000  0.4000000     -0.8833000     0.4909000 
1 1 1 10 41 12 o 4.308000  0.4790000     4.987000  0.6342000     3.630000  0.7180000     1.357000       0.9579000 
1 1 1 10 41 13 o 2.580000  0.5072000     2.342000  0.7098000     2.818000  0.7247000     -0.4762000     1.014000  
1 1 1 10 41 14 o 3.059000  0.4670000     2.629000  0.7073000     3.489000  0.6101000     -0.8598000     0.9341000 
1 1 1 10 41 15 o 2.407000  0.5151000     2.093000  0.7352000     2.722000  0.7218000     -0.6295000     1.030000  
1 1 1 10 41 16 o 4.035000  0.3671000     4.165000  0.4942000     3.905000  0.5430000     0.2599000      0.7342000 
1 1 1 10 41 17 o 1.374000  0.4349000     1.276000  0.5874000     1.471000  0.6415000     -0.1943000     0.8698000 
1 1 1 10 41 18 f 1.631000  0.4925000     1.728000  0.7071000     1.534000  0.6859000     0.1937000      0.9851000 
1 1 1 10 41 19 o 1.476000  0.4743000     1.279000  0.6094000     1.673000  0.7269000     -0.3944000     0.9486000 
1 1 1 10 41 20 o 1.449000  0.4393000     1.217000  0.5672000     1.681000  0.6709000     -0.4640000     0.8785000 
1 1 1 10 41 21 o 1.360000  0.4401000     1.507000  0.6796000     1.214000  0.5594000     0.2927000      0.8802000 
1 1 1 10 42 0  o 4.424000  0.3828000     4.424000  0.3828000     4.424000  0.3828000     0.000000       0.000000  
1 1 1 10 42 1  o 10.98000  0.1732000     10.75000  0.2448000     11.20000  0.2451000     -0.4447000     0.3464000 
1 1 1 10 42 2  o 2.023000  0.4548000     2.172000  0.6376000     1.874000  0.6486000     0.2983000      0.9095000 
1 1 1 10 42 3  o 12.54000  0.1744000     12.43000  0.2455000     12.65000  0.2477000     -0.2192000     0.3487000 
1 1 1 10 42 4  o 13.90000  0.1786000     13.95000  0.2515000     13.86000  0.2536000     0.9179000E-01  0.3572000 
1 1 1 10 42 5  o 5.618000  0.2563000     5.651000  0.3891000     5.586000  0.3337000     0.6518000E-01  0.5126000 
1 1 1 10 42 6  o 4.095000  0.3344000     4.259000  0.4898000     3.931000  0.4555000     0.3273000      0.6689000 
1 1 1 10 42 7  o 10.61000  0.1882000     10.44000  0.2665000     10.78000  0.2657000     -0.3449000     0.3763000 
1 1 1 10 42 8  f 10.12000  0.2075000     9.811000  0.2781000     10.42000  0.3080000     -0.6103000     0.4149000 
1 1 1 10 42 9  o 6.299000  0.2630000     6.106000  0.3543000     6.492000  0.3887000     -0.3867000     0.5260000 
1 1 1 10 42 10 o 3.660000  0.6044000     3.934000  0.7243000     3.386000  0.9677000     0.5472000      1.209000  
1 1 1 10 42 11 o 3.843000  0.4897000     3.713000  0.5863000     3.973000  0.7846000     -0.2595000     0.9794000 
1 1 1 10 42 12 o 3.439000  0.4301000     2.900000  0.6678000     3.978000  0.5421000     -1.079000      0.8602000 
1 1 1 10 42 13 o 3.142000  0.4575000     2.838000  0.6634000     3.445000  0.6301000     -0.6063000     0.9150000 
1 1 1 10 42 14 o 4.137000  0.3556000     4.080000  0.5180000     4.194000  0.4875000     -0.1131000     0.7113000 
1 1 1 10 42 15 o 1.990000  0.4824000     2.557000  0.7243000     1.422000  0.6374000     1.135000       0.9648000 
1 1 1 10 42 16 o 1.184000  0.3955000     1.329000  0.6064000     1.039000  0.5080000     0.2900000      0.7911000 
1 1 1 10 42 17 o 3.673000  0.4030000     4.395000  0.4628000     2.950000  0.6599000     1.444000       0.8061000 
1 1 1 10 42 18 o 2.977000  0.4638000     2.954000  0.6493000     3.001000  0.6624000     -0.4708000E-01 0.9276000 
1 1 1 10 42 19 o 2.088000  0.4464000     1.335000  0.6242000     2.842000  0.6383000     -1.506000      0.8928000 
1 1 1 10 42 20 o 1.480000  0.4514000     1.454000  0.6324000     1.507000  0.6443000     -0.5237000E-01 0.9028000 
1 1 1 10 43 0  o 14.18000  0.2526000     14.18000  0.2526000     14.18000  0.2526000     -0.000000      0.000000  
1 1 1 10 43 1  o 3.853000  0.3050000     3.589000  0.4595000     4.117000  0.4012000     -0.5274000     0.6100000 
1 1 1 10 43 2  o 10.61000  0.1768000     10.55000  0.2501000     10.68000  0.2500000     -0.1305000     0.3536000 
1 1 1 10 43 3  o 3.749000  0.3162000     3.639000  0.4614000     3.858000  0.4323000     -0.2184000     0.6323000 
1 1 1 10 43 4  o 7.341000  0.2050000     7.083000  0.2986000     7.599000  0.2809000     -0.5157000     0.4099000 
1 1 1 10 43 5  o 7.764000  0.2180000     7.638000  0.3296000     7.891000  0.2854000     -0.2525000     0.4360000 
1 1 1 10 43 6  o 13.89000  0.2019000     13.95000  0.3049000     13.84000  0.2649000     0.1150000      0.4039000 
1 1 1 10 43 7  o 9.244000  0.1984000     9.324000  0.2781000     9.164000  0.2831000     0.1599000      0.3968000 
1 1 1 10 43 8  o 4.978000  0.3109000     4.529000  0.4460000     5.427000  0.4332000     -0.8987000     0.6218000 
1 1 1 10 43 9  o 5.972000  0.3399000     5.848000  0.5344000     6.096000  0.4201000     -0.2481000     0.6797000 
1 1 1 10 43 10 o 2.804000  0.6151000     2.615000  0.6997000     2.993000  1.012000      -0.3781000     1.230000  
1 1 1 10 43 11 o 6.358000  0.2912000     5.926000  0.4558000     6.790000  0.3626000     -0.8635000     0.5824000 
1 1 1 10 43 12 o 1.172000  0.3953000     1.089000  0.5255000     1.254000  0.5906000     -0.1647000     0.7905000 
1 1 1 10 43 13 o 2.482000  0.4880000     2.959000  0.6447000     2.006000  0.7327000     0.9533000      0.9760000 
1 1 1 10 43 14 o 3.105000  0.4590000     2.911000  0.6714000     3.299000  0.6260000     -0.3874000     0.9180000 
1 1 1 10 43 15 o 1.751000  0.4980000     1.725000  0.6974000     1.778000  0.7110000     -0.5265000E-01 0.9959000 
1 1 1 10 43 16 o 2.457000  0.4892000     2.909000  0.6623000     2.004000  0.7201000     0.9045000      0.9784000 
1 1 1 10 43 17 o 1.901000  0.5483000     2.380000  0.8795000     1.421000  0.6550000     0.9591000      1.097000  
1 1 1 10 43 18 o 1.428000  0.4713000     1.316000  0.6088000     1.540000  0.7195000     -0.2249000     0.9425000 
1 1 1 10 43 19 o 1.594000  0.4545000     1.279000  0.5875000     1.909000  0.6935000     -0.6301000     0.9089000 
1 1 1 10 43 20 o 1.527000  0.4523000     1.606000  0.6537000     1.448000  0.6252000     0.1572000      0.9046000 
1 1 1 10 44 0  o 4.443000  0.4045000     4.443000  0.4045000     4.443000  0.4045000     0.000000       0.000000  
1 1 1 10 44 1  o 7.361000  0.2014000     7.321000  0.2865000     7.401000  0.2832000     -0.8041000E-01 0.4028000 
1 1 1 10 44 2  f 9.567000  0.1842000     9.690000  0.2595000     9.445000  0.2615000     0.2451000      0.3684000 
1 1 1 10 44 3  o 5.866000  0.2324000     6.241000  0.3108000     5.490000  0.3457000     0.7515000      0.4649000 
1 1 1 10 44 4  o 7.049000  0.2274000     7.105000  0.3407000     6.993000  0.3013000     0.1123000      0.4549000 
1 1 1 10 44 5  o 2.999000  0.4542000     3.064000  0.6805000     2.933000  0.6019000     0.1310000      0.9085000 
1 1 1 10 44 6  o 1.716000  0.4888000     1.926000  0.7325000     1.506000  0.6473000     0.4206000      0.9776000 
1 1 1 10 44 7  o 3.284000  0.4216000     3.688000  0.5331000     2.880000  0.6533000     0.8074000      0.8432000 
1 1 1 10 44 8  o 7.789000  0.2945000     7.568000  0.4778000     8.011000  0.3443000     -0.4427000     0.5890000 
1 1 1 10 44 9  o 4.467000  0.4603000     4.467000  0.4603000     ?         ?             ?              ?         
1 1 1 10 44 10 o 7.613000  0.2785000     7.450000  0.4449000     7.776000  0.3350000     -0.3260000     0.5570000 
1 1 1 10 44 11 o 1.407000  0.4456000     1.221000  0.5713000     1.593000  0.6841000     -0.3719000     0.8912000 
1 1 1 10 44 12 o 1.845000  0.4939000     1.562000  0.6564000     2.128000  0.7381000     -0.5653000     0.9878000 
1 1 1 10 44 13 o 1.808000  0.5001000     1.791000  0.7048000     1.825000  0.7098000     -0.3415000E-01 1.000000  
1 1 1 10 44 14 o 1.804000  0.5006000     1.670000  0.6877000     1.937000  0.7277000     -0.2667000     1.001000  
1 1 1 10 44 15 o 1.669000  0.4846000     1.464000  0.6426000     1.873000  0.7255000     -0.4095000     0.9692000 
1 1 1 10 44 16 o 1.873000  0.4927000     2.132000  0.7136000     1.615000  0.6795000     0.5167000      0.9854000 
1 1 1 10 44 17 o 2.647000  0.5200000     3.040000  0.6378000     2.255000  0.8215000     0.7848000      1.040000  
1 1 1 10 44 18 o 1.577000  0.4932000     1.806000  0.7760000     1.348000  0.6089000     0.4577000      0.9864000 
1 1 1 10 44 19 o 1.601000  0.4465000     1.165000  0.5521000     2.037000  0.7019000     -0.8722000     0.8930000 
1 1 1 10 44 20 o 1.673000  0.4762000     1.304000  0.6045000     2.043000  0.7359000     -0.7385000     0.9523000 
1 1 1 10 45 0  o 3.363000  0.5583000     3.363000  0.5583000     3.363000  0.5583000     0.000000       0.000000  
1 1 1 10 45 1  o 7.046000  0.2107000     7.030000  0.2984000     7.061000  0.2975000     -0.3189000E-01 0.4214000 
1 1 1 10 45 2  o 8.467000  0.1963000     8.404000  0.2771000     8.531000  0.2781000     -0.1276000     0.3926000 
1 1 1 10 45 3  o 11.04000  0.1863000     10.99000  0.2658000     11.09000  0.2611000     -0.1001000     0.3725000 
1 1 1 10 45 4  o 6.592000  0.2447000     6.288000  0.3778000     6.895000  0.3111000     -0.6067000     0.4894000 
1 1 1 10 45 5  o 5.099000  0.2957000     5.623000  0.4071000     4.576000  0.4289000     1.047000       0.5913000 
1 1 1 10 45 6  o 6.318000  0.2625000     6.404000  0.3955000     6.232000  0.3453000     0.1718000      0.5250000 
1 1 1 10 45 7  o 6.089000  0.3502000     5.315000  0.6174000     6.863000  0.3308000     -1.548000      0.7004000 
1 1 1 10 45 8  o 8.677000  0.3388000     8.551000  0.3045000     8.802000  0.6053000     -0.2502000     0.6775000 
1 1 1 10 45 9  f 9.168000  0.2988000     9.086000  0.4133000     9.249000  0.4318000     -0.1630000     0.5977000 
1 1 1 10 45 10 o 2.634000  0.4861000     2.045000  0.7125000     3.224000  0.6616000     -1.178000      0.9723000 
1 1 1 10 45 11 o 3.133000  0.4495000     2.999000  0.6302000     3.267000  0.6411000     -0.2682000     0.8990000 
1 1 1 10 45 12 o 1.776000  0.4837000     1.400000  0.6290000     2.152000  0.7351000     -0.7512000     0.9675000 
1 1 1 10 45 13 o 1.515000  0.4555000     1.808000  0.7048000     1.222000  0.5770000     0.5864000      0.9109000 
1 1 1 10 45 14 o 1.585000  0.4659000     1.318000  0.6044000     1.852000  0.7091000     -0.5338000     0.9318000 
1 1 1 10 45 15 o 3.387000  0.4267000     3.569000  0.5832000     3.205000  0.6230000     0.3643000      0.8534000 
1 1 1 10 45 16 o 1.507000  0.4842000     1.620000  0.7423000     1.394000  0.6219000     0.2259000      0.9684000 
1 1 1 10 45 17 o 2.509000  0.4782000     3.309000  0.5698000     1.708000  0.7682000     1.601000       0.9564000 
1 1 1 10 45 18 o 3.823000  0.3666000     4.074000  0.4824000     3.572000  0.5522000     0.5020000      0.7333000 
1 1 1 10 45 19 o 1.429000  0.4398000     1.276000  0.5858000     1.583000  0.6561000     -0.3072000     0.8796000 
1 1 1 10 46 0  o 9.210000  0.2752000     9.210000  0.2752000     9.210000  0.2752000     -0.000000      0.000000  
1 1 1 10 46 1  o 7.372000  0.2136000     7.364000  0.3022000     7.380000  0.3021000     -0.1596000E-01 0.4273000 
1 1 1 10 46 2  o 6.566000  0.2281000     6.736000  0.3166000     6.396000  0.3284000     0.3405000      0.4561000 
1 1 1 10 46 3  o 7.597000  0.2132000     7.306000  0.3054000     7.889000  0.2976000     -0.5839000     0.4264000 
1 1 1 10 46 4  o 1.632000  0.4684000     2.019000  0.7390000     1.245000  0.5757000     0.7736000      0.9368000 
1 1 1 10 46 5  o 5.073000  0.3044000     5.133000  0.4539000     5.013000  0.4057000     0.1205000      0.6088000 
1 1 1 10 46 6  o 6.389000  0.3123000     6.352000  0.5186000     6.426000  0.3482000     -0.7350000E-01 0.6246000 
1 1 1 10 46 7  o 4.238000  0.4930000     4.238000  0.4930000     ?         ?             ?              ?         
1 1 1 10 46 8  o 2.424000  0.6102000     2.390000  0.8460000     2.458000  0.8795000     -0.6850000E-01 1.220000  
1 1 1 10 46 9  o 1.916000  0.5141000     1.697000  0.6810000     2.135000  0.7704000     -0.4385000     1.028000  
1 1 1 10 46 10 o 1.555000  0.4703000     1.571000  0.6578000     1.539000  0.6724000     0.3269000E-01  0.9407000 
1 1 1 10 46 11 o 1.484000  0.4584000     1.486000  0.6442000     1.481000  0.6522000     0.5495000E-02  0.9167000 
1 1 1 10 46 12 o 1.776000  0.4649000     1.258000  0.5863000     2.294000  0.7215000     -1.035000      0.9297000 
1 1 1 10 46 13 o 2.381000  0.5111000     2.641000  0.7246000     2.120000  0.7209000     0.5215000      1.022000  
1 1 1 10 46 14 o 1.856000  0.4530000     1.146000  0.5492000     2.566000  0.7206000     -1.419000      0.9060000 
1 1 1 10 46 15 o 1.950000  0.5026000     1.819000  0.7079000     2.080000  0.7136000     -0.2614000     1.005000  
1 1 1 10 46 16 o 1.919000  0.5142000     1.338000  0.6122000     2.500000  0.8263000     -1.163000      1.028000  
1 1 1 10 46 17 o 2.624000  0.5269000     2.211000  0.8268000     3.036000  0.6533000     -0.8255000     1.054000  
1 1 1 10 46 18 o 1.114000  0.3771000     1.137000  0.5432000     1.091000  0.5233000     0.4569000E-01  0.7543000 
1 1 1 10 46 19 f 1.278000  0.4122000     1.422000  0.6224000     1.134000  0.5406000     0.2880000      0.8244000 
1 1 1 10 47 0  f 1.072000  0.6888000     1.072000  0.6888000     1.072000  0.6888000     -0.000000      0.000000  
1 1 1 10 47 1  o 1.588000  0.4603000     1.367000  0.6122000     1.809000  0.6874000     -0.4416000     0.9205000 
1 1 1 10 47 2  o 3.777000  0.3508000     3.599000  0.5149000     3.956000  0.4767000     -0.3571000     0.7017000 
1 1 1 10 47 3  o 7.093000  0.2264000     7.347000  0.3124000     6.839000  0.3277000     0.5081000      0.4528000 
1 1 1 10 47 4  o 4.894000  0.3765000     4.628000  0.6449000     5.160000  0.3886000     -0.5319000     0.7530000 
1 1 1 10 47 5  o 10.11000  0.3703000     10.20000  0.6230000     10.02000  0.4002000     0.1854000      0.7405000 
1 1 1 10 47 6  o 2.640000  0.7265000     2.640000  0.7265000     ?         ?             ?              ?         
1 1 1 10 47 7  f 8.259000  0.2702000     8.048000  0.4355000     8.470000  0.3199000     -0.4215000     0.5403000 
1 1 1 10 47 8  f 5.881000  0.2777000     5.475000  0.3822000     6.288000  0.4030000     -0.8128000     0.5554000 
1 1 1 10 47 9  o 2.038000  0.5233000     2.086000  0.7096000     1.990000  0.7693000     0.9671000E-01  1.047000  
1 1 1 10 47 10 o 1.888000  0.4765000     1.322000  0.5994000     2.453000  0.7409000     -1.131000      0.9530000 
1 1 1 10 47 11 o 2.892000  0.4692000     3.059000  0.6351000     2.726000  0.6908000     0.3326000      0.9384000 
1 1 1 10 47 12 o 2.844000  0.4610000     3.590000  0.5677000     2.098000  0.7265000     1.492000       0.9220000 
1 1 1 10 47 13 o 3.796000  0.3861000     3.796000  0.5453000     3.795000  0.5467000     0.1601000E-02  0.7722000 
1 1 1 10 47 14 o 3.600000  0.4116000     3.135000  0.6489000     4.064000  0.5065000     -0.9292000     0.8232000 
1 1 1 10 47 15 o 2.741000  0.5613000     2.851000  0.8842000     2.631000  0.6915000     0.2202000      1.123000  
1 1 1 10 47 16 o 2.160000  0.5713000     1.668000  0.6873000     2.652000  0.9129000     -0.9838000     1.143000  
1 1 1 10 47 17 o 1.165000  0.3911000     1.113000  0.5339000     1.216000  0.5716000     -0.1029000     0.7822000 
1 1 1 10 47 18 o 1.908000  0.4935000     1.747000  0.6832000     2.069000  0.7123000     -0.3218000     0.9869000 
1 1 1 10 48 0  o 5.865000  0.3652000     5.865000  0.3652000     5.865000  0.3652000     -0.000000      0.000000  
1 1 1 10 48 1  o 4.228000  0.3376000     4.351000  0.4621000     4.106000  0.4922000     0.2453000      0.6751000 
1 1 1 10 48 2  f 9.132000  0.2236000     9.159000  0.3403000     9.106000  0.2900000     0.5294000E-01  0.4471000 
1 1 1 10 48 3  o 8.377000  0.2840000     8.450000  0.4414000     8.304000  0.3574000     0.1460000      0.5680000 
1 1 1 10 48 4  o 8.159000  0.4407000     8.159000  0.4407000     ?         ?             ?              ?         
1 1 1 10 48 5  o 1.872000  0.5578000     1.585000  0.7109000     2.159000  0.8597000     -0.5735000     1.116000  
1 1 1 10 48 6  o 6.183000  0.3158000     5.942000  0.5205000     6.425000  0.3577000     -0.4822000     0.6316000 
1 1 1 10 48 7  o 5.499000  0.2776000     5.688000  0.3643000     5.310000  0.4190000     0.3784000      0.5553000 
1 1 1 10 48 8  o 7.184000  0.2474000     6.970000  0.3257000     7.398000  0.3726000     -0.4271000     0.4949000 
1 1 1 10 48 9  o 4.411000  0.3595000     3.623000  0.5557000     5.200000  0.4563000     -1.576000      0.7190000 
1 1 1 10 48 10 o 3.203000  0.4427000     3.154000  0.6307000     3.252000  0.6214000     -0.9810000E-01 0.8854000 
1 1 1 10 48 11 o 4.926000  0.3018000     5.286000  0.3946000     4.567000  0.4567000     0.7195000      0.6035000 
1 1 1 10 48 12 f 2.045000  0.5120000     1.847000  0.7162000     2.243000  0.7319000     -0.3959000     1.024000  
1 1 1 10 48 13 o 2.025000  0.5071000     2.245000  0.7265000     1.805000  0.7076000     0.4392000      1.014000  
1 1 1 10 48 14 o 2.945000  0.4490000     2.864000  0.6503000     3.025000  0.6193000     -0.1610000     0.8980000 
1 1 1 10 48 15 o 1.830000  0.4862000     2.294000  0.7290000     1.366000  0.6436000     0.9283000      0.9724000 
1 1 1 10 48 16 o 1.929000  0.5292000     2.012000  0.7947000     1.845000  0.6992000     0.1662000      1.058000  
1 1 1 10 48 17 o 1.498000  0.4586000     1.422000  0.6300000     1.574000  0.6666000     -0.1514000     0.9172000 
1 1 1 10 48 18 o 1.315000  0.4241000     1.364000  0.6148000     1.267000  0.5842000     0.9663000E-01  0.8481000 
1 1 1 10 49 0  o 1.922000  1.114000      1.922000  1.114000      1.922000  1.114000      0.000000       0.000000  
1 1 1 10 49 1  o 6.799000  0.6894000     6.799000  0.6894000     ?         ?             ?              ?         
1 1 1 10 49 2  o 5.913000  0.7307000     5.913000  0.7307000     ?         ?             ?              ?         
1 1 1 10 49 3  o 5.771000  0.4627000     5.941000  0.5007000     5.601000  0.7782000     0.3394000      0.9254000 
1 1 1 10 49 4  o 4.229000  0.3955000     4.537000  0.6047000     3.920000  0.5098000     0.6170000      0.7909000 
1 1 1 10 49 5  o 4.312000  0.3920000     3.602000  0.6577000     5.021000  0.4268000     -1.419000      0.7840000 
1 1 1 10 49 6  o 2.180000  0.5028000     2.288000  0.6992000     2.072000  0.7227000     0.2164000      1.006000  
1 1 1 10 49 7  o 5.111000  0.2971000     5.499000  0.3727000     4.723000  0.4628000     0.7760000      0.5942000 
1 1 1 10 49 8  o 1.829000  0.5127000     1.874000  0.7034000     1.783000  0.7461000     0.9084000E-01  1.025000  
1 1 1 10 49 9  f 2.805000  0.5077000     2.371000  0.7262000     3.239000  0.7098000     -0.8683000     1.015000  
1 1 1 10 49 10 o 3.171000  0.4546000     2.980000  0.6676000     3.362000  0.6173000     -0.3816000     0.9092000 
1 1 1 10 49 11 o 3.891000  0.3865000     4.435000  0.4736000     3.346000  0.6109000     1.088000       0.7730000 
1 1 1 10 49 12 o 2.401000  0.5022000     2.687000  0.6945000     2.115000  0.7255000     0.5718000      1.004000  
1 1 1 10 49 13 o 2.200000  0.4983000     1.916000  0.7020000     2.483000  0.7073000     -0.5669000     0.9966000 
1 1 1 10 49 14 o 1.763000  0.5352000     1.922000  0.8193000     1.603000  0.6889000     0.3184000      1.070000  
1 1 1 10 49 15 o 2.492000  0.5654000     2.697000  0.7158000     2.288000  0.8753000     0.4098000      1.131000  
1 1 1 10 49 16 o 2.737000  0.4821000     2.638000  0.7099000     2.836000  0.6525000     -0.1988000     0.9642000 
1 1 1 10 49 17 o 1.183000  0.3950000     1.234000  0.5769000     1.132000  0.5396000     0.1025000      0.7899000 
1 1 1 10 50 0  o 1.072000  0.7137000     1.072000  0.7137000     1.072000  0.7137000     0.000000       0.000000  
1 1 1 10 50 1  o 3.539000  0.4215000     3.778000  0.6043000     3.299000  0.5877000     0.4781000      0.8430000 
1 1 1 10 50 2  o 6.147000  0.2546000     6.004000  0.3698000     6.289000  0.3500000     -0.2849000     0.5092000 
1 1 1 10 50 3  f 5.872000  0.2822000     5.995000  0.4233000     5.748000  0.3733000     0.2473000      0.5644000 
1 1 1 10 50 4  o 5.161000  0.3101000     5.134000  0.4664000     5.187000  0.4088000     -0.5330000E-01 0.6202000 
1 1 1 10 50 5  o 2.111000  0.5322000     1.938000  0.7606000     2.285000  0.7447000     -0.3467000     1.064000  
1 1 1 10 50 6  o 5.423000  0.2774000     5.454000  0.3796000     5.393000  0.4047000     0.6044000E-01  0.5549000 
1 1 1 10 50 7  o 2.146000  0.5048000     1.894000  0.6948000     2.397000  0.7325000     -0.5031000     1.010000  
1 1 1 10 50 8  o 3.601000  0.4345000     3.186000  0.6301000     4.016000  0.5985000     -0.8305000     0.8691000 
1 1 1 10 50 9  o 1.939000  0.5220000     2.029000  0.7332000     1.849000  0.7431000     0.1800000      1.044000  
1 1 1 10 50 10 o 1.932000  0.5149000     2.187000  0.7529000     1.678000  0.7026000     0.5087000      1.030000  
1 1 1 10 50 11 o 1.314000  0.4229000     1.599000  0.6793000     1.029000  0.5040000     0.5700000      0.8458000 
1 1 1 10 50 12 o 5.014000  0.3039000     5.147000  0.4151000     4.881000  0.4440000     0.2662000      0.6078000 
1 1 1 10 50 13 o 1.566000  0.4826000     1.752000  0.7435000     1.380000  0.6154000     0.3713000      0.9651000 
1 1 1 10 50 14 o 1.422000  0.4689000     1.350000  0.6131000     1.494000  0.7097000     -0.1448000     0.9378000 
1 1 1 10 50 15 o 1.512000  0.4742000     1.421000  0.6665000     1.602000  0.6747000     -0.1810000     0.9484000 
1 1 1 10 50 16 o 1.416000  0.4335000     1.731000  0.6868000     1.102000  0.5293000     0.6296000      0.8671000 
1 1 1 10 50 17 o 2.441000  0.5101000     2.662000  0.7097000     2.220000  0.7329000     0.4420000      1.020000  
1 1 1 10 51 0  o 1.118000  0.7147000     1.118000  0.7147000     1.118000  0.7147000     0.000000       0.000000  
1 1 1 10 51 1  o 3.204000  0.4375000     3.132000  0.6412000     3.276000  0.5953000     -0.1440000     0.8750000 
1 1 1 10 51 2  o 2.001000  0.4619000     2.648000  0.6883000     1.353000  0.6162000     1.295000       0.9239000 
1 1 1 10 51 3  o 3.690000  0.4144000     3.992000  0.5826000     3.388000  0.5895000     0.6037000      0.8288000 
1 1 1 10 51 4  o 4.842000  0.3333000     4.937000  0.5037000     4.746000  0.4367000     0.1908000      0.6667000 
1 1 1 10 51 5  o 2.209000  0.4820000     2.740000  0.6742000     1.678000  0.6890000     1.062000       0.9640000 
1 1 1 10 51 6  o 3.779000  0.3885000     4.269000  0.4627000     3.290000  0.6242000     0.9797000      0.7770000 
1 1 1 10 51 7  o 2.650000  0.4911000     2.377000  0.7153000     2.923000  0.6730000     -0.5462000     0.9821000 
1 1 1 10 51 8  o 3.829000  0.4084000     3.708000  0.5660000     3.950000  0.5889000     -0.2421000     0.8168000 
1 1 1 10 51 9  o 4.321000  0.3806000     4.750000  0.4622000     3.892000  0.6047000     0.8588000      0.7611000 
1 1 1 10 51 10 o 2.412000  0.5092000     2.764000  0.7063000     2.059000  0.7336000     0.7048000      1.018000  
1 1 1 10 51 11 o 3.196000  0.4465000     3.371000  0.6208000     3.020000  0.6419000     0.3507000      0.8930000 
1 1 1 10 51 12 o 2.202000  0.5035000     2.060000  0.7138000     2.345000  0.7103000     -0.2844000     1.007000  
1 1 1 10 51 13 f 1.613000  0.5039000     1.641000  0.7120000     1.585000  0.7132000     0.5641000E-01  1.008000  
1 1 1 10 51 14 o 2.199000  0.5914000     2.126000  0.8366000     2.273000  0.8362000     -0.1468000     1.183000  
1 1 1 10 51 15 f 1.329000  0.4288000     1.387000  0.6214000     1.272000  0.5910000     0.1151000      0.8575000 
1 1 1 10 51 16 o 1.394000  0.4392000     1.187000  0.5597000     1.601000  0.6768000     -0.4142000     0.8783000 
1 1 1 10 52 0  o 4.860000  0.4311000     4.860000  0.4311000     4.860000  0.4311000     0.000000       0.000000  
1 1 1 10 52 1  o 5.105000  0.2881000     5.040000  0.4047000     5.169000  0.4102000     -0.1294000     0.5763000 
1 1 1 10 52 2  o 1.535000  0.4631000     1.282000  0.5942000     1.787000  0.7105000     -0.5051000     0.9262000 
1 1 1 10 52 3  o 3.946000  0.3950000     4.001000  0.5942000     3.892000  0.5207000     0.1092000      0.7900000 
1 1 1 10 52 4  o 2.599000  0.5204000     3.089000  0.7404000     2.109000  0.7314000     0.9809000      1.041000  
1 1 1 10 52 5  o 4.883000  0.3047000     5.244000  0.3991000     4.522000  0.4605000     0.7220000      0.6094000 
1 1 1 10 52 6  o 5.922000  0.2594000     6.192000  0.3512000     5.651000  0.3817000     0.5419000      0.5187000 
1 1 1 10 52 7  o 6.135000  0.2651000     6.149000  0.3612000     6.122000  0.3881000     0.2686000E-01  0.5302000 
1 1 1 10 52 8  o 1.629000  0.4901000     1.484000  0.6542000     1.774000  0.7299000     -0.2897000     0.9801000 
1 1 1 10 52 9  o 3.567000  0.4486000     3.427000  0.6220000     3.706000  0.6466000     -0.2788000     0.8972000 
1 1 1 10 52 10 o 2.282000  0.5069000     2.587000  0.7330000     1.976000  0.7004000     0.6116000      1.014000  
1 1 1 10 52 11 o 2.837000  0.4800000     2.811000  0.6847000     2.864000  0.6730000     -0.5342000E-01 0.9601000 
1 1 1 10 52 12 o 2.605000  0.5854000     2.610000  0.9217000     2.600000  0.7220000     0.1038000E-01  1.171000  
1 1 1 10 52 13 o 1.202000  0.4181000     1.043000  0.5130000     1.361000  0.6604000     -0.3188000     0.8362000 
1 1 1 10 52 14 o 1.322000  0.4286000     1.149000  0.5600000     1.494000  0.6488000     -0.3449000     0.8571000 
1 1 1 10 52 15 o 1.718000  0.4724000     1.316000  0.6052000     2.120000  0.7254000     -0.8037000     0.9447000 
1 1 1 10 52 16 o 1.157000  0.3891000     1.143000  0.5447000     1.170000  0.5557000     -0.2665000E-01 0.7781000 
1 1 1 10 53 0  o 8.412000  0.3073000     8.412000  0.3073000     8.412000  0.3073000     0.000000       0.000000  
1 1 1 10 53 1  o 8.629000  0.2151000     8.466000  0.3038000     8.791000  0.3046000     -0.3247000     0.4302000 
1 1 1 10 53 2  o 1.445000  0.4479000     1.576000  0.6632000     1.314000  0.6022000     0.2624000      0.8958000 
1 1 1 10 53 3  o 2.571000  0.4951000     1.996000  0.7697000     3.146000  0.6230000     -1.150000      0.9902000 
1 1 1 10 53 4  o 1.528000  0.4702000     1.712000  0.7147000     1.345000  0.6112000     0.3663000      0.9404000 
1 1 1 10 53 5  o 1.849000  0.4998000     1.942000  0.7156000     1.756000  0.6978000     0.1862000      0.9995000 
1 1 1 10 53 6  o 1.906000  0.5074000     1.821000  0.7063000     1.991000  0.7285000     -0.1695000     1.015000  
1 1 1 10 53 7  o 6.850000  0.2469000     6.655000  0.3485000     7.045000  0.3499000     -0.3903000     0.4938000 
1 1 1 10 53 8  o 1.698000  0.5021000     1.432000  0.6413000     1.965000  0.7728000     -0.5326000     1.004000  
1 1 1 10 53 9  o 1.762000  0.5089000     1.545000  0.6689000     1.980000  0.7670000     -0.4355000     1.018000  
1 1 1 10 53 10 o 1.840000  0.4956000     1.593000  0.6685000     2.086000  0.7318000     -0.4929000     0.9912000 
1 1 1 10 53 11 o 1.825000  0.5252000     1.663000  0.7524000     1.986000  0.7330000     -0.3222000     1.050000  
1 1 1 10 53 12 o 3.303000  0.5551000     4.114000  0.4981000     2.492000  0.9921000     1.622000       1.110000  
1 1 1 10 53 13 o 1.305000  0.4387000     1.574000  0.7142000     1.036000  0.5099000     0.5375000      0.8775000 
1 1 1 10 53 14 o 1.507000  0.4542000     1.736000  0.6899000     1.278000  0.5909000     0.4577000      0.9083000 
1 1 1 10 53 15 o 2.352000  0.5008000     2.753000  0.6914000     1.952000  0.7248000     0.8016000      1.002000  
1 1 1 10 54 0  o 8.158000  0.3104000     8.158000  0.3104000     8.158000  0.3104000     0.000000       0.000000  
1 1 1 10 54 1  o 2.081000  0.4901000     2.534000  0.7110000     1.628000  0.6747000     0.9064000      0.9802000 
1 1 1 10 54 2  o 1.832000  0.5040000     1.840000  0.7184000     1.824000  0.7071000     0.1620000E-01  1.008000  
1 1 1 10 54 3  o 2.533000  0.5304000     2.922000  0.7609000     2.144000  0.7391000     0.7776000      1.061000  
1 1 1 10 54 4  o 2.841000  0.5063000     2.606000  0.7678000     3.076000  0.6602000     -0.4702000     1.013000  
1 1 1 10 54 5  o 3.223000  0.4525000     2.685000  0.7156000     3.762000  0.5541000     -1.077000      0.9051000 
1 1 1 10 54 6  o 2.013000  0.5161000     1.959000  0.7203000     2.066000  0.7392000     -0.1074000     1.032000  
1 1 1 10 54 7  f 2.002000  0.5319000     1.953000  0.7319000     2.051000  0.7721000     -0.9848000E-01 1.064000  
1 1 1 10 54 8  o 2.577000  0.5375000     2.780000  0.7202000     2.373000  0.7980000     0.4071000      1.075000  
1 1 1 10 54 9  f 1.449000  0.4533000     1.673000  0.6921000     1.225000  0.5855000     0.4483000      0.9066000 
1 1 1 10 54 10 o 2.043000  0.5344000     1.913000  0.7815000     2.173000  0.7291000     -0.2603000     1.069000  
1 1 1 10 54 11 o 2.283000  0.5402000     2.777000  0.7081000     1.789000  0.8160000     0.9889000      1.080000  
1 1 1 10 54 12 o 2.092000  0.5310000     2.814000  0.8453000     1.370000  0.6430000     1.443000       1.062000  
1 1 1 10 54 13 f 3.454000  0.4333000     4.259000  0.4969000     2.649000  0.7101000     1.610000       0.8667000 
1 1 1 10 54 14 o 1.327000  0.4261000     1.145000  0.5486000     1.508000  0.6521000     -0.3630000     0.8522000 
1 1 1 10 54 15 o 2.158000  0.5047000     2.257000  0.7084000     2.059000  0.7190000     0.1982000      1.009000  
1 1 1 10 55 0  o 0.8352000 0.5816000     0.8352000 0.5816000     0.8352000 0.5816000     -0.000000      0.000000  
1 1 1 10 55 1  o 3.089000  0.4523000     3.292000  0.6099000     2.886000  0.6681000     0.4058000      0.9047000 
1 1 1 10 55 2  o 2.663000  0.4918000     1.936000  0.7709000     3.390000  0.6110000     -1.454000      0.9837000 
1 1 1 10 55 3  o 1.512000  0.4733000     1.668000  0.7151000     1.357000  0.6204000     0.3116000      0.9467000 
1 1 1 10 55 4  o 4.801000  0.3418000     4.801000  0.5130000     4.802000  0.4519000     -0.8712000E-03 0.6837000 
1 1 1 10 55 5  o 4.055000  0.3572000     4.204000  0.4843000     3.905000  0.5252000     0.2986000      0.7144000 
1 1 1 10 55 6  o 2.131000  0.5247000     2.279000  0.7453000     1.983000  0.7388000     0.2959000      1.049000  
1 1 1 10 55 7  o 3.293000  0.4605000     4.346000  0.4767000     2.240000  0.7881000     2.105000       0.9211000 
1 1 1 10 55 8  o 1.376000  0.4486000     1.078000  0.5255000     1.674000  0.7272000     -0.5955000     0.8972000 
1 1 1 10 55 9  f 1.934000  0.5036000     2.676000  0.8321000     1.191000  0.5677000     1.485000       1.007000  
1 1 1 10 55 10 o 1.304000  0.4521000     1.132000  0.5537000     1.476000  0.7147000     -0.3447000     0.9041000 
1 1 1 10 55 11 o 1.679000  0.5173000     1.526000  0.6998000     1.832000  0.7620000     -0.3068000     1.035000  
1 1 1 10 55 12 f 2.505000  0.4778000     3.130000  0.6279000     1.880000  0.7205000     1.249000       0.9557000 
1 1 1 10 55 13 o 1.921000  0.4886000     2.334000  0.7301000     1.508000  0.6494000     0.8258000      0.9772000 
1 1 1 10 55 14 o 1.540000  0.4552000     1.819000  0.6948000     1.261000  0.5881000     0.5577000      0.9103000 
1 1 1 10 56 0  o 1.048000  0.6890000     1.048000  0.6890000     1.048000  0.6890000     -0.000000      0.000000  
1 1 1 10 56 1  o 5.028000  0.3033000     4.940000  0.4424000     5.115000  0.4151000     -0.1746000     0.6067000 
1 1 1 10 56 2  o 1.952000  0.5101000     1.653000  0.7091000     2.251000  0.7336000     -0.5975000     1.020000  
1 1 1 10 56 3  o 2.744000  0.5244000     2.690000  0.7873000     2.798000  0.6930000     -0.1077000     1.049000  
1 1 1 10 56 4  o 3.821000  0.3805000     3.597000  0.5690000     4.045000  0.5051000     -0.4474000     0.7609000 
1 1 1 10 56 5  o 4.981000  0.3072000     5.395000  0.4107000     4.566000  0.4569000     0.8289000      0.6144000 
1 1 1 10 56 6  o 2.822000  0.4899000     2.423000  0.7265000     3.222000  0.6573000     -0.7990000     0.9797000 
1 1 1 10 56 7  o 1.792000  0.5079000     1.904000  0.7114000     1.680000  0.7252000     0.2240000      1.016000  
1 1 1 10 56 8  o 3.580000  0.5052000     4.663000  0.5712000     2.497000  0.8335000     2.166000       1.010000  
1 1 1 10 56 9  o 3.083000  0.5949000     3.774000  0.6822000     2.392000  0.9748000     1.382000       1.190000  
1 1 1 10 56 10 o 2.268000  0.5945000     2.525000  0.8787000     2.012000  0.8010000     0.5136000      1.189000  
1 1 1 10 56 11 o 2.619000  0.5103000     2.415000  0.7514000     2.823000  0.6907000     -0.4082000     1.021000  
1 1 1 10 56 12 o 2.438000  0.4754000     1.777000  0.7023000     3.098000  0.6408000     -1.320000      0.9507000 
1 1 1 10 56 13 o 1.828000  0.4846000     2.190000  0.7253000     1.467000  0.6428000     0.7233000      0.9692000 
1 1 1 10 56 14 o 2.036000  0.6540000     2.229000  0.9764000     1.842000  0.8702000     0.3873000      1.308000  
1 1 1 10 57 0  f 5.566000  0.4045000     5.566000  0.4045000     5.566000  0.4045000     0.000000       0.000000  
1 1 1 10 57 1  o 3.907000  0.4008000     3.228000  0.6591000     4.586000  0.4564000     -1.358000      0.8017000 
1 1 1 10 57 2  o 2.253000  0.5255000     1.891000  0.7657000     2.614000  0.7199000     -0.7235000     1.051000  
1 1 1 10 57 3  o 1.328000  0.4355000     1.283000  0.6092000     1.374000  0.6225000     -0.9028000E-01 0.8710000 
1 1 1 10 57 4  o 1.572000  0.4659000     1.331000  0.6090000     1.813000  0.7052000     -0.4816000     0.9317000 
1 1 1 10 57 5  o 1.435000  0.4504000     1.468000  0.6470000     1.402000  0.6267000     0.6546000E-01  0.9008000 
1 1 1 10 57 6  o 4.652000  0.3221000     4.509000  0.4621000     4.795000  0.4487000     -0.2854000     0.6441000 
1 1 1 10 57 7  o 1.627000  0.5136000     1.659000  0.7490000     1.594000  0.7029000     0.6418000E-01  1.027000  
1 1 1 10 57 8  o 3.012000  0.6598000     2.825000  0.7764000     3.199000  1.067000      -0.3742000     1.320000  
1 1 1 10 57 9  o 1.693000  0.5285000     1.751000  0.7694000     1.635000  0.7246000     0.1163000      1.057000  
1 1 1 10 57 10 o 2.392000  0.5345000     2.190000  0.7895000     2.595000  0.7208000     -0.4050000     1.069000  
1 1 1 10 57 11 o 1.439000  0.4444000     1.100000  0.5333000     1.777000  0.7110000     -0.6772000     0.8888000 
1 1 1 10 57 12 o 1.551000  0.4700000     1.483000  0.6460000     1.620000  0.6827000     -0.1374000     0.9399000 
1 1 1 10 57 13 o 1.465000  0.4562000     1.385000  0.6264000     1.544000  0.6634000     -0.1597000     0.9124000 
1 1 1 10 58 0  o 0.8389000 0.5856000     0.8389000 0.5856000     0.8389000 0.5856000     -0.000000      0.000000  
1 1 1 10 58 1  o 3.875000  0.3904000     4.197000  0.5192000     3.554000  0.5832000     0.6436000      0.7808000 
1 1 1 10 58 2  o 6.555000  0.2822000     6.551000  0.4252000     6.559000  0.3712000     -0.8478000E-02 0.5644000 
1 1 1 10 58 3  o 4.802000  0.3500000     5.053000  0.5144000     4.550000  0.4748000     0.5024000      0.7000000 
1 1 1 10 58 4  o 2.473000  0.5084000     2.720000  0.7005000     2.225000  0.7370000     0.4943000      1.017000  
1 1 1 10 58 5  o 1.340000  0.4331000     1.215000  0.5741000     1.465000  0.6486000     -0.2498000     0.8662000 
1 1 1 10 58 6  o 2.061000  0.5719000     2.452000  0.8856000     1.670000  0.7240000     0.7822000      1.144000  
1 1 1 10 58 7  o 3.575000  0.6219000     3.575000  0.6219000     ?         ?             ?              ?         
1 1 1 10 58 8  o 1.856000  0.5492000     2.327000  0.8715000     1.385000  0.6685000     0.9425000      1.098000  
1 1 1 10 58 9  f 2.118000  0.5272000     2.009000  0.7391000     2.227000  0.7521000     -0.2175000     1.054000  
1 1 1 10 58 10 o 1.691000  0.4535000     1.088000  0.5293000     2.293000  0.7366000     -1.206000      0.9070000 
1 1 1 10 58 11 o 1.121000  0.3811000     0.8758000 0.4412000     1.367000  0.6215000     -0.4908000     0.7622000 
1 1 1 10 58 12 o 1.894000  0.4645000     2.524000  0.7153000     1.265000  0.5929000     1.260000       0.9291000 
1 1 1 10 59 0  f 1.807000  0.8820000     1.807000  0.8820000     1.807000  0.8820000     -0.000000      0.000000  
1 1 1 10 59 1  o 3.905000  0.4218000     3.830000  0.6509000     3.979000  0.5368000     -0.1489000     0.8437000 
1 1 1 10 59 2  o 1.589000  0.4718000     1.307000  0.6181000     1.871000  0.7130000     -0.5634000     0.9436000 
1 1 1 10 59 3  o 2.472000  0.5603000     3.211000  0.8702000     1.734000  0.7060000     1.478000       1.121000  
1 1 1 10 59 4  o 1.740000  0.5337000     2.211000  0.8789000     1.268000  0.6056000     0.9427000      1.067000  
1 1 1 10 59 5  o 2.265000  0.8144000     2.265000  0.8144000     ?         ?             ?              ?         
1 1 1 10 59 6  o 3.198000  0.5540000     4.542000  0.6666000     1.853000  0.8851000     2.689000       1.108000  
1 1 1 10 59 7  o 2.194000  0.5835000     2.271000  0.8607000     2.117000  0.7882000     0.1543000      1.167000  
1 1 1 10 59 8  o 1.578000  0.4771000     1.792000  0.7076000     1.363000  0.6402000     0.4290000      0.9542000 
1 1 1 10 59 9  o 2.283000  0.5138000     2.716000  0.7242000     1.849000  0.7291000     0.8673000      1.028000  
1 1 1 10 59 10 o 1.363000  0.4302000     1.048000  0.5156000     1.677000  0.6887000     -0.6286000     0.8603000 
1 1 1 10 59 11 o 2.877000  0.5008000     2.908000  0.7041000     2.845000  0.7124000     0.6301000E-01  1.002000  
1 1 1 10 60 0  o 1.783000  1.020000      1.783000  1.020000      1.783000  1.020000      0.000000       0.000000  
1 1 1 10 60 1  o 3.130000  0.6832000     2.512000  1.042000      3.747000  0.8837000     -1.235000      1.366000  
1 1 1 10 60 2  o 3.097000  0.8095000     3.096000  1.162000      3.098000  1.127000      -0.1540000E-02 1.619000  
1 1 1 10 60 3  f 4.097000  1.052000      4.097000  1.052000      ?         ?             ?              ?         
1 1 1 10 60 4  o 1.932000  0.6028000     1.178000  0.5817000     2.686000  1.056000      -1.508000      1.206000  
1 1 1 10 60 5  o 4.185000  0.4430000     4.233000  0.7064000     4.137000  0.5347000     0.9642000E-01  0.8860000 
1 1 1 10 60 6  o 2.531000  0.5324000     2.516000  0.7566000     2.545000  0.7493000     -0.2879000E-01 1.065000  
1 1 1 10 60 7  o 1.536000  0.4821000     1.411000  0.6309000     1.662000  0.7292000     -0.2512000     0.9643000 
1 1 1 10 60 8  o 4.328000  0.4259000     5.000000  0.4572000     3.655000  0.7187000     1.345000       0.8518000 
1 1 1 10 60 9  o 2.509000  0.5295000     2.647000  0.7384000     2.372000  0.7592000     0.2753000      1.059000  
1 1 1 10 60 10 f 2.109000  0.5268000     2.263000  0.7569000     1.955000  0.7328000     0.3078000      1.054000  
1 1 1 10 61 0  o 2.896000  1.051000      2.896000  1.051000      2.896000  1.051000      -0.000000      0.000000  
1 1 1 10 61 1  o 3.650000  0.6421000     3.955000  1.052000      3.345000  0.7366000     0.6097000      1.284000  
1 1 1 10 61 2  o 1.684000  0.4918000     1.209000  0.5857000     2.160000  0.7903000     -0.9514000     0.9836000 
1 1 1 10 61 3  o 1.817000  0.4902000     1.388000  0.6440000     2.247000  0.7391000     -0.8586000     0.9803000 
1 1 1 10 61 4  o 2.510000  0.5211000     2.647000  0.7271000     2.372000  0.7466000     0.2751000      1.042000  
1 1 1 10 61 5  o 2.488000  0.5056000     2.772000  0.6931000     2.204000  0.7364000     0.5673000      1.011000  
1 1 1 10 61 6  o 1.988000  0.4967000     2.426000  0.7266000     1.549000  0.6775000     0.8778000      0.9934000 
1 1 1 10 61 7  f 2.986000  0.5076000     2.762000  0.6928000     3.210000  0.7421000     -0.4484000     1.015000  
1 1 1 10 61 8  o 5.379000  0.3433000     5.571000  0.4280000     5.187000  0.5369000     0.3845000      0.6866000 
1 1 1 10 61 9  o 1.947000  0.5220000     2.115000  0.7568000     1.780000  0.7193000     0.3350000      1.044000  
1 1 1 10 62 0  o 3.258000  0.7335000     3.258000  0.7335000     3.258000  0.7335000     0.000000       0.000000  
1 1 1 10 62 1  o 1.812000  0.5080000     1.604000  0.7076000     2.021000  0.7289000     -0.4170000     1.016000  
1 1 1 10 62 2  o 4.516000  0.3730000     4.403000  0.5679000     4.629000  0.4838000     -0.2255000     0.7460000 
1 1 1 10 62 3  o 1.917000  0.5067000     2.296000  0.7580000     1.538000  0.6725000     0.7580000      1.013000  
1 1 1 10 62 4  o 1.815000  0.5001000     2.059000  0.7407000     1.571000  0.6720000     0.4886000      1.000000  
1 1 1 10 62 5  o 1.812000  0.5064000     1.981000  0.7408000     1.643000  0.6906000     0.3385000      1.013000  
1 1 1 10 62 6  o 1.706000  0.5051000     1.517000  0.6591000     1.896000  0.7656000     -0.3789000     1.010000  
1 1 1 10 62 7  o 4.965000  0.3617000     4.941000  0.4645000     4.990000  0.5546000     -0.4890000E-01 0.7234000 
1 1 1 10 62 8  o 1.272000  0.4243000     1.348000  0.6185000     1.197000  0.5809000     0.1507000      0.8485000 
1 1 1 10 63 0  o 1.068000  0.7148000     1.068000  0.7148000     1.068000  0.7148000     0.000000       0.000000  
1 1 1 10 63 1  o 2.077000  0.5379000     2.380000  0.8044000     1.774000  0.7143000     0.6057000      1.076000  
1 1 1 10 63 2  o 2.659000  0.5253000     2.294000  0.8020000     3.024000  0.6786000     -0.7303000     1.051000  
1 1 1 10 63 3  o 1.603000  0.4807000     1.387000  0.6307000     1.820000  0.7256000     -0.4332000     0.9614000 
1 1 1 10 63 4  o 1.142000  0.3892000     1.057000  0.5182000     1.227000  0.5808000     -0.1692000     0.7784000 
1 1 1 10 63 5  o 2.127000  0.5196000     1.815000  0.7169000     2.438000  0.7522000     -0.6236000     1.039000  
1 1 1 10 63 6  o 1.159000  0.3981000     1.181000  0.5658000     1.136000  0.5600000     0.4497000E-01  0.7961000 
1 1 1 10 63 7  o 2.312000  0.5588000     2.094000  0.7379000     2.531000  0.8394000     -0.4370000     1.118000  
1 1 1 10 64 0  o 3.978000  0.6814000     3.978000  0.6814000     3.978000  0.6814000     -0.000000      0.000000  
1 1 1 10 64 1  o 3.543000  0.4774000     3.120000  0.7763000     3.967000  0.5558000     -0.8465000     0.9547000 
1 1 1 10 64 2  o 1.958000  0.5196000     2.391000  0.8013000     1.525000  0.6616000     0.8659000      1.039000  
1 1 1 10 64 3  o 1.432000  0.4520000     1.557000  0.6694000     1.308000  0.6075000     0.2485000      0.9039000 
1 1 1 10 64 4  o 1.888000  0.5041000     1.523000  0.6735000     2.254000  0.7501000     -0.7305000     1.008000  
1 1 1 10 64 5  o 1.260000  0.4182000     1.339000  0.6154000     1.181000  0.5666000     0.1584000      0.8365000 
1 1 1 10 65 0  o 3.277000  0.8376000     3.277000  0.8376000     3.277000  0.8376000     0.000000       0.000000  
1 1 1 10 65 1  o 1.363000  0.4442000     1.215000  0.5875000     1.511000  0.6664000     -0.2958000     0.8883000 
1 1 1 10 65 2  o 1.686000  0.4956000     1.836000  0.7326000     1.537000  0.6675000     0.2994000      0.9911000 
1 1 1 10 65 3  o 4.199000  0.6051000     4.309000  0.8466000     4.090000  0.8649000     0.2194000      1.210000  
1 1 1 11 0  1  o 17.31000  0.2753000     17.31000  0.2753000     17.31000  0.2753000     -0.000000      0.000000  
1 1 1 11 0  2  o 9.510000  0.1444000     9.510000  0.1444000     9.510000  0.1444000     0.000000       0.000000  
1 1 1 11 0  3  o 3.069000  0.1743000     3.069000  0.1743000     3.069000  0.1743000     0.000000       0.000000  
1 1 1 11 0  4  o 0.6714000 0.4183000     0.6714000 0.4183000     0.6714000 0.4183000     -0.000000      0.000000  
1 1 1 11 0  5  o 3.721000  0.2482000     3.721000  0.2482000     3.721000  0.2482000     0.000000       0.000000  
1 1 1 11 0  6  o 27.41000  0.3649000     27.41000  0.3649000     27.41000  0.3649000     0.000000       0.000000  
1 1 1 11 0  7  o 1.479000  0.6184000     1.479000  0.6184000     1.479000  0.6184000     -0.000000      0.000000  
1 1 1 11 0  8  o 3.625000  0.3379000     3.625000  0.3379000     3.625000  0.3379000     0.000000       0.000000  
1 1 1 11 0  9  o 10.36000  0.2151000     10.36000  0.2151000     10.36000  0.2151000     0.000000       0.000000  
1 1 1 11 0  10 o 6.129000  0.3283000     6.129000  0.3283000     6.129000  0.3283000     -0.000000      0.000000  
1 1 1 11 0  11 o 7.364000  0.4031000     7.364000  0.4031000     7.364000  0.4031000     0.000000       0.000000  
1 1 1 11 0  12 o 5.331000  0.3586000     5.331000  0.3586000     5.331000  0.3586000     0.000000       0.000000  
1 1 1 11 0  13 o 2.337000  0.8756000     2.337000  0.8756000     2.337000  0.8756000     0.000000       0.000000  
1 1 1 11 0  14 o 6.064000  0.3996000     6.064000  0.3996000     6.064000  0.3996000     0.000000       0.000000  
1 1 1 11 0  15 o 2.654000  1.151000      2.654000  1.151000      2.654000  1.151000      0.000000       0.000000  
1 1 1 11 0  16 o 1.611000  0.9804000     1.611000  0.9804000     1.611000  0.9804000     0.000000       0.000000  
1 1 1 11 0  17 o 14.48000  0.3290000     14.48000  0.3290000     14.48000  0.3290000     -0.000000      0.000000  
1 1 1 11 0  18 o 9.271000  0.4057000     9.271000  0.4057000     9.271000  0.4057000     0.000000       0.000000  
1 1 1 11 0  19 o 1.803000  1.056000      1.803000  1.056000      1.803000  1.056000      0.000000       0.000000  
1 1 1 11 0  20 o 1.061000  0.7599000     1.061000  0.7599000     1.061000  0.7599000     -0.000000      0.000000  
1 1 1 11 0  21 o 1.375000  0.9495000     1.375000  0.9495000     1.375000  0.9495000     -0.000000      0.000000  
1 1 1 11 0  22 o 1.175000  0.7914000     1.175000  0.7914000     1.175000  0.7914000     0.000000       0.000000  
1 1 1 11 0  23 o 3.017000  0.8450000     3.017000  0.8450000     3.017000  0.8450000     0.000000       0.000000  
1 1 1 11 0  24 o 1.081000  0.7199000     1.081000  0.7199000     1.081000  0.7199000     -0.000000      0.000000  
1 1 1 11 0  25 o 0.9535000 0.6594000     0.9535000 0.6594000     0.9535000 0.6594000     -0.000000      0.000000  
1 1 1 11 0  26 f 1.114000  0.7573000     1.114000  0.7573000     1.114000  0.7573000     0.000000       0.000000  
1 1 1 11 0  27 o 1.375000  0.9462000     1.375000  0.9462000     1.375000  0.9462000     -0.000000      0.000000  
1 1 1 11 1  0  o 20.91000  0.4613000     20.91000  0.4613000     20.91000  0.4613000     -0.000000      0.000000  
1 1 1 11 1  1  f 22.30000  0.2876000     22.66000  0.5029000     21.94000  0.2795000     0.7240000      0.5753000 
1 1 1 11 1  2  o 17.26000  0.1809000     17.40000  0.2294000     17.11000  0.2799000     0.2843000      0.3619000 
1 1 1 11 1  3  o 26.30000  0.2074000     26.27000  0.2928000     26.34000  0.2939000     -0.7572000E-01 0.4149000 
1 1 1 11 1  4  o 9.819000  0.1051000     10.00000  0.1494000     9.634000  0.1479000     0.3708000      0.2103000 
1 1 1 11 1  5  o 32.11000  0.2941000     32.06000  0.4156000     32.15000  0.4163000     -0.9152000E-01 0.5882000 
1 1 1 11 1  6  o 17.83000  0.1842000     17.88000  0.2607000     17.77000  0.2604000     0.1124000      0.3684000 
1 1 1 11 1  7  o 12.84000  0.1378000     12.89000  0.1942000     12.80000  0.1955000     0.8781000E-01  0.2756000 
1 1 1 11 1  8  o 5.096000  0.1785000     4.878000  0.2577000     5.314000  0.2472000     -0.4361000     0.3570000 
1 1 1 11 1  9  o 3.533000  0.2705000     3.280000  0.4099000     3.786000  0.3532000     -0.5062000     0.5411000 
1 1 1 11 1  10 f 7.572000  0.2085000     7.180000  0.3015000     7.963000  0.2882000     -0.7827000     0.4171000 
1 1 1 11 1  11 o 3.145000  0.5413000     3.264000  0.7226000     3.027000  0.8062000     0.2375000      1.083000  
1 1 1 11 1  12 o 8.434000  0.1991000     8.406000  0.2818000     8.462000  0.2814000     -0.5656000E-01 0.3982000 
1 1 1 11 1  13 o 14.95000  0.1921000     15.03000  0.2721000     14.86000  0.2713000     0.1691000      0.3842000 
1 1 1 11 1  14 o 2.639000  0.5298000     2.942000  0.7284000     2.336000  0.7694000     0.6063000      1.060000  
1 1 1 11 1  15 o 9.360000  0.3177000     9.420000  0.4410000     9.300000  0.4574000     0.1194000      0.6354000 
1 1 1 11 1  16 o 10.17000  0.4251000     9.524000  0.7570000     10.82000  0.3870000     -1.293000      0.8502000 
1 1 1 11 1  17 o 5.713000  0.3782000     5.442000  0.5499000     5.984000  0.5195000     -0.5426000     0.7564000 
1 1 1 11 1  18 o 5.507000  0.4094000     5.578000  0.5771000     5.436000  0.5810000     0.1419000      0.8188000 
1 1 1 11 1  19 o 7.414000  0.3493000     7.487000  0.4900000     7.341000  0.4979000     0.1462000      0.6985000 
1 1 1 11 1  20 o 3.361000  0.6537000     2.271000  0.9632000     4.451000  0.8841000     -2.180000      1.307000  
1 1 1 11 1  21 o 2.091000  0.6620000     1.911000  0.8884000     2.270000  0.9817000     -0.3590000     1.324000  
1 1 1 11 1  22 o 2.219000  0.5982000     2.328000  0.8607000     2.111000  0.8310000     0.2173000      1.196000  
1 1 1 11 1  23 o 1.631000  0.4966000     1.443000  0.6589000     1.819000  0.7432000     -0.3763000     0.9932000 
1 1 1 11 1  24 o 1.830000  0.5323000     1.812000  0.7522000     1.848000  0.7533000     -0.3533000E-01 1.065000  
1 1 1 11 1  25 o 1.225000  0.4155000     1.261000  0.6025000     1.188000  0.5724000     0.7382000E-01  0.8310000 
1 1 1 11 1  26 f 1.495000  0.4925000     1.381000  0.6580000     1.610000  0.7330000     -0.2285000     0.9850000 
1 1 1 11 1  27 o 1.174000  0.4245000     1.141000  0.5850000     1.207000  0.6153000     -0.6635000E-01 0.8490000 
1 1 1 11 2  0  o 1.430000  0.1822000     1.430000  0.1822000     1.430000  0.1822000     0.000000       0.000000  
1 1 1 11 2  1  o 33.76000  0.4292000     34.07000  0.7476000     33.45000  0.4217000     0.6202000      0.8584000 
1 1 1 11 2  2  o 28.53000  0.2878000     28.68000  0.4474000     28.38000  0.3622000     0.2978000      0.5756000 
1 1 1 11 2  3  o 17.85000  0.1523000     17.84000  0.1847000     17.87000  0.2423000     -0.3393000E-01 0.3046000 
1 1 1 11 2  4  o 6.622000  0.1017000     6.670000  0.1445000     6.574000  0.1431000     0.9667000E-01  0.2034000 
1 1 1 11 2  5  o 14.39000  0.1345000     14.28000  0.1894000     14.51000  0.1911000     -0.2311000     0.2691000 
1 1 1 11 2  6  o 9.351000  0.1428000     9.193000  0.2024000     9.510000  0.2015000     -0.3169000     0.2856000 
1 1 1 11 2  7  o 9.675000  0.1313000     9.797000  0.1857000     9.554000  0.1858000     0.2429000      0.2626000 
1 1 1 11 2  8  o 2.391000  0.3482000     2.528000  0.4622000     2.254000  0.5210000     0.2732000      0.6965000 
1 1 1 11 2  9  o 16.11000  0.1663000     16.26000  0.2355000     15.96000  0.2349000     0.2973000      0.3326000 
1 1 1 11 2  10 o 7.909000  0.2022000     7.995000  0.2842000     7.823000  0.2878000     0.1719000      0.4045000 
1 1 1 11 2  11 o 4.064000  0.4668000     4.557000  0.5823000     3.571000  0.7297000     0.9860000      0.9336000 
1 1 1 11 2  12 o 8.392000  0.1992000     8.181000  0.2799000     8.602000  0.2836000     -0.4213000     0.3985000 
1 1 1 11 2  13 o 3.948000  0.3621000     4.069000  0.5014000     3.828000  0.5226000     0.2409000      0.7242000 
1 1 1 11 2  14 o 13.70000  0.1975000     13.52000  0.2791000     13.89000  0.2795000     -0.3683000     0.3950000 
1 1 1 11 2  15 o 2.667000  0.6104000     2.233000  0.8640000     3.101000  0.8626000     -0.8679000     1.221000  
1 1 1 11 2  16 o 14.52000  0.2570000     14.91000  0.3631000     14.13000  0.3639000     0.7732000      0.5141000 
1 1 1 11 2  17 o 7.764000  0.3021000     7.599000  0.4355000     7.930000  0.4188000     -0.3307000     0.6042000 
1 1 1 11 2  18 o 2.262000  0.6275000     2.358000  0.8928000     2.166000  0.8819000     0.1920000      1.255000  
1 1 1 11 2  19 f 4.583000  0.5611000     3.958000  0.8982000     5.208000  0.6728000     -1.251000      1.122000  
1 1 1 11 2  20 f 2.642000  0.7244000     2.742000  1.025000      2.541000  1.024000      0.2005000      1.449000  
1 1 1 11 2  21 o 3.402000  0.8065000     3.538000  1.132000      3.266000  1.148000      0.2723000      1.613000  
1 1 1 11 2  22 o 2.849000  0.6012000     2.581000  0.8650000     3.117000  0.8351000     -0.5363000     1.202000  
1 1 1 11 2  23 o 2.092000  0.5102000     1.468000  0.6688000     2.716000  0.7708000     -1.248000      1.020000  
1 1 1 11 2  24 o 1.638000  0.5054000     1.534000  0.6896000     1.742000  0.7389000     -0.2073000     1.011000  
1 1 1 11 2  25 o 1.413000  0.4548000     1.710000  0.7254000     1.117000  0.5488000     0.5925000      0.9096000 
1 1 1 11 2  26 o 1.391000  0.4696000     1.462000  0.6880000     1.320000  0.6394000     0.1414000      0.9393000 
1 1 1 11 2  27 o 1.195000  0.6097000     1.195000  0.6097000     ?         ?             ?              ?         
1 1 1 11 3  0  o 32.43000  0.4091000     32.43000  0.4091000     32.43000  0.4091000     -0.000000      0.000000  
1 1 1 11 3  1  o 46.81000  0.3897000     46.95000  0.5904000     46.67000  0.5087000     0.2845000      0.7793000 
1 1 1 11 3  2  o 2.458000  0.1456000     2.666000  0.2148000     2.250000  0.1965000     0.4166000      0.2912000 
1 1 1 11 3  3  o 26.47000  0.2161000     26.55000  0.2641000     26.39000  0.3422000     0.1539000      0.4323000 
1 1 1 11 3  4  o 29.62000  0.2537000     29.63000  0.3316000     29.61000  0.3839000     0.2198000E-01  0.5073000 
1 1 1 11 3  5  o 21.03000  0.1763000     20.93000  0.2482000     21.14000  0.2504000     -0.2049000     0.3525000 
1 1 1 11 3  6  o 21.00000  0.2075000     21.03000  0.2935000     20.97000  0.2935000     0.6706000E-01  0.4151000 
1 1 1 11 3  7  o 15.72000  0.1512000     15.75000  0.2147000     15.68000  0.2129000     0.7103000E-01  0.3023000 
1 1 1 11 3  8  o 6.622000  0.1595000     6.686000  0.2239000     6.559000  0.2273000     0.1268000      0.3191000 
1 1 1 11 3  9  o 3.086000  0.3112000     3.086000  0.4371000     3.086000  0.4432000     0.2267000E-03  0.6224000 
1 1 1 11 3  10 o 8.601000  0.2004000     8.878000  0.2776000     8.324000  0.2893000     0.5539000      0.4009000 
1 1 1 11 3  11 o 7.340000  0.2919000     7.267000  0.4138000     7.414000  0.4118000     -0.1466000     0.5838000 
1 1 1 11 3  12 o 6.613000  0.2282000     6.780000  0.3172000     6.446000  0.3281000     0.3340000      0.4564000 
1 1 1 11 3  13 o 3.836000  0.3815000     3.679000  0.5598000     3.993000  0.5185000     -0.3139000     0.7630000 
1 1 1 11 3  14 o 6.962000  0.2581000     6.796000  0.3667000     7.127000  0.3632000     -0.3312000     0.5162000 
1 1 1 11 3  15 o 7.411000  0.3143000     7.847000  0.4169000     6.976000  0.4705000     0.8706000      0.6286000 
1 1 1 11 3  16 o 18.06000  0.2882000     17.98000  0.4464000     18.14000  0.3645000     -0.1539000     0.5764000 
1 1 1 11 3  17 o 1.968000  0.5804000     2.234000  0.8642000     1.701000  0.7749000     0.5328000      1.161000  
1 1 1 11 3  18 o 5.820000  0.4072000     5.870000  0.5558000     5.770000  0.5952000     0.9964000E-01  0.8144000 
1 1 1 11 3  19 o 11.76000  0.2706000     11.93000  0.3809000     11.59000  0.3844000     0.3415000      0.5412000 
1 1 1 11 3  20 o 4.723000  0.6320000     4.978000  0.8337000     4.469000  0.9501000     0.5098000      1.264000  
1 1 1 11 3  21 o 2.485000  0.7361000     2.740000  1.099000      2.231000  0.9796000     0.5091000      1.472000  
1 1 1 11 3  22 o 2.859000  0.5995000     3.408000  0.8170000     2.309000  0.8776000     1.099000       1.199000  
1 1 1 11 3  23 o 1.327000  0.4452000     1.394000  0.6526000     1.260000  0.6056000     0.1338000      0.8903000 
1 1 1 11 3  24 o 2.132000  0.5598000     2.311000  0.8008000     1.953000  0.7825000     0.3583000      1.120000  
1 1 1 11 3  25 o 1.634000  0.4948000     1.976000  0.7786000     1.292000  0.6108000     0.6839000      0.9895000 
1 1 1 11 3  26 o 1.486000  0.4936000     1.522000  0.7095000     1.450000  0.6865000     0.7257000E-01  0.9872000 
1 1 1 11 4  0  o 21.80000  0.2778000     21.80000  0.2778000     21.80000  0.2778000     0.000000       0.000000  
1 1 1 11 4  1  o 20.44000  0.1858000     20.53000  0.2639000     20.34000  0.2615000     0.1964000      0.3715000 
1 1 1 11 4  2  o 26.81000  0.2578000     26.91000  0.4225000     26.71000  0.2956000     0.1947000      0.5156000 
1 1 1 11 4  3  o 25.22000  0.2001000     24.85000  0.2781000     25.60000  0.2878000     -0.7444000     0.4002000 
1 1 1 11 4  4  o 33.06000  0.3075000     33.21000  0.3290000     32.91000  0.5195000     0.2979000      0.6150000 
1 1 1 11 4  5  o 14.68000  0.1485000     14.79000  0.1940000     14.57000  0.2248000     0.2261000      0.2970000 
1 1 1 11 4  6  o 10.75000  0.1366000     10.65000  0.1777000     10.86000  0.2075000     -0.2139000     0.2731000 
1 1 1 11 4  7  f 6.478000  0.1432000     6.391000  0.2051000     6.564000  0.1999000     -0.1730000     0.2864000 
1 1 1 11 4  8  f 4.012000  0.2223000     3.878000  0.3313000     4.146000  0.2964000     -0.2681000     0.4445000 
1 1 1 11 4  9  o 13.84000  0.1584000     13.91000  0.2261000     13.78000  0.2218000     0.1313000      0.3167000 
1 1 1 11 4  10 o 6.875000  0.2243000     7.281000  0.3016000     6.469000  0.3321000     0.8114000      0.4486000 
1 1 1 11 4  11 o 10.94000  0.2367000     10.93000  0.3644000     10.94000  0.3021000     -0.1503000E-01 0.4734000 
1 1 1 11 4  12 o 8.679000  0.1975000     8.658000  0.2793000     8.700000  0.2794000     -0.4238000E-01 0.3950000 
1 1 1 11 4  13 o 5.999000  0.2676000     6.242000  0.3642000     5.755000  0.3921000     0.4875000      0.5352000 
1 1 1 11 4  14 o 5.725000  0.2980000     5.520000  0.4315000     5.930000  0.4111000     -0.4106000     0.5960000 
1 1 1 11 4  15 o 6.162000  0.3620000     6.167000  0.5131000     6.158000  0.5110000     0.9558000E-02  0.7241000 
1 1 1 11 4  16 o 12.87000  0.3274000     12.63000  0.4704000     13.11000  0.4556000     -0.4855000     0.6548000 
1 1 1 11 4  17 o 4.308000  0.5065000     4.047000  0.7516000     4.569000  0.6792000     -0.5215000     1.013000  
1 1 1 11 4  18 o 5.876000  0.4040000     6.059000  0.5480000     5.693000  0.5937000     0.3653000      0.8080000 
1 1 1 11 4  19 o 4.686000  0.5477000     5.291000  0.6712000     4.081000  0.8658000     1.210000       1.095000  
1 1 1 11 4  20 o 3.609000  0.7358000     3.776000  1.007000      3.441000  1.073000      0.3352000      1.472000  
1 1 1 11 4  21 o 2.935000  0.7342000     2.190000  0.9889000     3.681000  1.085000      -1.491000      1.468000  
1 1 1 11 4  22 o 2.376000  0.6093000     2.061000  0.8449000     2.690000  0.8781000     -0.6285000     1.219000  
1 1 1 11 4  23 o 1.907000  0.5389000     1.957000  0.7745000     1.856000  0.7494000     0.1014000      1.078000  
1 1 1 11 4  24 f 1.517000  0.4823000     1.264000  0.6051000     1.770000  0.7513000     -0.5066000     0.9647000 
1 1 1 11 4  25 o 1.726000  0.5026000     1.303000  0.6183000     2.149000  0.7926000     -0.8464000     1.005000  
1 1 1 11 4  26 o 2.014000  0.5656000     1.641000  0.7187000     2.386000  0.8737000     -0.7443000     1.131000  
1 1 1 11 5  0  o 4.050000  0.1079000     4.050000  0.1079000     4.050000  0.1079000     -0.000000      0.000000  
1 1 1 11 5  1  o 44.21000  0.3937000     44.48000  0.5601000     43.93000  0.5533000     0.5511000      0.7873000 
1 1 1 11 5  2  o 3.834000  0.9227000E-01 3.948000  0.1350000     3.719000  0.1258000     0.2295000      0.1845000 
1 1 1 11 5  3  o 22.26000  0.1850000     22.47000  0.2942000     22.06000  0.2243000     0.4154000      0.3700000 
1 1 1 11 5  4  o 18.12000  0.1745000     18.08000  0.2445000     18.16000  0.2491000     -0.8183000E-01 0.3490000 
1 1 1 11 5  5  o 14.23000  0.1408000     14.02000  0.1646000     14.45000  0.2284000     -0.4300000     0.2816000 
1 1 1 11 5  6  o 18.14000  0.1751000     18.36000  0.2304000     17.91000  0.2637000     0.4435000      0.3502000 
1 1 1 11 5  7  o 5.886000  0.1497000     5.867000  0.2123000     5.904000  0.2111000     -0.3688000E-01 0.2994000 
1 1 1 11 5  8  o 5.765000  0.1712000     5.918000  0.2390000     5.613000  0.2453000     0.3047000      0.3425000 
1 1 1 11 5  9  o 8.427000  0.1588000     8.538000  0.2240000     8.316000  0.2253000     0.2213000      0.3177000 
1 1 1 11 5  10 o 9.081000  0.1978000     9.121000  0.2827000     9.041000  0.2768000     0.8019000E-01  0.3957000 
1 1 1 11 5  11 o 2.557000  0.5195000     2.559000  0.7417000     2.554000  0.7276000     0.5423000E-02  1.039000  
1 1 1 11 5  12 o 8.996000  0.1980000     9.176000  0.2785000     8.815000  0.2816000     0.3612000      0.3960000 
1 1 1 11 5  13 o 3.253000  0.4433000     3.358000  0.6124000     3.147000  0.6412000     0.2102000      0.8866000 
1 1 1 11 5  14 o 3.764000  0.4361000     4.030000  0.5735000     3.497000  0.6571000     0.5330000      0.8721000 
1 1 1 11 5  15 o 13.40000  0.2461000     13.60000  0.3485000     13.20000  0.3477000     0.4093000      0.4923000 
1 1 1 11 5  16 o 7.637000  0.4170000     7.377000  0.6113000     7.897000  0.5674000     -0.5197000     0.8340000 
1 1 1 11 5  17 o 3.805000  0.5667000     2.990000  0.9065000     4.620000  0.6805000     -1.630000      1.133000  
1 1 1 11 5  18 o 6.209000  0.3903000     5.543000  0.5964000     6.875000  0.5037000     -1.332000      0.7807000 
1 1 1 11 5  19 o 4.877000  0.5360000     5.429000  0.6770000     4.326000  0.8311000     1.103000       1.072000  
1 1 1 11 5  20 f 6.483000  0.4878000     7.462000  0.5863000     5.504000  0.7798000     1.958000       0.9756000 
1 1 1 11 5  21 o 2.474000  0.7229000     2.658000  1.078000      2.290000  0.9631000     0.3682000      1.446000  
1 1 1 11 5  22 o 3.204000  0.5832000     3.022000  0.8523000     3.386000  0.7964000     -0.3637000     1.166000  
1 1 1 11 5  23 o 2.120000  0.5515000     1.899000  0.7662000     2.341000  0.7935000     -0.4418000     1.103000  
1 1 1 11 5  24 o 1.345000  0.4462000     1.284000  0.6127000     1.406000  0.6487000     -0.1222000     0.8923000 
1 1 1 11 5  25 o 1.482000  0.4763000     1.406000  0.6498000     1.558000  0.6967000     -0.1520000     0.9527000 
1 1 1 11 5  26 o 1.454000  0.4704000     1.365000  0.6350000     1.543000  0.6943000     -0.1777000     0.9409000 
1 1 1 11 6  0  o 1.426000  0.3493000     1.426000  0.3493000     1.426000  0.3493000     0.000000       0.000000  
1 1 1 11 6  1  o 37.38000  0.3340000     37.23000  0.4704000     37.53000  0.4742000     -0.3046000     0.6680000 
1 1 1 11 6  2  o 26.83000  0.2436000     26.87000  0.3451000     26.79000  0.3438000     0.7655000E-01  0.4871000 
1 1 1 11 6  3  f 28.14000  0.2219000     27.91000  0.3111000     28.37000  0.3164000     -0.4543000     0.4437000 
1 1 1 11 6  4  o 29.63000  0.3310000     29.65000  0.4683000     29.61000  0.4678000     0.4314000E-01  0.6619000 
1 1 1 11 6  5  o 3.466000  0.1558000     3.490000  0.2094000     3.442000  0.2307000     0.4808000E-01  0.3115000 
1 1 1 11 6  6  o 25.34000  0.2166000     25.13000  0.2604000     25.56000  0.3463000     -0.4377000     0.4333000 
1 1 1 11 6  7  o 1.895000  0.3815000     1.744000  0.5279000     2.047000  0.5509000     -0.3033000     0.7630000 
1 1 1 11 6  8  o 9.812000  0.1456000     9.765000  0.2102000     9.858000  0.2016000     -0.9331000E-01 0.2913000 
1 1 1 11 6  9  o 3.618000  0.2672000     3.680000  0.3762000     3.556000  0.3794000     0.1241000      0.5343000 
1 1 1 11 6  10 o 5.549000  0.2229000     5.402000  0.3239000     5.696000  0.3064000     -0.2935000     0.4459000 
1 1 1 11 6  11 o 8.950000  0.2143000     8.584000  0.3067000     9.315000  0.2994000     -0.7316000     0.4286000 
1 1 1 11 6  12 o 4.559000  0.3063000     4.813000  0.4236000     4.304000  0.4424000     0.5086000      0.6125000 
1 1 1 11 6  13 o 7.724000  0.2270000     7.747000  0.3262000     7.702000  0.3157000     0.4464000E-01  0.4540000 
1 1 1 11 6  14 o 11.24000  0.2070000     11.14000  0.2936000     11.35000  0.2921000     -0.2148000     0.4141000 
1 1 1 11 6  15 f 2.885000  0.6079000     3.343000  0.8386000     2.426000  0.8801000     0.9167000      1.216000  
1 1 1 11 6  16 o 9.128000  0.3504000     8.722000  0.5601000     9.534000  0.4212000     -0.8127000     0.7008000 
1 1 1 11 6  17 o 5.454000  0.4236000     4.887000  0.6608000     6.020000  0.5301000     -1.132000      0.8471000 
1 1 1 11 6  18 o 1.827000  0.5755000     2.016000  0.8610000     1.637000  0.7637000     0.3784000      1.151000  
1 1 1 11 6  19 o 6.171000  0.4165000     6.296000  0.5760000     6.046000  0.6019000     0.2500000      0.8331000 
1 1 1 11 6  20 o 4.829000  0.6283000     5.294000  0.7966000     4.365000  0.9720000     0.9291000      1.257000  
1 1 1 11 6  21 o 3.045000  0.7150000     2.888000  1.003000      3.202000  1.020000      -0.3141000     1.430000  
1 1 1 11 6  22 o 1.712000  0.5335000     1.555000  0.7169000     1.869000  0.7903000     -0.3134000     1.067000  
1 1 1 11 6  23 o 1.982000  0.5463000     1.815000  0.7538000     2.149000  0.7908000     -0.3348000     1.093000  
1 1 1 11 6  24 o 1.556000  0.4835000     1.310000  0.6208000     1.802000  0.7415000     -0.4918000     0.9671000 
1 1 1 11 6  25 o 1.628000  0.5018000     1.529000  0.6880000     1.728000  0.7307000     -0.1986000     1.004000  
1 1 1 11 6  26 o 1.173000  0.4038000     1.149000  0.5612000     1.197000  0.5809000     -0.4820000E-01 0.8077000 
1 1 1 11 7  0  o 41.46000  0.5226000     41.46000  0.5226000     41.46000  0.5226000     -0.000000      0.000000  
1 1 1 11 7  1  o 14.39000  0.1398000     14.28000  0.1959000     14.51000  0.1994000     -0.2293000     0.2796000 
1 1 1 11 7  2  o 10.73000  0.1160000     10.93000  0.1664000     10.54000  0.1618000     0.3913000      0.2321000 
1 1 1 11 7  3  o 30.30000  0.2573000     30.43000  0.3383000     30.17000  0.3879000     0.2539000      0.5147000 
1 1 1 11 7  4  o 15.60000  0.1579000     15.73000  0.2261000     15.47000  0.2204000     0.2621000      0.3157000 
1 1 1 11 7  5  o 14.08000  0.2261000     14.17000  0.3960000     13.99000  0.2182000     0.1760000      0.4521000 
1 1 1 11 7  6  o 6.681000  0.1181000     6.891000  0.1631000     6.470000  0.1708000     0.4209000      0.2362000 
1 1 1 11 7  7  o 12.98000  0.1446000     13.16000  0.1721000     12.80000  0.2325000     0.3580000      0.2893000 
1 1 1 11 7  8  o 10.37000  0.1603000     10.30000  0.2068000     10.44000  0.2449000     -0.1393000     0.3205000 
1 1 1 11 7  9  o 5.539000  0.1977000     5.844000  0.2725000     5.233000  0.2865000     0.6114000      0.3955000 
1 1 1 11 7  10 o 9.079000  0.1741000     9.239000  0.2438000     8.918000  0.2486000     0.3210000      0.3482000 
1 1 1 11 7  11 f 7.058000  0.2246000     7.021000  0.3010000     7.095000  0.3335000     -0.7362000E-01 0.4492000 
1 1 1 11 7  12 o 7.624000  0.2138000     7.197000  0.3117000     8.052000  0.2926000     -0.8548000     0.4275000 
1 1 1 11 7  13 o 2.928000  0.4880000     3.422000  0.6350000     2.434000  0.7411000     0.9879000      0.9759000 
1 1 1 11 7  14 o 4.224000  0.3875000     3.863000  0.6034000     4.585000  0.4863000     -0.7216000     0.7750000 
1 1 1 11 7  15 o 4.527000  0.4723000     4.450000  0.6807000     4.604000  0.6549000     -0.1548000     0.9446000 
1 1 1 11 7  16 o 13.51000  0.2658000     13.34000  0.3814000     13.69000  0.3703000     -0.3554000     0.5316000 
1 1 1 11 7  17 o 2.895000  0.6322000     3.133000  0.8811000     2.657000  0.9069000     0.4762000      1.264000  
1 1 1 11 7  18 o 3.778000  0.6101000     3.816000  0.8607000     3.740000  0.8650000     0.7636000E-01  1.220000  
1 1 1 11 7  19 o 4.333000  0.5738000     5.077000  0.6740000     3.590000  0.9288000     1.488000       1.148000  
1 1 1 11 7  20 f 2.566000  0.7152000     2.650000  1.019000      2.482000  1.004000      0.1675000      1.430000  
1 1 1 11 7  21 o 2.309000  0.6734000     2.209000  0.9390000     2.409000  0.9653000     -0.1998000     1.347000  
1 1 1 11 7  22 f 3.007000  0.5726000     2.529000  0.8611000     3.485000  0.7549000     -0.9554000     1.145000  
1 1 1 11 7  23 o 2.621000  0.5634000     2.684000  0.7978000     2.559000  0.7956000     0.1253000      1.127000  
1 1 1 11 7  24 o 2.120000  0.5348000     1.702000  0.7217000     2.537000  0.7895000     -0.8352000     1.070000  
1 1 1 11 7  25 o 1.584000  0.4958000     1.643000  0.7180000     1.525000  0.6838000     0.1175000      0.9915000 
1 1 1 11 7  26 o 1.541000  0.4818000     1.424000  0.6491000     1.658000  0.7123000     -0.2344000     0.9637000 
1 1 1 11 8  0  o 20.87000  0.2729000     20.87000  0.2729000     20.87000  0.2729000     -0.000000      0.000000  
1 1 1 11 8  1  o 7.174000  0.9740000E-01 7.153000  0.1365000     7.195000  0.1389000     -0.4102000E-01 0.1948000 
1 1 1 11 8  2  o 23.43000  0.2163000     23.68000  0.3094000     23.17000  0.3024000     0.5070000      0.4327000 
1 1 1 11 8  3  o 17.93000  0.1735000     17.90000  0.2461000     17.96000  0.2445000     -0.6388000E-01 0.3469000 
1 1 1 11 8  4  o 24.91000  0.2007000     24.52000  0.2800000     25.29000  0.2877000     -0.7697000     0.4014000 
1 1 1 11 8  5  o 15.58000  0.2272000     15.43000  0.4178000     15.72000  0.1786000     -0.2939000     0.4544000 
1 1 1 11 8  6  o 9.734000  0.1401000     9.410000  0.1844000     10.06000  0.2109000     -0.6481000     0.2802000 
1 1 1 11 8  7  o 7.959000  0.1253000     7.962000  0.1742000     7.956000  0.1802000     0.6257000E-02  0.2506000 
1 1 1 11 8  8  o 15.21000  0.1639000     15.16000  0.1925000     15.27000  0.2653000     -0.1107000     0.3278000 
1 1 1 11 8  9  o 8.194000  0.1898000     7.995000  0.1999000     8.393000  0.3227000     -0.3981000     0.3796000 
1 1 1 11 8  10 o 11.44000  0.1692000     11.63000  0.2417000     11.26000  0.2369000     0.3701000      0.3385000 
1 1 1 11 8  11 o 3.050000  0.4031000     3.312000  0.5208000     2.788000  0.6155000     0.5248000      0.8062000 
1 1 1 11 8  12 o 2.928000  0.4567000     2.654000  0.6885000     3.202000  0.6002000     -0.5479000     0.9134000 
1 1 1 11 8  13 o 7.458000  0.2310000     7.762000  0.3233000     7.154000  0.3301000     0.6081000      0.4621000 
1 1 1 11 8  14 o 11.68000  0.2058000     11.43000  0.2937000     11.93000  0.2883000     -0.5000000     0.4115000 
1 1 1 11 8  15 o 5.657000  0.3308000     5.608000  0.4612000     5.707000  0.4744000     -0.9862000E-01 0.6616000 
1 1 1 11 8  16 o 7.919000  0.3331000     8.588000  0.4453000     7.251000  0.4956000     1.338000       0.6662000 
1 1 1 11 8  17 o 10.57000  0.2568000     10.63000  0.3635000     10.51000  0.3629000     0.1253000      0.5136000 
1 1 1 11 8  18 o 5.858000  0.4189000     5.504000  0.6126000     6.211000  0.5715000     -0.7065000     0.8378000 
1 1 1 11 8  19 o 4.713000  0.5251000     4.911000  0.6955000     4.515000  0.7869000     0.3966000      1.050000  
1 1 1 11 8  20 o 2.237000  0.6492000     2.029000  0.8790000     2.445000  0.9556000     -0.4156000     1.298000  
1 1 1 11 8  21 o 2.740000  0.6676000     3.313000  0.9597000     2.168000  0.9284000     1.145000       1.335000  
1 1 1 11 8  22 o 3.680000  0.5022000     3.757000  0.7138000     3.603000  0.7068000     0.1536000      1.004000  
1 1 1 11 8  23 o 1.490000  0.4807000     1.582000  0.7074000     1.399000  0.6510000     0.1825000      0.9613000 
1 1 1 11 8  24 o 1.750000  0.5204000     1.560000  0.7054000     1.939000  0.7652000     -0.3785000     1.041000  
1 1 1 11 8  25 o 1.554000  0.4847000     1.585000  0.6912000     1.524000  0.6797000     0.6050000E-01  0.9694000 
1 1 1 11 8  26 o 1.591000  0.4796000     2.013000  0.7708000     1.169000  0.5709000     0.8440000      0.9592000 
1 1 1 11 9  0  o 15.59000  0.2146000     15.59000  0.2146000     15.59000  0.2146000     -0.000000      0.000000  
1 1 1 11 9  1  o 34.17000  0.3081000     34.17000  0.4360000     34.17000  0.4355000     0.5043000E-02  0.6162000 
1 1 1 11 9  2  o 27.63000  0.2528000     27.64000  0.3575000     27.62000  0.3576000     0.2271000E-01  0.5057000 
1 1 1 11 9  3  o 12.00000  0.1605000     12.21000  0.2275000     11.78000  0.2265000     0.4353000      0.3210000 
1 1 1 11 9  4  o 23.01000  0.2315000     22.96000  0.2655000     23.06000  0.3792000     -0.9962000E-01 0.4629000 
1 1 1 11 9  5  o 5.766000  0.1060000     5.774000  0.1502000     5.757000  0.1496000     0.1657000E-01  0.2119000 
1 1 1 11 9  6  o 11.38000  0.1290000     11.62000  0.2046000     11.14000  0.1572000     0.4841000      0.2580000 
1 1 1 11 9  7  o 4.183000  0.1659000     4.069000  0.2388000     4.297000  0.2304000     -0.2288000     0.3318000 
1 1 1 11 9  8  o 3.338000  0.2123000     3.307000  0.2997000     3.369000  0.3009000     -0.6190000E-01 0.4247000 
1 1 1 11 9  9  o 4.368000  0.2069000     4.558000  0.2499000     4.177000  0.3298000     0.3812000      0.4138000 
1 1 1 11 9  10 o 11.62000  0.2082000     11.49000  0.1999000     11.76000  0.3654000     -0.2699000     0.4164000 
1 1 1 11 9  11 o 14.24000  0.1789000     14.16000  0.2541000     14.31000  0.2519000     -0.1559000     0.3577000 
1 1 1 11 9  12 o 10.42000  0.1910000     10.31000  0.2708000     10.54000  0.2695000     -0.2286000     0.3821000 
1 1 1 11 9  13 o 6.591000  0.2535000     6.222000  0.3730000     6.960000  0.3435000     -0.7383000     0.5071000 
1 1 1 11 9  14 o 5.141000  0.3316000     5.572000  0.4364000     4.711000  0.4994000     0.8609000      0.6632000 
1 1 1 11 9  15 o 5.371000  0.3524000     5.582000  0.4870000     5.160000  0.5094000     0.4223000      0.7048000 
1 1 1 11 9  16 o 7.204000  0.3520000     6.708000  0.5235000     7.700000  0.4708000     -0.9924000     0.7040000 
1 1 1 11 9  17 o 5.217000  0.4296000     5.878000  0.5401000     4.555000  0.6681000     1.323000       0.8591000 
1 1 1 11 9  18 o 9.974000  0.2810000     10.03000  0.3956000     9.914000  0.3992000     0.1199000      0.5620000 
1 1 1 11 9  19 o 2.408000  0.6322000     3.044000  0.9642000     1.771000  0.8178000     1.273000       1.264000  
1 1 1 11 9  20 o 5.262000  0.4766000     4.613000  0.7483000     5.911000  0.5906000     -1.298000      0.9533000 
1 1 1 11 9  21 o 2.383000  0.6588000     1.993000  0.8730000     2.773000  0.9870000     -0.7803000     1.318000  
1 1 1 11 9  22 o 2.818000  0.5176000     3.745000  0.6835000     1.892000  0.7774000     1.853000       1.035000  
1 1 1 11 9  23 o 1.841000  0.5375000     1.780000  0.7555000     1.902000  0.7649000     -0.1214000     1.075000  
1 1 1 11 9  24 o 1.666000  0.5192000     1.536000  0.7047000     1.795000  0.7627000     -0.2594000     1.038000  
1 1 1 11 9  25 o 1.848000  0.5004000     1.295000  0.6142000     2.400000  0.7900000     -1.105000      1.001000  
1 1 1 11 9  26 o 1.798000  0.5254000     1.931000  0.7534000     1.665000  0.7324000     0.2654000      1.051000  
1 1 1 11 10 0  o 53.01000  0.6680000     53.01000  0.6680000     53.01000  0.6680000     0.000000       0.000000  
1 1 1 11 10 1  o 12.56000  0.1323000     12.48000  0.1858000     12.65000  0.1885000     -0.1660000     0.2647000 
1 1 1 11 10 2  o 9.970000  0.1341000     10.07000  0.2109000     9.873000  0.1656000     0.1945000      0.2681000 
1 1 1 11 10 3  o 25.96000  0.3266000     26.01000  0.2948000     25.91000  0.5829000     0.1010000      0.6532000 
1 1 1 11 10 4  o 12.21000  0.1561000     12.17000  0.2396000     12.24000  0.2002000     -0.7330000E-01 0.3123000 
1 1 1 11 10 5  f 12.23000  0.1213000     12.35000  0.1726000     12.12000  0.1704000     0.2323000      0.2426000 
1 1 1 11 10 6  o 14.05000  0.1417000     14.11000  0.2257000     13.99000  0.1715000     0.1197000      0.2834000 
1 1 1 11 10 7  f 10.02000  0.1305000     9.884000  0.1816000     10.15000  0.1875000     -0.2648000     0.2610000 
1 1 1 11 10 8  o 2.165000  0.3119000     1.994000  0.4608000     2.337000  0.4204000     -0.3430000     0.6238000 
1 1 1 11 10 9  o 7.642000  0.2676000     7.673000  0.2288000     7.611000  0.4839000     0.6221000E-01  0.5352000 
1 1 1 11 10 10 o 5.926000  0.2008000     6.053000  0.2769000     5.798000  0.2908000     0.2553000      0.4015000 
1 1 1 11 10 11 o 3.594000  0.3264000     3.074000  0.3897000     4.114000  0.5236000     -1.040000      0.6527000 
1 1 1 11 10 12 o 11.57000  0.1909000     11.73000  0.2715000     11.41000  0.2684000     0.3216000      0.3817000 
1 1 1 11 10 13 o 2.804000  0.5065000     2.692000  0.7363000     2.917000  0.6957000     -0.2246000     1.013000  
1 1 1 11 10 14 o 10.06000  0.2364000     9.974000  0.3545000     10.14000  0.3130000     -0.1630000     0.4729000 
1 1 1 11 10 15 o 19.79000  0.2242000     19.51000  0.3151000     20.08000  0.3190000     -0.5715000     0.4484000 
1 1 1 11 10 16 o 2.147000  0.5949000     2.285000  0.8564000     2.010000  0.8260000     0.2757000      1.190000  
1 1 1 11 10 17 o 7.072000  0.3288000     6.589000  0.4887000     7.556000  0.4399000     -0.9676000     0.6575000 
1 1 1 11 10 18 o 3.671000  0.6204000     3.003000  0.9635000     4.340000  0.7819000     -1.338000      1.241000  
1 1 1 11 10 19 o 2.401000  0.6548000     2.755000  0.9647000     2.047000  0.8855000     0.7087000      1.310000  
1 1 1 11 10 20 o 2.250000  0.6389000     2.645000  0.9702000     1.856000  0.8317000     0.7897000      1.278000  
1 1 1 11 10 21 o 3.089000  0.6047000     3.594000  0.7951000     2.585000  0.9113000     1.009000       1.209000  
1 1 1 11 10 22 o 2.517000  0.5621000     2.937000  0.7875000     2.096000  0.8023000     0.8413000      1.124000  
1 1 1 11 10 23 o 1.819000  0.5269000     1.664000  0.7216000     1.973000  0.7681000     -0.3092000     1.054000  
1 1 1 11 10 24 o 1.934000  0.5202000     1.258000  0.6112000     2.609000  0.8420000     -1.351000      1.040000  
1 1 1 11 10 25 o 1.793000  0.5159000     2.138000  0.7820000     1.447000  0.6732000     0.6918000      1.032000  
1 1 1 11 10 26 o 1.404000  0.4569000     1.447000  0.6592000     1.360000  0.6329000     0.8720000E-01  0.9139000 
1 1 1 11 11 0  o 26.28000  0.3416000     26.28000  0.3416000     26.28000  0.3416000     0.000000       0.000000  
1 1 1 11 11 1  o 25.78000  0.2659000     25.59000  0.4102000     25.97000  0.3384000     -0.3754000     0.5318000 
1 1 1 11 11 2  o 29.63000  0.4709000     30.25000  0.6819000     29.00000  0.6497000     1.246000       0.9419000 
1 1 1 11 11 3  f 33.80000  0.3445000     33.92000  0.4361000     33.68000  0.5334000     0.2491000      0.6890000 
1 1 1 11 11 4  o 12.62000  0.1224000     12.61000  0.1732000     12.62000  0.1729000     -0.1086000E-01 0.2448000 
1 1 1 11 11 5  o 12.55000  0.1245000     12.41000  0.1757000     12.69000  0.1763000     -0.2773000     0.2489000 
1 1 1 11 11 6  o 7.496000  0.1135000     7.290000  0.1605000     7.702000  0.1605000     -0.4114000     0.2269000 
1 1 1 11 11 7  o 16.08000  0.1585000     16.26000  0.2529000     15.90000  0.1911000     0.3551000      0.3170000 
1 1 1 11 11 8  o 8.208000  0.1402000     8.204000  0.1934000     8.211000  0.2030000     -0.6947000E-02 0.2803000 
1 1 1 11 11 9  o 11.97000  0.1962000     11.56000  0.2101000     12.38000  0.3315000     -0.8215000     0.3925000 
1 1 1 11 11 10 o 12.05000  0.2842000     11.99000  0.5060000     12.11000  0.2589000     -0.1155000     0.5684000 
1 1 1 11 11 11 o 7.372000  0.1779000     6.797000  0.2522000     7.947000  0.2510000     -1.150000      0.3558000 
1 1 1 11 11 12 o 8.692000  0.2076000     8.545000  0.2319000     8.838000  0.3444000     -0.2927000     0.4152000 
1 1 1 11 11 13 o 10.19000  0.2267000     9.945000  0.2963000     10.43000  0.3431000     -0.4846000     0.4533000 
1 1 1 11 11 14 o 12.33000  0.2367000     12.08000  0.3418000     12.59000  0.3274000     -0.5026000     0.4733000 
1 1 1 11 11 15 o 13.38000  0.2182000     13.29000  0.3081000     13.47000  0.3091000     -0.1748000     0.4364000 
1 1 1 11 11 16 o 6.901000  0.3088000     7.129000  0.4270000     6.672000  0.4462000     0.4568000      0.6176000 
1 1 1 11 11 17 o 1.797000  0.5660000     1.777000  0.8021000     1.818000  0.7987000     -0.4109000E-01 1.132000  
1 1 1 11 11 18 o 3.002000  0.6350000     2.319000  0.9182000     3.684000  0.8773000     -1.365000      1.270000  
1 1 1 11 11 19 o 8.601000  0.3631000     8.802000  0.5101000     8.401000  0.5170000     0.4013000      0.7263000 
1 1 1 11 11 20 f 3.921000  0.5972000     3.029000  0.9749000     4.813000  0.6902000     -1.785000      1.194000  
1 1 1 11 11 21 o 2.105000  0.5876000     2.438000  0.8741000     1.771000  0.7855000     0.6671000      1.175000  
1 1 1 11 11 22 o 1.795000  0.5315000     1.904000  0.7783000     1.687000  0.7238000     0.2167000      1.063000  
1 1 1 11 11 23 o 1.593000  0.4899000     1.368000  0.6447000     1.818000  0.7379000     -0.4500000     0.9799000 
1 1 1 11 11 24 o 1.651000  0.5107000     1.377000  0.6510000     1.924000  0.7871000     -0.5475000     1.021000  
1 1 1 11 11 25 o 1.331000  0.4464000     1.280000  0.6122000     1.382000  0.6500000     -0.1019000     0.8929000 
1 1 1 11 11 26 o 1.629000  0.4969000     1.446000  0.6583000     1.811000  0.7444000     -0.3647000     0.9937000 
1 1 1 11 12 0  o 16.10000  0.3962000     16.10000  0.3962000     16.10000  0.3962000     -0.000000      0.000000  
1 1 1 11 12 1  f 13.98000  0.3597000     13.98000  0.3597000     ?         ?             ?              ?         
1 1 1 11 12 2  o 6.149000  0.1681000     6.062000  0.1958000     6.235000  0.2733000     -0.1732000     0.3362000 
1 1 1 11 12 3  o 18.31000  0.2007000     18.13000  0.3088000     18.50000  0.2566000     -0.3715000     0.4015000 
1 1 1 11 12 4  o 4.110000  0.1240000     4.217000  0.1731000     4.002000  0.1775000     0.2144000      0.2479000 
1 1 1 11 12 5  o 12.28000  0.1253000     12.48000  0.1786000     12.08000  0.1758000     0.4055000      0.2506000 
1 1 1 11 12 6  f 9.906000  0.1188000     9.757000  0.1685000     10.06000  0.1675000     -0.2983000     0.2376000 
1 1 1 11 12 7  o 3.642000  0.1625000     3.558000  0.2328000     3.726000  0.2269000     -0.1685000     0.3250000 
1 1 1 11 12 8  o 13.46000  0.1492000     13.43000  0.2086000     13.49000  0.2133000     -0.6659000E-01 0.2984000 
1 1 1 11 12 9  o 7.248000  0.1692000     7.018000  0.2216000     7.478000  0.2557000     -0.4603000     0.3384000 
1 1 1 11 12 10 o 13.50000  0.2098000     13.40000  0.3495000     13.61000  0.2320000     -0.2092000     0.4195000 
1 1 1 11 12 11 o 3.046000  0.3389000     3.747000  0.3591000     2.344000  0.5748000     1.403000       0.6777000 
1 1 1 11 12 12 o 4.098000  0.2653000     4.274000  0.3584000     3.921000  0.3914000     0.3534000      0.5307000 
1 1 1 11 12 13 f 13.43000  0.2017000     13.30000  0.2310000     13.56000  0.3306000     -0.2607000     0.4034000 
1 1 1 11 12 14 o 6.630000  0.3194000     6.784000  0.3150000     6.476000  0.5557000     0.3079000      0.6388000 
1 1 1 11 12 15 o 13.65000  0.2510000     13.85000  0.3526000     13.45000  0.3572000     0.3907000      0.5019000 
1 1 1 11 12 16 o 3.197000  0.5928000     2.988000  0.8496000     3.406000  0.8270000     -0.4182000     1.186000  
1 1 1 11 12 17 o 5.531000  0.3976000     5.743000  0.5462000     5.319000  0.5780000     0.4239000      0.7952000 
1 1 1 11 12 18 o 2.541000  0.6074000     3.363000  0.9249000     1.719000  0.7875000     1.643000       1.215000  
1 1 1 11 12 19 o 6.856000  0.4529000     6.763000  0.6572000     6.948000  0.6233000     -0.1854000     0.9058000 
1 1 1 11 12 20 o 2.851000  0.6303000     1.893000  0.8306000     3.809000  0.9483000     -1.916000      1.261000  
1 1 1 11 12 21 o 2.024000  0.5856000     1.785000  0.7906000     2.264000  0.8641000     -0.4781000     1.171000  
1 1 1 11 12 22 o 4.256000  0.4250000     4.320000  0.5942000     4.192000  0.6077000     0.1276000      0.8500000 
1 1 1 11 12 23 o 2.314000  0.5500000     2.012000  0.7811000     2.616000  0.7744000     -0.6033000     1.100000  
1 1 1 11 12 24 o 1.697000  0.5150000     1.305000  0.6243000     2.089000  0.8193000     -0.7843000     1.030000  
1 1 1 11 12 25 o 1.698000  0.5174000     1.472000  0.6829000     1.923000  0.7774000     -0.4511000     1.035000  
1 1 1 11 12 26 o 1.176000  0.4042000     1.278000  0.6098000     1.075000  0.5308000     0.2030000      0.8085000 
1 1 1 11 13 0  o 20.05000  0.3336000     20.05000  0.3336000     20.05000  0.3336000     0.000000       0.000000  
1 1 1 11 13 1  o 30.22000  0.4160000     30.42000  0.4828000     30.02000  0.6777000     0.4022000      0.8321000 
1 1 1 11 13 2  o 17.02000  0.1701000     17.31000  0.2434000     16.73000  0.2375000     0.5743000      0.3401000 
1 1 1 11 13 3  o 25.78000  0.2254000     25.85000  0.2956000     25.71000  0.3405000     0.1429000      0.4509000 
1 1 1 11 13 4  o 2.753000  0.1646000     3.000000  0.2187000     2.506000  0.2461000     0.4939000      0.3292000 
1 1 1 11 13 5  o 17.02000  0.1524000     17.03000  0.2159000     17.02000  0.2151000     0.6956000E-02  0.3048000 
1 1 1 11 13 6  o 4.751000  0.1326000     4.652000  0.1912000     4.850000  0.1838000     -0.1980000     0.2652000 
1 1 1 11 13 7  o 8.684000  0.1247000     8.614000  0.1773000     8.754000  0.1753000     -0.1396000     0.2493000 
1 1 1 11 13 8  o 4.007000  0.2041000     3.938000  0.3331000     4.077000  0.2360000     -0.1391000     0.4082000 
1 1 1 11 13 9  o 8.849000  0.1516000     8.934000  0.2099000     8.764000  0.2189000     0.1702000      0.3032000 
1 1 1 11 13 10 o 14.17000  0.1663000     13.87000  0.2326000     14.46000  0.2378000     -0.5835000     0.3326000 
1 1 1 11 13 11 o 20.30000  0.1967000     20.15000  0.2765000     20.44000  0.2799000     -0.2893000     0.3935000 
1 1 1 11 13 12 o 14.93000  0.1793000     15.33000  0.2518000     14.53000  0.2552000     0.7981000      0.3585000 
1 1 1 11 13 13 o 1.033000  0.3512000     0.9864000 0.4769000     1.080000  0.5155000     -0.9343000E-01 0.7023000 
1 1 1 11 13 14 o 18.38000  0.3415000     18.31000  0.3200000     18.44000  0.6034000     -0.1305000     0.6830000 
1 1 1 11 13 15 o 5.290000  0.4197000     4.868000  0.4296000     5.711000  0.7212000     -0.8437000     0.8394000 
1 1 1 11 13 16 o 6.524000  0.3784000     7.117000  0.4408000     5.931000  0.6152000     1.186000       0.7568000 
1 1 1 11 13 17 o 3.648000  0.5946000     3.370000  0.9035000     3.926000  0.7733000     -0.5566000     1.189000  
1 1 1 11 13 18 o 5.198000  0.4755000     5.635000  0.5983000     4.760000  0.7391000     0.8755000      0.9509000 
1 1 1 11 13 19 o 2.709000  0.7332000     2.708000  1.041000      2.710000  1.032000      -0.2051000E-02 1.466000  
1 1 1 11 13 20 o 2.599000  0.6519000     3.293000  0.9854000     1.905000  0.8539000     1.388000       1.304000  
1 1 1 11 13 21 o 2.306000  0.5931000     1.765000  0.7844000     2.846000  0.8898000     -1.081000      1.186000  
1 1 1 11 13 22 o 2.034000  0.5447000     2.342000  0.8076000     1.726000  0.7313000     0.6162000      1.089000  
1 1 1 11 13 23 f 1.455000  0.4706000     1.477000  0.6744000     1.433000  0.6566000     0.4332000E-01  0.9413000 
1 1 1 11 13 24 o 1.656000  0.5361000     1.529000  0.7242000     1.782000  0.7906000     -0.2527000     1.072000  
1 1 1 11 13 25 o 1.129000  0.3954000     1.050000  0.5267000     1.208000  0.5899000     -0.1583000     0.7908000 
1 1 1 11 13 26 o 1.024000  0.3602000     0.9964000 0.4975000     1.051000  0.5210000     -0.5486000E-01 0.7204000 
1 1 1 11 14 0  o 16.03000  0.2295000     16.03000  0.2295000     16.03000  0.2295000     -0.000000      0.000000  
1 1 1 11 14 1  o 19.61000  0.1903000     19.56000  0.2683000     19.66000  0.2699000     -0.9064000E-01 0.3806000 
1 1 1 11 14 2  o 10.16000  0.1194000     10.12000  0.1559000     10.21000  0.1808000     -0.8779000E-01 0.2388000 
1 1 1 11 14 3  o 11.19000  0.1259000     11.05000  0.1635000     11.34000  0.1916000     -0.2917000     0.2519000 
1 1 1 11 14 4  o 21.18000  0.1784000     20.95000  0.2500000     21.41000  0.2545000     -0.4653000     0.3567000 
1 1 1 11 14 5  o 16.94000  0.1524000     16.96000  0.2160000     16.91000  0.2151000     0.4843000E-01  0.3048000 
1 1 1 11 14 6  o 10.07000  0.1226000     10.12000  0.1740000     10.01000  0.1727000     0.1093000      0.2452000 
1 1 1 11 14 7  o 3.387000  0.1791000     3.251000  0.2647000     3.523000  0.2414000     -0.2712000     0.3583000 
1 1 1 11 14 8  o 10.96000  0.1754000     10.85000  0.2636000     11.08000  0.2314000     -0.2364000     0.3508000 
1 1 1 11 14 9  o 4.807000  0.2202000     4.621000  0.3044000     4.993000  0.3184000     -0.3722000     0.4405000 
1 1 1 11 14 10 o 9.277000  0.1624000     9.236000  0.2271000     9.319000  0.2321000     -0.8323000E-01 0.3248000 
1 1 1 11 14 11 o 16.55000  0.1797000     16.78000  0.2546000     16.31000  0.2537000     0.4687000      0.3594000 
1 1 1 11 14 12 o 22.47000  0.2139000     22.61000  0.3019000     22.32000  0.3032000     0.2890000      0.4279000 
1 1 1 11 14 13 f 2.793000  0.4133000     2.482000  0.6079000     3.104000  0.5602000     -0.6220000     0.8266000 
1 1 1 11 14 14 o 9.464000  0.2721000     9.154000  0.2817000     9.775000  0.4656000     -0.6214000     0.5442000 
1 1 1 11 14 15 f 8.451000  0.4156000     8.753000  0.7545000     8.149000  0.3486000     0.6039000      0.8312000 
1 1 1 11 14 16 o 5.338000  0.4336000     6.125000  0.3668000     4.551000  0.7858000     1.574000       0.8672000 
1 1 1 11 14 17 o 7.681000  0.3048000     7.697000  0.3192000     7.665000  0.5193000     0.3231000E-01  0.6095000 
1 1 1 11 14 18 o 7.829000  0.3251000     8.081000  0.4480000     7.577000  0.4713000     0.5042000      0.6503000 
1 1 1 11 14 19 o 3.662000  0.8160000     3.895000  1.174000      3.429000  1.133000      0.4663000      1.632000  
1 1 1 11 14 20 o 2.694000  0.6855000     2.756000  0.9746000     2.632000  0.9642000     0.1243000      1.371000  
1 1 1 11 14 21 o 2.824000  0.6129000     3.198000  0.8538000     2.451000  0.8796000     0.7467000      1.226000  
1 1 1 11 14 22 o 2.019000  0.5387000     2.311000  0.7936000     1.727000  0.7286000     0.5833000      1.077000  
1 1 1 11 14 23 o 1.942000  0.5082000     1.434000  0.6603000     2.449000  0.7728000     -1.015000      1.016000  
1 1 1 11 14 24 o 1.461000  0.4837000     1.580000  0.7241000     1.342000  0.6416000     0.2387000      0.9675000 
1 1 1 11 14 25 o 1.767000  0.5342000     1.497000  0.7083000     2.037000  0.8000000     -0.5406000     1.068000  
1 1 1 11 14 26 o 1.436000  0.4535000     1.129000  0.5531000     1.744000  0.7188000     -0.6146000     0.9070000 
1 1 1 11 15 0  o 6.307000  0.1704000     6.307000  0.1704000     6.307000  0.1704000     -0.000000      0.000000  
1 1 1 11 15 1  o 5.947000  0.1227000     5.852000  0.1724000     6.042000  0.1748000     -0.1897000     0.2455000 
1 1 1 11 15 2  o 9.343000  0.1184000     9.404000  0.1545000     9.283000  0.1794000     0.1211000      0.2367000 
1 1 1 11 15 3  o 8.216000  0.1174000     8.315000  0.1543000     8.116000  0.1770000     0.1991000      0.2348000 
1 1 1 11 15 4  o 5.118000  0.1216000     5.106000  0.1731000     5.130000  0.1708000     -0.2441000E-01 0.2432000 
1 1 1 11 15 5  o 11.96000  0.1266000     12.02000  0.1794000     11.90000  0.1786000     0.1208000      0.2532000 
1 1 1 11 15 6  o 8.768000  0.1212000     8.839000  0.1718000     8.696000  0.1711000     0.1432000      0.2425000 
1 1 1 11 15 7  f 2.412000  0.2526000     2.501000  0.3363000     2.323000  0.3770000     0.1784000      0.5052000 
1 1 1 11 15 8  o 3.075000  0.2596000     3.015000  0.3015000     3.136000  0.4226000     -0.1208000     0.5191000 
1 1 1 11 15 9  f 4.801000  0.4027000     4.424000  0.7388000     5.179000  0.3207000     -0.7553000     0.8054000 
1 1 1 11 15 10 o 2.518000  0.3608000     2.859000  0.4352000     2.176000  0.5756000     0.6832000      0.7216000 
1 1 1 11 15 11 o 13.98000  0.1717000     13.86000  0.2409000     14.11000  0.2447000     -0.2435000     0.3434000 
1 1 1 11 15 12 o 13.24000  0.1763000     13.52000  0.2459000     12.96000  0.2526000     0.5605000      0.3526000 
1 1 1 11 15 13 f 2.900000  0.4127000     2.896000  0.5740000     2.904000  0.5930000     -0.7912000E-02 0.8253000 
1 1 1 11 15 14 o 8.804000  0.2147000     8.672000  0.2874000     8.935000  0.3192000     -0.2630000     0.4295000 
1 1 1 11 15 15 o 9.169000  0.3004000     9.034000  0.5186000     9.303000  0.3034000     -0.2689000     0.6009000 
1 1 1 11 15 16 o 2.169000  0.5218000     1.647000  0.7058000     2.692000  0.7687000     -1.044000      1.044000  
1 1 1 11 15 17 o 4.448000  0.3705000     4.348000  0.5301000     4.549000  0.5177000     -0.2006000     0.7409000 
1 1 1 11 15 18 o 8.985000  0.3053000     9.289000  0.3144000     8.682000  0.5235000     0.6068000      0.6106000 
1 1 1 11 15 19 o 5.291000  0.6246000     6.344000  0.4503000     4.238000  1.165000      2.106000       1.249000  
1 1 1 11 15 20 o 2.090000  0.6534000     2.206000  0.9725000     1.974000  0.8729000     0.2316000      1.307000  
1 1 1 11 15 21 o 2.725000  0.5668000     1.869000  0.8067000     3.581000  0.7965000     -1.712000      1.134000  
1 1 1 11 15 22 o 2.147000  0.5510000     2.259000  0.7894000     2.035000  0.7688000     0.2241000      1.102000  
1 1 1 11 15 23 o 2.139000  0.5339000     1.863000  0.7480000     2.415000  0.7619000     -0.5525000     1.068000  
1 1 1 11 15 24 o 1.556000  0.5032000     1.457000  0.6856000     1.656000  0.7367000     -0.1986000     1.006000  
1 1 1 11 15 25 o 1.749000  0.5478000     1.623000  0.7504000     1.875000  0.7982000     -0.2527000     1.096000  
1 1 1 11 15 26 o 1.763000  0.5087000     2.043000  0.7713000     1.482000  0.6635000     0.5618000      1.017000  
1 1 1 11 16 0  o 13.84000  0.2121000     13.84000  0.2121000     13.84000  0.2121000     -0.000000      0.000000  
1 1 1 11 16 1  o 8.525000  0.1257000     8.565000  0.1764000     8.486000  0.1792000     0.7913000E-01  0.2515000 
1 1 1 11 16 2  o 7.185000  0.1173000     7.174000  0.1526000     7.197000  0.1782000     -0.2347000E-01 0.2346000 
1 1 1 11 16 3  o 13.47000  0.1411000     13.54000  0.1855000     13.39000  0.2126000     0.1544000      0.2822000 
1 1 1 11 16 4  o 16.01000  0.1464000     16.07000  0.2078000     15.95000  0.2064000     0.1259000      0.2929000 
1 1 1 11 16 5  o 6.604000  0.1310000     6.295000  0.1758000     6.913000  0.1942000     -0.6177000     0.2619000 
1 1 1 11 16 6  o 6.076000  0.1301000     6.152000  0.1836000     6.000000  0.1844000     0.1519000      0.2602000 
1 1 1 11 16 7  o 6.131000  0.1540000     5.993000  0.2381000     6.270000  0.1955000     -0.2774000     0.3080000 
1 1 1 11 16 8  o 6.598000  0.1423000     6.575000  0.2014000     6.621000  0.2012000     -0.4658000E-01 0.2846000 
1 1 1 11 16 9  o 2.609000  0.3390000     2.468000  0.5601000     2.751000  0.3821000     -0.2821000     0.6780000 
1 1 1 11 16 10 o 10.83000  0.1603000     10.87000  0.2531000     10.79000  0.1967000     0.8606000E-01  0.3205000 
1 1 1 11 16 11 o 11.80000  0.1947000     11.75000  0.2379000     11.86000  0.3082000     -0.1093000     0.3894000 
1 1 1 11 16 12 o 6.544000  0.2901000     6.357000  0.4074000     6.730000  0.4131000     -0.3728000     0.5803000 
1 1 1 11 16 13 o 7.990000  0.2042000     8.134000  0.2782000     7.845000  0.2991000     0.2887000      0.4084000 
1 1 1 11 16 14 o 2.346000  0.4782000     1.710000  0.6740000     2.982000  0.6784000     -1.272000      0.9563000 
1 1 1 11 16 15 o 1.602000  0.5170000     1.822000  0.8195000     1.381000  0.6304000     0.4407000      1.034000  
1 1 1 11 16 16 o 5.389000  0.3118000     5.445000  0.4228000     5.332000  0.4583000     0.1128000      0.6235000 
1 1 1 11 16 17 o 1.904000  0.5362000     1.871000  0.7602000     1.938000  0.7565000     -0.6690000E-01 1.072000  
1 1 1 11 16 18 o 2.594000  0.5822000     2.597000  0.7972000     2.591000  0.8487000     0.6618000E-02  1.164000  
1 1 1 11 16 19 o 4.262000  0.6611000     4.858000  0.5561000     3.665000  1.199000      1.193000       1.322000  
1 1 1 11 16 20 o 4.003000  0.6920000     3.417000  1.082000      4.589000  0.8629000     -1.172000      1.384000  
1 1 1 11 16 21 o 2.662000  0.5975000     2.779000  0.7309000     2.545000  0.9454000     0.2337000      1.195000  
1 1 1 11 16 22 o 1.506000  0.4764000     1.557000  0.6594000     1.455000  0.6879000     0.1020000      0.9529000 
1 1 1 11 16 23 o 1.826000  0.5274000     1.850000  0.7539000     1.801000  0.7377000     0.4898000E-01  1.055000  
1 1 1 11 16 24 o 1.359000  0.4556000     1.262000  0.6139000     1.456000  0.6732000     -0.1938000     0.9111000 
1 1 1 11 16 25 o 1.438000  0.4771000     1.305000  0.6239000     1.571000  0.7220000     -0.2666000     0.9542000 
1 1 1 11 16 26 o 1.341000  0.4428000     1.425000  0.6540000     1.256000  0.5970000     0.1694000      0.8855000 
1 1 1 11 17 0  o 15.91000  0.2344000     15.91000  0.2344000     15.91000  0.2344000     0.000000       0.000000  
1 1 1 11 17 1  o 6.411000  0.1438000     6.400000  0.1834000     6.422000  0.2216000     -0.2213000E-01 0.2877000 
1 1 1 11 17 2  o 7.667000  0.1208000     7.476000  0.1570000     7.859000  0.1836000     -0.3831000     0.2416000 
1 1 1 11 17 3  o 10.58000  0.1279000     10.63000  0.1681000     10.54000  0.1930000     0.9087000E-01  0.2559000 
1 1 1 11 17 4  o 11.79000  0.1263000     11.85000  0.1795000     11.73000  0.1777000     0.1214000      0.2526000 
1 1 1 11 17 5  o 8.223000  0.1213000     8.224000  0.1722000     8.222000  0.1708000     0.1141000E-02  0.2425000 
1 1 1 11 17 6  o 4.968000  0.1454000     4.958000  0.2065000     4.979000  0.2047000     -0.2082000E-01 0.2908000 
1 1 1 11 17 7  o 11.78000  0.1784000     11.49000  0.2709000     12.06000  0.2321000     -0.5654000     0.3567000 
1 1 1 11 17 8  o 10.48000  0.1806000     10.70000  0.2180000     10.25000  0.2879000     0.4420000      0.3611000 
1 1 1 11 17 9  o 11.98000  0.1480000     12.14000  0.2107000     11.82000  0.2079000     0.3230000      0.2960000 
1 1 1 11 17 10 o 5.225000  0.1763000     5.022000  0.2591000     5.428000  0.2393000     -0.4061000     0.3527000 
1 1 1 11 17 11 o 12.66000  0.1703000     12.67000  0.2363000     12.66000  0.2452000     0.1503000E-01  0.3406000 
1 1 1 11 17 12 o 11.16000  0.1751000     11.03000  0.2419000     11.28000  0.2531000     -0.2573000     0.3501000 
1 1 1 11 17 13 o 12.28000  0.2062000     12.41000  0.2863000     12.16000  0.2969000     0.2496000      0.4125000 
1 1 1 11 17 14 o 7.332000  0.2375000     7.010000  0.3141000     7.655000  0.3562000     -0.6451000     0.4749000 
1 1 1 11 17 15 o 2.268000  0.5201000     1.902000  0.7194000     2.633000  0.7514000     -0.7311000     1.040000  
1 1 1 11 17 16 o 10.71000  0.2163000     10.66000  0.3036000     10.75000  0.3080000     -0.9647000E-01 0.4325000 
1 1 1 11 17 17 o 6.823000  0.2850000     6.942000  0.3884000     6.703000  0.4173000     0.2387000      0.5701000 
1 1 1 11 17 18 o 1.970000  0.5554000     1.856000  0.7412000     2.085000  0.8274000     -0.2286000     1.111000  
1 1 1 11 17 19 o 1.313000  0.4449000     1.228000  0.5980000     1.397000  0.6589000     -0.1688000     0.8898000 
1 1 1 11 17 20 f 2.206000  0.5930000     1.802000  0.8654000     2.611000  0.8110000     -0.8091000     1.186000  
1 1 1 11 17 21 o 2.543000  0.5524000     2.496000  0.7630000     2.589000  0.7990000     -0.9334000E-01 1.105000  
1 1 1 11 17 22 o 2.794000  0.4804000     3.245000  0.5767000     2.342000  0.7685000     0.9027000      0.9608000 
1 1 1 11 17 23 o 1.302000  0.4371000     1.181000  0.5547000     1.423000  0.6756000     -0.2421000     0.8741000 
1 1 1 11 17 24 o 1.148000  0.3936000     1.159000  0.5480000     1.137000  0.5650000     0.2171000E-01  0.7871000 
1 1 1 11 17 25 o 1.589000  0.5133000     1.400000  0.6621000     1.779000  0.7846000     -0.3789000     1.027000  
1 1 1 11 17 26 o 1.062000  0.3748000     1.085000  0.5401000     1.039000  0.5197000     0.4576000E-01  0.7496000 
1 1 1 11 18 0  o 0.6424000 0.4266000     0.6424000 0.4266000     0.6424000 0.4266000     0.000000       0.000000  
1 1 1 11 18 1  o 8.259000  0.1450000     8.482000  0.1839000     8.035000  0.2243000     0.4466000      0.2900000 
1 1 1 11 18 2  o 17.76000  0.1695000     17.77000  0.2218000     17.75000  0.2565000     0.1630000E-01  0.3391000 
1 1 1 11 18 3  o 12.67000  0.1398000     12.55000  0.1812000     12.80000  0.2131000     -0.2591000     0.2797000 
1 1 1 11 18 4  o 5.166000  0.1328000     5.239000  0.1864000     5.093000  0.1892000     0.1462000      0.2656000 
1 1 1 11 18 5  o 4.050000  0.1578000     4.053000  0.2263000     4.047000  0.2200000     0.5180000E-02  0.3157000 
1 1 1 11 18 6  o 6.179000  0.1478000     6.214000  0.1922000     6.144000  0.2247000     0.7041000E-01  0.2957000 
1 1 1 11 18 7  o 4.141000  0.2086000     4.033000  0.2482000     4.250000  0.3352000     -0.2169000     0.4171000 
1 1 1 11 18 8  o 4.479000  0.2481000     4.772000  0.3552000     4.187000  0.3465000     0.5852000      0.4962000 
1 1 1 11 18 9  f 7.988000  0.1473000     7.883000  0.2067000     8.094000  0.2098000     -0.2103000     0.2945000 
1 1 1 11 18 10 o 5.279000  0.1818000     5.404000  0.2523000     5.154000  0.2619000     0.2498000      0.3637000 
1 1 1 11 18 11 o 8.351000  0.1758000     8.583000  0.2762000     8.120000  0.2175000     0.4630000      0.3515000 
1 1 1 11 18 12 o 3.487000  0.3424000     3.538000  0.4555000     3.436000  0.5113000     0.1021000      0.6848000 
1 1 1 11 18 13 o 5.714000  0.4835000     6.344000  0.3398000     5.084000  0.9054000     1.260000       0.9671000 
1 1 1 11 18 14 o 12.23000  0.2184000     12.53000  0.3001000     11.93000  0.3174000     0.5949000      0.4368000 
1 1 1 11 18 15 o 2.292000  0.5117000     2.681000  0.6965000     1.904000  0.7500000     0.7767000      1.023000  
1 1 1 11 18 16 o 4.817000  0.3514000     4.852000  0.4851000     4.781000  0.5085000     0.7173000E-01  0.7028000 
1 1 1 11 18 17 o 5.890000  0.3188000     5.653000  0.4524000     6.127000  0.4493000     -0.4746000     0.6376000 
1 1 1 11 18 18 o 1.773000  0.5315000     1.515000  0.6938000     2.030000  0.8054000     -0.5145000     1.063000  
1 1 1 11 18 19 o 2.674000  0.5665000     2.273000  0.8086000     3.076000  0.7936000     -0.8033000     1.133000  
1 1 1 11 18 20 f 2.359000  0.5813000     2.528000  0.8270000     2.190000  0.8172000     0.3377000      1.163000  
1 1 1 11 18 21 o 2.201000  0.5444000     1.856000  0.7414000     2.545000  0.7973000     -0.6894000     1.089000  
1 1 1 11 18 22 o 1.765000  0.4960000     2.044000  0.7364000     1.487000  0.6647000     0.5568000      0.9920000 
1 1 1 11 18 23 o 1.982000  0.5090000     1.673000  0.6958000     2.290000  0.7432000     -0.6171000     1.018000  
1 1 1 11 18 24 o 3.172000  0.4561000     3.505000  0.5864000     2.838000  0.6987000     0.6669000      0.9121000 
1 1 1 11 18 25 o 1.321000  0.4243000     1.117000  0.5272000     1.526000  0.6649000     -0.4090000     0.8486000 
1 1 1 11 19 0  o 3.784000  0.2417000     3.784000  0.2417000     3.784000  0.2417000     0.000000       0.000000  
1 1 1 11 19 1  o 8.599000  0.1479000     8.921000  0.1891000     8.276000  0.2274000     0.6453000      0.2957000 
1 1 1 11 19 2  o 9.778000  0.1285000     9.794000  0.1680000     9.763000  0.1945000     0.3171000E-01  0.2570000 
1 1 1 11 19 3  o 2.838000  0.2135000     2.728000  0.2824000     2.947000  0.3202000     -0.2191000     0.4269000 
1 1 1 11 19 4  o 8.732000  0.1219000     8.723000  0.1732000     8.742000  0.1716000     -0.1949000E-01 0.2439000 
1 1 1 11 19 5  o 2.928000  0.2069000     2.863000  0.3010000     2.993000  0.2841000     -0.1300000     0.4138000 
1 1 1 11 19 6  o 6.022000  0.1697000     6.124000  0.2717000     5.920000  0.2035000     0.2041000      0.3394000 
1 1 1 11 19 7  o 15.30000  0.1934000     15.38000  0.2199000     15.22000  0.3182000     0.1645000      0.3868000 
1 1 1 11 19 8  f 10.09000  0.1555000     10.31000  0.2395000     9.874000  0.1984000     0.4341000      0.3110000 
1 1 1 11 19 9  o 9.965000  0.1455000     9.995000  0.2054000     9.934000  0.2061000     0.6123000E-01  0.2910000 
1 1 1 11 19 10 o 2.873000  0.3126000     3.220000  0.3813000     2.527000  0.4955000     0.6931000      0.6252000 
1 1 1 11 19 11 o 9.332000  0.1580000     9.529000  0.2216000     9.135000  0.2252000     0.3941000      0.3160000 
1 1 1 11 19 12 o 11.22000  0.1822000     10.92000  0.2547000     11.52000  0.2605000     -0.6015000     0.3644000 
1 1 1 11 19 13 o 15.33000  0.2489000     15.32000  0.2689000     15.33000  0.4189000     -0.5460000E-02 0.4977000 
1 1 1 11 19 14 o 2.857000  0.6918000     3.400000  1.165000      2.313000  0.7467000     1.086000       1.384000  
1 1 1 11 19 15 o 5.586000  0.2933000     5.573000  0.4089000     5.598000  0.4205000     -0.2484000E-01 0.5865000 
1 1 1 11 19 16 o 2.339000  0.6202000     2.501000  0.9518000     2.177000  0.7953000     0.3234000      1.240000  
1 1 1 11 19 17 o 2.828000  0.5740000     2.976000  0.7844000     2.681000  0.8383000     0.2950000      1.148000  
1 1 1 11 19 18 o 3.030000  0.6005000     2.717000  0.8579000     3.343000  0.8403000     -0.6264000     1.201000  
1 1 1 11 19 19 o 2.352000  0.5476000     3.038000  0.8079000     1.666000  0.7395000     1.372000       1.095000  
1 1 1 11 19 20 o 2.576000  0.5460000     2.049000  0.7891000     3.103000  0.7547000     -1.054000      1.092000  
1 1 1 11 19 21 o 1.734000  0.4977000     2.087000  0.7652000     1.381000  0.6367000     0.7057000      0.9955000 
1 1 1 11 19 22 o 1.726000  0.4977000     1.537000  0.6622000     1.916000  0.7431000     -0.3797000     0.9954000 
1 1 1 11 19 23 f 2.284000  0.5235000     1.806000  0.7229000     2.762000  0.7572000     -0.9561000     1.047000  
1 1 1 11 19 24 o 1.537000  0.4722000     1.593000  0.6775000     1.481000  0.6579000     0.1119000      0.9444000 
1 1 1 11 19 25 o 1.453000  0.4499000     1.648000  0.6797000     1.258000  0.5896000     0.3899000      0.8998000 
1 1 1 11 20 0  o 12.62000  0.2115000     12.62000  0.2115000     12.62000  0.2115000     0.000000       0.000000  
1 1 1 11 20 1  o 7.475000  0.1524000     7.645000  0.1937000     7.306000  0.2354000     0.3384000      0.3048000 
1 1 1 11 20 2  o 7.967000  0.1286000     8.098000  0.1675000     7.837000  0.1951000     0.2616000      0.2571000 
1 1 1 11 20 3  o 2.954000  0.2192000     3.113000  0.2621000     2.795000  0.3513000     0.3180000      0.4383000 
1 1 1 11 20 4  o 9.215000  0.1259000     9.355000  0.1772000     9.075000  0.1790000     0.2797000      0.2519000 
1 1 1 11 20 5  o 7.582000  0.1315000     7.791000  0.1871000     7.372000  0.1848000     0.4185000      0.2629000 
1 1 1 11 20 6  o 7.725000  0.1603000     8.006000  0.1910000     7.445000  0.2576000     0.5603000      0.3207000 
1 1 1 11 20 7  o 6.574000  0.1924000     6.237000  0.2898000     6.912000  0.2531000     -0.6753000     0.3848000 
1 1 1 11 20 8  o 15.81000  0.1624000     15.44000  0.2257000     16.19000  0.2335000     -0.7459000     0.3247000 
1 1 1 11 20 9  o 15.25000  0.1624000     15.29000  0.2288000     15.21000  0.2304000     0.8149000E-01  0.3247000 
1 1 1 11 20 10 o 9.982000  0.1517000     10.09000  0.2132000     9.879000  0.2160000     0.2070000      0.3035000 
1 1 1 11 20 11 o 5.565000  0.2116000     6.068000  0.2544000     5.062000  0.3382000     1.006000       0.4232000 
1 1 1 11 20 12 o 1.842000  0.4455000     1.732000  0.6554000     1.952000  0.6037000     -0.2208000     0.8911000 
1 1 1 11 20 13 o 13.64000  0.1901000     13.85000  0.2663000     13.42000  0.2715000     0.4341000      0.3803000 
1 1 1 11 20 14 o 9.601000  0.2878000     9.804000  0.4923000     9.397000  0.2982000     0.4073000      0.5756000 
1 1 1 11 20 15 o 12.48000  0.2162000     12.70000  0.2888000     12.26000  0.3219000     0.4446000      0.4324000 
1 1 1 11 20 16 o 4.971000  0.3452000     4.733000  0.4937000     5.210000  0.4825000     -0.4771000     0.6903000 
1 1 1 11 20 17 f 9.303000  0.2464000     8.875000  0.3414000     9.731000  0.3554000     -0.8558000     0.4928000 
1 1 1 11 20 18 o 5.116000  0.5816000     5.160000  0.5643000     5.073000  1.017000      0.8664000E-01  1.163000  
1 1 1 11 20 19 o 2.405000  0.6024000     2.069000  0.8184000     2.740000  0.8841000     -0.6706000     1.205000  
1 1 1 11 20 20 o 3.375000  0.5083000     3.466000  0.7133000     3.283000  0.7244000     0.1830000      1.017000  
1 1 1 11 20 21 o 5.505000  0.3218000     5.332000  0.4817000     5.678000  0.4270000     -0.3465000     0.6437000 
1 1 1 11 20 22 o 1.642000  0.4880000     1.747000  0.7110000     1.537000  0.6686000     0.2101000      0.9759000 
1 1 1 11 20 23 o 1.145000  0.3922000     1.183000  0.5698000     1.107000  0.5392000     0.7566000E-01  0.7844000 
1 1 1 11 20 24 o 1.370000  0.4401000     1.155000  0.5558000     1.585000  0.6826000     -0.4293000     0.8803000 
1 1 1 11 20 25 o 1.581000  0.4746000     1.435000  0.6393000     1.727000  0.7015000     -0.2918000     0.9491000 
1 1 1 11 21 0  o 4.710000  0.2279000     4.710000  0.2279000     4.710000  0.2279000     0.000000       0.000000  
1 1 1 11 21 1  o 9.375000  0.1564000     9.334000  0.1988000     9.417000  0.2414000     -0.8381000E-01 0.3127000 
1 1 1 11 21 2  o 9.537000  0.1329000     9.644000  0.1741000     9.431000  0.2009000     0.2133000      0.2658000 
1 1 1 11 21 3  o 6.644000  0.1377000     6.667000  0.1799000     6.620000  0.2084000     0.4702000E-01  0.2754000 
1 1 1 11 21 4  o 1.397000  0.3278000     1.135000  0.4557000     1.660000  0.4715000     -0.5252000     0.6557000 
1 1 1 11 21 5  o 3.632000  0.2464000     3.795000  0.3642000     3.469000  0.3320000     0.3262000      0.4928000 
1 1 1 11 21 6  o 7.402000  0.1748000     7.375000  0.1951000     7.429000  0.2900000     -0.5454000E-01 0.3495000 
1 1 1 11 21 7  o 10.97000  0.1629000     11.04000  0.2401000     10.90000  0.2201000     0.1422000      0.3257000 
1 1 1 11 21 8  o 7.695000  0.1459000     7.787000  0.2047000     7.603000  0.2079000     0.1837000      0.2918000 
1 1 1 11 21 9  o 5.144000  0.1802000     5.118000  0.2553000     5.170000  0.2544000     -0.5147000E-01 0.3604000 
1 1 1 11 21 10 o 8.727000  0.1574000     8.680000  0.2202000     8.774000  0.2249000     -0.9377000E-01 0.3148000 
1 1 1 11 21 11 o 8.518000  0.1652000     8.752000  0.2288000     8.283000  0.2384000     0.4685000      0.3304000 
1 1 1 11 21 12 o 8.385000  0.2076000     8.179000  0.3341000     8.592000  0.2465000     -0.4125000     0.4152000 
1 1 1 11 21 13 o 12.36000  0.2062000     12.31000  0.2692000     12.40000  0.3124000     -0.8912000E-01 0.4124000 
1 1 1 11 21 14 o 13.02000  0.1995000     13.13000  0.2782000     12.91000  0.2860000     0.2158000      0.3990000 
1 1 1 11 21 15 o 12.17000  0.2079000     12.41000  0.2888000     11.94000  0.2992000     0.4712000      0.4158000 
1 1 1 11 21 16 o 8.140000  0.2491000     7.984000  0.3512000     8.297000  0.3534000     -0.3128000     0.4982000 
1 1 1 11 21 17 o 3.122000  0.5771000     2.962000  0.7984000     3.281000  0.8334000     -0.3194000     1.154000  
1 1 1 11 21 18 o 3.156000  0.7284000     2.347000  0.8479000     3.966000  1.185000      -1.619000      1.457000  
1 1 1 11 21 19 o 2.802000  0.7576000     3.399000  1.256000      2.205000  0.8479000     1.193000       1.515000  
1 1 1 11 21 20 o 2.187000  0.6010000     2.025000  0.8775000     2.350000  0.8213000     -0.3246000     1.202000  
1 1 1 11 21 21 o 2.761000  0.5231000     3.064000  0.7207000     2.457000  0.7584000     0.6070000      1.046000  
1 1 1 11 21 22 o 1.711000  0.4878000     2.023000  0.7393000     1.399000  0.6367000     0.6243000      0.9756000 
1 1 1 11 21 23 o 1.877000  0.5490000     2.220000  0.7833000     1.533000  0.7695000     0.6867000      1.098000  
1 1 1 11 21 24 o 1.043000  0.3645000     0.9899000 0.4927000     1.097000  0.5372000     -0.1072000     0.7289000 
1 1 1 11 21 25 o 1.165000  0.3938000     1.244000  0.5840000     1.085000  0.5284000     0.1595000      0.7875000 
1 1 1 11 22 0  f 11.57000  0.2111000     11.57000  0.2111000     11.57000  0.2111000     -0.000000      0.000000  
1 1 1 11 22 1  o 8.145000  0.1596000     8.026000  0.2045000     8.265000  0.2451000     -0.2396000     0.3192000 
1 1 1 11 22 2  o 1.507000  0.3236000     1.032000  0.4343000     1.982000  0.4798000     -0.9493000     0.6471000 
1 1 1 11 22 3  o 18.06000  0.1787000     17.63000  0.2291000     18.50000  0.2743000     -0.8678000     0.3574000 
1 1 1 11 22 4  o 2.358000  0.3223000     2.498000  0.5042000     2.218000  0.4017000     0.2801000      0.6446000 
1 1 1 11 22 5  f 4.983000  0.2228000     4.765000  0.2272000     5.200000  0.3834000     -0.4347000     0.4457000 
1 1 1 11 22 6  o 16.90000  0.2013000     17.20000  0.3303000     16.60000  0.2303000     0.6046000      0.4026000 
1 1 1 11 22 7  o 8.702000  0.1416000     8.814000  0.1999000     8.591000  0.2005000     0.2233000      0.2831000 
1 1 1 11 22 8  o 7.568000  0.1512000     7.743000  0.2099000     7.392000  0.2176000     0.3505000      0.3024000 
1 1 1 11 22 9  o 8.224000  0.2141000     8.471000  0.2165000     7.976000  0.3693000     0.4948000      0.4281000 
1 1 1 11 22 10 f 12.51000  0.1597000     12.73000  0.2270000     12.29000  0.2248000     0.4431000      0.3195000 
1 1 1 11 22 11 o 10.32000  0.1598000     10.01000  0.2230000     10.64000  0.2291000     -0.6348000     0.3197000 
1 1 1 11 22 12 o 16.59000  0.2286000     16.95000  0.2904000     16.23000  0.3532000     0.7247000      0.4572000 
1 1 1 11 22 13 o 15.20000  0.2400000     14.88000  0.3557000     15.51000  0.3224000     -0.6268000     0.4801000 
1 1 1 11 22 14 o 13.27000  0.2000000     13.31000  0.2820000     13.24000  0.2836000     0.6993000E-01  0.3999000 
1 1 1 11 22 15 o 5.774000  0.2939000     5.751000  0.4025000     5.797000  0.4283000     -0.4554000E-01 0.5878000 
1 1 1 11 22 16 o 4.773000  0.3797000     4.253000  0.5786000     5.292000  0.4919000     -1.039000      0.7594000 
1 1 1 11 22 17 o 5.296000  0.3688000     4.702000  0.5602000     5.890000  0.4799000     -1.188000      0.7377000 
1 1 1 11 22 18 o 4.241000  0.6240000     5.288000  0.4947000     3.194000  1.146000      2.094000       1.248000  
1 1 1 11 22 19 o 3.414000  0.7615000     3.362000  1.317000      3.467000  0.7650000     -0.1051000     1.523000  
1 1 1 11 22 20 o 1.571000  0.4962000     1.421000  0.6581000     1.721000  0.7428000     -0.2998000     0.9924000 
1 1 1 11 22 21 o 1.468000  0.4703000     1.515000  0.6762000     1.421000  0.6539000     0.9374000E-01  0.9406000 
1 1 1 11 22 22 f 1.523000  0.4731000     1.717000  0.7205000     1.328000  0.6134000     0.3892000      0.9462000 
1 1 1 11 22 23 o 1.408000  0.4610000     1.553000  0.6720000     1.264000  0.6314000     0.2891000      0.9221000 
1 1 1 11 22 24 o 1.294000  0.4555000     1.426000  0.7196000     1.162000  0.5588000     0.2643000      0.9111000 
1 1 1 11 22 25 o 1.573000  0.4712000     1.342000  0.6111000     1.803000  0.7174000     -0.4609000     0.9424000 
1 1 1 11 23 0  o 2.995000  0.3407000     2.995000  0.3407000     2.995000  0.3407000     -0.000000      0.000000  
1 1 1 11 23 1  o 10.79000  0.1591000     10.84000  0.1853000     10.74000  0.2587000     0.9403000E-01  0.3183000 
1 1 1 11 23 2  o 9.144000  0.1394000     9.170000  0.1810000     9.119000  0.2121000     0.5010000E-01  0.2788000 
1 1 1 11 23 3  o 5.575000  0.1855000     5.697000  0.2854000     5.453000  0.2369000     0.2442000      0.3709000 
1 1 1 11 23 4  o 1.683000  0.3881000     1.850000  0.4590000     1.517000  0.6260000     0.3326000      0.7763000 
1 1 1 11 23 5  o 4.186000  0.2338000     4.343000  0.3376000     4.028000  0.3236000     0.3150000      0.4676000 
1 1 1 11 23 6  o 2.824000  0.2765000     2.337000  0.4238000     3.311000  0.3551000     -0.9739000     0.5529000 
1 1 1 11 23 7  o 10.43000  0.1426000     10.42000  0.2019000     10.44000  0.2014000     -0.1303000E-01 0.2852000 
1 1 1 11 23 8  o 18.87000  0.1802000     18.47000  0.2514000     19.27000  0.2583000     -0.7980000     0.3604000 
1 1 1 11 23 9  o 2.075000  0.3704000     2.447000  0.4808000     1.702000  0.5635000     0.7455000      0.7407000 
1 1 1 11 23 10 o 13.94000  0.1639000     13.99000  0.2312000     13.89000  0.2324000     0.9727000E-01  0.3279000 
1 1 1 11 23 11 o 20.19000  0.1950000     19.85000  0.2724000     20.53000  0.2791000     -0.6787000     0.3900000 
1 1 1 11 23 12 o 14.89000  0.2102000     14.61000  0.2444000     15.17000  0.3421000     -0.5605000     0.4205000 
1 1 1 11 23 13 o 6.616000  0.2577000     6.863000  0.4169000     6.368000  0.3030000     0.4951000      0.5154000 
1 1 1 11 23 14 o 6.936000  0.2537000     6.618000  0.3684000     7.254000  0.3490000     -0.6355000     0.5074000 
1 1 1 11 23 15 o 3.465000  0.4585000     3.765000  0.5791000     3.164000  0.7109000     0.6007000      0.9169000 
1 1 1 11 23 16 o 2.302000  0.5757000     2.244000  0.7967000     2.360000  0.8313000     -0.1158000     1.151000  
1 1 1 11 23 17 o 5.579000  0.3408000     5.114000  0.4933000     6.045000  0.4703000     -0.9311000     0.6816000 
1 1 1 11 23 18 o 1.802000  0.5362000     2.060000  0.8104000     1.543000  0.7022000     0.5167000      1.072000  
1 1 1 11 23 19 o 1.819000  0.5723000     2.043000  0.8919000     1.595000  0.7174000     0.4472000      1.145000  
1 1 1 11 23 20 o 4.312000  0.4099000     4.109000  0.5984000     4.515000  0.5603000     -0.4064000     0.8198000 
1 1 1 11 23 21 o 2.210000  0.5436000     1.974000  0.7642000     2.446000  0.7732000     -0.4720000     1.087000  
1 1 1 11 23 22 o 1.427000  0.4613000     1.335000  0.6246000     1.519000  0.6790000     -0.1837000     0.9226000 
1 1 1 11 23 23 o 1.338000  0.4380000     1.072000  0.5256000     1.603000  0.7009000     -0.5311000     0.8761000 
1 1 1 11 23 24 o 1.261000  0.4458000     1.608000  0.7645000     0.9148000 0.4590000     0.6929000      0.8917000 
1 1 1 11 23 25 o 1.379000  0.4411000     1.349000  0.6158000     1.409000  0.6317000     -0.6071000E-01 0.8822000 
1 1 1 11 24 0  o 11.77000  0.2218000     11.77000  0.2218000     11.77000  0.2218000     -0.000000      0.000000  
1 1 1 11 24 1  o 6.173000  0.1802000     6.021000  0.2339000     6.324000  0.2742000     -0.3029000     0.3604000 
1 1 1 11 24 2  o 8.653000  0.1857000     8.300000  0.2626000     9.007000  0.2627000     -0.7069000     0.3714000 
1 1 1 11 24 3  o 8.575000  0.1892000     8.575000  0.1892000     ?         ?             ?              ?         
1 1 1 11 24 4  o 15.31000  0.2001000     15.39000  0.3076000     15.23000  0.2561000     0.1607000      0.4002000 
1 1 1 11 24 5  o 6.887000  0.1435000     6.974000  0.2037000     6.799000  0.2022000     0.1750000      0.2870000 
1 1 1 11 24 6  o 8.720000  0.1422000     8.913000  0.1995000     8.526000  0.2028000     0.3870000      0.2845000 
1 1 1 11 24 7  o 23.79000  0.2086000     23.68000  0.2935000     23.90000  0.2964000     -0.2204000     0.4172000 
1 1 1 11 24 8  o 13.09000  0.1546000     13.12000  0.2192000     13.06000  0.2179000     0.5880000E-01  0.3091000 
1 1 1 11 24 9  o 12.35000  0.1560000     12.27000  0.2191000     12.43000  0.2223000     -0.1638000     0.3121000 
1 1 1 11 24 10 o 13.47000  0.1638000     13.47000  0.2307000     13.47000  0.2324000     0.3386000E-02  0.3275000 
1 1 1 11 24 11 o 7.232000  0.2218000     7.098000  0.3579000     7.365000  0.2623000     -0.2676000     0.4437000 
1 1 1 11 24 12 o 3.583000  0.3534000     4.166000  0.3683000     3.000000  0.6032000     1.166000       0.7067000 
1 1 1 11 24 13 o 8.996000  0.1835000     8.905000  0.2621000     9.088000  0.2568000     -0.1825000     0.3669000 
1 1 1 11 24 14 o 12.10000  0.2134000     12.27000  0.3117000     11.93000  0.2914000     0.3454000      0.4267000 
1 1 1 11 24 15 o 12.42000  0.2101000     12.39000  0.2927000     12.46000  0.3016000     -0.7249000E-01 0.4203000 
1 1 1 11 24 16 o 5.687000  0.3320000     5.325000  0.4724000     6.050000  0.4667000     -0.7258000     0.6640000 
1 1 1 11 24 17 o 5.755000  0.3699000     5.542000  0.5391000     5.967000  0.5067000     -0.4247000     0.7398000 
1 1 1 11 24 18 o 1.769000  0.5412000     1.697000  0.7348000     1.840000  0.7948000     -0.1435000     1.082000  
1 1 1 11 24 19 o 2.158000  0.5975000     1.539000  0.6884000     2.776000  0.9767000     -1.237000      1.195000  
1 1 1 11 24 20 o 2.188000  0.5095000     2.853000  0.7503000     1.523000  0.6895000     1.330000       1.019000  
1 1 1 11 24 21 o 2.587000  0.5198000     3.105000  0.6997000     2.069000  0.7688000     1.036000       1.040000  
1 1 1 11 24 22 o 1.486000  0.4677000     1.660000  0.7058000     1.312000  0.6139000     0.3485000      0.9354000 
1 1 1 11 24 23 f 1.333000  0.4348000     1.423000  0.6428000     1.242000  0.5857000     0.1810000      0.8697000 
1 1 1 11 24 24 o 1.505000  0.4791000     1.426000  0.6786000     1.583000  0.6765000     -0.1569000     0.9582000 
1 1 1 11 24 25 o 1.309000  0.4335000     1.370000  0.6309000     1.247000  0.5948000     0.1229000      0.8671000 
1 1 1 11 25 1  o 8.144000  0.2683000     8.144000  0.2683000     ?         ?             ?              ?         
1 1 1 11 25 2  o 14.26000  0.2939000     14.26000  0.2939000     ?         ?             ?              ?         
1 1 1 11 25 3  o 5.709000  0.1933000     5.769000  0.2973000     5.650000  0.2472000     0.1192000      0.3867000 
1 1 1 11 25 4  o 15.59000  0.1570000     15.72000  0.2221000     15.45000  0.2220000     0.2767000      0.3140000 
1 1 1 11 25 5  o 17.41000  0.1677000     17.38000  0.2369000     17.44000  0.2375000     -0.6019000E-01 0.3355000 
1 1 1 11 25 6  o 12.81000  0.1487000     12.86000  0.2100000     12.76000  0.2107000     0.9812000E-01  0.2975000 
1 1 1 11 25 7  o 15.12000  0.1601000     14.93000  0.2250000     15.30000  0.2277000     -0.3703000     0.3201000 
1 1 1 11 25 8  o 15.98000  0.1668000     15.82000  0.2360000     16.14000  0.2358000     -0.3233000     0.3336000 
1 1 1 11 25 9  o 22.13000  0.2030000     22.03000  0.2867000     22.22000  0.2873000     -0.1912000     0.4059000 
1 1 1 11 25 10 o 7.192000  0.1747000     7.008000  0.2487000     7.377000  0.2456000     -0.3686000     0.3495000 
1 1 1 11 25 11 o 3.415000  0.3686000     3.496000  0.4520000     3.334000  0.5825000     0.1616000      0.7373000 
1 1 1 11 25 12 o 12.17000  0.2231000     12.08000  0.2661000     12.26000  0.3581000     -0.1761000     0.4462000 
1 1 1 11 25 13 o 6.247000  0.2161000     6.349000  0.3002000     6.144000  0.3109000     0.2048000      0.4322000 
1 1 1 11 25 14 o 2.002000  0.4817000     2.222000  0.6752000     1.782000  0.6873000     0.4399000      0.9635000 
1 1 1 11 25 15 o 7.245000  0.2611000     7.234000  0.3557000     7.256000  0.3823000     -0.2278000E-01 0.5222000 
1 1 1 11 25 16 o 2.902000  0.5365000     2.264000  0.7950000     3.540000  0.7207000     -1.276000      1.073000  
1 1 1 11 25 17 o 1.987000  0.6121000     2.196000  0.8576000     1.778000  0.8736000     0.4172000      1.224000  
1 1 1 11 25 18 o 2.864000  0.6094000     2.478000  0.8712000     3.250000  0.8524000     -0.7713000     1.219000  
1 1 1 11 25 19 o 2.729000  0.5313000     2.299000  0.7766000     3.159000  0.7254000     -0.8600000     1.063000  
1 1 1 11 25 20 o 1.762000  0.5125000     1.734000  0.7161000     1.790000  0.7333000     -0.5645000E-01 1.025000  
1 1 1 11 25 21 o 1.794000  0.5137000     1.765000  0.7201000     1.823000  0.7329000     -0.5827000E-01 1.027000  
1 1 1 11 25 22 o 1.795000  0.5275000     1.558000  0.6915000     2.032000  0.7967000     -0.4742000     1.055000  
1 1 1 11 25 23 o 1.485000  0.4629000     1.729000  0.7123000     1.241000  0.5914000     0.4880000      0.9258000 
1 1 1 11 25 24 o 1.171000  0.3950000     0.9504000 0.4751000     1.391000  0.6312000     -0.4402000     0.7900000 
1 1 1 11 26 0  o 0.5862000 0.4160000     0.5862000 0.4160000     0.5862000 0.4160000     -0.000000      0.000000  
1 1 1 11 26 1  o 4.550000  0.2155000     4.535000  0.2797000     4.564000  0.3278000     -0.2912000E-01 0.4309000 
1 1 1 11 26 2  o 11.60000  0.1698000     11.51000  0.1963000     11.70000  0.2772000     -0.1971000     0.3397000 
1 1 1 11 26 3  o 11.52000  0.1518000     11.62000  0.1986000     11.42000  0.2296000     0.1993000      0.3036000 
1 1 1 11 26 4  f 12.30000  0.1444000     12.24000  0.2029000     12.36000  0.2056000     -0.1183000     0.2888000 
1 1 1 11 26 5  f 3.759000  0.2083000     3.750000  0.2924000     3.768000  0.2968000     -0.1768000E-01 0.4166000 
1 1 1 11 26 6  o 23.75000  0.2079000     23.77000  0.2938000     23.72000  0.2943000     0.4513000E-01  0.4159000 
1 1 1 11 26 7  o 15.55000  0.1633000     15.44000  0.2303000     15.67000  0.2314000     -0.2216000     0.3265000 
1 1 1 11 26 8  o 12.58000  0.1549000     12.40000  0.2192000     12.77000  0.2188000     -0.3730000     0.3098000 
1 1 1 11 26 9  o 27.51000  0.2376000     27.91000  0.3394000     27.10000  0.3325000     0.8052000      0.4752000 
1 1 1 11 26 10 o 10.43000  0.1805000     10.72000  0.2782000     10.13000  0.2300000     0.5909000      0.3610000 
1 1 1 11 26 11 o 14.75000  0.1830000     14.80000  0.2444000     14.71000  0.2726000     0.9231000E-01  0.3661000 
1 1 1 11 26 12 o 7.377000  0.2364000     7.207000  0.3877000     7.547000  0.2706000     -0.3410000     0.4728000 
1 1 1 11 26 13 o 11.84000  0.1788000     11.98000  0.2492000     11.71000  0.2564000     0.2697000      0.3575000 
1 1 1 11 26 14 o 9.107000  0.1935000     9.273000  0.2684000     8.941000  0.2789000     0.3319000      0.3871000 
1 1 1 11 26 15 o 3.639000  0.4319000     3.836000  0.6396000     3.443000  0.5805000     0.3930000      0.8637000 
1 1 1 11 26 16 o 5.639000  0.3343000     5.577000  0.4591000     5.700000  0.4861000     -0.1222000     0.6686000 
1 1 1 11 26 17 o 1.965000  0.5843000     2.225000  0.8248000     1.704000  0.8278000     0.5212000      1.169000  
1 1 1 11 26 18 o 3.401000  0.7759000     4.159000  1.303000      2.642000  0.8429000     1.517000       1.552000  
1 1 1 11 26 19 o 2.048000  0.5851000     2.063000  0.8742000     2.032000  0.7780000     0.3142000E-01  1.170000  
1 1 1 11 26 20 o 2.327000  0.5258000     2.849000  0.7515000     1.805000  0.7354000     1.044000       1.052000  
1 1 1 11 26 21 f 1.690000  0.5004000     1.467000  0.6605000     1.913000  0.7517000     -0.4460000     1.001000  
1 1 1 11 26 22 f 4.053000  0.5792000     4.581000  0.5437000     3.525000  1.023000      1.056000       1.158000  
1 1 1 11 26 23 o 1.495000  0.4767000     1.577000  0.6992000     1.413000  0.6483000     0.1643000      0.9535000 
1 1 1 11 26 24 o 1.068000  0.3701000     1.086000  0.5314000     1.050000  0.5154000     0.3609000E-01  0.7403000 
1 1 1 11 27 0  f 1.012000  0.6023000     1.012000  0.6023000     1.012000  0.6023000     0.000000       0.000000  
1 1 1 11 27 1  o 20.21000  0.2239000     20.15000  0.2583000     20.27000  0.3658000     -0.1208000     0.4478000 
1 1 1 11 27 2  o 6.545000  0.1792000     6.369000  0.2071000     6.720000  0.2926000     -0.3509000     0.3585000 
1 1 1 11 27 3  o 16.53000  0.1637000     16.52000  0.2295000     16.55000  0.2336000     -0.3356000E-01 0.3275000 
1 1 1 11 27 4  o 14.34000  0.1538000     14.49000  0.2173000     14.18000  0.2177000     0.3111000      0.3076000 
1 1 1 11 27 5  o 19.19000  0.1792000     19.28000  0.2533000     19.09000  0.2534000     0.1840000      0.3583000 
1 1 1 11 27 6  o 14.66000  0.1581000     14.67000  0.2237000     14.64000  0.2235000     0.3465000E-01  0.3163000 
1 1 1 11 27 7  o 6.704000  0.1615000     6.633000  0.2307000     6.775000  0.2261000     -0.1419000     0.3230000 
1 1 1 11 27 8  o 5.018000  0.1955000     5.113000  0.2711000     4.923000  0.2816000     0.1898000      0.3909000 
1 1 1 11 27 9  o 11.57000  0.1597000     11.59000  0.2254000     11.56000  0.2263000     0.3467000E-01  0.3194000 
1 1 1 11 27 10 o 9.452000  0.2162000     9.571000  0.3298000     9.334000  0.2796000     0.2378000      0.4324000 
1 1 1 11 27 11 o 11.69000  0.2153000     11.58000  0.2392000     11.81000  0.3581000     -0.2239000     0.4306000 
1 1 1 11 27 12 o 8.035000  0.1882000     8.463000  0.2598000     7.606000  0.2724000     0.8575000      0.3764000 
1 1 1 11 27 13 o 6.052000  0.2373000     6.064000  0.3410000     6.041000  0.3300000     0.2270000E-01  0.4746000 
1 1 1 11 27 14 o 4.488000  0.2996000     4.346000  0.4316000     4.630000  0.4158000     -0.2846000     0.5993000 
1 1 1 11 27 15 o 7.930000  0.2140000     8.194000  0.2917000     7.667000  0.3131000     0.5279000      0.4280000 
1 1 1 11 27 16 o 6.446000  0.3103000     6.463000  0.4243000     6.429000  0.4530000     0.3393000E-01  0.6207000 
1 1 1 11 27 17 o 2.121000  0.5747000     2.229000  0.8219000     2.013000  0.8034000     0.2158000      1.149000  
1 1 1 11 27 18 o 1.850000  0.5625000     1.742000  0.8056000     1.958000  0.7853000     -0.2164000     1.125000  
1 1 1 11 27 19 o 1.791000  0.5156000     1.491000  0.6718000     2.091000  0.7823000     -0.6001000     1.031000  
1 1 1 11 27 20 o 2.003000  0.5344000     1.979000  0.7529000     2.028000  0.7587000     -0.4876000E-01 1.069000  
1 1 1 11 27 21 o 2.077000  0.5249000     1.698000  0.7101000     2.457000  0.7732000     -0.7586000     1.050000  
1 1 1 11 27 22 o 2.144000  0.6396000     1.885000  0.7407000     2.402000  1.043000      -0.5167000     1.279000  
1 1 1 11 27 23 o 1.714000  0.5639000     1.803000  0.8777000     1.625000  0.7083000     0.1776000      1.128000  
1 1 1 11 27 24 o 1.100000  0.3782000     0.9895000 0.4915000     1.211000  0.5749000     -0.2211000     0.7564000 
1 1 1 11 28 0  o 17.11000  0.2701000     17.11000  0.2701000     17.11000  0.2701000     -0.000000      0.000000  
1 1 1 11 28 1  o 2.831000  0.3236000     2.605000  0.4115000     3.058000  0.4996000     -0.4528000     0.6472000 
1 1 1 11 28 2  f 16.54000  0.1981000     17.19000  0.2358000     15.90000  0.3185000     1.294000       0.3963000 
1 1 1 11 28 3  o 10.02000  0.1437000     9.932000  0.2008000     10.11000  0.2056000     -0.1779000     0.2874000 
1 1 1 11 28 4  o 7.451000  0.1488000     7.665000  0.2047000     7.237000  0.2161000     0.4275000      0.2977000 
1 1 1 11 28 5  f 1.431000  0.3744000     1.443000  0.5319000     1.420000  0.5272000     0.2306000E-01  0.7489000 
1 1 1 11 28 6  o 21.87000  0.1979000     21.91000  0.2808000     21.84000  0.2788000     0.6941000E-01  0.3957000 
1 1 1 11 28 7  o 9.361000  0.1515000     9.592000  0.2140000     9.129000  0.2146000     0.4630000      0.3031000 
1 1 1 11 28 8  o 10.63000  0.1553000     10.67000  0.2200000     10.59000  0.2193000     0.7428000E-01  0.3107000 
1 1 1 11 28 9  o 7.947000  0.1716000     7.650000  0.2440000     8.244000  0.2414000     -0.5938000     0.3433000 
1 1 1 11 28 10 o 12.01000  0.1992000     11.86000  0.2341000     12.16000  0.3223000     -0.2918000     0.3984000 
1 1 1 11 28 11 o 11.15000  0.2276000     11.62000  0.3443000     10.68000  0.2977000     0.9422000      0.4552000 
1 1 1 11 28 12 o 5.403000  0.2394000     5.338000  0.3384000     5.468000  0.3387000     -0.1301000     0.4788000 
1 1 1 11 28 13 o 1.288000  0.4080000     1.048000  0.5044000     1.528000  0.6415000     -0.4795000     0.8160000 
1 1 1 11 28 14 o 10.01000  0.1945000     9.726000  0.2730000     10.30000  0.2771000     -0.5752000     0.3890000 
1 1 1 11 28 15 o 1.572000  0.4723000     1.634000  0.6760000     1.511000  0.6598000     0.1232000      0.9446000 
1 1 1 11 28 16 f 4.729000  0.4141000     4.812000  0.6745000     4.645000  0.4806000     0.1672000      0.8282000 
1 1 1 11 28 17 o 6.770000  0.3189000     6.736000  0.4217000     6.805000  0.4785000     -0.6856000E-01 0.6378000 
1 1 1 11 28 18 o 4.086000  0.4553000     5.140000  0.4824000     3.031000  0.7722000     2.109000       0.9105000 
1 1 1 11 28 19 o 1.627000  0.5007000     1.722000  0.7277000     1.531000  0.6880000     0.1908000      1.001000  
1 1 1 11 28 20 o 3.067000  0.4872000     3.525000  0.6183000     2.609000  0.7531000     0.9159000      0.9745000 
1 1 1 11 28 21 o 2.172000  0.5304000     1.976000  0.7466000     2.368000  0.7536000     -0.3923000     1.061000  
1 1 1 11 28 22 o 1.366000  0.4641000     1.184000  0.5686000     1.547000  0.7335000     -0.3630000     0.9281000 
1 1 1 11 28 23 o 1.378000  0.4890000     1.676000  0.8235000     1.080000  0.5276000     0.5961000      0.9780000 
1 1 1 11 28 24 o 2.261000  0.5180000     2.579000  0.7244000     1.943000  0.7407000     0.6355000      1.036000  
1 1 1 11 29 0  o 3.053000  0.4260000     3.053000  0.4260000     3.053000  0.4260000     -0.000000      0.000000  
1 1 1 11 29 1  o 3.159000  0.3027000     3.319000  0.3237000     2.998000  0.5116000     0.3214000      0.6054000 
1 1 1 11 29 2  o 13.66000  0.1837000     13.87000  0.2147000     13.46000  0.2983000     0.4181000      0.3675000 
1 1 1 11 29 3  o 21.83000  0.1958000     21.81000  0.2757000     21.86000  0.2781000     -0.4573000E-01 0.3916000 
1 1 1 11 29 4  o 11.90000  0.1471000     11.86000  0.2069000     11.95000  0.2091000     -0.8899000E-01 0.2942000 
1 1 1 11 29 5  o 13.99000  0.1557000     13.83000  0.2183000     14.15000  0.2220000     -0.3216000     0.3113000 
1 1 1 11 29 6  o 14.28000  0.1589000     14.55000  0.2260000     14.01000  0.2234000     0.5444000      0.3178000 
1 1 1 11 29 7  o 9.555000  0.1545000     9.522000  0.2191000     9.588000  0.2178000     -0.6520000E-01 0.3089000 
1 1 1 11 29 8  o 10.95000  0.1700000     11.06000  0.2248000     10.83000  0.2552000     0.2304000      0.3401000 
1 1 1 11 29 9  o 8.014000  0.2220000     8.373000  0.3339000     7.655000  0.2926000     0.7176000      0.4440000 
1 1 1 11 29 10 o 13.99000  0.2163000     14.08000  0.2435000     13.90000  0.3575000     0.1793000      0.4325000 
1 1 1 11 29 11 o 2.247000  0.4361000     2.610000  0.5916000     1.883000  0.6409000     0.7273000      0.8722000 
1 1 1 11 29 12 o 5.345000  0.2505000     5.835000  0.3164000     4.855000  0.3885000     0.9806000      0.5011000 
1 1 1 11 29 13 f 4.578000  0.2895000     4.493000  0.4093000     4.662000  0.4095000     -0.1696000     0.5790000 
1 1 1 11 29 14 o 9.780000  0.1969000     9.277000  0.2809000     10.28000  0.2761000     -1.006000      0.3939000 
1 1 1 11 29 15 o 8.242000  0.2190000     8.296000  0.3056000     8.188000  0.3137000     0.1087000      0.4379000 
1 1 1 11 29 16 o 1.815000  0.5544000     2.144000  0.8617000     1.485000  0.6979000     0.6586000      1.109000  
1 1 1 11 29 17 o 2.203000  0.6074000     2.015000  0.8482000     2.390000  0.8695000     -0.3753000     1.215000  
1 1 1 11 29 18 o 2.356000  0.5702000     2.455000  0.8113000     2.258000  0.8014000     0.1977000      1.140000  
1 1 1 11 29 19 o 1.744000  0.4996000     1.423000  0.6535000     2.064000  0.7559000     -0.6410000     0.9993000 
1 1 1 11 29 20 o 1.555000  0.4783000     1.696000  0.7036000     1.414000  0.6480000     0.2817000      0.9566000 
1 1 1 11 29 21 o 1.267000  0.4215000     1.252000  0.5913000     1.282000  0.6009000     -0.3003000E-01 0.8431000 
1 1 1 11 29 22 o 1.835000  0.5009000     2.224000  0.7636000     1.447000  0.6484000     0.7771000      1.002000  
1 1 1 11 29 23 o 2.478000  0.5445000     2.010000  0.8345000     2.946000  0.6995000     -0.9359000     1.089000  
1 1 1 11 29 24 o 1.496000  0.4652000     1.626000  0.6902000     1.366000  0.6238000     0.2600000      0.9304000 
1 1 1 11 30 0  o 7.989000  0.2099000     7.989000  0.2099000     7.989000  0.2099000     0.000000       0.000000  
1 1 1 11 30 1  f 2.301000  0.3818000     2.041000  0.4942000     2.562000  0.5821000     -0.5219000     0.7636000 
1 1 1 11 30 2  o 6.778000  0.1842000     6.636000  0.2174000     6.920000  0.2975000     -0.2842000     0.3685000 
1 1 1 11 30 3  o 7.548000  0.1528000     7.572000  0.2133000     7.523000  0.2189000     0.4960000E-01  0.3056000 
1 1 1 11 30 4  o 12.83000  0.1512000     12.75000  0.2124000     12.90000  0.2153000     -0.1522000     0.3024000 
1 1 1 11 30 5  o 27.66000  0.2356000     27.80000  0.3343000     27.52000  0.3322000     0.2768000      0.4713000 
1 1 1 11 30 6  o 10.44000  0.1517000     10.63000  0.2140000     10.25000  0.2151000     0.3808000      0.3034000 
1 1 1 11 30 7  o 8.615000  0.1594000     8.748000  0.2219000     8.481000  0.2288000     0.2671000      0.3188000 
1 1 1 11 30 8  o 14.35000  0.1837000     14.34000  0.2817000     14.36000  0.2359000     -0.2455000E-01 0.3674000 
1 1 1 11 30 9  f 8.510000  0.2020000     8.486000  0.2398000     8.533000  0.3251000     -0.4637000E-01 0.4039000 
1 1 1 11 30 10 o 10.12000  0.2255000     10.16000  0.3364000     10.08000  0.3004000     0.7503000E-01  0.4510000 
1 1 1 11 30 11 o 7.064000  0.2009000     7.026000  0.2806000     7.103000  0.2875000     -0.7647000E-01 0.4017000 
1 1 1 11 30 12 o 3.701000  0.3380000     3.179000  0.5264000     4.222000  0.4243000     -1.043000      0.6761000 
1 1 1 11 30 13 o 10.74000  0.1879000     10.40000  0.2651000     11.09000  0.2664000     -0.6901000     0.3758000 
1 1 1 11 30 14 o 2.514000  0.4686000     1.750000  0.6935000     3.278000  0.6303000     -1.528000      0.9372000 
1 1 1 11 30 15 o 4.974000  0.3010000     5.007000  0.4196000     4.941000  0.4317000     0.6539000E-01  0.6021000 
1 1 1 11 30 16 o 2.137000  0.5322000     2.074000  0.7409000     2.200000  0.7641000     -0.1259000     1.064000  
1 1 1 11 30 17 o 3.378000  0.6629000     2.655000  1.158000      4.102000  0.6448000     -1.447000      1.326000  
1 1 1 11 30 18 o 3.893000  0.4552000     4.345000  0.5683000     3.440000  0.7111000     0.9054000      0.9103000 
1 1 1 11 30 19 o 2.058000  0.5399000     1.921000  0.7446000     2.195000  0.7821000     -0.2742000     1.080000  
1 1 1 11 30 20 o 1.682000  0.4977000     1.933000  0.7526000     1.431000  0.6516000     0.5016000      0.9955000 
1 1 1 11 30 21 o 1.624000  0.5007000     1.622000  0.7037000     1.627000  0.7126000     -0.4909000E-02 1.001000  
1 1 1 11 30 22 o 1.312000  0.4314000     1.520000  0.6725000     1.105000  0.5404000     0.4149000      0.8628000 
1 1 1 11 30 23 o 1.428000  0.4550000     1.275000  0.6020000     1.582000  0.6825000     -0.3078000     0.9100000 
1 1 1 11 31 0  o 1.211000  0.6450000     1.211000  0.6450000     1.211000  0.6450000     -0.000000      0.000000  
1 1 1 11 31 1  o 14.42000  0.1904000     14.52000  0.2215000     14.32000  0.3098000     0.1964000      0.3809000 
1 1 1 11 31 2  o 11.11000  0.1783000     11.47000  0.2079000     10.75000  0.2898000     0.7171000      0.3566000 
1 1 1 11 31 3  o 8.147000  0.1526000     7.990000  0.2140000     8.304000  0.2175000     -0.3138000     0.3051000 
1 1 1 11 31 4  f 19.75000  0.1853000     19.70000  0.2616000     19.80000  0.2625000     -0.1025000     0.3706000 
1 1 1 11 31 5  o 29.65000  0.2499000     29.66000  0.3527000     29.65000  0.3542000     0.8862000E-02  0.4998000 
1 1 1 11 31 6  o 17.51000  0.1765000     17.68000  0.2505000     17.34000  0.2487000     0.3376000      0.3530000 
1 1 1 11 31 7  o 9.811000  0.1584000     9.651000  0.2255000     9.971000  0.2224000     -0.3202000     0.3167000 
1 1 1 11 31 8  o 13.73000  0.2340000     13.80000  0.3389000     13.66000  0.3228000     0.1412000      0.4680000 
1 1 1 11 31 9  o 10.38000  0.2200000     10.43000  0.2634000     10.33000  0.3524000     0.9925000E-01  0.4399000 
1 1 1 11 31 10 o 9.975000  0.1752000     9.956000  0.2479000     9.994000  0.2475000     -0.3828000E-01 0.3503000 
1 1 1 11 31 11 o 2.685000  0.4289000     2.830000  0.5631000     2.541000  0.6471000     0.2889000      0.8578000 
1 1 1 11 31 12 o 14.16000  0.1845000     14.28000  0.2592000     14.04000  0.2625000     0.2433000      0.3689000 
1 1 1 11 31 13 o 3.042000  0.4325000     3.516000  0.5215000     2.568000  0.6902000     0.9482000      0.8651000 
1 1 1 11 31 14 o 1.804000  0.4964000     2.029000  0.7276000     1.579000  0.6754000     0.4502000      0.9928000 
1 1 1 11 31 15 o 3.564000  0.5129000     3.720000  0.7987000     3.407000  0.6437000     0.3135000      1.026000  
1 1 1 11 31 16 o 5.430000  0.3097000     5.635000  0.3971000     5.225000  0.4753000     0.4090000      0.6194000 
1 1 1 11 31 17 o 4.125000  0.4354000     3.692000  0.7522000     4.559000  0.4387000     -0.8665000     0.8708000 
1 1 1 11 31 18 o 1.336000  0.4431000     1.116000  0.5493000     1.555000  0.6953000     -0.4393000     0.8861000 
1 1 1 11 31 19 o 3.733000  0.4256000     4.311000  0.5202000     3.155000  0.6737000     1.155000       0.8512000 
1 1 1 11 31 20 o 3.241000  0.4715000     2.797000  0.7378000     3.686000  0.5874000     -0.8890000     0.9431000 
1 1 1 11 31 21 o 1.805000  0.5836000     1.472000  0.6665000     2.138000  0.9583000     -0.6661000     1.167000  
1 1 1 11 31 22 o 1.482000  0.4841000     1.551000  0.7133000     1.412000  0.6548000     0.1393000      0.9683000 
1 1 1 11 31 23 o 1.304000  0.4266000     1.168000  0.5575000     1.441000  0.6458000     -0.2734000     0.8532000 
1 1 1 11 32 0  o 21.25000  0.2737000     21.25000  0.2737000     21.25000  0.2737000     -0.000000      0.000000  
1 1 1 11 32 1  o 17.10000  0.2083000     16.84000  0.2385000     17.35000  0.3414000     -0.5107000     0.4165000 
1 1 1 11 32 2  o 1.927000  0.4176000     2.116000  0.5257000     1.739000  0.6490000     0.3765000      0.8352000 
1 1 1 11 32 3  o 6.886000  0.1728000     7.047000  0.2232000     6.725000  0.2637000     0.3227000      0.3455000 
1 1 1 11 32 4  o 15.41000  0.1654000     15.25000  0.2323000     15.57000  0.2355000     -0.3253000     0.3307000 
1 1 1 11 32 5  o 15.59000  0.1672000     15.26000  0.2331000     15.91000  0.2399000     -0.6406000     0.3345000 
1 1 1 11 32 6  o 11.04000  0.1576000     10.92000  0.2236000     11.15000  0.2222000     -0.2337000     0.3152000 
1 1 1 11 32 7  f 26.22000  0.2835000     26.25000  0.4642000     26.18000  0.3255000     0.6556000E-01  0.5669000 
1 1 1 11 32 8  o 12.60000  0.1968000     12.46000  0.2328000     12.73000  0.3173000     -0.2747000     0.3936000 
1 1 1 11 32 9  o 6.442000  0.2469000     6.475000  0.4101000     6.409000  0.2750000     0.6583000E-01  0.4938000 
1 1 1 11 32 10 o 9.481000  0.1779000     9.520000  0.2512000     9.442000  0.2519000     0.7761000E-01  0.3557000 
1 1 1 11 32 11 o 1.552000  0.4337000     1.870000  0.6561000     1.233000  0.5673000     0.6366000      0.8673000 
1 1 1 11 32 12 o 4.076000  0.3292000     4.096000  0.4526000     4.055000  0.4782000     0.4088000E-01  0.6584000 
1 1 1 11 32 13 o 3.353000  0.4124000     2.768000  0.6476000     3.939000  0.5109000     -1.171000      0.8249000 
1 1 1 11 32 14 f 3.549000  0.4041000     3.515000  0.5689000     3.584000  0.5740000     -0.6932000E-01 0.8082000 
1 1 1 11 32 15 f 9.502000  0.2565000     9.227000  0.3239000     9.777000  0.3978000     -0.5499000     0.5130000 
1 1 1 11 32 16 o 8.934000  0.2770000     8.594000  0.3348000     9.274000  0.4415000     -0.6802000     0.5541000 
1 1 1 11 32 17 o 2.352000  0.5217000     2.653000  0.7190000     2.052000  0.7560000     0.6014000      1.043000  
1 1 1 11 32 18 o 1.495000  0.4781000     1.566000  0.6935000     1.425000  0.6584000     0.1413000      0.9562000 
1 1 1 11 32 19 f 2.513000  0.5350000     2.452000  0.7524000     2.574000  0.7608000     -0.1220000     1.070000  
1 1 1 11 32 20 o 1.427000  0.4412000     0.9936000 0.4910000     1.860000  0.7332000     -0.8668000     0.8824000 
1 1 1 11 32 21 o 1.985000  0.5720000     1.599000  0.6853000     2.372000  0.9159000     -0.7729000     1.144000  
1 1 1 11 32 22 o 1.449000  0.5062000     1.777000  0.8551000     1.122000  0.5421000     0.6552000      1.012000  
1 1 1 11 32 23 o 1.012000  0.3546000     1.085000  0.5307000     0.9394000 0.4703000     0.1458000      0.7091000 
1 1 1 11 33 0  o 9.708000  0.2146000     9.708000  0.2146000     9.708000  0.2146000     -0.000000      0.000000  
1 1 1 11 33 1  o 9.648000  0.1847000     9.905000  0.2127000     9.390000  0.3022000     0.5152000      0.3695000 
1 1 1 11 33 2  o 9.561000  0.1834000     9.627000  0.2134000     9.496000  0.2984000     0.1311000      0.3669000 
1 1 1 11 33 3  o 15.74000  0.1802000     15.71000  0.2359000     15.76000  0.2724000     -0.5142000E-01 0.3603000 
1 1 1 11 33 4  o 7.227000  0.1663000     7.263000  0.2332000     7.191000  0.2372000     0.7187000E-01  0.3326000 
1 1 1 11 33 5  o 22.32000  0.2042000     22.21000  0.2872000     22.43000  0.2904000     -0.2205000     0.4084000 
1 1 1 11 33 6  o 16.71000  0.2173000     16.87000  0.3572000     16.56000  0.2476000     0.3041000      0.4346000 
1 1 1 11 33 7  f 13.72000  0.2482000     13.75000  0.2372000     13.68000  0.4361000     0.6365000E-01  0.4964000 
1 1 1 11 33 8  o 9.012000  0.2220000     9.180000  0.3339000     8.845000  0.2926000     0.3343000      0.4440000 
1 1 1 11 33 9  o 3.418000  0.3272000     2.988000  0.5122000     3.849000  0.4073000     -0.8606000     0.6544000 
1 1 1 11 33 10 o 10.71000  0.1771000     10.69000  0.2518000     10.72000  0.2490000     -0.3412000E-01 0.3541000 
1 1 1 11 33 11 o 7.059000  0.2131000     7.023000  0.2906000     7.095000  0.3117000     -0.7211000E-01 0.4262000 
1 1 1 11 33 12 o 2.062000  0.4815000     2.417000  0.6743000     1.708000  0.6874000     0.7093000      0.9629000 
1 1 1 11 33 13 o 1.672000  0.4721000     1.260000  0.5850000     2.084000  0.7412000     -0.8235000     0.9442000 
1 1 1 11 33 14 o 5.256000  0.2948000     5.483000  0.4054000     5.029000  0.4283000     0.4536000      0.5897000 
1 1 1 11 33 15 o 1.278000  0.4257000     1.217000  0.5754000     1.339000  0.6276000     -0.1226000     0.8515000 
1 1 1 11 33 16 o 3.967000  0.4672000     3.720000  0.7728000     4.215000  0.5253000     -0.4948000     0.9344000 
1 1 1 11 33 17 o 3.112000  0.4643000     2.865000  0.7147000     3.360000  0.5929000     -0.4947000     0.9286000 
1 1 1 11 33 18 o 1.333000  0.4383000     1.375000  0.6470000     1.291000  0.5915000     0.8390000E-01  0.8766000 
1 1 1 11 33 19 f 2.011000  0.5223000     2.139000  0.7525000     1.882000  0.7245000     0.2562000      1.045000  
1 1 1 11 33 20 o 1.940000  0.4744000     2.532000  0.7226000     1.347000  0.6150000     1.186000       0.9489000 
1 1 1 11 33 21 o 1.273000  0.4212000     1.510000  0.6693000     1.037000  0.5114000     0.4740000      0.8423000 
1 1 1 11 33 22 o 1.453000  0.4720000     1.485000  0.6986000     1.422000  0.6350000     0.6260000E-01  0.9440000 
1 1 1 11 33 23 o 1.223000  0.4062000     1.472000  0.6530000     0.9736000 0.4834000     0.4988000      0.8124000 
1 1 1 11 34 0  o 16.52000  0.2422000     16.52000  0.2422000     16.52000  0.2422000     -0.000000      0.000000  
1 1 1 11 34 1  o 6.004000  0.2180000     6.198000  0.2443000     5.810000  0.3611000     0.3879000      0.4360000 
1 1 1 11 34 2  o 21.89000  0.2447000     21.94000  0.2836000     21.83000  0.3988000     0.1073000      0.4894000 
1 1 1 11 34 3  o 20.58000  0.2079000     20.93000  0.2754000     20.22000  0.3115000     0.7089000      0.4158000 
1 1 1 11 34 4  o 14.87000  0.1661000     14.96000  0.2343000     14.77000  0.2356000     0.1878000      0.3322000 
1 1 1 11 34 5  o 12.65000  0.1771000     12.81000  0.2694000     12.50000  0.2301000     0.3116000      0.3543000 
1 1 1 11 34 6  o 20.44000  0.3142000     20.08000  0.3144000     20.80000  0.5440000     -0.7212000     0.6283000 
1 1 1 11 34 7  o 11.75000  0.2348000     11.42000  0.3242000     12.07000  0.3397000     -0.6470000     0.4695000 
1 1 1 11 34 8  o 4.733000  0.2456000     4.779000  0.3424000     4.687000  0.3522000     0.9220000E-01  0.4912000 
1 1 1 11 34 9  o 20.95000  0.2045000     20.59000  0.2860000     21.30000  0.2923000     -0.7089000     0.4089000 
1 1 1 11 34 10 o 16.31000  0.1865000     15.82000  0.2605000     16.79000  0.2670000     -0.9681000     0.3730000 
1 1 1 11 34 11 o 8.830000  0.1933000     8.936000  0.2718000     8.723000  0.2748000     0.2136000      0.3865000 
1 1 1 11 34 12 o 12.16000  0.1894000     12.27000  0.2663000     12.04000  0.2693000     0.2230000      0.3788000 
1 1 1 11 34 13 o 5.430000  0.2790000     5.890000  0.3640000     4.971000  0.4230000     0.9186000      0.5581000 
1 1 1 11 34 14 o 2.382000  0.5942000     2.343000  0.8583000     2.421000  0.8219000     -0.7774000E-01 1.188000  
1 1 1 11 34 15 o 3.363000  0.5445000     3.390000  0.6156000     3.336000  0.8983000     0.5396000E-01  1.089000  
1 1 1 11 34 16 o 2.024000  0.5201000     2.307000  0.7491000     1.741000  0.7216000     0.5662000      1.040000  
1 1 1 11 34 17 o 1.934000  0.5122000     1.979000  0.7272000     1.888000  0.7216000     0.9159000E-01  1.024000  
1 1 1 11 34 18 o 2.106000  0.4529000     1.295000  0.5953000     2.917000  0.6827000     -1.623000      0.9057000 
1 1 1 11 34 19 o 2.073000  0.5280000     2.140000  0.7488000     2.005000  0.7445000     0.1355000      1.056000  
1 1 1 11 34 20 o 1.313000  0.4313000     1.427000  0.6383000     1.199000  0.5804000     0.2276000      0.8627000 
1 1 1 11 34 21 o 1.436000  0.4634000     1.462000  0.6522000     1.411000  0.6585000     0.5068000E-01  0.9268000 
1 1 1 11 34 22 o 1.536000  0.4666000     1.281000  0.5970000     1.791000  0.7173000     -0.5099000     0.9332000 
1 1 1 11 34 23 o 1.203000  0.4357000     1.171000  0.6024000     1.235000  0.6295000     -0.6415000E-01 0.8713000 
1 1 1 11 35 0  o 15.53000  0.2398000     15.53000  0.2398000     15.53000  0.2398000     0.000000       0.000000  
1 1 1 11 35 1  o 26.89000  0.2848000     26.94000  0.3292000     26.84000  0.4648000     0.9232000E-01  0.5696000 
1 1 1 11 35 2  o 18.12000  0.2202000     17.88000  0.2532000     18.36000  0.3603000     -0.4719000     0.4404000 
1 1 1 11 35 3  o 15.53000  0.1817000     15.87000  0.2391000     15.19000  0.2735000     0.6744000      0.3633000 
1 1 1 11 35 4  o 22.54000  0.2541000     22.46000  0.4150000     22.62000  0.2932000     -0.1682000     0.5082000 
1 1 1 11 35 5  o 16.36000  0.2775000     16.38000  0.2837000     16.35000  0.4770000     0.2852000E-01  0.5550000 
1 1 1 11 35 6  o 9.183000  0.2213000     9.109000  0.3277000     9.256000  0.2976000     -0.1466000     0.4427000 
1 1 1 11 35 7  o 13.51000  0.1842000     13.58000  0.2811000     13.43000  0.2381000     0.1470000      0.3684000 
1 1 1 11 35 8  o 6.641000  0.2212000     6.602000  0.3418000     6.680000  0.2807000     -0.7702000E-01 0.4423000 
1 1 1 11 35 9  o 19.24000  0.1972000     19.40000  0.2794000     19.09000  0.2783000     0.3092000      0.3944000 
1 1 1 11 35 10 o 7.513000  0.2026000     7.664000  0.2862000     7.362000  0.2867000     0.3023000      0.4051000 
1 1 1 11 35 11 o 8.385000  0.1995000     8.180000  0.2863000     8.590000  0.2779000     -0.4099000     0.3990000 
1 1 1 11 35 12 o 1.846000  0.5015000     1.797000  0.7051000     1.894000  0.7133000     -0.9780000E-01 1.003000  
1 1 1 11 35 13 o 2.961000  0.4660000     3.623000  0.5632000     2.298000  0.7426000     1.325000       0.9321000 
1 1 1 11 35 14 o 6.359000  0.2997000     5.764000  0.3825000     6.954000  0.4616000     -1.190000      0.5995000 
1 1 1 11 35 15 o 2.067000  0.5923000     2.078000  0.8524000     2.057000  0.8225000     0.2033000E-01  1.185000  
1 1 1 11 35 16 o 2.804000  0.5049000     2.552000  0.7355000     3.055000  0.6919000     -0.5032000     1.010000  
1 1 1 11 35 17 o 1.420000  0.4464000     1.651000  0.6886000     1.188000  0.5683000     0.4628000      0.8928000 
1 1 1 11 35 18 o 1.416000  0.4330000     1.050000  0.5131000     1.782000  0.6976000     -0.7319000     0.8660000 
1 1 1 11 35 19 o 1.410000  0.4466000     1.418000  0.6597000     1.401000  0.6020000     0.1734000E-01  0.8931000 
1 1 1 11 35 20 o 2.255000  0.5674000     2.621000  0.7109000     1.890000  0.8845000     0.7313000      1.135000  
1 1 1 11 35 21 o 1.587000  0.5043000     1.562000  0.7241000     1.612000  0.7023000     -0.4970000E-01 1.009000  
1 1 1 11 35 22 o 1.468000  0.4649000     1.411000  0.6429000     1.525000  0.6718000     -0.1141000     0.9299000 
1 1 1 11 36 0  o 9.071000  0.2348000     9.071000  0.2348000     9.071000  0.2348000     -0.000000      0.000000  
1 1 1 11 36 1  o 14.81000  0.2046000     14.47000  0.2343000     15.14000  0.3356000     -0.6641000     0.4093000 
1 1 1 11 36 2  o 11.84000  0.2056000     11.59000  0.2646000     12.09000  0.3147000     -0.5056000     0.4112000 
1 1 1 11 36 3  o 5.039000  0.3656000     5.546000  0.3964000     4.532000  0.6145000     1.014000       0.7312000 
1 1 1 11 36 4  o 22.09000  0.2933000     22.09000  0.2933000     ?         ?             ?              ?         
1 1 1 11 36 5  o 16.64000  0.2297000     16.50000  0.3496000     16.78000  0.2980000     -0.2785000     0.4594000 
1 1 1 11 36 6  o 5.716000  0.2264000     5.891000  0.3357000     5.541000  0.3038000     0.3497000      0.4528000 
1 1 1 11 36 7  o 1.520000  0.4254000     1.726000  0.6315000     1.314000  0.5702000     0.4124000      0.8508000 
1 1 1 11 36 8  f 7.548000  0.1902000     7.520000  0.2707000     7.575000  0.2673000     -0.5542000E-01 0.3804000 
1 1 1 11 36 9  o 5.250000  0.2386000     5.503000  0.3251000     4.996000  0.3492000     0.5074000      0.4771000 
1 1 1 11 36 10 o 3.492000  0.3645000     3.915000  0.4398000     3.070000  0.5815000     0.8457000      0.7291000 
1 1 1 11 36 11 o 3.431000  0.3948000     3.431000  0.5680000     3.431000  0.5486000     -0.2487000E-03 0.7897000 
1 1 1 11 36 12 o 7.228000  0.2301000     7.343000  0.3231000     7.113000  0.3278000     0.2295000      0.4602000 
1 1 1 11 36 13 o 5.295000  0.3569000     5.435000  0.5753000     5.156000  0.4225000     0.2785000      0.7138000 
1 1 1 11 36 14 o 2.001000  0.5320000     2.125000  0.7508000     1.876000  0.7537000     0.2486000      1.064000  
1 1 1 11 36 15 o 6.645000  0.2885000     6.403000  0.4509000     6.887000  0.3601000     -0.4840000     0.5770000 
1 1 1 11 36 16 o 6.507000  0.2724000     7.013000  0.3372000     6.002000  0.4281000     1.012000       0.5449000 
1 1 1 11 36 17 o 1.971000  0.4976000     1.683000  0.6846000     2.258000  0.7223000     -0.5760000     0.9952000 
1 1 1 11 36 18 o 3.212000  0.4266000     3.119000  0.6112000     3.305000  0.5953000     -0.1866000     0.8532000 
1 1 1 11 36 19 o 1.900000  0.4792000     1.549000  0.7006000     2.251000  0.6539000     -0.7018000     0.9584000 
1 1 1 11 36 20 o 1.753000  0.5094000     1.582000  0.6782000     1.925000  0.7603000     -0.3428000     1.019000  
1 1 1 11 36 21 o 1.528000  0.4986000     1.976000  0.8477000     1.079000  0.5251000     0.8972000      0.9971000 
1 1 1 11 36 22 o 1.803000  0.5095000     1.755000  0.7162000     1.851000  0.7249000     -0.9560000E-01 1.019000  
1 1 1 11 37 0  o 10.94000  0.4597000     10.94000  0.4597000     10.94000  0.4597000     -0.000000      0.000000  
1 1 1 11 37 1  o 19.46000  0.3912000     19.97000  0.5451000     18.96000  0.5613000     1.011000       0.7825000 
1 1 1 11 37 2  o 16.73000  0.3514000     16.73000  0.3514000     ?         ?             ?              ?         
1 1 1 11 37 3  o 20.12000  0.2785000     19.82000  0.3813000     20.43000  0.4061000     -0.6087000     0.5570000 
1 1 1 11 37 4  o 11.43000  0.1989000     11.42000  0.3211000     11.44000  0.2347000     -0.2199000E-01 0.3977000 
1 1 1 11 37 5  o 16.46000  0.1789000     16.60000  0.2522000     16.33000  0.2537000     0.2687000      0.3577000 
1 1 1 11 37 6  o 13.22000  0.1697000     13.11000  0.2389000     13.33000  0.2409000     -0.2151000     0.3393000 
1 1 1 11 37 7  o 5.767000  0.2172000     5.489000  0.3187000     6.045000  0.2951000     -0.5557000     0.4343000 
1 1 1 11 37 8  o 8.595000  0.1858000     8.518000  0.2607000     8.672000  0.2647000     -0.1535000     0.3716000 
1 1 1 11 37 9  f 3.878000  0.3143000     4.213000  0.4123000     3.544000  0.4745000     0.6685000      0.6286000 
1 1 1 11 37 10 o 7.532000  0.2067000     7.494000  0.2920000     7.569000  0.2927000     -0.7556000E-01 0.4134000 
1 1 1 11 37 11 o 7.587000  0.2186000     7.234000  0.3183000     7.941000  0.2997000     -0.7073000     0.4372000 
1 1 1 11 37 12 o 9.699000  0.2042000     9.394000  0.2888000     10.00000  0.2887000     -0.6085000     0.4083000 
1 1 1 11 37 13 o 7.378000  0.2872000     7.670000  0.3245000     7.087000  0.4740000     0.5828000      0.5745000 
1 1 1 11 37 14 o 6.372000  0.3834000     6.352000  0.5134000     6.392000  0.5696000     -0.4025000E-01 0.7668000 
1 1 1 11 37 15 o 1.697000  0.4910000     1.948000  0.7358000     1.447000  0.6505000     0.5015000      0.9821000 
1 1 1 11 37 16 o 2.957000  0.4714000     3.104000  0.6420000     2.811000  0.6905000     0.2930000      0.9428000 
1 1 1 11 37 17 f 2.745000  0.4913000     2.795000  0.6847000     2.695000  0.7047000     0.1008000      0.9826000 
1 1 1 11 37 18 o 1.212000  0.3953000     0.9214000 0.4599000     1.503000  0.6430000     -0.5817000     0.7906000 
1 1 1 11 37 19 o 1.108000  0.3839000     1.224000  0.5945000     0.9915000 0.4859000     0.2321000      0.7678000 
1 1 1 11 37 20 o 2.195000  0.7770000     ?         ?             2.195000  0.7770000     ?              ?         
1 1 1 11 37 21 o 1.691000  0.4964000     1.704000  0.7066000     1.677000  0.6975000     0.2712000E-01  0.9928000 
1 1 1 11 37 22 o 1.347000  0.4345000     1.144000  0.5520000     1.549000  0.6713000     -0.4054000     0.8691000 
1 1 1 11 38 0  o 3.194000  0.7453000     3.194000  0.7453000     3.194000  0.7453000     -0.000000      0.000000  
1 1 1 11 38 1  o 6.636000  0.2400000     6.411000  0.3146000     6.861000  0.3625000     -0.4497000     0.4800000 
1 1 1 11 38 2  o 19.16000  0.2442000     19.21000  0.3106000     19.11000  0.3770000     0.1026000      0.4885000 
1 1 1 11 38 3  o 20.63000  0.2137000     20.60000  0.2802000     20.66000  0.3227000     -0.6225000E-01 0.4274000 
1 1 1 11 38 4  o 2.890000  0.3631000     3.036000  0.4755000     2.743000  0.5489000     0.2922000      0.7263000 
1 1 1 11 38 5  o 11.10000  0.1697000     11.20000  0.2388000     10.99000  0.2411000     0.2164000      0.3393000 
1 1 1 11 38 6  o 12.69000  0.1719000     12.73000  0.2418000     12.65000  0.2444000     0.7805000E-01  0.3438000 
1 1 1 11 38 7  o 4.018000  0.2931000     3.997000  0.4186000     4.040000  0.4104000     -0.4330000E-01 0.5862000 
1 1 1 11 38 8  o 15.15000  0.1829000     15.07000  0.2585000     15.23000  0.2588000     -0.1656000     0.3658000 
1 1 1 11 38 9  f 7.459000  0.2055000     7.213000  0.2981000     7.704000  0.2829000     -0.4911000     0.4110000 
1 1 1 11 38 10 o 12.83000  0.1870000     12.82000  0.2624000     12.83000  0.2665000     -0.1055000E-01 0.3741000 
1 1 1 11 38 11 f 9.807000  0.1984000     10.04000  0.2787000     9.580000  0.2824000     0.4558000      0.3967000 
1 1 1 11 38 12 o 1.685000  0.5091000     2.250000  0.8615000     1.120000  0.5429000     1.130000       1.018000  
1 1 1 11 38 13 o 1.997000  0.5375000     1.989000  0.7521000     2.006000  0.7682000     -0.1651000E-01 1.075000  
1 1 1 11 38 14 o 4.094000  0.4281000     3.598000  0.6996000     4.590000  0.4937000     -0.9914000     0.8563000 
1 1 1 11 38 15 o 1.814000  0.4967000     1.422000  0.6367000     2.207000  0.7625000     -0.7853000     0.9934000 
1 1 1 11 38 16 o 2.388000  0.5071000     2.863000  0.7019000     1.912000  0.7320000     0.9512000      1.014000  
1 1 1 11 38 17 o 3.631000  0.3972000     4.031000  0.4884000     3.230000  0.6266000     0.8002000      0.7944000 
1 1 1 11 38 18 o 2.231000  0.4940000     2.336000  0.7016000     2.127000  0.6955000     0.2087000      0.9879000 
1 1 1 11 38 19 o 1.541000  0.4753000     1.649000  0.6828000     1.433000  0.6614000     0.2159000      0.9506000 
1 1 1 11 38 20 o 2.379000  0.5127000     1.535000  0.7131000     3.222000  0.7368000     -1.688000      1.025000  
1 1 1 11 38 21 o 1.412000  0.4507000     1.549000  0.6753000     1.275000  0.5971000     0.2737000      0.9015000 
1 1 1 11 39 0  o 0.5475000 0.4032000     0.5475000 0.4032000     0.5475000 0.4032000     -0.000000      0.000000  
1 1 1 11 39 1  o 7.597000  0.1939000     7.590000  0.2566000     7.603000  0.2908000     -0.1286000E-01 0.3878000 
1 1 1 11 39 2  o 3.810000  0.3456000     4.002000  0.3821000     3.619000  0.5759000     0.3835000      0.6912000 
1 1 1 11 39 3  o 12.29000  0.1799000     12.45000  0.2362000     12.13000  0.2713000     0.3185000      0.3597000 
1 1 1 11 39 4  o 12.13000  0.1810000     12.04000  0.2374000     12.22000  0.2734000     -0.1798000     0.3621000 
1 1 1 11 39 5  o 6.325000  0.2038000     5.978000  0.2950000     6.672000  0.2813000     -0.6940000     0.4077000 
1 1 1 11 39 6  o 11.62000  0.1755000     11.67000  0.2461000     11.58000  0.2503000     0.9506000E-01  0.3510000 
1 1 1 11 39 7  o 21.74000  0.2108000     21.82000  0.2997000     21.65000  0.2965000     0.1712000      0.4216000 
1 1 1 11 39 8  o 11.75000  0.1786000     11.86000  0.2530000     11.64000  0.2520000     0.2162000      0.3571000 
1 1 1 11 39 9  o 7.573000  0.2076000     7.740000  0.2923000     7.405000  0.2949000     0.3354000      0.4152000 
1 1 1 11 39 10 o 3.140000  0.4198000     3.404000  0.5366000     2.877000  0.6457000     0.5267000      0.8396000 
1 1 1 11 39 11 o 2.141000  0.5085000     1.930000  0.7105000     2.352000  0.7277000     -0.4226000     1.017000  
1 1 1 11 39 12 o 8.084000  0.2703000     8.367000  0.3204000     7.802000  0.4354000     0.5652000      0.5406000 
1 1 1 11 39 13 o 6.181000  0.3680000     6.748000  0.5038000     5.615000  0.5365000     1.133000       0.7360000 
1 1 1 11 39 14 o 3.841000  0.3953000     4.072000  0.5124000     3.610000  0.6022000     0.4622000      0.7907000 
1 1 1 11 39 15 o 3.755000  0.3961000     4.038000  0.5078000     3.471000  0.6081000     0.5676000      0.7922000 
1 1 1 11 39 16 o 2.877000  0.4758000     3.154000  0.6373000     2.601000  0.7067000     0.5524000      0.9516000 
1 1 1 11 39 17 o 1.407000  0.4431000     1.298000  0.5922000     1.516000  0.6592000     -0.2179000     0.8861000 
1 1 1 11 39 18 o 1.294000  0.4134000     1.071000  0.5155000     1.518000  0.6465000     -0.4470000     0.8268000 
1 1 1 11 39 19 o 1.281000  0.4147000     1.257000  0.5789000     1.304000  0.5939000     -0.4759000E-01 0.8293000 
1 1 1 11 39 20 o 1.528000  0.4713000     1.739000  0.7439000     1.316000  0.5789000     0.4233000      0.9427000 
1 1 1 11 39 21 f 2.124000  0.5307000     2.073000  0.7476000     2.175000  0.7535000     -0.1015000     1.061000  
1 1 1 11 40 0  o 12.31000  0.2787000     12.31000  0.2787000     12.31000  0.2787000     -0.000000      0.000000  
1 1 1 11 40 1  o 8.086000  0.1936000     8.083000  0.2519000     8.089000  0.2940000     -0.6530000E-02 0.3872000 
1 1 1 11 40 2  o 13.94000  0.2098000     14.17000  0.2450000     13.72000  0.3406000     0.4542000      0.4196000 
1 1 1 11 40 3  o 4.221000  0.2927000     4.662000  0.3498000     3.780000  0.4694000     0.8824000      0.5854000 
1 1 1 11 40 4  o 9.156000  0.1887000     9.075000  0.2485000     9.237000  0.2841000     -0.1623000     0.3774000 
1 1 1 11 40 5  o 1.717000  0.4547000     1.598000  0.6314000     1.837000  0.6544000     -0.2394000     0.9094000 
1 1 1 11 40 6  o 17.03000  0.1875000     16.94000  0.2646000     17.12000  0.2656000     -0.1706000     0.3750000 
1 1 1 11 40 7  o 7.542000  0.2033000     7.653000  0.2886000     7.432000  0.2863000     0.2212000      0.4065000 
1 1 1 11 40 8  o 2.033000  0.4829000     2.314000  0.6896000     1.751000  0.6761000     0.5630000      0.9657000 
1 1 1 11 40 9  o 7.126000  0.2190000     7.412000  0.3010000     6.839000  0.3183000     0.5732000      0.4381000 
1 1 1 11 40 10 o 8.419000  0.2072000     8.483000  0.2924000     8.355000  0.2936000     0.1278000      0.4144000 
1 1 1 11 40 11 o 10.05000  0.2501000     10.38000  0.4079000     9.717000  0.2894000     0.6614000      0.5002000 
1 1 1 11 40 12 o 2.937000  0.5661000     2.932000  0.6773000     2.941000  0.9072000     -0.8673000E-02 1.132000  
1 1 1 11 40 13 o 1.683000  0.5111000     2.078000  0.8234000     1.289000  0.6056000     0.7891000      1.022000  
1 1 1 11 40 14 o 2.465000  0.5318000     2.532000  0.7366000     2.399000  0.7673000     0.1332000      1.064000  
1 1 1 11 40 15 o 1.414000  0.4507000     1.338000  0.6160000     1.490000  0.6580000     -0.1523000     0.9014000 
1 1 1 11 40 16 o 3.988000  0.3700000     4.228000  0.4770000     3.748000  0.5657000     0.4795000      0.7400000 
1 1 1 11 40 17 o 3.418000  0.4055000     3.409000  0.5605000     3.427000  0.5860000     -0.1774000E-01 0.8109000 
1 1 1 11 40 18 f 2.040000  0.5529000     2.274000  0.8604000     1.805000  0.6948000     0.4684000      1.106000  
1 1 1 11 40 19 o 1.272000  0.4259000     1.226000  0.5666000     1.318000  0.6360000     -0.9144000E-01 0.8518000 
1 1 1 11 40 20 o 1.176000  0.3903000     1.268000  0.5810000     1.084000  0.5213000     0.1845000      0.7806000 
1 1 1 11 40 21 o 1.385000  0.4505000     1.355000  0.6406000     1.415000  0.6337000     -0.5991000E-01 0.9011000 
1 1 1 11 41 0  o 16.32000  0.2983000     16.32000  0.2983000     16.32000  0.2983000     0.000000       0.000000  
1 1 1 11 41 1  o 15.76000  0.1954000     15.89000  0.2559000     15.63000  0.2955000     0.2662000      0.3909000 
1 1 1 11 41 2  o 14.99000  0.2170000     14.75000  0.2490000     15.22000  0.3556000     -0.4679000     0.4341000 
1 1 1 11 41 3  o 11.21000  0.1857000     11.31000  0.2437000     11.12000  0.2801000     0.1937000      0.3713000 
1 1 1 11 41 4  o 7.630000  0.2049000     7.924000  0.2676000     7.335000  0.3103000     0.5889000      0.4097000 
1 1 1 11 41 5  o 10.63000  0.1771000     10.40000  0.2496000     10.86000  0.2513000     -0.4603000     0.3542000 
1 1 1 11 41 6  o 3.935000  0.3143000     3.942000  0.4393000     3.927000  0.4496000     0.1501000E-01  0.6286000 
1 1 1 11 41 7  o 2.333000  0.4636000     2.771000  0.6315000     1.895000  0.6788000     0.8761000      0.9271000 
1 1 1 11 41 8  o 4.108000  0.3221000     4.162000  0.4506000     4.053000  0.4604000     0.1083000      0.6442000 
1 1 1 11 41 9  o 9.415000  0.1981000     9.317000  0.2800000     9.513000  0.2804000     -0.1958000     0.3963000 
1 1 1 11 41 10 o 7.536000  0.2484000     7.481000  0.3912000     7.590000  0.3063000     -0.1090000     0.4968000 
1 1 1 11 41 11 o 6.009000  0.3111000     5.934000  0.3806000     6.084000  0.4922000     -0.1496000     0.6222000 
1 1 1 11 41 12 o 5.635000  0.3762000     5.747000  0.5512000     5.524000  0.5122000     0.2233000      0.7525000 
1 1 1 11 41 13 o 4.855000  0.3251000     4.259000  0.4991000     5.452000  0.4166000     -1.193000      0.6501000 
1 1 1 11 41 14 o 2.410000  0.4979000     1.913000  0.7258000     2.907000  0.6818000     -0.9939000     0.9958000 
1 1 1 11 41 15 o 1.511000  0.4514000     1.861000  0.7085000     1.161000  0.5594000     0.6993000      0.9027000 
1 1 1 11 41 16 o 1.412000  0.4449000     1.532000  0.6589000     1.292000  0.5980000     0.2398000      0.8898000 
1 1 1 11 41 17 o 2.804000  0.4795000     2.569000  0.7019000     3.039000  0.6535000     -0.4705000     0.9590000 
1 1 1 11 41 18 o 1.992000  0.4983000     2.365000  0.6942000     1.618000  0.7151000     0.7474000      0.9967000 
1 1 1 11 41 19 o 1.617000  0.4999000     1.155000  0.5567000     2.079000  0.8305000     -0.9239000     0.9998000 
1 1 1 11 41 20 o 1.410000  0.4324000     1.697000  0.6782000     1.123000  0.5367000     0.5742000      0.8648000 
1 1 1 11 42 0  o 9.525000  0.2920000     9.525000  0.2920000     9.525000  0.2920000     0.000000       0.000000  
1 1 1 11 42 1  o 11.30000  0.1902000     11.11000  0.2498000     11.50000  0.2867000     -0.3874000     0.3803000 
1 1 1 11 42 2  o 9.364000  0.1974000     9.800000  0.2485000     8.927000  0.3067000     0.8732000      0.3948000 
1 1 1 11 42 3  f 10.75000  0.1896000     10.66000  0.2486000     10.83000  0.2862000     -0.1695000     0.3791000 
1 1 1 11 42 4  o 1.993000  0.4748000     1.834000  0.6509000     2.151000  0.6914000     -0.3176000     0.9496000 
1 1 1 11 42 5  o 1.580000  0.4345000     1.932000  0.6607000     1.228000  0.5644000     0.7038000      0.8689000 
1 1 1 11 42 6  o 6.760000  0.2180000     7.070000  0.2999000     6.451000  0.3164000     0.6197000      0.4359000 
1 1 1 11 42 7  o 6.995000  0.2201000     7.274000  0.3048000     6.715000  0.3177000     0.5588000      0.4403000 
1 1 1 11 42 8  o 15.44000  0.1913000     15.68000  0.2736000     15.19000  0.2676000     0.4847000      0.3827000 
1 1 1 11 42 9  o 9.983000  0.1972000     9.993000  0.2802000     9.973000  0.2775000     0.1954000E-01  0.3944000 
1 1 1 11 42 10 o 3.335000  0.6193000     2.934000  0.8788000     3.735000  0.8729000     -0.8005000     1.239000  
1 1 1 11 42 11 o 3.949000  0.4805000     3.922000  0.5872000     3.976000  0.7609000     -0.5316000E-01 0.9611000 
1 1 1 11 42 12 o 6.649000  0.2536000     6.091000  0.3664000     7.207000  0.3506000     -1.116000      0.5071000 
1 1 1 11 42 13 o 3.061000  0.4763000     3.112000  0.6548000     3.009000  0.6918000     0.1038000      0.9525000 
1 1 1 11 42 14 o 3.720000  0.4007000     3.399000  0.6015000     4.040000  0.5297000     -0.6417000     0.8015000 
1 1 1 11 42 15 o 1.554000  0.4719000     1.542000  0.6649000     1.566000  0.6697000     -0.2389000E-01 0.9437000 
1 1 1 11 42 16 o 3.412000  0.4230000     3.589000  0.5656000     3.234000  0.6292000     0.3552000      0.8461000 
1 1 1 11 42 17 o 2.088000  0.5276000     1.805000  0.7582000     2.371000  0.7338000     -0.5657000     1.055000  
1 1 1 11 42 18 o 1.953000  0.4752000     2.391000  0.6901000     1.515000  0.6534000     0.8763000      0.9504000 
1 1 1 11 42 19 o 1.414000  0.4369000     1.176000  0.5661000     1.652000  0.6656000     -0.4762000     0.8738000 
1 1 1 11 42 20 o 1.348000  0.4249000     1.552000  0.6513000     1.143000  0.5459000     0.4092000      0.8499000 
1 1 1 11 43 0  o 25.89000  0.3825000     25.89000  0.3825000     25.89000  0.3825000     -0.000000      0.000000  
1 1 1 11 43 1  o 18.91000  0.2114000     18.75000  0.2754000     19.08000  0.3207000     -0.3336000     0.4227000 
1 1 1 11 43 2  o 16.70000  0.2019000     16.39000  0.2603000     17.01000  0.3087000     -0.6184000     0.4038000 
1 1 1 11 43 3  o 8.047000  0.2065000     8.137000  0.2707000     7.957000  0.3118000     0.1805000      0.4129000 
1 1 1 11 43 4  o 10.34000  0.1931000     10.58000  0.2523000     10.10000  0.2924000     0.4772000      0.3862000 
1 1 1 11 43 5  o 3.419000  0.3723000     3.613000  0.4910000     3.226000  0.5598000     0.3874000      0.7446000 
1 1 1 11 43 6  o 7.765000  0.2065000     7.792000  0.2893000     7.739000  0.2948000     0.5321000E-01  0.4131000 
1 1 1 11 43 7  o 16.85000  0.1950000     16.57000  0.2745000     17.12000  0.2769000     -0.5517000     0.3899000 
1 1 1 11 43 8  o 15.87000  0.1943000     15.39000  0.2739000     16.35000  0.2756000     -0.9562000     0.3885000 
1 1 1 11 43 9  o 4.034000  0.4333000     4.152000  0.7062000     3.916000  0.5022000     0.2364000      0.8665000 
1 1 1 11 43 10 o 2.616000  0.6145000     2.594000  0.7190000     2.638000  0.9967000     -0.4412000E-01 1.229000  
1 1 1 11 43 11 o 3.821000  0.4399000     4.639000  0.5442000     3.002000  0.6912000     1.637000       0.8797000 
1 1 1 11 43 12 o 4.927000  0.3101000     5.234000  0.3985000     4.620000  0.4753000     0.6133000      0.6203000 
1 1 1 11 43 13 o 1.458000  0.4439000     1.132000  0.5444000     1.784000  0.7013000     -0.6519000     0.8878000 
1 1 1 11 43 14 o 2.839000  0.4947000     2.757000  0.7013000     2.920000  0.6978000     -0.1628000     0.9893000 
1 1 1 11 43 15 o 4.495000  0.3313000     4.393000  0.4926000     4.597000  0.4431000     -0.2036000     0.6626000 
1 1 1 11 43 16 o 3.517000  0.4118000     3.326000  0.6094000     3.708000  0.5540000     -0.3822000     0.8235000 
1 1 1 11 43 17 o 1.856000  0.5505000     1.532000  0.7173000     2.180000  0.8352000     -0.6481000     1.101000  
1 1 1 11 43 18 o 3.454000  0.5157000     3.975000  0.5216000     2.933000  0.8899000     1.042000       1.031000  
1 1 1 11 43 19 o 2.208000  0.4508000     1.588000  0.6574000     2.827000  0.6172000     -1.238000      0.9017000 
1 1 1 11 43 20 o 1.748000  0.4593000     1.327000  0.6033000     2.170000  0.6926000     -0.8427000     0.9185000 
1 1 1 11 44 0  o 1.373000  0.8042000     1.373000  0.8042000     1.373000  0.8042000     0.000000       0.000000  
1 1 1 11 44 1  o 15.68000  0.1996000     15.45000  0.2603000     15.91000  0.3028000     -0.4620000     0.3992000 
1 1 1 11 44 2  o 8.027000  0.1979000     7.997000  0.2779000     8.058000  0.2819000     -0.6110000E-01 0.3959000 
1 1 1 11 44 3  f 7.618000  0.2167000     7.548000  0.2858000     7.689000  0.3259000     -0.1414000     0.4334000 
1 1 1 11 44 4  o 8.206000  0.2110000     8.059000  0.2772000     8.352000  0.3182000     -0.2929000     0.4220000 
1 1 1 11 44 5  o 6.194000  0.2482000     6.464000  0.3225000     5.924000  0.3774000     0.5396000      0.4965000 
1 1 1 11 44 6  o 5.927000  0.2455000     5.868000  0.3495000     5.986000  0.3449000     -0.1175000     0.4910000 
1 1 1 11 44 7  o 2.500000  0.5046000     2.559000  0.7068000     2.440000  0.7203000     0.1197000      1.009000  
1 1 1 11 44 8  o 4.475000  0.4503000     3.833000  0.8100000     5.117000  0.3939000     -1.284000      0.9007000 
1 1 1 11 44 9  o 4.899000  0.4831000     5.547000  0.3905000     4.252000  0.8838000     1.294000       0.9662000 
1 1 1 11 44 10 o 2.778000  0.4699000     4.128000  0.6842000     1.428000  0.6443000     2.700000       0.9398000 
1 1 1 11 44 11 o 1.791000  0.4966000     1.966000  0.7219000     1.616000  0.6820000     0.3498000      0.9931000 
1 1 1 11 44 12 o 2.055000  0.4448000     2.865000  0.6691000     1.245000  0.5862000     1.620000       0.8896000 
1 1 1 11 44 13 o 2.933000  0.4791000     2.787000  0.7051000     3.079000  0.6490000     -0.2928000     0.9583000 
1 1 1 11 44 14 o 5.740000  0.2768000     5.845000  0.3886000     5.635000  0.3943000     0.2099000      0.5536000 
1 1 1 11 44 15 o 4.747000  0.3722000     5.070000  0.4152000     4.424000  0.6179000     0.6454000      0.7444000 
1 1 1 11 44 16 o 1.070000  0.3683000     1.211000  0.5724000     0.9291000 0.4635000     0.2819000      0.7365000 
1 1 1 11 44 17 o 1.290000  0.4206000     1.432000  0.6274000     1.148000  0.5605000     0.2840000      0.8413000 
1 1 1 11 44 18 o 1.786000  0.5176000     2.133000  0.8192000     1.439000  0.6327000     0.6939000      1.035000  
1 1 1 11 44 19 o 1.849000  0.4757000     2.160000  0.6977000     1.538000  0.6468000     0.6222000      0.9514000 
1 1 1 11 45 0  o 4.871000  0.4443000     4.871000  0.4443000     4.871000  0.4443000     0.000000       0.000000  
1 1 1 11 45 1  o 9.710000  0.2035000     9.765000  0.2664000     9.655000  0.3077000     0.1096000      0.4070000 
1 1 1 11 45 2  o 4.461000  0.3064000     5.059000  0.3719000     3.862000  0.4871000     1.198000       0.6128000 
1 1 1 11 45 3  o 9.963000  0.2026000     10.22000  0.2652000     9.703000  0.3064000     0.5198000      0.4052000 
1 1 1 11 45 4  o 5.825000  0.2607000     6.049000  0.3287000     5.602000  0.4048000     0.4472000      0.5215000 
1 1 1 11 45 5  o 4.145000  0.3404000     4.037000  0.4667000     4.254000  0.4956000     -0.2177000     0.6808000 
1 1 1 11 45 6  o 8.292000  0.2079000     8.310000  0.2919000     8.274000  0.2962000     0.3568000E-01  0.4159000 
1 1 1 11 45 7  o 5.259000  0.3628000     5.110000  0.6134000     5.409000  0.3877000     -0.2987000     0.7257000 
1 1 1 11 45 8  o 6.957000  0.3621000     6.948000  0.3425000     6.965000  0.6380000     -0.1731000E-01 0.7241000 
1 1 1 11 45 9  o 3.639000  0.5280000     3.295000  0.8278000     3.982000  0.6555000     -0.6872000     1.056000  
1 1 1 11 45 10 o 3.476000  0.4215000     3.422000  0.5729000     3.531000  0.6184000     -0.1088000     0.8430000 
1 1 1 11 45 11 o 4.622000  0.3354000     4.253000  0.4935000     4.991000  0.4545000     -0.7382000     0.6709000 
1 1 1 11 45 12 o 9.687000  0.2074000     9.847000  0.2917000     9.527000  0.2949000     0.3205000      0.4148000 
1 1 1 11 45 13 o 6.360000  0.2570000     6.606000  0.3537000     6.113000  0.3729000     0.4938000      0.5140000 
1 1 1 11 45 14 o 3.188000  0.4515000     3.087000  0.6579000     3.290000  0.6184000     -0.2028000     0.9029000 
1 1 1 11 45 15 f 2.525000  0.5106000     2.512000  0.7282000     2.538000  0.7158000     -0.2586000E-01 1.021000  
1 1 1 11 45 16 o 1.945000  0.5489000     2.104000  0.8388000     1.785000  0.7083000     0.3193000      1.098000  
1 1 1 11 45 17 o 1.240000  0.4160000     1.312000  0.5943000     1.168000  0.5822000     0.1443000      0.8320000 
1 1 1 11 45 18 o 1.629000  0.4684000     1.707000  0.6786000     1.550000  0.6459000     0.1575000      0.9368000 
1 1 1 11 45 19 o 2.197000  0.4212000     1.267000  0.5807000     3.127000  0.6102000     -1.860000      0.8424000 
1 1 1 11 46 0  o 5.867000  0.4089000     5.867000  0.4089000     5.867000  0.4089000     -0.000000      0.000000  
1 1 1 11 46 1  o 4.660000  0.3145000     4.517000  0.4277000     4.803000  0.4612000     -0.2857000     0.6290000 
1 1 1 11 46 2  o 2.242000  0.4626000     2.810000  0.6368000     1.673000  0.6713000     1.137000       0.9253000 
1 1 1 11 46 3  o 8.126000  0.2176000     8.113000  0.2872000     8.138000  0.3271000     -0.2472000E-01 0.4353000 
1 1 1 11 46 4  o 5.177000  0.2886000     5.168000  0.3899000     5.187000  0.4256000     -0.1881000E-01 0.5772000 
1 1 1 11 46 5  f 1.448000  0.4550000     1.390000  0.6206000     1.506000  0.6656000     -0.1158000     0.9100000 
1 1 1 11 46 6  o 7.393000  0.2702000     7.510000  0.4402000     7.276000  0.3134000     0.2346000      0.5404000 
1 1 1 11 46 7  o 12.17000  0.2778000     12.17000  0.2778000     ?         ?             ?              ?         
1 1 1 11 46 8  o 11.24000  0.2630000     11.09000  0.3972000     11.39000  0.3449000     -0.2993000     0.5260000 
1 1 1 11 46 9  o 4.858000  0.3149000     4.730000  0.4409000     4.986000  0.4498000     -0.2561000     0.6298000 
1 1 1 11 46 10 o 6.585000  0.2462000     6.384000  0.3450000     6.786000  0.3513000     -0.4011000     0.4924000 
1 1 1 11 46 11 o 7.767000  0.2269000     7.860000  0.3140000     7.675000  0.3275000     0.1851000      0.4537000 
1 1 1 11 46 12 o 5.276000  0.2888000     5.375000  0.4073000     5.177000  0.4096000     0.1983000      0.5776000 
1 1 1 11 46 13 o 4.987000  0.3016000     5.149000  0.4190000     4.826000  0.4340000     0.3233000      0.6033000 
1 1 1 11 46 14 o 2.602000  0.5013000     2.425000  0.7270000     2.780000  0.6905000     -0.3559000     1.003000  
1 1 1 11 46 15 o 4.029000  0.3656000     3.533000  0.5835000     4.525000  0.4407000     -0.9920000     0.7312000 
1 1 1 11 46 16 o 1.302000  0.4262000     1.415000  0.6225000     1.189000  0.5823000     0.2260000      0.8524000 
1 1 1 11 46 17 o 2.656000  0.5894000     2.696000  0.8299000     2.616000  0.8373000     0.7996000E-01  1.179000  
1 1 1 11 46 18 o 2.207000  0.4597000     2.907000  0.6514000     1.506000  0.6487000     1.401000       0.9193000 
1 1 1 11 46 19 o 1.376000  0.4828000     1.385000  0.6899000     1.367000  0.6756000     0.1738000E-01  0.9657000 
1 1 1 11 47 0  o 4.288000  0.5333000     4.288000  0.5333000     4.288000  0.5333000     -0.000000      0.000000  
1 1 1 11 47 1  o 12.64000  0.2053000     12.69000  0.2683000     12.58000  0.3107000     0.1165000      0.4105000 
1 1 1 11 47 2  o 14.56000  0.1894000     14.36000  0.2662000     14.76000  0.2694000     -0.3975000     0.3787000 
1 1 1 11 47 3  o 4.724000  0.3012000     5.150000  0.3855000     4.298000  0.4629000     0.8518000      0.6024000 
1 1 1 11 47 4  o 1.608000  0.4690000     2.127000  0.7728000     1.088000  0.5315000     1.038000       0.9379000 
1 1 1 11 47 5  o 4.370000  0.5232000     4.087000  0.6852000     4.652000  0.7909000     -0.5650000     1.046000  
1 1 1 11 47 6  o 13.75000  0.3086000     13.75000  0.3086000     ?         ?             ?              ?         
1 1 1 11 47 7  o 5.915000  0.3354000     5.520000  0.5576000     6.311000  0.3730000     -0.7910000     0.6709000 
1 1 1 11 47 8  o 2.127000  0.5047000     1.699000  0.6959000     2.556000  0.7312000     -0.8570000     1.009000  
1 1 1 11 47 9  o 4.758000  0.3119000     4.438000  0.4530000     5.078000  0.4288000     -0.6402000     0.6238000 
1 1 1 11 47 10 o 2.449000  0.4520000     1.545000  0.6635000     3.354000  0.6140000     -1.809000      0.9040000 
1 1 1 11 47 11 o 4.309000  0.3470000     4.515000  0.4569000     4.103000  0.5223000     0.4119000      0.6939000 
1 1 1 11 47 12 o 5.153000  0.3114000     5.129000  0.4611000     5.176000  0.4186000     -0.4735000E-01 0.6228000 
1 1 1 11 47 13 o 2.507000  0.5110000     2.445000  0.7333000     2.569000  0.7120000     -0.1238000     1.022000  
1 1 1 11 47 14 o 3.592000  0.3815000     3.977000  0.5041000     3.207000  0.5728000     0.7707000      0.7630000 
1 1 1 11 47 15 o 1.427000  0.4701000     1.662000  0.7527000     1.192000  0.5634000     0.4702000      0.9403000 
1 1 1 11 47 16 o 1.423000  0.4710000     1.226000  0.5739000     1.620000  0.7470000     -0.3942000     0.9420000 
1 1 1 11 47 17 o 2.291000  0.5066000     2.377000  0.7118000     2.205000  0.7210000     0.1716000      1.013000  
1 1 1 11 47 18 o 3.031000  0.4423000     3.419000  0.5664000     2.643000  0.6795000     0.7759000      0.8846000 
1 1 1 11 48 0  o 1.784000  0.9129000     1.784000  0.9129000     1.784000  0.9129000     0.000000       0.000000  
1 1 1 11 48 1  o 9.183000  0.2330000     9.041000  0.3322000     9.326000  0.3268000     -0.2852000     0.4660000 
1 1 1 11 48 2  o 4.548000  0.3563000     4.700000  0.4942000     4.396000  0.5133000     0.3047000      0.7125000 
1 1 1 11 48 3  o 2.927000  0.5559000     3.215000  0.8101000     2.640000  0.7613000     0.5748000      1.112000  
1 1 1 11 48 4  o 7.151000  0.3691000     7.151000  0.3691000     ?         ?             ?              ?         
1 1 1 11 48 5  o 7.078000  0.3521000     7.179000  0.4639000     6.977000  0.5298000     0.2022000      0.7042000 
1 1 1 11 48 6  o 7.223000  0.2648000     7.271000  0.4027000     7.176000  0.3441000     0.9483000E-01  0.5297000 
1 1 1 11 48 7  o 6.740000  0.2422000     6.462000  0.3381000     7.017000  0.3469000     -0.5550000     0.4844000 
1 1 1 11 48 8  o 7.055000  0.2372000     6.835000  0.3371000     7.276000  0.3337000     -0.4416000     0.4743000 
1 1 1 11 48 9  o 3.770000  0.3792000     3.698000  0.5398000     3.842000  0.5327000     -0.1439000     0.7584000 
1 1 1 11 48 10 o 4.055000  0.3643000     3.838000  0.5500000     4.273000  0.4778000     -0.4350000     0.7286000 
1 1 1 11 48 11 o 2.625000  0.4944000     3.069000  0.6401000     2.180000  0.7535000     0.8895000      0.9887000 
1 1 1 11 48 12 o 3.339000  0.4282000     2.859000  0.6780000     3.819000  0.5231000     -0.9595000     0.8564000 
1 1 1 11 48 13 o 3.510000  0.4231000     2.702000  0.7061000     4.319000  0.4663000     -1.617000      0.8462000 
1 1 1 11 48 14 o 2.812000  0.4657000     2.441000  0.7157000     3.184000  0.5960000     -0.7422000     0.9313000 
1 1 1 11 48 15 o 1.478000  0.4704000     1.362000  0.6154000     1.595000  0.7117000     -0.2331000     0.9409000 
1 1 1 11 48 16 o 2.163000  0.5342000     2.843000  0.8229000     1.484000  0.6813000     1.359000       1.068000  
1 1 1 11 48 17 o 1.982000  0.5079000     1.850000  0.7028000     2.114000  0.7333000     -0.2645000     1.016000  
1 1 1 11 48 18 o 1.193000  0.4025000     1.250000  0.5892000     1.136000  0.5485000     0.1144000      0.8050000 
1 1 1 11 49 0  o 8.197000  0.5931000     8.197000  0.5931000     8.197000  0.5931000     0.000000       0.000000  
1 1 1 11 49 1  o 1.596000  0.7552000     1.596000  0.7552000     ?         ?             ?              ?         
1 1 1 11 49 2  f 4.118000  0.7200000     5.330000  0.8495000     2.906000  1.163000      2.424000       1.440000  
1 1 1 11 49 3  o 8.559000  0.4084000     8.321000  0.4417000     8.796000  0.6870000     -0.4752000     0.8167000 
1 1 1 11 49 4  o 10.51000  0.2611000     10.63000  0.3998000     10.39000  0.3360000     0.2333000      0.5223000 
1 1 1 11 49 5  o 7.523000  0.2451000     7.220000  0.3225000     7.826000  0.3693000     -0.6065000     0.4903000 
1 1 1 11 49 6  o 5.043000  0.3234000     4.892000  0.4109000     5.194000  0.4996000     -0.3029000     0.6469000 
1 1 1 11 49 7  o 4.784000  0.3068000     4.702000  0.4258000     4.866000  0.4417000     -0.1640000     0.6135000 
1 1 1 11 49 8  o 3.122000  0.4458000     3.145000  0.6199000     3.099000  0.6408000     0.4537000E-01  0.8916000 
1 1 1 11 49 9  o 3.607000  0.4025000     4.004000  0.5198000     3.209000  0.6147000     0.7952000      0.8050000 
1 1 1 11 49 10 o 2.243000  0.5041000     1.823000  0.7165000     2.663000  0.7092000     -0.8401000     1.008000  
1 1 1 11 49 11 o 4.513000  0.3269000     4.801000  0.4404000     4.225000  0.4832000     0.5760000      0.6538000 
1 1 1 11 49 12 o 2.625000  0.4829000     2.321000  0.7188000     2.928000  0.6450000     -0.6079000     0.9658000 
1 1 1 11 49 13 o 4.972000  0.3005000     4.903000  0.4391000     5.041000  0.4103000     -0.1380000     0.6010000 
1 1 1 11 49 14 o 2.694000  0.5472000     3.681000  0.8281000     1.707000  0.7154000     1.974000       1.094000  
1 1 1 11 49 15 o 1.704000  0.5203000     1.736000  0.7155000     1.671000  0.7556000     0.6514000E-01  1.041000  
1 1 1 11 49 16 o 2.910000  0.4675000     2.987000  0.6434000     2.834000  0.6785000     0.1531000      0.9350000 
1 1 1 11 49 17 o 1.588000  0.4671000     1.575000  0.6571000     1.601000  0.6641000     -0.2626000E-01 0.9342000 
1 1 1 11 50 0  o 2.141000  1.054000      2.141000  1.054000      2.141000  1.054000      0.000000       0.000000  
1 1 1 11 50 1  o 7.531000  0.2916000     7.720000  0.4574000     7.342000  0.3618000     0.3776000      0.5832000 
1 1 1 11 50 2  o 1.989000  0.4944000     1.650000  0.6833000     2.328000  0.7147000     -0.6779000     0.9888000 
1 1 1 11 50 3  o 5.681000  0.2596000     5.693000  0.3660000     5.668000  0.3683000     0.2549000E-01  0.5192000 
1 1 1 11 50 4  o 2.536000  0.5266000     2.275000  0.7071000     2.798000  0.7806000     -0.5238000     1.053000  
1 1 1 11 50 5  o 5.747000  0.2956000     5.847000  0.3669000     5.646000  0.4637000     0.2014000      0.5912000 
1 1 1 11 50 6  o 5.024000  0.3165000     5.174000  0.3893000     4.873000  0.4991000     0.3016000      0.6330000 
1 1 1 11 50 7  o 2.497000  0.4998000     2.592000  0.6825000     2.402000  0.7303000     0.1904000      0.9996000 
1 1 1 11 50 8  o 2.565000  0.5038000     2.514000  0.7276000     2.616000  0.6971000     -0.1023000     1.008000  
1 1 1 11 50 9  o 5.757000  0.2808000     5.749000  0.4023000     5.764000  0.3918000     -0.1529000E-01 0.5616000 
1 1 1 11 50 10 o 5.101000  0.3045000     5.372000  0.4139000     4.829000  0.4467000     0.5426000      0.6090000 
1 1 1 11 50 11 o 4.813000  0.3129000     4.789000  0.4542000     4.837000  0.4305000     -0.4859000E-01 0.6258000 
1 1 1 11 50 12 o 3.611000  0.4005000     3.301000  0.6153000     3.921000  0.5128000     -0.6198000     0.8010000 
1 1 1 11 50 13 o 1.599000  0.5039000     1.858000  0.8035000     1.340000  0.6084000     0.5177000      1.008000  
1 1 1 11 50 14 o 2.791000  0.5930000     2.426000  0.7065000     3.157000  0.9527000     -0.7302000     1.186000  
1 1 1 11 50 15 o 3.716000  0.4449000     3.772000  0.6965000     3.660000  0.5538000     0.1121000      0.8898000 
1 1 1 11 50 16 o 2.720000  0.4505000     1.843000  0.7111000     3.598000  0.5534000     -1.755000      0.9010000 
1 1 1 11 50 17 o 2.833000  0.4664000     3.257000  0.5929000     2.409000  0.7201000     0.8482000      0.9328000 
1 1 1 11 51 0  o 7.056000  0.3739000     7.056000  0.3739000     7.056000  0.3739000     -0.000000      0.000000  
1 1 1 11 51 1  o 2.850000  0.5045000     2.216000  0.7657000     3.484000  0.6572000     -1.268000      1.009000  
1 1 1 11 51 2  o 2.651000  0.4841000     2.380000  0.7068000     2.921000  0.6617000     -0.5417000     0.9682000 
1 1 1 11 51 3  o 2.553000  0.4984000     2.269000  0.7189000     2.836000  0.6904000     -0.5677000     0.9968000 
1 1 1 11 51 4  o 4.841000  0.3321000     4.248000  0.4691000     5.434000  0.4701000     -1.186000      0.6641000 
1 1 1 11 51 5  o 4.668000  0.3271000     4.505000  0.4368000     4.831000  0.4870000     -0.3262000     0.6542000 
1 1 1 11 51 6  o 3.117000  0.4681000     2.857000  0.6620000     3.376000  0.6621000     -0.5181000     0.9363000 
1 1 1 11 51 7  o 7.002000  0.2399000     6.915000  0.3395000     7.089000  0.3390000     -0.1739000     0.4797000 
1 1 1 11 51 8  o 6.913000  0.2472000     7.073000  0.3424000     6.754000  0.3567000     0.3190000      0.4944000 
1 1 1 11 51 9  o 3.425000  0.4335000     4.081000  0.5248000     2.770000  0.6902000     1.311000       0.8670000 
1 1 1 11 51 10 o 1.681000  0.4865000     1.713000  0.6937000     1.649000  0.6822000     0.6399000E-01  0.9730000 
1 1 1 11 51 11 o 3.051000  0.4583000     2.839000  0.6809000     3.264000  0.6137000     -0.4252000     0.9167000 
1 1 1 11 51 12 o 1.612000  0.4751000     1.664000  0.6807000     1.560000  0.6629000     0.1042000      0.9502000 
1 1 1 11 51 13 o 2.510000  0.4917000     3.347000  0.6442000     1.672000  0.7429000     1.676000       0.9833000 
1 1 1 11 51 14 o 2.794000  0.5834000     2.096000  0.7708000     3.492000  0.8760000     -1.395000      1.167000  
1 1 1 11 51 15 o 1.724000  0.4852000     1.791000  0.6910000     1.657000  0.6812000     0.1341000      0.9704000 
1 1 1 11 51 16 o 1.559000  0.4656000     1.609000  0.6680000     1.509000  0.6488000     0.1003000      0.9312000 
1 1 1 11 52 0  o 5.098000  0.4619000     5.098000  0.4619000     5.098000  0.4619000     -0.000000      0.000000  
1 1 1 11 52 1  o 3.510000  0.4745000     4.058000  0.5695000     2.963000  0.7592000     1.095000       0.9491000 
1 1 1 11 52 2  o 4.983000  0.2983000     5.267000  0.3951000     4.698000  0.4470000     0.5690000      0.5966000 
1 1 1 11 52 3  o 8.042000  0.2191000     7.873000  0.3154000     8.211000  0.3042000     -0.3374000     0.4382000 
1 1 1 11 52 4  o 1.860000  0.5013000     1.939000  0.7136000     1.780000  0.7043000     0.1584000      1.003000  
1 1 1 11 52 5  o 4.578000  0.3443000     4.153000  0.5027000     5.003000  0.4707000     -0.8500000     0.6886000 
1 1 1 11 52 6  o 6.525000  0.2646000     6.493000  0.3552000     6.556000  0.3923000     -0.6216000E-01 0.5292000 
1 1 1 11 52 7  o 4.594000  0.3320000     4.402000  0.4832000     4.786000  0.4553000     -0.3842000     0.6639000 
1 1 1 11 52 8  o 2.741000  0.4951000     3.036000  0.6547000     2.445000  0.7429000     0.5914000      0.9903000 
1 1 1 11 52 9  o 4.765000  0.3123000     4.725000  0.4573000     4.805000  0.4256000     -0.8028000E-01 0.6247000 
1 1 1 11 52 10 o 5.934000  0.2699000     5.919000  0.3871000     5.949000  0.3761000     -0.3006000E-01 0.5397000 
1 1 1 11 52 11 o 5.062000  0.3029000     4.723000  0.4462000     5.402000  0.4097000     -0.6792000     0.6058000 
1 1 1 11 52 12 o 2.238000  0.5867000     2.604000  0.9033000     1.872000  0.7490000     0.7313000      1.173000  
1 1 1 11 52 13 o 1.722000  0.4756000     2.214000  0.7322000     1.230000  0.6072000     0.9844000      0.9513000 
1 1 1 11 52 14 o 1.948000  0.5126000     1.778000  0.7323000     2.119000  0.7174000     -0.3410000     1.025000  
1 1 1 11 52 15 o 1.365000  0.4365000     1.564000  0.6612000     1.165000  0.5699000     0.3994000      0.8729000 
1 1 1 11 52 16 o 1.648000  0.4838000     1.739000  0.6845000     1.557000  0.6839000     0.1822000      0.9676000 
1 1 1 11 53 0  o 5.455000  0.4530000     5.455000  0.4530000     5.455000  0.4530000     0.000000       0.000000  
1 1 1 11 53 1  o 1.540000  0.4787000     1.521000  0.6697000     1.558000  0.6843000     -0.3790000E-01 0.9575000 
1 1 1 11 53 2  o 4.344000  0.3317000     4.470000  0.4601000     4.217000  0.4781000     0.2536000      0.6635000 
1 1 1 11 53 3  o 2.411000  0.4910000     2.023000  0.7205000     2.799000  0.6673000     -0.7755000     0.9821000 
1 1 1 11 53 4  o 4.413000  0.3382000     3.934000  0.5261000     4.892000  0.4253000     -0.9581000     0.6765000 
1 1 1 11 53 5  o 3.901000  0.4514000     4.020000  0.5050000     3.782000  0.7484000     0.2378000      0.9028000 
1 1 1 11 53 6  o 7.298000  0.2542000     7.630000  0.3249000     6.966000  0.3909000     0.6644000      0.5083000 
1 1 1 11 53 7  o 1.798000  0.5028000     1.494000  0.6547000     2.102000  0.7633000     -0.6087000     1.006000  
1 1 1 11 53 8  f 3.045000  0.4726000     2.860000  0.6882000     3.229000  0.6480000     -0.3694000     0.9453000 
1 1 1 11 53 9  o 1.437000  0.4481000     1.289000  0.5999000     1.585000  0.6658000     -0.2957000     0.8962000 
1 1 1 11 53 10 o 1.574000  0.4696000     1.646000  0.6826000     1.502000  0.6451000     0.1439000      0.9393000 
1 1 1 11 53 11 o 1.334000  0.4458000     1.323000  0.6457000     1.345000  0.6149000     -0.2292000E-01 0.8917000 
1 1 1 11 53 12 o 3.675000  0.5360000     3.302000  0.6009000     4.048000  0.8878000     -0.7460000     1.072000  
1 1 1 11 53 13 o 2.303000  0.5365000     2.171000  0.8134000     2.435000  0.6998000     -0.2635000     1.073000  
1 1 1 11 53 14 o 2.309000  0.5091000     2.174000  0.7255000     2.445000  0.7145000     -0.2707000     1.018000  
1 1 1 11 53 15 o 1.327000  0.4263000     1.397000  0.6186000     1.258000  0.5866000     0.1398000      0.8525000 
1 1 1 11 54 0  o 1.168000  0.7616000     1.168000  0.7616000     1.168000  0.7616000     -0.000000      0.000000  
1 1 1 11 54 1  f 2.984000  0.5050000     2.858000  0.7691000     3.109000  0.6546000     -0.2506000     1.010000  
1 1 1 11 54 2  o 2.400000  0.5115000     2.634000  0.7153000     2.166000  0.7313000     0.4685000      1.023000  
1 1 1 11 54 3  o 6.547000  0.2524000     6.601000  0.3509000     6.493000  0.3628000     0.1081000      0.5047000 
1 1 1 11 54 4  o 4.668000  0.3167000     4.583000  0.4518000     4.753000  0.4441000     -0.1697000     0.6335000 
1 1 1 11 54 5  o 6.348000  0.2695000     6.486000  0.3568000     6.209000  0.4040000     0.2769000      0.5390000 
1 1 1 11 54 6  o 3.627000  0.4280000     4.052000  0.5026000     3.201000  0.6929000     0.8510000      0.8560000 
1 1 1 11 54 7  o 2.954000  0.4866000     2.316000  0.7387000     3.591000  0.6336000     -1.275000      0.9732000 
1 1 1 11 54 8  o 3.911000  0.3818000     4.076000  0.5134000     3.746000  0.5652000     0.3302000      0.7635000 
1 1 1 11 54 9  o 2.378000  0.4176000     3.480000  0.5928000     1.277000  0.5883000     2.204000       0.8352000 
1 1 1 11 54 10 o 1.952000  0.5313000     2.096000  0.7959000     1.808000  0.7040000     0.2887000      1.063000  
1 1 1 11 54 11 o 3.747000  0.5552000     3.828000  0.5606000     3.666000  0.9586000     0.1625000      1.110000  
1 1 1 11 54 12 o 1.812000  0.5298000     1.530000  0.7007000     2.093000  0.7947000     -0.5636000     1.060000  
1 1 1 11 54 13 o 1.726000  0.4746000     1.403000  0.6241000     2.050000  0.7151000     -0.6467000     0.9492000 
1 1 1 11 54 14 o 1.542000  0.4505000     1.124000  0.5384000     1.961000  0.7224000     -0.8367000     0.9010000 
1 1 1 11 55 0  o 1.256000  0.7974000     1.256000  0.7974000     1.256000  0.7974000     0.000000       0.000000  
1 1 1 11 55 1  o 4.630000  0.3502000     4.672000  0.5325000     4.589000  0.4550000     0.8363000E-01  0.7004000 
1 1 1 11 55 2  o 7.801000  0.2348000     8.166000  0.3200000     7.437000  0.3436000     0.7286000      0.4695000 
1 1 1 11 55 3  o 1.574000  0.4735000     1.641000  0.6836000     1.507000  0.6554000     0.1332000      0.9470000 
1 1 1 11 55 4  o 5.857000  0.2678000     5.570000  0.3884000     6.144000  0.3689000     -0.5745000     0.5357000 
1 1 1 11 55 5  o 6.275000  0.2793000     6.404000  0.3749000     6.145000  0.4140000     0.2588000      0.5585000 
1 1 1 11 55 6  o 4.072000  0.3932000     4.368000  0.4861000     3.776000  0.6182000     0.5917000      0.7864000 
1 1 1 11 55 7  o 2.794000  0.5114000     2.951000  0.6891000     2.637000  0.7560000     0.3139000      1.023000  
1 1 1 11 55 8  o 2.750000  0.4868000     3.042000  0.6590000     2.459000  0.7168000     0.5836000      0.9737000 
1 1 1 11 55 9  o 1.608000  0.4728000     2.286000  0.8247000     0.9294000 0.4626000     1.357000       0.9456000 
1 1 1 11 55 10 o 3.258000  0.6185000     3.173000  0.7263000     3.343000  1.001000      -0.1707000     1.237000  
1 1 1 11 55 11 o 1.206000  0.4171000     1.315000  0.6330000     1.097000  0.5433000     0.2180000      0.8342000 
1 1 1 11 55 12 o 2.451000  0.4560000     1.630000  0.6819000     3.272000  0.6056000     -1.642000      0.9120000 
1 1 1 11 55 13 o 1.336000  0.4279000     1.331000  0.6062000     1.340000  0.6041000     -0.8599000E-02 0.8558000 
1 1 1 11 55 14 f 1.799000  0.4890000     2.072000  0.7231000     1.525000  0.6583000     0.5464000      0.9779000 
1 1 1 11 56 0  o 1.085000  0.7256000     1.085000  0.7256000     1.085000  0.7256000     0.000000       0.000000  
1 1 1 11 56 1  o 4.335000  0.3760000     4.148000  0.5960000     4.523000  0.4585000     -0.3756000     0.7520000 
1 1 1 11 56 2  o 3.657000  0.4104000     3.966000  0.5350000     3.348000  0.6224000     0.6176000      0.8207000 
1 1 1 11 56 3  o 9.532000  0.2175000     9.489000  0.3111000     9.575000  0.3040000     -0.8602000E-01 0.4350000 
1 1 1 11 56 4  o 2.125000  0.5065000     2.282000  0.7125000     1.968000  0.7202000     0.3139000      1.013000  
1 1 1 11 56 5  o 6.816000  0.2493000     6.801000  0.3530000     6.832000  0.3521000     -0.3047000E-01 0.4986000 
1 1 1 11 56 6  o 3.495000  0.4489000     3.559000  0.5956000     3.430000  0.6719000     0.1291000      0.8978000 
1 1 1 11 56 7  o 2.407000  0.5349000     2.267000  0.7293000     2.548000  0.7827000     -0.2806000     1.070000  
1 1 1 11 56 8  o 1.363000  0.4481000     1.407000  0.6580000     1.318000  0.6085000     0.8919000E-01  0.8962000 
1 1 1 11 56 9  o 1.403000  0.4770000     1.211000  0.5849000     1.594000  0.7537000     -0.3824000     0.9540000 
1 1 1 11 56 10 o 1.752000  0.5208000     1.614000  0.7060000     1.890000  0.7658000     -0.2761000     1.042000  
1 1 1 11 56 11 o 1.945000  0.5180000     1.767000  0.7289000     2.123000  0.7362000     -0.3556000     1.036000  
1 1 1 11 56 12 o 1.289000  0.4163000     1.597000  0.6763000     0.9808000 0.4858000     0.6165000      0.8327000 
1 1 1 11 56 13 o 1.767000  0.4966000     1.852000  0.7130000     1.682000  0.6913000     0.1700000      0.9931000 
1 1 1 11 57 0  o 1.406000  0.8511000     1.406000  0.8511000     1.406000  0.8511000     0.000000       0.000000  
1 1 1 11 57 1  o 2.508000  0.5338000     2.294000  0.8059000     2.723000  0.7001000     -0.4289000     1.068000  
1 1 1 11 57 2  o 2.572000  0.5155000     2.775000  0.7276000     2.368000  0.7306000     0.4078000      1.031000  
1 1 1 11 57 3  o 5.374000  0.2899000     5.425000  0.4079000     5.322000  0.4120000     0.1024000      0.5798000 
1 1 1 11 57 4  o 3.261000  0.4347000     3.789000  0.5341000     2.733000  0.6861000     1.056000       0.8694000 
1 1 1 11 57 5  o 2.508000  0.4754000     3.185000  0.6346000     1.832000  0.7080000     1.354000       0.9508000 
1 1 1 11 57 6  o 1.917000  0.5172000     1.808000  0.7040000     2.026000  0.7580000     -0.2182000     1.034000  
1 1 1 11 57 7  o 1.785000  0.5295000     1.705000  0.7515000     1.864000  0.7461000     -0.1590000     1.059000  
1 1 1 11 57 8  o 2.969000  0.6120000     3.540000  0.7014000     2.399000  1.003000      1.141000       1.224000  
1 1 1 11 57 9  o 1.592000  0.5030000     1.711000  0.7482000     1.473000  0.6724000     0.2384000      1.006000  
1 1 1 11 57 10 o 1.257000  0.4200000     1.300000  0.6139000     1.213000  0.5734000     0.8658000E-01  0.8401000 
1 1 1 11 57 11 o 1.479000  0.4534000     1.683000  0.6873000     1.276000  0.5916000     0.4076000      0.9068000 
1 1 1 11 57 12 o 1.071000  0.3684000     0.9529000 0.4747000     1.190000  0.5635000     -0.2369000     0.7368000 
1 1 1 11 58 0  f 3.562000  0.7564000     3.562000  0.7564000     3.562000  0.7564000     0.000000       0.000000  
1 1 1 11 58 1  o 3.511000  0.4701000     2.945000  0.7768000     4.077000  0.5297000     -1.132000      0.9402000 
1 1 1 11 58 2  o 7.152000  0.2732000     6.906000  0.4206000     7.398000  0.3489000     -0.4923000     0.5465000 
1 1 1 11 58 3  o 2.792000  0.4683000     2.047000  0.7389000     3.536000  0.5754000     -1.489000      0.9365000 
1 1 1 11 58 4  o 1.275000  0.4195000     1.354000  0.6173000     1.196000  0.5681000     0.1583000      0.8389000 
1 1 1 11 58 5  o 3.448000  0.4577000     3.381000  0.7056000     3.515000  0.5833000     -0.1342000     0.9154000 
1 1 1 11 58 6  o 2.373000  0.6262000     2.787000  0.8927000     1.959000  0.8784000     0.8281000      1.252000  
1 1 1 11 58 7  o 2.192000  0.7455000     2.192000  0.7455000     ?         ?             ?              ?         
1 1 1 11 58 8  o 1.543000  0.4965000     1.141000  0.5676000     1.944000  0.8149000     -0.8034000     0.9931000 
1 1 1 11 58 9  o 1.659000  0.4884000     1.714000  0.7038000     1.605000  0.6774000     0.1086000      0.9769000 
1 1 1 11 58 10 o 1.563000  0.4655000     1.814000  0.7071000     1.313000  0.6057000     0.5011000      0.9310000 
1 1 1 11 58 11 o 2.374000  0.5124000     2.065000  0.7341000     2.683000  0.7152000     -0.6177000     1.025000  
1 1 1 11 58 12 o 1.947000  0.5238000     1.686000  0.6875000     2.208000  0.7906000     -0.5219000     1.048000  
1 1 1 11 59 0  o 0.9349000 0.6496000     0.9349000 0.6496000     0.9349000 0.6496000     0.000000       0.000000  
1 1 1 11 59 1  o 1.864000  0.5153000     1.615000  0.7045000     2.112000  0.7521000     -0.4969000     1.031000  
1 1 1 11 59 2  o 2.001000  0.5385000     2.108000  0.7953000     1.894000  0.7262000     0.2146000      1.077000  
1 1 1 11 59 3  o 4.949000  0.3375000     5.011000  0.5062000     4.886000  0.4465000     0.1258000      0.6750000 
1 1 1 11 59 4  f 5.204000  0.4212000     5.025000  0.6698000     5.384000  0.5108000     -0.3594000     0.8423000 
1 1 1 11 59 5  o 2.407000  0.7989000     2.407000  0.7989000     ?         ?             ?              ?         
1 1 1 11 59 6  o 1.743000  0.5259000     1.939000  0.7609000     1.547000  0.7260000     0.3922000      1.052000  
1 1 1 11 59 7  o 1.511000  0.4709000     1.116000  0.5578000     1.906000  0.7589000     -0.7896000     0.9418000 
1 1 1 11 59 8  o 3.918000  0.4225000     4.063000  0.5388000     3.773000  0.6510000     0.2908000      0.8451000 
1 1 1 11 59 9  o 3.589000  0.4372000     3.031000  0.7058000     4.146000  0.5162000     -1.116000      0.8744000 
1 1 1 11 59 10 o 1.170000  0.3955000     1.181000  0.5643000     1.158000  0.5544000     0.2240000E-01  0.7911000 
1 1 1 11 59 11 o 1.828000  0.4976000     2.086000  0.7355000     1.570000  0.6704000     0.5160000      0.9952000 
1 1 1 11 60 0  o 0.9257000 0.6619000     0.9257000 0.6619000     0.9257000 0.6619000     -0.000000      0.000000  
1 1 1 11 60 1  o 4.138000  0.7562000     4.371000  1.042000      3.905000  1.096000      0.4661000      1.512000  
1 1 1 11 60 2  o 2.084000  0.6603000     2.222000  0.9656000     1.947000  0.9009000     0.2748000      1.321000  
1 1 1 11 60 3  o 2.590000  0.8782000     2.590000  0.8782000     ?         ?             ?              ?         
1 1 1 11 60 4  o 5.513000  0.5498000     5.555000  0.5849000     5.472000  0.9312000     0.8308000E-01  1.100000  
1 1 1 11 60 5  o 1.396000  0.4598000     1.450000  0.6833000     1.342000  0.6154000     0.1080000      0.9195000 
1 1 1 11 60 6  o 3.923000  0.3991000     3.645000  0.6010000     4.201000  0.5252000     -0.5562000     0.7981000 
1 1 1 11 60 7  o 1.257000  0.4226000     1.192000  0.5687000     1.321000  0.6252000     -0.1295000     0.8452000 
1 1 1 11 60 8  o 1.794000  0.4995000     2.144000  0.7471000     1.444000  0.6630000     0.7004000      0.9989000 
1 1 1 11 60 9  o 2.214000  0.5227000     2.508000  0.7499000     1.919000  0.7285000     0.5892000      1.045000  
1 1 1 11 60 10 o 1.123000  0.3833000     1.384000  0.6303000     0.8630000 0.4362000     0.5206000      0.7665000 
1 1 1 11 61 0  o 11.39000  0.4557000     11.39000  0.4557000     11.39000  0.4557000     0.000000       0.000000  
1 1 1 11 61 1  o 4.901000  0.5974000     4.296000  1.085000      5.506000  0.4999000     -1.209000      1.195000  
1 1 1 11 61 2  o 1.893000  0.5383000     1.556000  0.7241000     2.229000  0.7968000     -0.6727000     1.077000  
1 1 1 11 61 3  o 2.744000  0.5182000     2.197000  0.8053000     3.290000  0.6525000     -1.093000      1.036000  
1 1 1 11 61 4  o 5.102000  0.3088000     4.796000  0.4527000     5.407000  0.4201000     -0.6107000     0.6176000 
1 1 1 11 61 5  o 2.746000  0.5014000     2.511000  0.7214000     2.980000  0.6965000     -0.4690000     1.003000  
1 1 1 11 61 6  o 1.928000  0.4928000     1.452000  0.6449000     2.405000  0.7452000     -0.9528000     0.9855000 
1 1 1 11 61 7  o 1.352000  0.4427000     1.131000  0.5441000     1.574000  0.6985000     -0.4429000     0.8854000 
1 1 1 11 61 8  o 1.910000  0.5269000     2.138000  0.7654000     1.682000  0.7244000     0.4561000      1.054000  
1 1 1 11 61 9  o 1.388000  0.4452000     1.551000  0.6665000     1.224000  0.5903000     0.3269000      0.8904000 
1 1 1 11 62 0  o 1.098000  0.7161000     1.098000  0.7161000     1.098000  0.7161000     -0.000000      0.000000  
1 1 1 11 62 1  o 2.595000  0.5164000     1.983000  0.7852000     3.206000  0.6710000     -1.224000      1.033000  
1 1 1 11 62 2  o 1.299000  0.4337000     1.411000  0.6549000     1.188000  0.5686000     0.2221000      0.8673000 
1 1 1 11 62 3  o 3.168000  0.4723000     3.057000  0.6933000     3.278000  0.6415000     -0.2213000     0.9445000 
1 1 1 11 62 4  o 3.167000  0.4696000     3.076000  0.6766000     3.259000  0.6514000     -0.1830000     0.9392000 
1 1 1 11 62 5  o 1.514000  0.4620000     1.313000  0.6050000     1.716000  0.6984000     -0.4030000     0.9240000 
1 1 1 11 62 6  o 1.684000  0.4909000     1.534000  0.6621000     1.835000  0.7250000     -0.3011000     0.9818000 
1 1 1 11 62 7  o 1.237000  0.4141000     1.312000  0.6034000     1.163000  0.5673000     0.1494000      0.8282000 
1 1 1 11 63 0  o 0.8703000 0.6077000     0.8703000 0.6077000     0.8703000 0.6077000     -0.000000      0.000000  
1 1 1 11 63 1  o 1.504000  0.4578000     1.134000  0.5576000     1.873000  0.7262000     -0.7387000     0.9156000 
1 1 1 11 63 2  o 1.840000  0.5230000     1.721000  0.7401000     1.959000  0.7392000     -0.2383000     1.046000  
1 1 1 11 63 3  o 3.446000  0.4606000     3.145000  0.7024000     3.746000  0.5961000     -0.6009000     0.9213000 
1 1 1 11 63 4  o 1.416000  0.4409000     1.738000  0.7029000     1.093000  0.5323000     0.6454000      0.8817000 
1 1 1 11 63 5  o 1.230000  0.4103000     1.132000  0.5458000     1.327000  0.6128000     -0.1948000     0.8206000 
1 1 1 11 63 6  o 1.087000  0.3744000     1.135000  0.5473000     1.038000  0.5111000     0.9668000E-01  0.7488000 
1 1 1 11 64 0  o 0.7219000 0.5209000     0.7219000 0.5209000     0.7219000 0.5209000     0.000000       0.000000  
1 1 1 11 64 1  o 1.320000  0.4411000     1.410000  0.6622000     1.230000  0.5829000     0.1801000      0.8822000 
1 1 1 11 64 2  o 3.606000  0.4828000     3.098000  0.7996000     4.114000  0.5414000     -1.016000      0.9657000 
1 1 1 11 64 3  o 1.409000  0.4559000     1.646000  0.7162000     1.172000  0.5643000     0.4738000      0.9118000 
1 1 1 11 64 4  o 2.396000  0.4280000     1.260000  0.5903000     3.532000  0.6198000     -2.272000      0.8559000 
1 1 1 11 65 0  o 0.8650000 0.6388000     0.8650000 0.6388000     0.8650000 0.6388000     -0.000000      0.000000  
1 1 1 12 0  1  o 3.362000  0.1773000     3.362000  0.1773000     3.362000  0.1773000     -0.000000      0.000000  
1 1 1 12 0  2  o 19.90000  0.2232000     19.90000  0.2232000     19.90000  0.2232000     0.000000       0.000000  
1 1 1 12 0  3  o 1.709000  0.3285000     1.709000  0.3285000     1.709000  0.3285000     -0.000000      0.000000  
1 1 1 12 0  4  o 24.26000  0.2765000     24.26000  0.2765000     24.26000  0.2765000     0.000000       0.000000  
1 1 1 12 0  5  o 12.58000  0.1783000     12.58000  0.1783000     12.58000  0.1783000     0.000000       0.000000  
1 1 1 12 0  6  o 13.18000  0.2776000     13.18000  0.2776000     13.18000  0.2776000     -0.000000      0.000000  
1 1 1 12 0  7  o 5.389000  0.2530000     5.389000  0.2530000     5.389000  0.2530000     -0.000000      0.000000  
1 1 1 12 0  8  o 13.69000  0.2454000     13.69000  0.2454000     13.69000  0.2454000     0.000000       0.000000  
1 1 1 12 0  9  o 0.8920000 0.5946000     0.8920000 0.5946000     0.8920000 0.5946000     -0.000000      0.000000  
1 1 1 12 0  10 o 17.34000  0.2936000     17.34000  0.2936000     17.34000  0.2936000     0.000000       0.000000  
1 1 1 12 0  11 o 1.339000  0.7967000     1.339000  0.7967000     1.339000  0.7967000     -0.000000      0.000000  
1 1 1 12 0  12 o 7.197000  0.3078000     7.197000  0.3078000     7.197000  0.3078000     0.000000       0.000000  
1 1 1 12 0  13 o 2.795000  0.7845000     2.795000  0.7845000     2.795000  0.7845000     -0.000000      0.000000  
1 1 1 12 0  14 o 6.676000  0.3715000     6.676000  0.3715000     6.676000  0.3715000     0.000000       0.000000  
1 1 1 12 0  15 o 3.741000  0.8629000     3.741000  0.8629000     3.741000  0.8629000     0.000000       0.000000  
1 1 1 12 0  16 o 2.358000  1.144000      2.358000  1.144000      2.358000  1.144000      0.000000       0.000000  
1 1 1 12 0  17 o 9.390000  0.3819000     9.390000  0.3819000     9.390000  0.3819000     0.000000       0.000000  
1 1 1 12 0  18 o 7.292000  0.4948000     7.292000  0.4948000     7.292000  0.4948000     0.000000       0.000000  
1 1 1 12 0  19 o 1.582000  0.9870000     1.582000  0.9870000     1.582000  0.9870000     0.000000       0.000000  
1 1 1 12 0  20 o 2.079000  1.175000      2.079000  1.175000      2.079000  1.175000      -0.000000      0.000000  
1 1 1 12 0  21 o 1.191000  0.8263000     1.191000  0.8263000     1.191000  0.8263000     0.000000       0.000000  
1 1 1 12 0  22 o 2.443000  0.9884000     2.443000  0.9884000     2.443000  0.9884000     0.000000       0.000000  
1 1 1 12 0  23 o 1.094000  0.7274000     1.094000  0.7274000     1.094000  0.7274000     0.000000       0.000000  
1 1 1 12 0  24 o 1.500000  0.8744000     1.500000  0.8744000     1.500000  0.8744000     -0.000000      0.000000  
1 1 1 12 0  25 o 0.9371000 0.6490000     0.9371000 0.6490000     0.9371000 0.6490000     0.000000       0.000000  
1 1 1 12 0  26 o 1.641000  0.9579000     1.641000  0.9579000     1.641000  0.9579000     -0.000000      0.000000  
1 1 1 12 1  0  o 15.22000  0.3400000     15.22000  0.3400000     15.22000  0.3400000     -0.000000      0.000000  
1 1 1 12 1  1  o 14.85000  0.1965000     14.80000  0.3408000     14.90000  0.1959000     -0.9784000E-01 0.3931000 
1 1 1 12 1  2  o 17.09000  0.1427000     17.07000  0.1730000     17.10000  0.2269000     -0.2899000E-01 0.2853000 
1 1 1 12 1  3  o 35.53000  0.2762000     35.29000  0.3880000     35.78000  0.3933000     -0.4967000     0.5525000 
1 1 1 12 1  4  o 24.12000  0.1946000     24.09000  0.2748000     24.16000  0.2755000     -0.6723000E-01 0.3892000 
1 1 1 12 1  5  o 10.08000  0.1166000     9.969000  0.1634000     10.20000  0.1664000     -0.2288000     0.2332000 
1 1 1 12 1  6  o 8.374000  0.1861000     8.214000  0.2599000     8.533000  0.2663000     -0.3192000     0.3721000 
1 1 1 12 1  7  o 9.297000  0.1512000     8.981000  0.2133000     9.612000  0.2142000     -0.6315000     0.3023000 
1 1 1 12 1  8  o 15.50000  0.1820000     15.52000  0.2580000     15.47000  0.2567000     0.4901000E-01  0.3640000 
1 1 1 12 1  9  o 2.805000  0.3880000     3.079000  0.5087000     2.531000  0.5861000     0.5475000      0.7761000 
1 1 1 12 1  10 o 8.361000  0.2011000     8.172000  0.2887000     8.551000  0.2801000     -0.3791000     0.4023000 
1 1 1 12 1  11 o 7.095000  0.2437000     6.798000  0.3516000     7.393000  0.3375000     -0.5949000     0.4873000 
1 1 1 12 1  12 o 9.514000  0.1908000     9.227000  0.2721000     9.801000  0.2676000     -0.5738000     0.3816000 
1 1 1 12 1  13 o 11.19000  0.1938000     11.30000  0.2734000     11.07000  0.2748000     0.2381000      0.3876000 
1 1 1 12 1  14 o 2.669000  0.5364000     2.708000  0.7731000     2.630000  0.7437000     0.7751000E-01  1.073000  
1 1 1 12 1  15 o 9.433000  0.2693000     9.239000  0.3851000     9.627000  0.3764000     -0.3882000     0.5385000 
1 1 1 12 1  16 f 10.43000  0.2777000     10.09000  0.4009000     10.77000  0.3843000     -0.6791000     0.5553000 
1 1 1 12 1  17 o 2.813000  0.6268000     2.921000  0.8837000     2.705000  0.8891000     0.2163000      1.254000  
1 1 1 12 1  18 o 4.208000  0.5551000     4.003000  0.8200000     4.413000  0.7485000     -0.4101000     1.110000  
1 1 1 12 1  19 o 5.477000  0.4439000     5.520000  0.6233000     5.434000  0.6322000     0.8663000E-01  0.8878000 
1 1 1 12 1  20 o 3.439000  0.7041000     4.068000  0.9597000     2.809000  1.031000      1.259000       1.408000  
1 1 1 12 1  21 o 2.217000  0.6452000     1.435000  0.7134000     2.999000  1.075000      -1.564000      1.290000  
1 1 1 12 1  22 o 1.738000  0.5232000     1.571000  0.7094000     1.905000  0.7692000     -0.3336000     1.046000  
1 1 1 12 1  23 o 1.922000  0.5106000     1.482000  0.6693000     2.362000  0.7714000     -0.8807000     1.021000  
1 1 1 12 1  24 o 2.029000  0.5462000     1.985000  0.7690000     2.073000  0.7758000     -0.8797000E-01 1.092000  
1 1 1 12 1  25 o 1.689000  0.4876000     1.255000  0.5978000     2.123000  0.7705000     -0.8688000     0.9752000 
1 1 1 12 1  26 o 1.324000  0.4531000     1.279000  0.6239000     1.368000  0.6573000     -0.8844000E-01 0.9062000 
1 1 1 12 2  0  o 23.21000  0.3605000     23.21000  0.3605000     23.21000  0.3605000     0.000000       0.000000  
1 1 1 12 2  1  o 45.12000  0.5726000     45.44000  0.9968000     44.79000  0.5639000     0.6517000      1.145000  
1 1 1 12 2  2  o 26.58000  0.2402000     26.20000  0.3340000     26.96000  0.3454000     -0.7605000     0.4805000 
1 1 1 12 2  3  o 7.672000  0.9990000E-01 7.597000  0.1284000     7.747000  0.1531000     -0.1503000     0.1998000 
1 1 1 12 2  4  o 14.44000  0.1300000     14.43000  0.1840000     14.46000  0.1837000     -0.3180000E-01 0.2600000 
1 1 1 12 2  5  o 10.67000  0.1187000     10.61000  0.1679000     10.73000  0.1679000     -0.1161000     0.2374000 
1 1 1 12 2  6  o 14.03000  0.1636000     14.04000  0.2313000     14.02000  0.2314000     0.1896000E-01  0.3272000 
1 1 1 12 2  7  o 2.137000  0.3804000     2.290000  0.5151000     1.983000  0.5600000     0.3070000      0.7608000 
1 1 1 12 2  8  o 1.635000  0.4139000     1.943000  0.5974000     1.328000  0.5729000     0.6150000      0.8277000 
1 1 1 12 2  9  o 5.590000  0.2210000     5.491000  0.3102000     5.689000  0.3149000     -0.1984000     0.4420000 
1 1 1 12 2  10 o 10.38000  0.1930000     10.16000  0.2720000     10.59000  0.2740000     -0.4338000     0.3861000 
1 1 1 12 2  11 o 12.58000  0.2312000     12.46000  0.3554000     12.71000  0.2957000     -0.2440000     0.4623000 
1 1 1 12 2  12 o 4.841000  0.2838000     4.904000  0.4014000     4.778000  0.4012000     0.1258000      0.5676000 
1 1 1 12 2  13 o 6.811000  0.2384000     6.583000  0.3400000     7.039000  0.3343000     -0.4557000     0.4768000 
1 1 1 12 2  14 o 9.895000  0.2127000     9.820000  0.3047000     9.970000  0.2968000     -0.1497000     0.4254000 
1 1 1 12 2  15 o 9.034000  0.2758000     8.996000  0.3906000     9.073000  0.3895000     -0.7633000E-01 0.5517000 
1 1 1 12 2  16 o 5.773000  0.4196000     5.696000  0.5987000     5.849000  0.5880000     -0.1527000     0.8392000 
1 1 1 12 2  17 o 8.426000  0.2926000     8.614000  0.4123000     8.239000  0.4155000     0.3751000      0.5853000 
1 1 1 12 2  18 f 12.78000  0.2492000     12.84000  0.3530000     12.73000  0.3520000     0.1101000      0.4985000 
1 1 1 12 2  19 o 6.266000  0.3957000     5.593000  0.6060000     6.938000  0.5091000     -1.345000      0.7915000 
1 1 1 12 2  20 o 2.000000  0.6286000     2.080000  0.9109000     1.920000  0.8667000     0.1598000      1.257000  
1 1 1 12 2  21 f 3.036000  0.7674000     3.586000  1.112000      2.485000  1.058000      1.101000       1.535000  
1 1 1 12 2  22 o 2.640000  0.5555000     2.054000  0.8035000     3.226000  0.7674000     -1.172000      1.111000  
1 1 1 12 2  23 o 1.739000  0.5152000     1.705000  0.7183000     1.772000  0.7389000     -0.6727000E-01 1.030000  
1 1 1 12 2  24 o 1.703000  0.5112000     1.617000  0.7089000     1.790000  0.7367000     -0.1726000     1.022000  
1 1 1 12 2  25 o 1.560000  0.4896000     1.696000  0.7277000     1.424000  0.6552000     0.2724000      0.9792000 
1 1 1 12 2  26 o 1.852000  0.5555000     1.558000  0.7164000     2.145000  0.8491000     -0.5867000     1.111000  
1 1 1 12 3  0  o 69.61000  0.7564000     69.61000  0.7564000     69.61000  0.7564000     -0.000000      0.000000  
1 1 1 12 3  1  o 16.32000  0.1406000     16.48000  0.2143000     16.15000  0.1822000     0.3312000      0.2813000 
1 1 1 12 3  2  o 5.636000  0.9245000E-01 5.555000  0.1251000     5.717000  0.1362000     -0.1622000     0.1849000 
1 1 1 12 3  3  o 25.68000  0.2032000     25.56000  0.2854000     25.80000  0.2894000     -0.2384000     0.4064000 
1 1 1 12 3  4  o 5.313000  0.1236000     5.162000  0.1606000     5.464000  0.1879000     -0.3021000     0.2472000 
1 1 1 12 3  5  o 10.37000  0.1178000     10.25000  0.1668000     10.48000  0.1663000     -0.2262000     0.2355000 
1 1 1 12 3  6  o 3.803000  0.2148000     3.891000  0.3079000     3.715000  0.2996000     0.1753000      0.4296000 
1 1 1 12 3  7  o 1.484000  0.3954000     1.472000  0.5634000     1.495000  0.5550000     -0.2331000E-01 0.7908000 
1 1 1 12 3  8  o 5.838000  0.2023000     5.528000  0.2924000     6.148000  0.2797000     -0.6206000     0.4047000 
1 1 1 12 3  9  o 12.70000  0.1792000     12.67000  0.2530000     12.74000  0.2538000     -0.7496000E-01 0.3584000 
1 1 1 12 3  10 o 13.75000  0.1955000     13.80000  0.2772000     13.70000  0.2756000     0.9580000E-01  0.3909000 
1 1 1 12 3  11 o 5.432000  0.3797000     6.391000  0.4627000     4.472000  0.6021000     1.919000       0.7593000 
1 1 1 12 3  12 o 7.257000  0.2150000     7.118000  0.3065000     7.396000  0.3017000     -0.2780000     0.4301000 
1 1 1 12 3  13 o 4.702000  0.3099000     4.741000  0.4356000     4.662000  0.4410000     0.7858000E-01  0.6198000 
1 1 1 12 3  14 o 12.04000  0.2046000     12.15000  0.2888000     11.92000  0.2898000     0.2394000      0.4091000 
1 1 1 12 3  15 o 12.83000  0.2484000     12.91000  0.3460000     12.75000  0.3566000     0.1588000      0.4968000 
1 1 1 12 3  16 o 8.867000  0.3073000     9.112000  0.4213000     8.621000  0.4474000     0.4909000      0.6145000 
1 1 1 12 3  17 o 3.854000  0.5511000     4.248000  0.6861000     3.460000  0.8627000     0.7889000      1.102000  
1 1 1 12 3  18 o 4.843000  0.4976000     4.821000  0.6949000     4.864000  0.7126000     -0.4270000E-01 0.9953000 
1 1 1 12 3  19 o 4.951000  0.5365000     4.125000  0.8727000     5.778000  0.6244000     -1.653000      1.073000  
1 1 1 12 3  20 o 2.994000  0.7195000     3.123000  1.004000      2.864000  1.031000      0.2596000      1.439000  
1 1 1 12 3  21 o 2.400000  0.6708000     3.206000  1.091000      1.594000  0.7809000     1.613000       1.342000  
1 1 1 12 3  22 o 1.599000  0.5068000     1.480000  0.6815000     1.718000  0.7503000     -0.2376000     1.014000  
1 1 1 12 3  23 o 2.124000  0.5198000     2.751000  0.7875000     1.498000  0.6788000     1.253000       1.040000  
1 1 1 12 3  24 o 1.349000  0.4420000     1.000000  0.5016000     1.697000  0.7280000     -0.6971000     0.8840000 
1 1 1 12 3  25 o 1.327000  0.4419000     1.356000  0.6355000     1.298000  0.6142000     0.5792000E-01  0.8838000 
1 1 1 12 3  26 o 1.525000  0.5035000     1.834000  0.7998000     1.216000  0.6118000     0.6175000      1.007000  
1 1 1 12 4  0  o 25.45000  0.2796000     25.45000  0.2796000     25.45000  0.2796000     0.000000       0.000000  
1 1 1 12 4  1  o 7.862000  0.7468000E-01 7.854000  0.1058000     7.870000  0.1054000     -0.1665000E-01 0.1494000 
1 1 1 12 4  2  o 32.68000  0.2631000     33.12000  0.4198000     32.25000  0.3171000     0.8715000      0.5261000 
1 1 1 12 4  3  o 26.18000  0.2073000     26.18000  0.2922000     26.19000  0.2942000     -0.6701000E-02 0.4147000 
1 1 1 12 4  4  o 9.424000  0.1097000     9.360000  0.1408000     9.487000  0.1681000     -0.1270000     0.2193000 
1 1 1 12 4  5  o 13.47000  0.1349000     13.50000  0.1617000     13.44000  0.2161000     0.5248000E-01  0.2699000 
1 1 1 12 4  6  o 7.625000  0.1493000     7.879000  0.2115000     7.371000  0.2108000     0.5083000      0.2986000 
1 1 1 12 4  7  o 11.64000  0.1568000     11.54000  0.2220000     11.74000  0.2216000     -0.1967000     0.3136000 
1 1 1 12 4  8  o 7.898000  0.1767000     7.825000  0.2523000     7.972000  0.2473000     -0.1469000     0.3533000 
1 1 1 12 4  9  o 3.535000  0.3292000     3.591000  0.4609000     3.478000  0.4701000     0.1131000      0.6584000 
1 1 1 12 4  10 o 8.005000  0.2129000     8.109000  0.2994000     7.901000  0.3028000     0.2080000      0.4259000 
1 1 1 12 4  11 o 3.965000  0.4836000     3.819000  0.7063000     4.112000  0.6607000     -0.2934000     0.9671000 
1 1 1 12 4  12 o 3.973000  0.3498000     4.364000  0.4411000     3.583000  0.5431000     0.7808000      0.6997000 
1 1 1 12 4  13 f 14.89000  0.1934000     14.61000  0.2741000     15.18000  0.2727000     -0.5704000     0.3867000 
1 1 1 12 4  14 f 6.739000  0.2647000     6.691000  0.3801000     6.787000  0.3684000     -0.9615000E-01 0.5294000 
1 1 1 12 4  15 o 13.26000  0.2478000     13.40000  0.3513000     13.13000  0.3496000     0.2683000      0.4956000 
1 1 1 12 4  16 o 4.324000  0.6320000     4.522000  0.9515000     4.125000  0.8322000     0.3974000      1.264000  
1 1 1 12 4  17 o 2.023000  0.5975000     1.722000  0.7802000     2.324000  0.9052000     -0.6022000     1.195000  
1 1 1 12 4  18 o 5.091000  0.5043000     4.977000  0.7671000     5.204000  0.6548000     -0.2271000     1.009000  
1 1 1 12 4  19 o 5.825000  0.4303000     5.793000  0.6206000     5.857000  0.5962000     -0.6427000E-01 0.8606000 
1 1 1 12 4  20 o 5.692000  0.5102000     5.713000  0.7034000     5.670000  0.7391000     0.4359000E-01  1.020000  
1 1 1 12 4  21 o 4.169000  0.7672000     4.205000  1.092000      4.133000  1.078000      0.7270000E-01  1.534000  
1 1 1 12 4  22 o 1.970000  0.5647000     2.006000  0.8091000     1.935000  0.7880000     0.7067000E-01  1.129000  
1 1 1 12 4  23 o 1.479000  0.4685000     1.211000  0.5852000     1.748000  0.7319000     -0.5365000     0.9371000 
1 1 1 12 4  24 o 1.623000  0.5007000     1.516000  0.6838000     1.729000  0.7315000     -0.2125000     1.001000  
1 1 1 12 4  25 o 1.598000  0.4973000     1.732000  0.7377000     1.464000  0.6672000     0.2677000      0.9946000 
1 1 1 12 4  26 o 1.572000  0.5110000     1.752000  0.7726000     1.392000  0.6690000     0.3593000      1.022000  
1 1 1 12 5  0  o 16.01000  0.1821000     16.01000  0.1821000     16.01000  0.1821000     0.000000       0.000000  
1 1 1 12 5  1  o 21.19000  0.1672000     21.36000  0.2382000     21.03000  0.2348000     0.3292000      0.3344000 
1 1 1 12 5  2  o 31.43000  0.2449000     31.53000  0.3472000     31.33000  0.3454000     0.1975000      0.4898000 
1 1 1 12 5  3  f 19.83000  0.1671000     20.00000  0.2656000     19.67000  0.2029000     0.3243000      0.3342000 
1 1 1 12 5  4  o 16.29000  0.1611000     16.44000  0.2272000     16.14000  0.2284000     0.3059000      0.3222000 
1 1 1 12 5  5  o 18.32000  0.1503000     18.25000  0.1980000     18.39000  0.2263000     -0.1404000     0.3007000 
1 1 1 12 5  6  o 5.041000  0.1563000     5.020000  0.1820000     5.063000  0.2541000     -0.4365000E-01 0.3125000 
1 1 1 12 5  7  o 7.591000  0.1598000     7.134000  0.2333000     8.048000  0.2185000     -0.9136000     0.3197000 
1 1 1 12 5  8  o 5.565000  0.2069000     5.477000  0.2964000     5.653000  0.2886000     -0.1760000     0.4137000 
1 1 1 12 5  9  o 6.246000  0.1995000     6.469000  0.2587000     6.023000  0.3038000     0.4460000      0.3991000 
1 1 1 12 5  10 o 6.181000  0.2135000     5.551000  0.3262000     6.811000  0.2756000     -1.261000      0.4271000 
1 1 1 12 5  11 o 3.601000  0.4848000     3.532000  0.7653000     3.669000  0.5953000     -0.1365000     0.9695000 
1 1 1 12 5  12 o 6.537000  0.2337000     6.611000  0.3300000     6.462000  0.3310000     0.1495000      0.4674000 
1 1 1 12 5  13 o 4.367000  0.3521000     3.868000  0.5544000     4.866000  0.4341000     -0.9978000     0.7041000 
1 1 1 12 5  14 o 7.514000  0.2532000     7.533000  0.3544000     7.496000  0.3616000     0.3746000E-01  0.5063000 
1 1 1 12 5  15 o 7.049000  0.3310000     6.661000  0.4856000     7.436000  0.4499000     -0.7750000     0.6620000 
1 1 1 12 5  16 o 2.054000  0.6434000     2.414000  1.005000      1.694000  0.8033000     0.7207000      1.287000  
1 1 1 12 5  17 o 3.451000  0.6020000     2.913000  0.9090000     3.988000  0.7896000     -1.075000      1.204000  
1 1 1 12 5  18 o 6.882000  0.4012000     7.034000  0.5182000     6.730000  0.6127000     0.3032000      0.8024000 
1 1 1 12 5  19 f 4.169000  0.6033000     4.365000  0.8163000     3.972000  0.8885000     0.3934000      1.207000  
1 1 1 12 5  20 o 2.687000  0.6969000     3.143000  1.026000      2.231000  0.9436000     0.9116000      1.394000  
1 1 1 12 5  21 o 1.782000  0.5963000     1.397000  0.6958000     2.166000  0.9685000     -0.7693000     1.193000  
1 1 1 12 5  22 o 1.676000  0.5194000     1.802000  0.7674000     1.549000  0.7002000     0.2526000      1.039000  
1 1 1 12 5  23 o 1.918000  0.5453000     1.730000  0.7328000     2.105000  0.8077000     -0.3756000     1.091000  
1 1 1 12 5  24 o 1.780000  0.5203000     1.658000  0.7108000     1.902000  0.7600000     -0.2436000     1.041000  
1 1 1 12 5  25 o 1.554000  0.4887000     1.642000  0.7121000     1.465000  0.6694000     0.1767000      0.9774000 
1 1 1 12 5  26 o 1.652000  0.5310000     1.770000  0.7839000     1.533000  0.7164000     0.2368000      1.062000  
1 1 1 12 6  0  o 1.286000  0.2790000     1.286000  0.2790000     1.286000  0.2790000     0.000000       0.000000  
1 1 1 12 6  1  o 26.46000  0.2069000     26.65000  0.2943000     26.26000  0.2907000     0.3866000      0.4137000 
1 1 1 12 6  2  o 22.98000  0.1824000     23.03000  0.2588000     22.94000  0.2573000     0.9079000E-01  0.3649000 
1 1 1 12 6  3  o 2.311000  0.1301000     2.385000  0.1840000     2.237000  0.1838000     0.1474000      0.2601000 
1 1 1 12 6  4  o 15.98000  0.2408000     15.88000  0.2712000     16.09000  0.3978000     -0.2064000     0.4815000 
1 1 1 12 6  5  o 9.131000  0.1540000     9.489000  0.2452000     8.772000  0.1862000     0.7176000      0.3079000 
1 1 1 12 6  6  o 1.257000  0.3034000     1.390000  0.4173000     1.123000  0.4407000     0.2674000      0.6069000 
1 1 1 12 6  7  o 8.506000  0.1632000     8.578000  0.1748000     8.435000  0.2755000     0.1433000      0.3263000 
1 1 1 12 6  8  o 8.473000  0.1727000     8.206000  0.2497000     8.741000  0.2387000     -0.5349000     0.3455000 
1 1 1 12 6  9  o 5.933000  0.2082000     5.900000  0.2776000     5.965000  0.3104000     -0.6504000E-01 0.4164000 
1 1 1 12 6  10 o 6.924000  0.1973000     6.927000  0.2774000     6.922000  0.2806000     0.5807000E-02  0.3946000 
1 1 1 12 6  11 o 3.590000  0.4116000     3.606000  0.5780000     3.575000  0.5863000     0.3081000E-01  0.8233000 
1 1 1 12 6  12 o 25.81000  0.2353000     25.89000  0.3335000     25.72000  0.3319000     0.1731000      0.4706000 
1 1 1 12 6  13 o 16.47000  0.1977000     16.59000  0.2801000     16.35000  0.2790000     0.2342000      0.3953000 
1 1 1 12 6  14 o 12.32000  0.2074000     12.03000  0.2964000     12.60000  0.2903000     -0.5736000     0.4149000 
1 1 1 12 6  15 o 15.93000  0.2460000     15.82000  0.3506000     16.04000  0.3453000     -0.2133000     0.4921000 
1 1 1 12 6  16 o 5.091000  0.6055000     5.415000  0.8292000     4.768000  0.8825000     0.6472000      1.211000  
1 1 1 12 6  17 o 10.93000  0.2611000     10.61000  0.3769000     11.25000  0.3614000     -0.6321000     0.5222000 
1 1 1 12 6  18 o 2.066000  0.6185000     2.274000  0.9176000     1.857000  0.8295000     0.4175000      1.237000  
1 1 1 12 6  19 o 3.866000  0.6301000     3.444000  0.9585000     4.289000  0.8180000     -0.8443000     1.260000  
1 1 1 12 6  20 o 1.918000  0.6055000     2.119000  0.9115000     1.718000  0.7975000     0.4010000      1.211000  
1 1 1 12 6  21 o 2.326000  0.6737000     1.983000  0.9091000     2.669000  0.9946000     -0.6855000     1.347000  
1 1 1 12 6  22 o 2.576000  0.5565000     3.004000  0.7800000     2.147000  0.7939000     0.8566000      1.113000  
1 1 1 12 6  23 o 2.011000  0.5185000     1.485000  0.6741000     2.538000  0.7880000     -1.053000      1.037000  
1 1 1 12 6  24 o 2.044000  0.5071000     2.674000  0.7773000     1.415000  0.6514000     1.259000       1.014000  
1 1 1 12 6  25 o 1.351000  0.4428000     1.673000  0.7216000     1.030000  0.5134000     0.6430000      0.8856000 
1 1 1 12 6  26 o 1.962000  0.5157000     1.436000  0.6609000     2.488000  0.7919000     -1.052000      1.031000  
1 1 1 12 7  0  o 7.223000  0.1123000     7.223000  0.1123000     7.223000  0.1123000     -0.000000      0.000000  
1 1 1 12 7  1  o 15.25000  0.1267000     15.23000  0.1787000     15.27000  0.1797000     -0.4255000E-01 0.2534000 
1 1 1 12 7  2  o 27.25000  0.2148000     27.39000  0.3048000     27.11000  0.3027000     0.2819000      0.4296000 
1 1 1 12 7  3  o 8.182000  0.9184000E-01 8.220000  0.1304000     8.143000  0.1293000     0.7667000E-01  0.1837000 
1 1 1 12 7  4  o 8.888000  0.1171000     8.914000  0.1684000     8.863000  0.1628000     0.5066000E-01  0.2342000 
1 1 1 12 7  5  o 2.030000  0.3893000     2.083000  0.6817000     1.978000  0.3763000     0.1050000      0.7787000 
1 1 1 12 7  6  o 5.391000  0.1299000     5.326000  0.1783000     5.456000  0.1890000     -0.1306000     0.2598000 
1 1 1 12 7  7  o 2.363000  0.2683000     2.615000  0.3149000     2.111000  0.4345000     0.5033000      0.5366000 
1 1 1 12 7  8  o 7.216000  0.1866000     7.273000  0.1901000     7.159000  0.3212000     0.1140000      0.3732000 
1 1 1 12 7  9  o 6.959000  0.1975000     6.544000  0.2729000     7.373000  0.2855000     -0.8293000     0.3949000 
1 1 1 12 7  10 o 16.79000  0.1808000     16.78000  0.2543000     16.80000  0.2570000     -0.2818000E-01 0.3616000 
1 1 1 12 7  11 o 8.125000  0.2280000     7.868000  0.3259000     8.382000  0.3189000     -0.5136000     0.4560000 
1 1 1 12 7  12 f 10.86000  0.1874000     10.85000  0.2662000     10.88000  0.2639000     -0.2977000E-01 0.3749000 
1 1 1 12 7  13 o 13.94000  0.1933000     13.83000  0.2716000     14.05000  0.2751000     -0.2154000     0.3866000 
1 1 1 12 7  14 o 8.633000  0.2342000     8.818000  0.3279000     8.447000  0.3346000     0.3716000      0.4685000 
1 1 1 12 7  15 o 9.594000  0.2400000     9.340000  0.3447000     9.848000  0.3341000     -0.5077000     0.4800000 
1 1 1 12 7  16 o 3.494000  0.6277000     2.457000  1.001000      4.531000  0.7572000     -2.074000      1.255000  
1 1 1 12 7  17 o 1.801000  0.5657000     1.952000  0.8416000     1.650000  0.7562000     0.3024000      1.131000  
1 1 1 12 7  18 o 5.469000  0.4338000     5.915000  0.5548000     5.024000  0.6671000     0.8910000      0.8676000 
1 1 1 12 7  19 o 2.074000  0.6246000     2.131000  0.8961000     2.016000  0.8704000     0.1148000      1.249000  
1 1 1 12 7  20 o 2.102000  0.6254000     1.972000  0.8544000     2.233000  0.9135000     -0.2604000     1.251000  
1 1 1 12 7  21 f 2.122000  0.6365000     2.069000  0.8848000     2.175000  0.9152000     -0.1058000     1.273000  
1 1 1 12 7  22 o 2.253000  0.5273000     1.577000  0.7052000     2.928000  0.7842000     -1.352000      1.055000  
1 1 1 12 7  23 o 1.435000  0.4649000     1.537000  0.6882000     1.333000  0.6252000     0.2039000      0.9298000 
1 1 1 12 7  24 o 1.649000  0.5147000     1.400000  0.6608000     1.897000  0.7892000     -0.4962000     1.029000  
1 1 1 12 7  25 o 1.549000  0.4845000     1.670000  0.7141000     1.428000  0.6551000     0.2422000      0.9691000 
1 1 1 12 7  26 f 1.153000  0.3993000     1.162000  0.5696000     1.144000  0.5599000     0.1850000E-01  0.7987000 
1 1 1 12 8  0  o 46.71000  0.5096000     46.71000  0.5096000     46.71000  0.5096000     -0.000000      0.000000  
1 1 1 12 8  1  o 2.531000  0.1163000     2.550000  0.1625000     2.512000  0.1665000     0.3769000E-01  0.2327000 
1 1 1 12 8  2  o 12.60000  0.1127000     12.56000  0.1590000     12.64000  0.1597000     -0.8142000E-01 0.2254000 
1 1 1 12 8  3  o 14.13000  0.1364000     14.11000  0.2081000     14.15000  0.1765000     -0.4038000E-01 0.2728000 
1 1 1 12 8  4  o 9.999000  0.1056000     10.08000  0.1504000     9.913000  0.1484000     0.1723000      0.2112000 
1 1 1 12 8  5  o 17.36000  0.2467000     17.35000  0.4545000     17.36000  0.1921000     -0.5709000E-02 0.4934000 
1 1 1 12 8  6  o 6.158000  0.1262000     6.160000  0.1728000     6.156000  0.1841000     0.3703000E-02  0.2525000 
1 1 1 12 8  7  o 12.46000  0.1445000     12.49000  0.1904000     12.44000  0.2173000     0.4822000E-01  0.2890000 
1 1 1 12 8  8  o 11.77000  0.1493000     11.57000  0.1955000     11.96000  0.2257000     -0.3945000     0.2986000 
1 1 1 12 8  9  o 5.369000  0.3049000     5.260000  0.2460000     5.479000  0.5579000     -0.2186000     0.6097000 
1 1 1 12 8  10 o 6.950000  0.1991000     6.781000  0.2870000     7.119000  0.2760000     -0.3379000     0.3982000 
1 1 1 12 8  11 o 3.608000  0.3736000     3.004000  0.6013000     4.211000  0.4434000     -1.206000      0.7471000 
1 1 1 12 8  12 o 2.482000  0.4463000     1.652000  0.6772000     3.313000  0.5816000     -1.661000      0.8926000 
1 1 1 12 8  13 o 5.803000  0.2708000     5.616000  0.3894000     5.989000  0.3766000     -0.3726000     0.5417000 
1 1 1 12 8  14 o 2.423000  0.5384000     1.943000  0.7682000     2.902000  0.7546000     -0.9585000     1.077000  
1 1 1 12 8  15 o 2.077000  0.5719000     1.995000  0.7955000     2.158000  0.8220000     -0.1634000     1.144000  
1 1 1 12 8  16 o 1.810000  0.5728000     1.618000  0.7569000     2.001000  0.8600000     -0.3826000     1.146000  
1 1 1 12 8  17 o 5.318000  0.4187000     5.445000  0.5815000     5.191000  0.6024000     0.2543000      0.8373000 
1 1 1 12 8  18 o 5.169000  0.4749000     4.724000  0.7245000     5.615000  0.6143000     -0.8909000     0.9498000 
1 1 1 12 8  19 o 2.555000  0.6635000     2.641000  0.9340000     2.468000  0.9426000     0.1731000      1.327000  
1 1 1 12 8  20 o 2.317000  0.6434000     2.187000  0.8928000     2.447000  0.9266000     -0.2602000     1.287000  
1 1 1 12 8  21 o 1.611000  0.5384000     1.532000  0.7290000     1.690000  0.7924000     -0.1586000     1.077000  
1 1 1 12 8  22 o 1.983000  0.5151000     1.371000  0.6445000     2.595000  0.8037000     -1.224000      1.030000  
1 1 1 12 8  23 o 1.775000  0.5201000     1.962000  0.7722000     1.587000  0.6970000     0.3747000      1.040000  
1 1 1 12 8  24 o 1.478000  0.4830000     1.547000  0.7064000     1.408000  0.6591000     0.1389000      0.9661000 
1 1 1 12 8  25 o 1.286000  0.4284000     1.477000  0.6672000     1.095000  0.5376000     0.3821000      0.8569000 
1 1 1 12 8  26 o 1.537000  0.4704000     1.934000  0.7585000     1.141000  0.5564000     0.7922000      0.9407000 
1 1 1 12 9  0  o 7.256000  0.1223000     7.256000  0.1223000     7.256000  0.1223000     -0.000000      0.000000  
1 1 1 12 9  1  o 28.18000  0.2220000     28.25000  0.3145000     28.10000  0.3133000     0.1504000      0.4439000 
1 1 1 12 9  2  o 25.86000  0.2056000     25.87000  0.2909000     25.85000  0.2907000     0.1934000E-01  0.4113000 
1 1 1 12 9  3  o 33.76000  0.3750000     33.71000  0.5304000     33.80000  0.5303000     -0.9400000E-01 0.7500000 
1 1 1 12 9  4  o 17.23000  0.1834000     17.26000  0.2100000     17.21000  0.3008000     0.4800000E-01  0.3668000 
1 1 1 12 9  5  o 2.718000  0.1580000     2.875000  0.2111000     2.562000  0.2352000     0.3137000      0.3160000 
1 1 1 12 9  6  o 18.24000  0.1638000     18.40000  0.2328000     18.09000  0.2304000     0.3069000      0.3276000 
1 1 1 12 9  7  o 9.336000  0.1365000     9.442000  0.1812000     9.230000  0.2041000     0.2116000      0.2730000 
1 1 1 12 9  8  o 6.803000  0.1502000     6.657000  0.1969000     6.950000  0.2269000     -0.2932000     0.3004000 
1 1 1 12 9  9  o 5.787000  0.2908000     5.264000  0.2596000     6.310000  0.5206000     -1.046000      0.5817000 
1 1 1 12 9  10 o 8.747000  0.2944000     8.707000  0.1994000     8.787000  0.5540000     -0.8024000E-01 0.5888000 
1 1 1 12 9  11 o 7.155000  0.2130000     7.345000  0.2984000     6.964000  0.3040000     0.3808000      0.4260000 
1 1 1 12 9  12 o 15.71000  0.1891000     15.48000  0.2667000     15.95000  0.2681000     -0.4757000     0.3781000 
1 1 1 12 9  13 o 14.45000  0.1934000     14.34000  0.2738000     14.57000  0.2734000     -0.2233000     0.3869000 
1 1 1 12 9  14 o 4.248000  0.4059000     4.102000  0.5899000     4.394000  0.5576000     -0.2920000     0.8117000 
1 1 1 12 9  15 o 2.853000  0.5565000     2.302000  0.8223000     3.403000  0.7502000     -1.101000      1.113000  
1 1 1 12 9  16 o 1.986000  0.6077000     2.025000  0.8649000     1.947000  0.8540000     0.7762000E-01  1.215000  
1 1 1 12 9  17 o 3.962000  0.5515000     3.543000  0.8394000     4.380000  0.7157000     -0.8371000     1.103000  
1 1 1 12 9  18 o 2.240000  0.6258000     1.797000  0.8122000     2.683000  0.9523000     -0.8854000     1.252000  
1 1 1 12 9  19 o 4.647000  0.5371000     4.282000  0.8096000     5.013000  0.7061000     -0.7317000     1.074000  
1 1 1 12 9  20 o 2.277000  0.6207000     1.772000  0.8061000     2.783000  0.9440000     -1.010000      1.241000  
1 1 1 12 9  21 o 3.160000  0.6609000     2.707000  0.9253000     3.613000  0.9438000     -0.9053000     1.322000  
1 1 1 12 9  22 o 2.337000  0.5698000     2.126000  0.8102000     2.547000  0.8013000     -0.4209000     1.140000  
1 1 1 12 9  23 o 2.087000  0.5319000     1.652000  0.7195000     2.522000  0.7836000     -0.8703000     1.064000  
1 1 1 12 9  24 o 2.032000  0.5512000     1.626000  0.7291000     2.438000  0.8269000     -0.8121000     1.102000  
1 1 1 12 9  25 o 1.457000  0.4560000     1.870000  0.7497000     1.045000  0.5194000     0.8253000      0.9121000 
1 1 1 12 9  26 o 1.309000  0.4357000     1.497000  0.6775000     1.121000  0.5481000     0.3764000      0.8714000 
1 1 1 12 10 0  o 8.438000  0.1312000     8.438000  0.1312000     8.438000  0.1312000     -0.000000      0.000000  
1 1 1 12 10 1  o 4.033000  0.1013000     3.894000  0.1440000     4.172000  0.1425000     -0.2775000     0.2026000 
1 1 1 12 10 2  o 22.83000  0.1995000     22.85000  0.3021000     22.81000  0.2606000     0.3431000E-01  0.3990000 
1 1 1 12 10 3  o 9.820000  0.1311000     9.977000  0.1689000     9.663000  0.2006000     0.3136000      0.2622000 
1 1 1 12 10 4  o 15.75000  0.1824000     16.03000  0.2843000     15.47000  0.2286000     0.5586000      0.3649000 
1 1 1 12 10 5  o 16.66000  0.1477000     16.63000  0.2088000     16.69000  0.2091000     -0.5338000E-01 0.2955000 
1 1 1 12 10 6  o 16.86000  0.1589000     16.85000  0.2520000     16.87000  0.1938000     -0.2613000E-01 0.3179000 
1 1 1 12 10 7  o 13.01000  0.1418000     12.99000  0.1964000     13.03000  0.2047000     -0.4265000E-01 0.2836000 
1 1 1 12 10 8  o 8.418000  0.1482000     8.265000  0.1972000     8.570000  0.2213000     -0.3048000     0.2964000 
1 1 1 12 10 9  o 7.813000  0.2626000     7.710000  0.2287000     7.916000  0.4728000     -0.2058000     0.5252000 
1 1 1 12 10 10 o 15.37000  0.2249000     15.32000  0.3112000     15.41000  0.3247000     -0.8804000E-01 0.4498000 
1 1 1 12 10 11 o 12.85000  0.1842000     13.16000  0.2121000     12.54000  0.3013000     0.6212000      0.3685000 
1 1 1 12 10 12 o 9.756000  0.1982000     9.786000  0.2789000     9.727000  0.2817000     0.5932000E-01  0.3964000 
1 1 1 12 10 13 o 6.570000  0.2551000     6.947000  0.3429000     6.194000  0.3777000     0.7530000      0.5101000 
1 1 1 12 10 14 o 16.83000  0.2400000     16.97000  0.3421000     16.68000  0.3366000     0.2885000      0.4799000 
1 1 1 12 10 15 o 9.972000  0.2389000     9.836000  0.3413000     10.11000  0.3344000     -0.2714000     0.4778000 
1 1 1 12 10 16 o 5.874000  0.3884000     5.506000  0.5413000     6.242000  0.5572000     -0.7358000     0.7768000 
1 1 1 12 10 17 o 2.770000  0.6338000     3.142000  0.8963000     2.398000  0.8963000     0.7442000      1.268000  
1 1 1 12 10 18 o 4.500000  0.5356000     4.389000  0.7820000     4.611000  0.7321000     -0.2220000     1.071000  
1 1 1 12 10 19 o 3.019000  0.6829000     2.598000  0.9660000     3.440000  0.9655000     -0.8422000     1.366000  
1 1 1 12 10 20 o 4.936000  0.4852000     4.739000  0.7301000     5.134000  0.6394000     -0.3942000     0.9705000 
1 1 1 12 10 21 o 2.212000  0.6259000     2.184000  0.8479000     2.241000  0.9209000     -0.5670000E-01 1.252000  
1 1 1 12 10 22 o 2.240000  0.5565000     2.490000  0.7993000     1.989000  0.7746000     0.5009000      1.113000  
1 1 1 12 10 23 o 2.222000  0.5527000     1.990000  0.7778000     2.454000  0.7854000     -0.4638000     1.105000  
1 1 1 12 10 24 o 1.229000  0.4229000     1.339000  0.6380000     1.119000  0.5551000     0.2195000      0.8457000 
1 1 1 12 10 25 o 1.414000  0.4583000     1.259000  0.5989000     1.570000  0.6939000     -0.3107000     0.9166000 
1 1 1 12 10 26 o 1.652000  0.4980000     1.437000  0.6526000     1.868000  0.7525000     -0.4315000     0.9961000 
1 1 1 12 11 0  o 8.360000  0.1347000     8.360000  0.1347000     8.360000  0.1347000     -0.000000      0.000000  
1 1 1 12 11 1  f 16.21000  0.1500000     16.25000  0.2272000     16.17000  0.1960000     0.7638000E-01  0.3001000 
1 1 1 12 11 2  o 11.22000  0.1532000     11.20000  0.2190000     11.23000  0.2143000     -0.2173000E-01 0.3064000 
1 1 1 12 11 3  o 8.409000  0.1327000     8.706000  0.1636000     8.112000  0.2091000     0.5936000      0.2655000 
1 1 1 12 11 4  o 16.37000  0.1575000     16.42000  0.2397000     16.32000  0.2044000     0.9895000E-01  0.3150000 
1 1 1 12 11 5  o 15.79000  0.1434000     16.00000  0.2041000     15.59000  0.2016000     0.4052000      0.2868000 
1 1 1 12 11 6  o 5.151000  0.1263000     5.068000  0.1805000     5.235000  0.1767000     -0.1677000     0.2525000 
1 1 1 12 11 7  f 1.699000  0.3157000     1.758000  0.4750000     1.640000  0.4159000     0.1181000      0.6313000 
1 1 1 12 11 8  o 7.281000  0.1557000     7.386000  0.2020000     7.176000  0.2371000     0.2102000      0.3115000 
1 1 1 12 11 9  o 10.74000  0.1966000     10.78000  0.2082000     10.69000  0.3336000     0.9901000E-01  0.3932000 
1 1 1 12 11 10 o 2.712000  0.5590000     3.571000  0.9278000     1.853000  0.6237000     1.718000       1.118000  
1 1 1 12 11 11 o 2.034000  0.4121000     2.255000  0.5455000     1.812000  0.6178000     0.4429000      0.8242000 
1 1 1 12 11 12 o 7.222000  0.2240000     7.124000  0.2389000     7.319000  0.3791000     -0.1946000     0.4481000 
1 1 1 12 11 13 o 10.61000  0.2045000     10.58000  0.2307000     10.63000  0.3378000     -0.4524000E-01 0.4090000 
1 1 1 12 11 14 o 8.518000  0.2747000     8.763000  0.3899000     8.272000  0.3871000     0.4912000      0.5494000 
1 1 1 12 11 15 o 8.226000  0.2657000     8.324000  0.3732000     8.128000  0.3783000     0.1960000      0.5314000 
1 1 1 12 11 16 o 3.024000  0.5863000     3.727000  0.7819000     2.321000  0.8739000     1.406000       1.173000  
1 1 1 12 11 17 o 4.365000  0.5070000     4.291000  0.7365000     4.438000  0.6969000     -0.1470000     1.014000  
1 1 1 12 11 18 o 3.363000  0.6670000     3.137000  0.9724000     3.589000  0.9132000     -0.4511000     1.334000  
1 1 1 12 11 19 o 2.631000  0.6798000     3.324000  1.036000      1.939000  0.8802000     1.385000       1.360000  
1 1 1 12 11 20 o 2.738000  0.6393000     2.326000  0.9084000     3.151000  0.8998000     -0.8249000     1.279000  
1 1 1 12 11 21 o 2.932000  0.5922000     3.228000  0.7847000     2.636000  0.8873000     0.5924000      1.184000  
1 1 1 12 11 22 o 1.369000  0.4514000     1.320000  0.6223000     1.418000  0.6540000     -0.9767000E-01 0.9028000 
1 1 1 12 11 23 o 2.490000  0.5442000     2.902000  0.7690000     2.079000  0.7701000     0.8238000      1.088000  
1 1 1 12 11 24 o 2.121000  0.5765000     2.023000  0.8026000     2.219000  0.8277000     -0.1956000     1.153000  
1 1 1 12 11 25 o 2.160000  0.5448000     1.697000  0.7285000     2.624000  0.8103000     -0.9268000     1.090000  
1 1 1 12 11 26 o 1.549000  0.4764000     1.269000  0.6051000     1.829000  0.7360000     -0.5605000     0.9529000 
1 1 1 12 12 0  o 22.36000  0.3646000     22.36000  0.3646000     22.36000  0.3646000     -0.000000      0.000000  
1 1 1 12 12 1  o 9.962000  0.2086000     9.962000  0.2086000     ?         ?             ?              ?         
1 1 1 12 12 2  o 10.67000  0.1758000     10.73000  0.1763000     10.61000  0.3043000     0.1202000      0.3517000 
1 1 1 12 12 3  f 23.33000  0.2339000     23.32000  0.3820000     23.34000  0.2699000     -0.1106000E-01 0.4677000 
1 1 1 12 12 4  o 7.289000  0.1056000     7.392000  0.1496000     7.186000  0.1492000     0.2062000      0.2112000 
1 1 1 12 12 5  o 7.607000  0.1118000     7.524000  0.1584000     7.690000  0.1579000     -0.1662000     0.2237000 
1 1 1 12 12 6  o 1.866000  0.2761000     1.946000  0.3749000     1.786000  0.4054000     0.1596000      0.5522000 
1 1 1 12 12 7  o 7.890000  0.1323000     7.937000  0.2094000     7.844000  0.1619000     0.9222000E-01  0.2647000 
1 1 1 12 12 8  o 7.593000  0.1573000     8.027000  0.2014000     7.160000  0.2418000     0.8666000      0.3147000 
1 1 1 12 12 9  o 6.244000  0.1770000     6.103000  0.2325000     6.385000  0.2670000     -0.2820000     0.3540000 
1 1 1 12 12 10 o 8.814000  0.2923000     9.068000  0.5247000     8.561000  0.2580000     0.5063000      0.5847000 
1 1 1 12 12 11 o 3.671000  0.2719000     3.910000  0.3495000     3.431000  0.4166000     0.4792000      0.5438000 
1 1 1 12 12 12 f 16.46000  0.1841000     16.28000  0.2590000     16.64000  0.2616000     -0.3569000     0.3681000 
1 1 1 12 12 13 o 7.568000  0.1883000     7.450000  0.2561000     7.685000  0.2760000     -0.2351000     0.3765000 
1 1 1 12 12 14 o 10.30000  0.3335000     10.35000  0.2934000     10.24000  0.5990000     0.1087000      0.6670000 
1 1 1 12 12 15 o 10.32000  0.2579000     10.51000  0.3285000     10.14000  0.3975000     0.3692000      0.5157000 
1 1 1 12 12 16 o 2.436000  0.5920000     1.872000  0.8124000     3.000000  0.8613000     -1.128000      1.184000  
1 1 1 12 12 17 o 9.006000  0.2844000     8.686000  0.4153000     9.326000  0.3885000     -0.6393000     0.5687000 
1 1 1 12 12 18 o 4.848000  0.5169000     5.262000  0.6519000     4.435000  0.8023000     0.8273000      1.034000  
1 1 1 12 12 19 o 4.170000  0.6690000     3.615000  1.038000      4.725000  0.8449000     -1.110000      1.338000  
1 1 1 12 12 20 o 2.055000  0.5754000     1.498000  0.7138000     2.611000  0.9027000     -1.113000      1.151000  
1 1 1 12 12 21 o 2.241000  0.5973000     1.948000  0.8136000     2.535000  0.8746000     -0.5868000     1.195000  
1 1 1 12 12 22 o 2.810000  0.5321000     3.316000  0.7077000     2.304000  0.7949000     1.012000       1.064000  
1 1 1 12 12 23 o 1.293000  0.4340000     1.212000  0.5870000     1.374000  0.6395000     -0.1613000     0.8680000 
1 1 1 12 12 24 f 1.761000  0.5559000     1.976000  0.8459000     1.547000  0.7216000     0.4285000      1.112000  
1 1 1 12 12 25 o 1.171000  0.4066000     1.138000  0.5629000     1.204000  0.5869000     -0.6535000E-01 0.8132000 
1 1 1 12 12 26 o 1.477000  0.4722000     1.509000  0.6748000     1.444000  0.6607000     0.6453000E-01  0.9444000 
1 1 1 12 13 0  o 1.997000  0.4357000     1.997000  0.4357000     1.997000  0.4357000     -0.000000      0.000000  
1 1 1 12 13 1  o 23.05000  0.2655000     22.79000  0.3716000     23.31000  0.3792000     -0.5172000     0.5309000 
1 1 1 12 13 2  o 13.87000  0.1383000     13.92000  0.2101000     13.81000  0.1800000     0.1128000      0.2767000 
1 1 1 12 13 3  o 4.324000  0.1191000     4.346000  0.1696000     4.302000  0.1672000     0.4449000E-01  0.2382000 
1 1 1 12 13 4  o 2.479000  0.1845000     2.453000  0.2598000     2.504000  0.2620000     -0.5130000E-01 0.3690000 
1 1 1 12 13 5  o 3.524000  0.1544000     3.550000  0.2178000     3.498000  0.2190000     0.5200000E-01  0.3089000 
1 1 1 12 13 6  o 12.86000  0.1347000     13.03000  0.1922000     12.70000  0.1886000     0.3308000      0.2693000 
1 1 1 12 13 7  o 3.201000  0.2126000     3.082000  0.3362000     3.321000  0.2603000     -0.2392000     0.4252000 
1 1 1 12 13 8  o 5.905000  0.1780000     5.558000  0.2884000     6.251000  0.2085000     -0.6930000     0.3559000 
1 1 1 12 13 9  o 6.356000  0.1785000     6.342000  0.2347000     6.370000  0.2689000     -0.2822000E-01 0.3569000 
1 1 1 12 13 10 o 3.323000  0.3921000     3.078000  0.6551000     3.569000  0.4311000     -0.4914000     0.7842000 
1 1 1 12 13 11 o 6.881000  0.1861000     7.187000  0.2509000     6.574000  0.2749000     0.6135000      0.3722000 
1 1 1 12 13 12 o 8.907000  0.1784000     8.986000  0.2439000     8.829000  0.2604000     0.1572000      0.3568000 
1 1 1 12 13 13 o 11.67000  0.1807000     11.78000  0.2490000     11.56000  0.2620000     0.2179000      0.3614000 
1 1 1 12 13 14 o 5.497000  0.3934000     5.351000  0.3826000     5.642000  0.6876000     -0.2909000     0.7869000 
1 1 1 12 13 15 o 6.939000  0.3278000     6.089000  0.3554000     7.788000  0.5510000     -1.699000      0.6557000 
1 1 1 12 13 16 o 2.559000  0.5871000     2.702000  0.7041000     2.415000  0.9397000     0.2873000      1.174000  
1 1 1 12 13 17 o 3.007000  0.6548000     2.771000  0.9371000     3.243000  0.9150000     -0.4716000     1.310000  
1 1 1 12 13 18 o 9.373000  0.2988000     9.465000  0.4229000     9.281000  0.4223000     0.1844000      0.5976000 
1 1 1 12 13 19 o 2.416000  0.6654000     3.120000  1.056000      1.713000  0.8100000     1.407000       1.331000  
1 1 1 12 13 20 o 1.848000  0.5855000     1.659000  0.7661000     2.037000  0.8856000     -0.3783000     1.171000  
1 1 1 12 13 21 o 3.747000  0.5499000     3.759000  0.7736000     3.735000  0.7817000     0.2484000E-01  1.100000  
1 1 1 12 13 22 o 1.792000  0.5209000     1.610000  0.7085000     1.974000  0.7637000     -0.3637000     1.042000  
1 1 1 12 13 23 o 1.801000  0.4971000     1.302000  0.6143000     2.301000  0.7817000     -0.9992000     0.9941000 
1 1 1 12 13 24 o 1.582000  0.5050000     1.354000  0.6509000     1.810000  0.7723000     -0.4556000     1.010000  
1 1 1 12 13 25 o 1.618000  0.4985000     1.367000  0.6479000     1.868000  0.7578000     -0.5007000     0.9970000 
1 1 1 12 13 26 o 1.465000  0.4675000     1.297000  0.6156000     1.633000  0.7038000     -0.3354000     0.9350000 
1 1 1 12 14 0  o 7.043000  0.1432000     7.043000  0.1432000     7.043000  0.1432000     -0.000000      0.000000  
1 1 1 12 14 1  o 11.74000  0.1164000     11.69000  0.1644000     11.80000  0.1649000     -0.1065000     0.2328000 
1 1 1 12 14 2  o 13.01000  0.1244000     13.09000  0.1764000     12.92000  0.1754000     0.1709000      0.2488000 
1 1 1 12 14 3  o 3.614000  0.1393000     3.494000  0.2029000     3.734000  0.1910000     -0.2405000     0.2786000 
1 1 1 12 14 4  o 6.212000  0.1143000     6.186000  0.1621000     6.239000  0.1611000     -0.5249000E-01 0.2285000 
1 1 1 12 14 5  o 11.35000  0.1238000     11.34000  0.1749000     11.35000  0.1754000     -0.6897000E-02 0.2477000 
1 1 1 12 14 6  o 11.04000  0.1276000     11.14000  0.1831000     10.95000  0.1778000     0.1854000      0.2552000 
1 1 1 12 14 7  o 8.274000  0.1391000     8.566000  0.2128000     7.983000  0.1792000     0.5833000      0.2781000 
1 1 1 12 14 8  o 1.193000  0.3595000     0.9295000 0.4454000     1.456000  0.5646000     -0.5266000     0.7191000 
1 1 1 12 14 9  o 9.634000  0.1900000     9.480000  0.2390000     9.789000  0.2955000     -0.3087000     0.3801000 
1 1 1 12 14 10 o 9.439000  0.1710000     9.454000  0.2249000     9.425000  0.2575000     0.2872000E-01  0.3419000 
1 1 1 12 14 11 o 1.966000  0.4251000     2.286000  0.5716000     1.647000  0.6294000     0.6392000      0.8502000 
1 1 1 12 14 12 f 9.236000  0.2178000     9.271000  0.2556000     9.200000  0.3528000     0.7065000E-01  0.4356000 
1 1 1 12 14 13 f 13.54000  0.1838000     13.35000  0.2591000     13.74000  0.2608000     -0.3887000     0.3677000 
1 1 1 12 14 14 o 13.03000  0.2509000     12.95000  0.2643000     13.11000  0.4265000     -0.1620000     0.5018000 
1 1 1 12 14 15 o 3.014000  0.6045000     2.301000  1.031000      3.728000  0.6320000     -1.427000      1.209000  
1 1 1 12 14 16 o 3.293000  0.4525000     3.417000  0.5819000     3.168000  0.6932000     0.2495000      0.9050000 
1 1 1 12 14 17 o 2.309000  0.5901000     2.497000  0.7635000     2.122000  0.9000000     0.3749000      1.180000  
1 1 1 12 14 18 o 2.306000  0.6220000     1.834000  0.7204000     2.777000  1.014000      -0.9438000     1.244000  
1 1 1 12 14 19 o 2.093000  0.6978000     2.767000  1.201000      1.420000  0.7116000     1.347000       1.396000  
1 1 1 12 14 20 o 3.108000  0.6712000     3.566000  0.9276000     2.649000  0.9703000     0.9172000      1.342000  
1 1 1 12 14 21 o 3.148000  0.5729000     2.486000  0.8758000     3.811000  0.7389000     -1.325000      1.146000  
1 1 1 12 14 22 o 1.640000  0.4938000     1.993000  0.7776000     1.286000  0.6089000     0.7069000      0.9876000 
1 1 1 12 14 23 o 2.729000  0.5305000     2.663000  0.7635000     2.795000  0.7368000     -0.1321000     1.061000  
1 1 1 12 14 24 o 1.506000  0.4906000     1.665000  0.7434000     1.346000  0.6404000     0.3187000      0.9812000 
1 1 1 12 14 25 o 1.452000  0.4857000     1.486000  0.7098000     1.419000  0.6631000     0.6783000E-01  0.9714000 
1 1 1 12 14 26 o 1.620000  0.4925000     1.435000  0.6558000     1.805000  0.7348000     -0.3692000     0.9849000 
1 1 1 12 15 0  o 2.456000  0.2540000     2.456000  0.2540000     2.456000  0.2540000     0.000000       0.000000  
1 1 1 12 15 1  f 4.454000  0.1192000     4.406000  0.1681000     4.502000  0.1690000     -0.9555000E-01 0.2383000 
1 1 1 12 15 2  o 14.13000  0.1322000     14.07000  0.1861000     14.19000  0.1879000     -0.1171000     0.2644000 
1 1 1 12 15 3  o 8.903000  0.1118000     9.154000  0.1582000     8.652000  0.1580000     0.5027000      0.2236000 
1 1 1 12 15 4  o 7.153000  0.1134000     7.112000  0.1611000     7.195000  0.1595000     -0.8216000E-01 0.2267000 
1 1 1 12 15 5  o 13.03000  0.1323000     13.06000  0.1871000     12.99000  0.1871000     0.7202000E-01  0.2646000 
1 1 1 12 15 6  o 7.161000  0.1252000     7.069000  0.1803000     7.253000  0.1736000     -0.1843000     0.2503000 
1 1 1 12 15 7  o 4.117000  0.1869000     4.144000  0.2848000     4.091000  0.2420000     0.5226000E-01  0.3737000 
1 1 1 12 15 8  o 1.953000  0.3915000     1.522000  0.5592000     2.383000  0.5482000     -0.8619000     0.7831000 
1 1 1 12 15 9  o 8.084000  0.2912000     8.460000  0.5019000     7.708000  0.2955000     0.7525000      0.5824000 
1 1 1 12 15 10 o 8.083000  0.1765000     8.003000  0.2330000     8.162000  0.2653000     -0.1590000     0.3531000 
1 1 1 12 15 11 o 11.61000  0.1699000     11.75000  0.2368000     11.48000  0.2437000     0.2683000      0.3398000 
1 1 1 12 15 12 o 14.66000  0.1795000     14.58000  0.2516000     14.75000  0.2562000     -0.1696000     0.3591000 
1 1 1 12 15 13 o 5.379000  0.2543000     5.729000  0.3400000     5.029000  0.3781000     0.7000000      0.5085000 
1 1 1 12 15 14 o 8.739000  0.2059000     8.785000  0.2903000     8.693000  0.2920000     0.9163000E-01  0.4118000 
1 1 1 12 15 15 o 5.718000  0.5987000     4.794000  1.142000      6.642000  0.3604000     -1.848000      1.197000  
1 1 1 12 15 16 o 6.177000  0.2761000     6.274000  0.3814000     6.080000  0.3993000     0.1942000      0.5522000 
1 1 1 12 15 17 o 8.837000  0.2423000     8.889000  0.3349000     8.786000  0.3502000     0.1030000      0.4845000 
1 1 1 12 15 18 o 2.842000  0.5634000     2.768000  0.7647000     2.915000  0.8276000     -0.1471000     1.127000  
1 1 1 12 15 19 o 2.353000  0.6672000     2.183000  0.8014000     2.524000  1.067000      -0.3409000     1.334000  
1 1 1 12 15 20 o 2.055000  0.5742000     2.456000  0.8154000     1.655000  0.8087000     0.8014000      1.148000  
1 1 1 12 15 21 o 2.386000  0.5669000     2.938000  0.8218000     1.834000  0.7810000     1.104000       1.134000  
1 1 1 12 15 22 o 1.819000  0.5261000     1.863000  0.7590000     1.775000  0.7288000     0.8816000E-01  1.052000  
1 1 1 12 15 23 o 1.743000  0.5071000     1.516000  0.6767000     1.970000  0.7553000     -0.4532000     1.014000  
1 1 1 12 15 24 o 1.447000  0.4780000     1.402000  0.6674000     1.492000  0.6845000     -0.8967000E-01 0.9561000 
1 1 1 12 15 25 o 1.409000  0.4782000     1.396000  0.6746000     1.423000  0.6778000     -0.2661000E-01 0.9563000 
1 1 1 12 15 26 o 1.294000  0.4392000     1.184000  0.5811000     1.404000  0.6586000     -0.2200000     0.8783000 
1 1 1 12 16 0  o 8.177000  0.1531000     8.177000  0.1531000     8.177000  0.1531000     -0.000000      0.000000  
1 1 1 12 16 1  o 5.787000  0.1213000     5.883000  0.1807000     5.690000  0.1619000     0.1930000      0.2426000 
1 1 1 12 16 2  o 11.55000  0.1206000     11.57000  0.1699000     11.52000  0.1713000     0.4750000E-01  0.2412000 
1 1 1 12 16 3  o 10.13000  0.1165000     9.981000  0.1644000     10.28000  0.1653000     -0.3033000     0.2331000 
1 1 1 12 16 4  o 2.385000  0.2236000     1.954000  0.3620000     2.817000  0.2625000     -0.8623000     0.4472000 
1 1 1 12 16 5  o 9.136000  0.1206000     9.182000  0.1710000     9.090000  0.1700000     0.9280000E-01  0.2411000 
1 1 1 12 16 6  o 5.340000  0.1412000     5.536000  0.1985000     5.143000  0.2008000     0.3927000      0.2823000 
1 1 1 12 16 7  o 16.66000  0.1947000     16.74000  0.3185000     16.58000  0.2239000     0.1530000      0.3893000 
1 1 1 12 16 8  o 12.65000  0.1648000     12.74000  0.2424000     12.56000  0.2232000     0.1861000      0.3296000 
1 1 1 12 16 9  o 10.33000  0.1870000     10.45000  0.3022000     10.20000  0.2203000     0.2498000      0.3740000 
1 1 1 12 16 10 o 4.127000  0.2393000     3.892000  0.3842000     4.362000  0.2854000     -0.4697000     0.4786000 
1 1 1 12 16 11 o 12.23000  0.1808000     12.65000  0.2381000     11.81000  0.2722000     0.8340000      0.3616000 
1 1 1 12 16 12 o 12.52000  0.1784000     12.57000  0.2508000     12.47000  0.2538000     0.9771000E-01  0.3568000 
1 1 1 12 16 13 o 8.063000  0.2199000     7.944000  0.3067000     8.181000  0.3153000     -0.2361000     0.4398000 
1 1 1 12 16 14 o 1.963000  0.5027000     2.148000  0.7095000     1.777000  0.7123000     0.3709000      1.005000  
1 1 1 12 16 15 o 6.452000  0.3964000     6.025000  0.7152000     6.880000  0.3423000     -0.8558000     0.7929000 
1 1 1 12 16 16 o 3.304000  0.4879000     3.397000  0.6581000     3.212000  0.7206000     0.1853000      0.9759000 
1 1 1 12 16 17 o 6.071000  0.3028000     5.788000  0.4423000     6.354000  0.4136000     -0.5659000     0.6056000 
1 1 1 12 16 18 o 1.798000  0.5345000     1.976000  0.7849000     1.620000  0.7258000     0.3560000      1.069000  
1 1 1 12 16 19 f 2.667000  0.5789000     2.136000  0.7895000     3.197000  0.8468000     -1.061000      1.158000  
1 1 1 12 16 20 o 1.857000  0.5807000     1.966000  0.8907000     1.748000  0.7452000     0.2177000      1.161000  
1 1 1 12 16 21 o 2.598000  0.5857000     2.599000  0.7193000     2.598000  0.9245000     0.1433000E-02  1.171000  
1 1 1 12 16 22 o 1.386000  0.4609000     1.134000  0.5402000     1.638000  0.7470000     -0.5032000     0.9219000 
1 1 1 12 16 23 o 1.357000  0.4421000     1.606000  0.6981000     1.109000  0.5425000     0.4966000      0.8841000 
1 1 1 12 16 24 o 1.300000  0.4348000     1.294000  0.6141000     1.305000  0.6157000     -0.1153000E-01 0.8696000 
1 1 1 12 16 25 o 1.720000  0.5155000     2.233000  0.8396000     1.207000  0.5983000     1.026000       1.031000  
1 1 1 12 17 0  o 3.004000  0.2348000     3.004000  0.2348000     3.004000  0.2348000     0.000000       0.000000  
1 1 1 12 17 1  o 18.95000  0.1635000     18.97000  0.2314000     18.92000  0.2310000     0.4818000E-01  0.3270000 
1 1 1 12 17 2  o 7.657000  0.1124000     7.787000  0.1583000     7.528000  0.1597000     0.2598000      0.2249000 
1 1 1 12 17 3  f 4.509000  0.1334000     4.618000  0.1879000     4.400000  0.1895000     0.2180000      0.2669000 
1 1 1 12 17 4  o 1.261000  0.2908000     1.626000  0.4282000     0.8958000 0.3935000     0.7300000      0.5816000 
1 1 1 12 17 5  o 8.930000  0.1219000     8.880000  0.1733000     8.980000  0.1716000     -0.1006000     0.2439000 
1 1 1 12 17 6  o 12.62000  0.1384000     12.45000  0.1970000     12.79000  0.1945000     -0.3394000     0.2768000 
1 1 1 12 17 7  o 7.310000  0.1841000     7.356000  0.2601000     7.265000  0.2605000     0.9095000E-01  0.3681000 
1 1 1 12 17 8  o 8.729000  0.2107000     8.983000  0.2331000     8.475000  0.3510000     0.5080000      0.4213000 
1 1 1 12 17 9  o 4.954000  0.1854000     4.926000  0.2515000     4.981000  0.2725000     -0.5531000E-01 0.3708000 
1 1 1 12 17 10 o 9.590000  0.1664000     9.333000  0.2554000     9.848000  0.2134000     -0.5156000     0.3328000 
1 1 1 12 17 11 o 7.493000  0.2210000     7.897000  0.3418000     7.089000  0.2803000     0.8073000      0.4420000 
1 1 1 12 17 12 o 7.720000  0.1979000     7.458000  0.2813000     7.982000  0.2786000     -0.5236000     0.3959000 
1 1 1 12 17 13 o 8.401000  0.2224000     8.542000  0.3059000     8.260000  0.3229000     0.2821000      0.4448000 
1 1 1 12 17 14 o 2.827000  0.4737000     2.539000  0.6917000     3.115000  0.6475000     -0.5760000     0.9475000 
1 1 1 12 17 15 o 10.37000  0.2085000     10.24000  0.2919000     10.50000  0.2978000     -0.2657000     0.4170000 
1 1 1 12 17 16 o 2.743000  0.5346000     2.375000  0.7766000     3.111000  0.7351000     -0.7365000     1.069000  
1 1 1 12 17 17 o 2.344000  0.5057000     1.579000  0.7011000     3.110000  0.7290000     -1.531000      1.011000  
1 1 1 12 17 18 o 5.811000  0.3303000     6.187000  0.4387000     5.435000  0.4939000     0.7521000      0.6606000 
1 1 1 12 17 19 o 2.279000  0.5442000     2.827000  0.7950000     1.732000  0.7434000     1.095000       1.088000  
1 1 1 12 17 20 o 2.239000  0.5723000     1.720000  0.8219000     2.758000  0.7965000     -1.038000      1.145000  
1 1 1 12 17 21 o 1.614000  0.4827000     1.929000  0.7449000     1.298000  0.6143000     0.6318000      0.9655000 
1 1 1 12 17 22 o 3.713000  0.3994000     3.962000  0.4710000     3.463000  0.6452000     0.4989000      0.7988000 
1 1 1 12 17 23 o 1.294000  0.4191000     1.509000  0.6395000     1.079000  0.5417000     0.4292000      0.8382000 
1 1 1 12 17 24 o 1.623000  0.5001000     1.463000  0.6260000     1.782000  0.7800000     -0.3191000     1.000000  
1 1 1 12 17 25 o 1.722000  0.5312000     1.412000  0.6610000     2.032000  0.8318000     -0.6203000     1.062000  
1 1 1 12 18 0  o 7.915000  0.1593000     7.915000  0.1593000     7.915000  0.1593000     0.000000       0.000000  
1 1 1 12 18 1  o 8.680000  0.1138000     8.664000  0.1604000     8.695000  0.1616000     -0.3114000E-01 0.2277000 
1 1 1 12 18 2  o 14.84000  0.1397000     14.97000  0.1981000     14.71000  0.1971000     0.2642000      0.2794000 
1 1 1 12 18 3  o 9.717000  0.1188000     9.729000  0.1675000     9.705000  0.1685000     0.2424000E-01  0.2376000 
1 1 1 12 18 4  o 3.915000  0.1552000     3.867000  0.2236000     3.963000  0.2152000     -0.9595000E-01 0.3103000 
1 1 1 12 18 5  o 12.04000  0.1327000     12.13000  0.1883000     11.96000  0.1871000     0.1694000      0.2654000 
1 1 1 12 18 6  o 3.054000  0.2343000     2.921000  0.3729000     3.187000  0.2839000     -0.2669000     0.4687000 
1 1 1 12 18 7  o 7.791000  0.1740000     7.883000  0.2335000     7.698000  0.2580000     0.1850000      0.3479000 
1 1 1 12 18 8  o 14.27000  0.2849000     14.50000  0.4836000     14.05000  0.3013000     0.4507000      0.5698000 
1 1 1 12 18 9  o 17.50000  0.1821000     17.37000  0.2425000     17.64000  0.2716000     -0.2684000     0.3641000 
1 1 1 12 18 10 o 19.51000  0.2167000     19.92000  0.2651000     19.10000  0.3429000     0.8235000      0.4334000 
1 1 1 12 18 11 o 17.06000  0.1934000     17.00000  0.2955000     17.12000  0.2497000     -0.1111000     0.3869000 
1 1 1 12 18 12 o 6.894000  0.2074000     7.165000  0.2794000     6.624000  0.3066000     0.5412000      0.4148000 
1 1 1 12 18 13 o 5.720000  0.4296000     5.493000  0.3938000     5.946000  0.7636000     -0.4529000     0.8591000 
1 1 1 12 18 14 o 8.596000  0.2313000     8.591000  0.3129000     8.600000  0.3408000     -0.9769000E-02 0.4626000 
1 1 1 12 18 15 o 6.850000  0.2627000     6.384000  0.3756000     7.315000  0.3674000     -0.9311000     0.5254000 
1 1 1 12 18 16 o 2.396000  0.5381000     2.827000  0.7391000     1.965000  0.7821000     0.8610000      1.076000  
1 1 1 12 18 17 o 5.613000  0.3216000     5.577000  0.4644000     5.648000  0.4449000     -0.7145000E-01 0.6431000 
1 1 1 12 18 18 o 2.040000  0.5816000     2.134000  0.8516000     1.945000  0.7923000     0.1885000      1.163000  
1 1 1 12 18 19 o 2.834000  0.5646000     2.399000  0.8213000     3.269000  0.7750000     -0.8698000     1.129000  
1 1 1 12 18 20 o 2.187000  0.5838000     1.870000  0.8332000     2.504000  0.8178000     -0.6334000     1.168000  
1 1 1 12 18 21 o 2.137000  0.5155000     1.578000  0.6873000     2.696000  0.7686000     -1.118000      1.031000  
1 1 1 12 18 22 o 1.348000  0.4363000     1.402000  0.6274000     1.294000  0.6066000     0.1073000      0.8727000 
1 1 1 12 18 23 o 1.916000  0.4991000     2.397000  0.7575000     1.435000  0.6500000     0.9625000      0.9981000 
1 1 1 12 18 24 o 1.873000  0.5093000     1.761000  0.7015000     1.985000  0.7385000     -0.2242000     1.019000  
1 1 1 12 18 25 o 1.935000  0.4864000     2.151000  0.6853000     1.720000  0.6905000     0.4310000      0.9728000 
1 1 1 12 19 0  o 4.865000  0.1829000     4.865000  0.1829000     4.865000  0.1829000     -0.000000      0.000000  
1 1 1 12 19 1  o 15.04000  0.1416000     15.15000  0.2012000     14.94000  0.1994000     0.2153000      0.2833000 
1 1 1 12 19 2  o 9.886000  0.1197000     9.716000  0.1687000     10.06000  0.1698000     -0.3402000     0.2394000 
1 1 1 12 19 3  o 9.175000  0.1198000     9.251000  0.1694000     9.098000  0.1694000     0.1533000      0.2396000 
1 1 1 12 19 4  o 8.186000  0.1231000     8.233000  0.1750000     8.140000  0.1732000     0.9283000E-01  0.2462000 
1 1 1 12 19 5  o 10.13000  0.1281000     10.20000  0.1819000     10.06000  0.1805000     0.1382000      0.2562000 
1 1 1 12 19 6  o 12.90000  0.1826000     12.97000  0.2818000     12.84000  0.2323000     0.1329000      0.3652000 
1 1 1 12 19 7  o 11.78000  0.1645000     11.88000  0.2382000     11.68000  0.2270000     0.1979000      0.3291000 
1 1 1 12 19 8  o 15.48000  0.2069000     15.17000  0.3446000     15.79000  0.2291000     -0.6184000     0.4138000 
1 1 1 12 19 9  o 8.368000  0.1825000     7.930000  0.2586000     8.805000  0.2577000     -0.8751000     0.3651000 
1 1 1 12 19 10 o 19.06000  0.1945000     19.18000  0.2601000     18.94000  0.2892000     0.2339000      0.3890000 
1 1 1 12 19 11 o 5.163000  0.2167000     5.269000  0.3253000     5.058000  0.2863000     0.2104000      0.4334000 
1 1 1 12 19 12 o 15.75000  0.1856000     15.86000  0.2589000     15.64000  0.2658000     0.2235000      0.3711000 
1 1 1 12 19 13 o 10.45000  0.2633000     10.83000  0.2673000     10.06000  0.4538000     0.7776000      0.5267000 
1 1 1 12 19 14 o 8.881000  0.3810000     9.462000  0.6756000     8.300000  0.3525000     1.161000       0.7620000 
1 1 1 12 19 15 o 8.504000  0.2332000     8.235000  0.3331000     8.773000  0.3266000     -0.5380000     0.4665000 
1 1 1 12 19 16 o 6.927000  0.2714000     7.010000  0.3695000     6.844000  0.3977000     0.1663000      0.5428000 
1 1 1 12 19 17 o 4.870000  0.3794000     4.652000  0.5510000     5.087000  0.5218000     -0.4355000     0.7589000 
1 1 1 12 19 18 o 2.291000  0.5701000     1.707000  0.7490000     2.874000  0.8597000     -1.167000      1.140000  
1 1 1 12 19 19 o 1.583000  0.4986000     1.408000  0.6565000     1.758000  0.7507000     -0.3503000     0.9973000 
1 1 1 12 19 20 o 4.250000  0.4102000     4.260000  0.5577000     4.240000  0.6015000     0.2015000E-01  0.8203000 
1 1 1 12 19 21 o 1.873000  0.5222000     2.018000  0.7528000     1.728000  0.7239000     0.2903000      1.044000  
1 1 1 12 19 22 o 1.893000  0.5074000     1.628000  0.6880000     2.158000  0.7461000     -0.5301000     1.015000  
1 1 1 12 19 23 o 2.016000  0.5177000     2.295000  0.7491000     1.738000  0.7148000     0.5571000      1.035000  
1 1 1 12 19 24 o 1.461000  0.4552000     1.356000  0.6191000     1.567000  0.6676000     -0.2114000     0.9104000 
1 1 1 12 19 25 o 1.438000  0.4530000     1.481000  0.6483000     1.395000  0.6328000     0.8656000E-01  0.9060000 
1 1 1 12 20 0  o 0.5023000 0.3534000     0.5023000 0.3534000     0.5023000 0.3534000     -0.000000      0.000000  
1 1 1 12 20 1  o 13.44000  0.1349000     13.34000  0.1905000     13.54000  0.1912000     -0.2090000     0.2699000 
1 1 1 12 20 2  o 6.417000  0.1339000     6.113000  0.2054000     6.721000  0.1719000     -0.6078000     0.2679000 
1 1 1 12 20 3  o 4.110000  0.1558000     4.134000  0.2136000     4.087000  0.2269000     0.4670000E-01  0.3116000 
1 1 1 12 20 4  o 7.594000  0.1262000     7.615000  0.1772000     7.572000  0.1798000     0.4360000E-01  0.2524000 
1 1 1 12 20 5  o 7.307000  0.1448000     7.374000  0.2218000     7.239000  0.1862000     0.1346000      0.2896000 
1 1 1 12 20 6  o 1.688000  0.3316000     0.9403000 0.4275000     2.436000  0.5069000     -1.496000      0.6631000 
1 1 1 12 20 7  o 11.27000  0.2638000     11.39000  0.4406000     11.15000  0.2903000     0.2375000      0.5276000 
1 1 1 12 20 8  o 6.576000  0.1681000     6.471000  0.2589000     6.680000  0.2146000     -0.2094000     0.3363000 
1 1 1 12 20 9  o 4.456000  0.2016000     4.636000  0.2676000     4.276000  0.3016000     0.3594000      0.4032000 
1 1 1 12 20 10 o 3.607000  0.2514000     3.516000  0.3456000     3.697000  0.3652000     -0.1810000     0.5028000 
1 1 1 12 20 11 o 14.99000  0.1873000     15.10000  0.2694000     14.87000  0.2602000     0.2333000      0.3746000 
1 1 1 12 20 12 o 10.95000  0.1775000     11.07000  0.2785000     10.82000  0.2201000     0.2491000      0.3550000 
1 1 1 12 20 13 o 11.59000  0.2222000     11.63000  0.2662000     11.56000  0.3559000     0.7250000E-01  0.4445000 
1 1 1 12 20 14 o 1.947000  0.5757000     2.426000  0.9496000     1.469000  0.6511000     0.9571000      1.151000  
1 1 1 12 20 15 o 9.423000  0.2215000     9.311000  0.3102000     9.535000  0.3162000     -0.2244000     0.4430000 
1 1 1 12 20 16 o 2.858000  0.5673000     1.640000  0.7069000     4.076000  0.8874000     -2.436000      1.135000  
1 1 1 12 20 17 o 2.371000  0.5817000     2.200000  0.7951000     2.543000  0.8492000     -0.3430000     1.163000  
1 1 1 12 20 18 o 3.029000  0.7640000     2.334000  0.8339000     3.724000  1.280000      -1.390000      1.528000  
1 1 1 12 20 19 o 4.618000  0.4368000     4.833000  0.5385000     4.402000  0.6879000     0.4312000      0.8736000 
1 1 1 12 20 20 o 1.885000  0.5318000     1.622000  0.7044000     2.149000  0.7968000     -0.5263000     1.064000  
1 1 1 12 20 21 o 2.229000  0.4739000     1.354000  0.6261000     3.103000  0.7115000     -1.749000      0.9477000 
1 1 1 12 20 22 o 2.029000  0.4465000     2.845000  0.6848000     1.213000  0.5731000     1.631000       0.8930000 
1 1 1 12 20 23 o 1.515000  0.4842000     1.699000  0.7092000     1.332000  0.6593000     0.3665000      0.9683000 
1 1 1 12 20 24 o 2.067000  0.5254000     1.958000  0.7219000     2.175000  0.7636000     -0.2173000     1.051000  
1 1 1 12 20 25 o 1.255000  0.4104000     1.033000  0.5070000     1.477000  0.6455000     -0.4437000     0.8208000 
1 1 1 12 21 0  o 6.950000  0.1741000     6.950000  0.1741000     6.950000  0.1741000     0.000000       0.000000  
1 1 1 12 21 1  o 4.449000  0.1474000     4.456000  0.2091000     4.441000  0.2078000     0.1527000E-01  0.2948000 
1 1 1 12 21 2  o 18.96000  0.1688000     18.70000  0.2366000     19.22000  0.2410000     -0.5235000     0.3377000 
1 1 1 12 21 3  f 13.51000  0.1394000     13.49000  0.1966000     13.53000  0.1977000     -0.3277000E-01 0.2788000 
1 1 1 12 21 4  o 8.706000  0.1279000     8.686000  0.1797000     8.726000  0.1819000     -0.4021000E-01 0.2557000 
1 1 1 12 21 5  o 10.58000  0.1738000     10.57000  0.2668000     10.60000  0.2228000     -0.2322000E-01 0.3476000 
1 1 1 12 21 6  o 5.760000  0.1917000     5.695000  0.2198000     5.825000  0.3141000     -0.1299000     0.3834000 
1 1 1 12 21 7  o 2.419000  0.3907000     1.826000  0.7025000     3.012000  0.3422000     -1.186000      0.7815000 
1 1 1 12 21 8  o 26.96000  0.2495000     26.78000  0.3763000     27.13000  0.3276000     -0.3563000     0.4990000 
1 1 1 12 21 9  o 8.478000  0.1591000     8.598000  0.2181000     8.358000  0.2317000     0.2400000      0.3182000 
1 1 1 12 21 10 o 14.28000  0.1711000     14.33000  0.2289000     14.22000  0.2543000     0.1076000      0.3421000 
1 1 1 12 21 11 o 10.26000  0.1746000     10.61000  0.2491000     9.910000  0.2448000     0.6961000      0.3493000 
1 1 1 12 21 12 o 9.375000  0.2038000     9.320000  0.3267000     9.430000  0.2437000     -0.1103000     0.4076000 
1 1 1 12 21 13 o 4.796000  0.3140000     4.836000  0.3893000     4.756000  0.4928000     0.7950000E-01  0.6280000 
1 1 1 12 21 14 o 15.73000  0.2024000     15.97000  0.2846000     15.50000  0.2880000     0.4784000      0.4049000 
1 1 1 12 21 15 o 6.665000  0.2662000     6.341000  0.3910000     6.989000  0.3614000     -0.6489000     0.5324000 
1 1 1 12 21 16 o 1.749000  0.5153000     2.074000  0.7887000     1.425000  0.6633000     0.6485000      1.031000  
1 1 1 12 21 17 o 2.236000  0.5737000     2.015000  0.7805000     2.456000  0.8411000     -0.4408000     1.147000  
1 1 1 12 21 18 o 2.103000  0.6422000     1.693000  0.7390000     2.512000  1.050000      -0.8193000     1.284000  
1 1 1 12 21 19 o 2.059000  0.5890000     2.384000  0.8901000     1.733000  0.7717000     0.6510000      1.178000  
1 1 1 12 21 20 o 1.784000  0.5065000     1.324000  0.6255000     2.243000  0.7969000     -0.9185000     1.013000  
1 1 1 12 21 21 o 1.757000  0.5137000     1.820000  0.7409000     1.695000  0.7119000     0.1260000      1.027000  
1 1 1 12 21 22 o 1.158000  0.3939000     1.073000  0.5269000     1.242000  0.5857000     -0.1689000     0.7879000 
1 1 1 12 21 23 o 1.445000  0.4967000     1.245000  0.5819000     1.646000  0.8052000     -0.4012000     0.9935000 
1 1 1 12 21 24 o 1.237000  0.4174000     1.270000  0.6002000     1.205000  0.5801000     0.6528000E-01  0.8347000 
1 1 1 12 21 25 o 1.214000  0.4052000     1.183000  0.5566000     1.244000  0.5891000     -0.6174000E-01 0.8104000 
1 1 1 12 22 0  o 14.75000  0.2050000     14.75000  0.2050000     14.75000  0.2050000     0.000000       0.000000  
1 1 1 12 22 1  o 17.80000  0.1624000     17.98000  0.2313000     17.62000  0.2279000     0.3614000      0.3247000 
1 1 1 12 22 2  o 10.87000  0.1300000     10.89000  0.1842000     10.85000  0.1836000     0.3198000E-01  0.2601000 
1 1 1 12 22 3  o 6.176000  0.1375000     6.544000  0.1883000     5.809000  0.2005000     0.7347000      0.2750000 
1 1 1 12 22 4  o 3.149000  0.2614000     3.137000  0.4320000     3.162000  0.2946000     -0.2489000E-01 0.5229000 
1 1 1 12 22 5  o 8.040000  0.1578000     8.095000  0.1907000     7.985000  0.2515000     0.1099000      0.3156000 
1 1 1 12 22 6  o 10.39000  0.1847000     10.36000  0.2873000     10.42000  0.2323000     -0.6123000E-01 0.3694000 
1 1 1 12 22 7  o 9.387000  0.1556000     9.384000  0.2377000     9.390000  0.2008000     -0.6327000E-02 0.3112000 
1 1 1 12 22 8  o 5.014000  0.2016000     5.178000  0.3020000     4.851000  0.2670000     0.3279000      0.4031000 
1 1 1 12 22 9  o 20.46000  0.2035000     20.71000  0.2738000     20.21000  0.3013000     0.5005000      0.4071000 
1 1 1 12 22 10 o 10.06000  0.1710000     9.878000  0.2428000     10.24000  0.2410000     -0.3650000     0.3421000 
1 1 1 12 22 11 o 11.22000  0.1824000     11.02000  0.2257000     11.41000  0.2867000     -0.3849000     0.3649000 
1 1 1 12 22 12 f 8.862000  0.2167000     9.178000  0.2640000     8.546000  0.3436000     0.6326000      0.4334000 
1 1 1 12 22 13 f 4.503000  0.3661000     4.466000  0.4978000     4.540000  0.5371000     -0.7465000E-01 0.7323000 
1 1 1 12 22 14 o 13.26000  0.2016000     13.54000  0.2803000     12.99000  0.2898000     0.5426000      0.4031000 
1 1 1 12 22 15 o 11.95000  0.2092000     11.99000  0.2901000     11.90000  0.3016000     0.8960000E-01  0.4184000 
1 1 1 12 22 16 o 2.788000  0.5598000     2.958000  0.7698000     2.618000  0.8130000     0.3403000      1.120000  
1 1 1 12 22 17 o 2.774000  0.5242000     1.896000  0.7711000     3.651000  0.7104000     -1.756000      1.048000  
1 1 1 12 22 18 o 2.127000  0.5422000     2.710000  0.8109000     1.543000  0.7199000     1.167000       1.084000  
1 1 1 12 22 19 o 1.961000  0.6076000     1.886000  0.9163000     2.036000  0.7983000     -0.1508000     1.215000  
1 1 1 12 22 20 o 4.136000  0.4109000     4.261000  0.5479000     4.011000  0.6124000     0.2503000      0.8217000 
1 1 1 12 22 21 f 2.311000  0.5243000     1.799000  0.7289000     2.822000  0.7537000     -1.023000      1.049000  
1 1 1 12 22 22 o 1.679000  0.4972000     1.757000  0.7157000     1.601000  0.6903000     0.1561000      0.9944000 
1 1 1 12 22 23 o 1.441000  0.4688000     1.537000  0.6638000     1.344000  0.6621000     0.1930000      0.9376000 
1 1 1 12 22 24 o 1.456000  0.5096000     1.672000  0.8317000     1.241000  0.5890000     0.4316000      1.019000  
1 1 1 12 22 25 o 1.078000  0.3718000     0.9220000 0.4621000     1.234000  0.5824000     -0.3123000     0.7435000 
1 1 1 12 23 0  o 26.68000  0.3138000     26.68000  0.3138000     26.68000  0.3138000     -0.000000      0.000000  
1 1 1 12 23 1  o 9.333000  0.1280000     9.212000  0.1807000     9.454000  0.1813000     -0.2415000     0.2560000 
1 1 1 12 23 2  o 10.45000  0.1305000     10.49000  0.1845000     10.41000  0.1847000     0.8001000E-01  0.2611000 
1 1 1 12 23 3  o 19.35000  0.2147000     19.30000  0.3507000     19.40000  0.2477000     -0.9782000E-01 0.4293000 
1 1 1 12 23 4  o 8.288000  0.2016000     8.483000  0.1887000     8.094000  0.3563000     0.3883000      0.4032000 
1 1 1 12 23 5  o 13.29000  0.2465000     12.77000  0.4263000     13.82000  0.2478000     -1.049000      0.4931000 
1 1 1 12 23 6  o 15.05000  0.1559000     15.26000  0.2228000     14.85000  0.2183000     0.4136000      0.3119000 
1 1 1 12 23 7  o 9.521000  0.1568000     9.560000  0.2405000     9.482000  0.2013000     0.7781000E-01  0.3136000 
1 1 1 12 23 8  o 10.92000  0.1647000     10.89000  0.2512000     10.95000  0.2131000     -0.5796000E-01 0.3294000 
1 1 1 12 23 9  o 6.662000  0.1884000     6.693000  0.2786000     6.631000  0.2538000     0.6136000E-01  0.3768000 
1 1 1 12 23 10 o 3.622000  0.2630000     3.562000  0.3626000     3.682000  0.3809000     -0.1195000     0.5259000 
1 1 1 12 23 11 o 6.532000  0.1948000     6.334000  0.2708000     6.729000  0.2801000     -0.3950000     0.3896000 
1 1 1 12 23 12 o 4.548000  0.2570000     4.700000  0.3382000     4.397000  0.3871000     0.3022000      0.5140000 
1 1 1 12 23 13 o 11.33000  0.2275000     11.00000  0.3590000     11.66000  0.2797000     -0.6664000     0.4551000 
1 1 1 12 23 14 o 13.32000  0.2034000     13.25000  0.2815000     13.40000  0.2937000     -0.1451000     0.4068000 
1 1 1 12 23 15 o 1.812000  0.5043000     2.169000  0.7643000     1.454000  0.6581000     0.7151000      1.009000  
1 1 1 12 23 16 o 7.210000  0.2733000     7.034000  0.3868000     7.385000  0.3861000     -0.3512000     0.5466000 
1 1 1 12 23 17 o 8.054000  0.3302000     8.295000  0.3695000     7.814000  0.5474000     0.4804000      0.6605000 
1 1 1 12 23 18 o 2.304000  0.5590000     1.861000  0.7627000     2.746000  0.8174000     -0.8847000     1.118000  
1 1 1 12 23 19 o 2.634000  0.6265000     2.261000  0.9726000     3.006000  0.7899000     -0.7452000     1.253000  
1 1 1 12 23 20 o 1.625000  0.4922000     1.309000  0.6155000     1.940000  0.7681000     -0.6304000     0.9843000 
1 1 1 12 23 21 o 1.463000  0.4649000     1.428000  0.6450000     1.499000  0.6699000     -0.7055000E-01 0.9299000 
1 1 1 12 23 22 f 1.575000  0.4842000     1.619000  0.6905000     1.531000  0.6789000     0.8807000E-01  0.9683000 
1 1 1 12 23 23 o 2.269000  0.5155000     1.938000  0.7199000     2.601000  0.7380000     -0.6636000     1.031000  
1 1 1 12 23 24 o 1.256000  0.4458000     1.412000  0.7140000     1.101000  0.5342000     0.3105000      0.8917000 
1 1 1 12 23 25 o 1.113000  0.4050000     1.128000  0.5801000     1.098000  0.5653000     0.3053000E-01  0.8100000 
1 1 1 12 24 0  o 8.644000  0.1870000     8.644000  0.1870000     8.644000  0.1870000     0.000000       0.000000  
1 1 1 12 24 1  o 4.426000  0.1817000     4.190000  0.2835000     4.662000  0.2275000     -0.4715000     0.3635000 
1 1 1 12 24 2  o 13.47000  0.2038000     13.91000  0.2917000     13.02000  0.2846000     0.8953000      0.4075000 
1 1 1 12 24 3  o 6.298000  0.2044000     6.298000  0.2044000     ?         ?             ?              ?         
1 1 1 12 24 4  o 17.62000  0.2161000     17.59000  0.3332000     17.66000  0.2753000     -0.6767000E-01 0.4322000 
1 1 1 12 24 5  o 11.27000  0.1404000     11.28000  0.2005000     11.27000  0.1966000     0.5504000E-02  0.2808000 
1 1 1 12 24 6  o 18.94000  0.1774000     19.29000  0.2547000     18.59000  0.2468000     0.7015000      0.3547000 
1 1 1 12 24 7  o 6.310000  0.1761000     6.018000  0.2751000     6.603000  0.2200000     -0.5854000     0.3522000 
1 1 1 12 24 8  o 13.82000  0.1726000     13.93000  0.2633000     13.71000  0.2233000     0.2153000      0.3452000 
1 1 1 12 24 9  o 10.20000  0.1758000     10.16000  0.2589000     10.24000  0.2379000     -0.8505000E-01 0.3516000 
1 1 1 12 24 10 o 7.682000  0.1761000     7.848000  0.2369000     7.516000  0.2607000     0.3319000      0.3522000 
1 1 1 12 24 11 o 7.621000  0.2200000     7.721000  0.3460000     7.521000  0.2720000     0.2001000      0.4401000 
1 1 1 12 24 12 o 1.853000  0.3984000     0.9492000 0.4599000     2.757000  0.6505000     -1.808000      0.7967000 
1 1 1 12 24 13 o 5.992000  0.2546000     5.931000  0.3988000     6.054000  0.3165000     -0.1229000     0.5092000 
1 1 1 12 24 14 o 4.047000  0.3729000     4.020000  0.5980000     4.075000  0.4458000     -0.5479000E-01 0.7459000 
1 1 1 12 24 15 o 6.495000  0.2829000     6.516000  0.3894000     6.475000  0.4106000     0.4067000E-01  0.5659000 
1 1 1 12 24 16 o 3.497000  0.5035000     2.731000  0.8020000     4.262000  0.6090000     -1.531000      1.007000  
1 1 1 12 24 17 o 2.035000  0.5774000     2.273000  0.8407000     1.798000  0.7918000     0.4751000      1.155000  
1 1 1 12 24 18 o 1.905000  0.5501000     2.036000  0.7889000     1.774000  0.7669000     0.2618000      1.100000  
1 1 1 12 24 19 o 3.184000  0.5090000     2.918000  0.7292000     3.450000  0.7103000     -0.5320000     1.018000  
1 1 1 12 24 20 o 1.729000  0.5124000     1.943000  0.7653000     1.515000  0.6817000     0.4287000      1.025000  
1 1 1 12 24 21 o 1.539000  0.4793000     1.579000  0.6841000     1.499000  0.6716000     0.7998000E-01  0.9587000 
1 1 1 12 24 22 o 1.806000  0.5183000     1.672000  0.7123000     1.941000  0.7531000     -0.2690000     1.037000  
1 1 1 12 24 23 o 1.663000  0.4867000     1.865000  0.7234000     1.461000  0.6514000     0.4039000      0.9734000 
1 1 1 12 24 24 o 1.520000  0.4865000     1.578000  0.7253000     1.461000  0.6487000     0.1166000      0.9731000 
1 1 1 12 25 0  o 15.69000  0.4460000     15.69000  0.4460000     15.69000  0.4460000     -0.000000      0.000000  
1 1 1 12 25 2  o 14.89000  0.2162000     14.86000  0.3012000     14.91000  0.3103000     -0.5082000E-01 0.4324000 
1 1 1 12 25 3  o 3.598000  0.2501000     3.558000  0.4086000     3.637000  0.2886000     -0.7910000E-01 0.5002000 
1 1 1 12 25 4  o 13.53000  0.1475000     13.70000  0.2092000     13.36000  0.2080000     0.3469000      0.2950000 
1 1 1 12 25 5  o 8.062000  0.1423000     8.082000  0.2033000     8.043000  0.1991000     0.3832000E-01  0.2846000 
1 1 1 12 25 6  o 2.942000  0.2793000     2.510000  0.4530000     3.375000  0.3270000     -0.8654000     0.5587000 
1 1 1 12 25 7  o 16.98000  0.1849000     16.97000  0.2805000     16.99000  0.2409000     -0.1841000E-01 0.3698000 
1 1 1 12 25 8  o 8.264000  0.1716000     7.984000  0.2656000     8.545000  0.2172000     -0.5618000     0.3431000 
1 1 1 12 25 9  o 17.74000  0.2042000     17.49000  0.2939000     17.98000  0.2835000     -0.4833000     0.4083000 
1 1 1 12 25 10 o 15.81000  0.1831000     15.85000  0.2452000     15.76000  0.2720000     0.9257000E-01  0.3662000 
1 1 1 12 25 11 o 6.212000  0.2364000     6.011000  0.3022000     6.413000  0.3637000     -0.4014000     0.4728000 
1 1 1 12 25 12 o 7.821000  0.2669000     7.827000  0.2804000     7.815000  0.4542000     0.1286000E-01  0.5338000 
1 1 1 12 25 13 o 6.703000  0.2066000     6.563000  0.2897000     6.843000  0.2946000     -0.2799000     0.4132000 
1 1 1 12 25 14 o 12.97000  0.2001000     12.98000  0.3174000     12.97000  0.2436000     0.6842000E-02  0.4001000 
1 1 1 12 25 15 o 2.113000  0.5095000     1.416000  0.6497000     2.810000  0.7849000     -1.394000      1.019000  
1 1 1 12 25 16 o 2.952000  0.5436000     2.418000  0.7990000     3.487000  0.7375000     -1.069000      1.087000  
1 1 1 12 25 17 o 2.866000  0.7400000     2.590000  0.8461000     3.143000  1.214000      -0.5534000     1.480000  
1 1 1 12 25 18 o 3.571000  0.5418000     3.828000  0.6614000     3.315000  0.8583000     0.5132000      1.084000  
1 1 1 12 25 19 o 4.037000  0.4035000     4.034000  0.5501000     4.040000  0.5905000     -0.5707000E-02 0.8070000 
1 1 1 12 25 20 o 2.303000  0.5453000     2.574000  0.7675000     2.033000  0.7747000     0.5412000      1.091000  
1 1 1 12 25 21 o 1.400000  0.4555000     1.444000  0.6530000     1.357000  0.6353000     0.8655000E-01  0.9111000 
1 1 1 12 25 22 o 2.396000  0.5755000     2.335000  0.7965000     2.457000  0.8308000     -0.1221000     1.151000  
1 1 1 12 25 23 o 1.191000  0.4026000     1.084000  0.5289000     1.299000  0.6070000     -0.2156000     0.8051000 
1 1 1 12 25 24 o 1.576000  0.4485000     0.9695000 0.4838000     2.182000  0.7554000     -1.212000      0.8971000 
1 1 1 12 26 0  o 16.83000  0.2639000     16.83000  0.2639000     16.83000  0.2639000     0.000000       0.000000  
1 1 1 12 26 1  o 3.699000  0.2130000     4.144000  0.3009000     3.253000  0.3016000     0.8914000      0.4260000 
1 1 1 12 26 2  o 6.366000  0.1606000     6.362000  0.2081000     6.369000  0.2448000     -0.6447000E-02 0.3213000 
1 1 1 12 26 3  o 15.68000  0.1574000     15.55000  0.2216000     15.82000  0.2237000     -0.2678000     0.3149000 
1 1 1 12 26 4  o 14.75000  0.1538000     14.71000  0.2168000     14.80000  0.2182000     -0.9545000E-01 0.3076000 
1 1 1 12 26 5  o 8.521000  0.1432000     8.661000  0.2024000     8.382000  0.2027000     0.2791000      0.2864000 
1 1 1 12 26 6  o 12.93000  0.1501000     13.05000  0.2131000     12.80000  0.2116000     0.2501000      0.3003000 
1 1 1 12 26 7  o 13.40000  0.1696000     13.33000  0.2582000     13.47000  0.2201000     -0.1312000     0.3393000 
1 1 1 12 26 8  o 10.09000  0.1673000     9.937000  0.2579000     10.25000  0.2131000     -0.3153000     0.3345000 
1 1 1 12 26 9  o 12.22000  0.1744000     12.18000  0.2650000     12.27000  0.2269000     -0.8970000E-01 0.3489000 
1 1 1 12 26 10 o 9.887000  0.1887000     9.861000  0.2815000     9.913000  0.2514000     -0.5162000E-01 0.3774000 
1 1 1 12 26 11 o 8.881000  0.1795000     8.947000  0.2402000     8.815000  0.2667000     0.1314000      0.3589000 
1 1 1 12 26 12 o 15.12000  0.2264000     15.02000  0.3557000     15.21000  0.2803000     -0.1844000     0.4529000 
1 1 1 12 26 13 o 4.137000  0.2938000     4.003000  0.4162000     4.272000  0.4148000     -0.2690000     0.5876000 
1 1 1 12 26 14 o 7.592000  0.2066000     7.746000  0.2891000     7.438000  0.2953000     0.3078000      0.4132000 
1 1 1 12 26 15 o 6.933000  0.2762000     6.858000  0.4491000     7.007000  0.3217000     -0.1490000     0.5525000 
1 1 1 12 26 16 o 3.879000  0.4883000     4.845000  0.5139000     2.913000  0.8305000     1.931000       0.9766000 
1 1 1 12 26 17 o 5.228000  0.5251000     5.267000  0.4778000     5.188000  0.9352000     0.7892000E-01  1.050000  
1 1 1 12 26 18 o 2.097000  0.6613000     2.228000  1.044000      1.966000  0.8119000     0.2624000      1.323000  
1 1 1 12 26 19 o 2.339000  0.5376000     2.050000  0.7599000     2.628000  0.7607000     -0.5783000     1.075000  
1 1 1 12 26 20 o 1.845000  0.5186000     1.896000  0.7369000     1.794000  0.7298000     0.1020000      1.037000  
1 1 1 12 26 21 o 3.030000  0.4797000     3.560000  0.5866000     2.501000  0.7591000     1.059000       0.9594000 
1 1 1 12 26 22 o 1.756000  0.5560000     1.751000  0.7309000     1.760000  0.8380000     -0.8901000E-02 1.112000  
1 1 1 12 26 23 o 2.246000  0.5267000     2.560000  0.7272000     1.931000  0.7621000     0.6295000      1.053000  
1 1 1 12 26 24 o 1.319000  0.4296000     1.178000  0.5651000     1.459000  0.6473000     -0.2807000     0.8593000 
1 1 1 12 27 0  o 4.252000  0.2647000     4.252000  0.2647000     4.252000  0.2647000     0.000000       0.000000  
1 1 1 12 27 1  o 11.57000  0.1405000     11.63000  0.1988000     11.51000  0.1987000     0.1159000      0.2810000 
1 1 1 12 27 2  o 10.28000  0.1385000     10.24000  0.1956000     10.32000  0.1962000     -0.7349000E-01 0.2770000 
1 1 1 12 27 3  o 11.68000  0.1431000     11.67000  0.2028000     11.68000  0.2019000     -0.1369000E-01 0.2862000 
1 1 1 12 27 4  o 11.65000  0.1440000     11.80000  0.2032000     11.49000  0.2041000     0.3073000      0.2880000 
1 1 1 12 27 5  o 11.24000  0.1451000     11.17000  0.2041000     11.32000  0.2064000     -0.1551000     0.2903000 
1 1 1 12 27 6  o 8.097000  0.1493000     8.254000  0.2129000     7.940000  0.2095000     0.3146000      0.2987000 
1 1 1 12 27 7  o 6.167000  0.1862000     6.075000  0.2908000     6.260000  0.2326000     -0.1845000     0.3724000 
1 1 1 12 27 8  o 12.07000  0.1704000     11.88000  0.2605000     12.26000  0.2197000     -0.3791000     0.3408000 
1 1 1 12 27 9  o 12.53000  0.1782000     12.19000  0.2713000     12.87000  0.2312000     -0.6761000     0.3564000 
1 1 1 12 27 10 o 5.850000  0.2829000     5.596000  0.4220000     6.105000  0.3770000     -0.5089000     0.5659000 
1 1 1 12 27 11 o 9.482000  0.2488000     9.817000  0.2416000     9.148000  0.4350000     0.6688000      0.4976000 
1 1 1 12 27 12 o 11.13000  0.2089000     11.38000  0.2708000     10.87000  0.3180000     0.5023000      0.4177000 
1 1 1 12 27 13 o 7.389000  0.2069000     7.437000  0.2860000     7.341000  0.2989000     0.9609000E-01  0.4137000 
1 1 1 12 27 14 f 3.678000  0.3726000     3.999000  0.4696000     3.357000  0.5787000     0.6411000      0.7452000 
1 1 1 12 27 15 o 6.203000  0.2742000     6.212000  0.4255000     6.194000  0.3460000     0.1815000E-01  0.5484000 
1 1 1 12 27 16 o 5.258000  0.3501000     5.087000  0.5023000     5.429000  0.4878000     -0.3419000     0.7002000 
1 1 1 12 27 17 f 1.741000  0.5181000     1.969000  0.7735000     1.513000  0.6895000     0.4560000      1.036000  
1 1 1 12 27 18 o 3.957000  0.6054000     3.654000  1.067000      4.261000  0.5728000     -0.6066000     1.211000  
1 1 1 12 27 19 o 1.583000  0.4760000     1.024000  0.5104000     2.141000  0.8036000     -1.117000      0.9520000 
1 1 1 12 27 20 o 2.085000  0.5283000     2.289000  0.7498000     1.880000  0.7445000     0.4092000      1.057000  
1 1 1 12 27 21 f 1.685000  0.4770000     2.059000  0.7314000     1.311000  0.6126000     0.7477000      0.9541000 
1 1 1 12 27 22 o 2.319000  0.5871000     2.420000  0.7329000     2.218000  0.9174000     0.2020000      1.174000  
1 1 1 12 27 23 o 1.948000  0.5417000     1.689000  0.7316000     2.208000  0.7991000     -0.5197000     1.083000  
1 1 1 12 27 24 o 1.358000  0.4411000     1.444000  0.6493000     1.271000  0.5972000     0.1732000      0.8822000 
1 1 1 12 28 0  o 16.94000  0.2336000     16.94000  0.2336000     16.94000  0.2336000     -0.000000      0.000000  
1 1 1 12 28 1  o 13.51000  0.1492000     13.64000  0.2116000     13.38000  0.2104000     0.2641000      0.2984000 
1 1 1 12 28 2  o 14.11000  0.1519000     13.82000  0.2128000     14.40000  0.2169000     -0.5834000     0.3039000 
1 1 1 12 28 3  o 19.54000  0.1808000     19.73000  0.2570000     19.34000  0.2543000     0.3875000      0.3616000 
1 1 1 12 28 4  o 13.80000  0.1526000     13.69000  0.2146000     13.90000  0.2170000     -0.2117000     0.3052000 
1 1 1 12 28 5  o 11.34000  0.1472000     11.26000  0.2074000     11.41000  0.2090000     -0.1575000     0.2945000 
1 1 1 12 28 6  o 14.29000  0.1581000     14.35000  0.2245000     14.23000  0.2228000     0.1139000      0.3163000 
1 1 1 12 28 7  o 5.995000  0.1894000     6.368000  0.2842000     5.622000  0.2505000     0.7462000      0.3788000 
1 1 1 12 28 8  o 8.371000  0.1756000     8.457000  0.2694000     8.285000  0.2254000     0.1725000      0.3513000 
1 1 1 12 28 9  o 15.30000  0.1883000     15.34000  0.2890000     15.25000  0.2416000     0.9160000E-01  0.3766000 
1 1 1 12 28 10 o 14.31000  0.2036000     14.21000  0.2397000     14.41000  0.3292000     -0.1986000     0.4072000 
1 1 1 12 28 11 o 16.97000  0.2596000     16.97000  0.3679000     16.96000  0.3663000     0.5342000E-02  0.5191000 
1 1 1 12 28 12 o 2.314000  0.4051000     1.372000  0.5933000     3.256000  0.5519000     -1.884000      0.8103000 
1 1 1 12 28 13 o 12.50000  0.1830000     12.52000  0.2562000     12.47000  0.2614000     0.5339000E-01  0.3660000 
1 1 1 12 28 14 o 4.577000  0.3184000     5.094000  0.3970000     4.060000  0.4979000     1.034000       0.6368000 
1 1 1 12 28 15 o 8.759000  0.2064000     8.825000  0.2917000     8.694000  0.2922000     0.1312000      0.4129000 
1 1 1 12 28 16 o 2.185000  0.6454000     2.004000  0.8273000     2.366000  0.9909000     -0.3624000     1.291000  
1 1 1 12 28 17 o 3.801000  0.4937000     3.845000  0.6368000     3.757000  0.7547000     0.8753000E-01  0.9875000 
1 1 1 12 28 18 o 1.458000  0.4622000     1.807000  0.7451000     1.110000  0.5471000     0.6970000      0.9244000 
1 1 1 12 28 19 o 1.962000  0.5384000     2.009000  0.7673000     1.914000  0.7555000     0.9493000E-01  1.077000  
1 1 1 12 28 20 o 1.369000  0.4442000     1.191000  0.5736000     1.548000  0.6783000     -0.3565000     0.8883000 
1 1 1 12 28 21 o 2.344000  0.5312000     2.069000  0.7519000     2.619000  0.7506000     -0.5495000     1.062000  
1 1 1 12 28 22 o 1.546000  0.4758000     1.292000  0.6027000     1.800000  0.7364000     -0.5074000     0.9517000 
1 1 1 12 28 23 o 1.795000  0.5240000     1.440000  0.7248000     2.151000  0.7570000     -0.7110000     1.048000  
1 1 1 12 28 24 o 1.629000  0.4701000     1.139000  0.5551000     2.119000  0.7589000     -0.9801000     0.9402000 
1 1 1 12 29 0  o 5.299000  0.2424000     5.299000  0.2424000     5.299000  0.2424000     -0.000000      0.000000  
1 1 1 12 29 1  o 4.706000  0.1822000     4.593000  0.2621000     4.820000  0.2530000     -0.2273000     0.3643000 
1 1 1 12 29 2  o 8.374000  0.1447000     8.571000  0.2031000     8.176000  0.2063000     0.3955000      0.2895000 
1 1 1 12 29 3  o 10.68000  0.1446000     10.71000  0.2036000     10.66000  0.2053000     0.4056000E-01  0.2891000 
1 1 1 12 29 4  o 22.92000  0.2029000     22.27000  0.2811000     23.56000  0.2928000     -1.292000      0.4059000 
1 1 1 12 29 5  o 9.538000  0.1484000     9.352000  0.2104000     9.724000  0.2092000     -0.3724000     0.2967000 
1 1 1 12 29 6  o 23.79000  0.2101000     23.75000  0.2970000     23.82000  0.2973000     -0.7052000E-01 0.4202000 
1 1 1 12 29 7  o 17.54000  0.1914000     17.66000  0.2911000     17.42000  0.2485000     0.2336000      0.3828000 
1 1 1 12 29 8  o 19.19000  0.2048000     19.24000  0.3118000     19.14000  0.2657000     0.1015000      0.4097000 
1 1 1 12 29 9  o 14.82000  0.2216000     14.67000  0.3401000     14.98000  0.2843000     -0.3047000     0.4433000 
1 1 1 12 29 10 o 14.44000  0.2609000     13.99000  0.2425000     14.89000  0.4620000     -0.8956000     0.5218000 
1 1 1 12 29 11 o 4.776000  0.2916000     5.035000  0.4278000     4.518000  0.3965000     0.5174000      0.5833000 
1 1 1 12 29 12 o 2.578000  0.4377000     3.158000  0.5207000     1.998000  0.7037000     1.160000       0.8755000 
1 1 1 12 29 13 o 6.073000  0.2356000     5.765000  0.3354000     6.380000  0.3309000     -0.6149000     0.4711000 
1 1 1 12 29 14 o 9.353000  0.2013000     9.455000  0.2772000     9.250000  0.2921000     0.2045000      0.4027000 
1 1 1 12 29 15 o 2.421000  0.4714000     1.683000  0.6901000     3.159000  0.6424000     -1.475000      0.9429000 
1 1 1 12 29 16 o 3.165000  0.5151000     2.139000  0.8189000     4.192000  0.6251000     -2.053000      1.030000  
1 1 1 12 29 17 o 8.037000  0.3144000     8.090000  0.4619000     7.984000  0.4266000     0.1060000      0.6288000 
1 1 1 12 29 18 o 4.612000  0.3850000     4.689000  0.5341000     4.536000  0.5547000     0.1533000      0.7700000 
1 1 1 12 29 19 o 2.211000  0.5469000     2.039000  0.7614000     2.382000  0.7854000     -0.3433000     1.094000  
1 1 1 12 29 20 o 2.184000  0.5423000     2.428000  0.7782000     1.941000  0.7556000     0.4873000      1.085000  
1 1 1 12 29 21 f 1.593000  0.4766000     1.905000  0.7421000     1.281000  0.5982000     0.6243000      0.9531000 
1 1 1 12 29 22 o 1.589000  0.4730000     1.433000  0.6313000     1.744000  0.7045000     -0.3110000     0.9460000 
1 1 1 12 29 23 o 1.586000  0.4698000     1.139000  0.5696000     2.032000  0.7474000     -0.8932000     0.9397000 
1 1 1 12 30 0  o 6.780000  0.2183000     6.780000  0.2183000     6.780000  0.2183000     0.000000       0.000000  
1 1 1 12 30 1  o 7.027000  0.1532000     7.178000  0.2168000     6.877000  0.2164000     0.3011000      0.3063000 
1 1 1 12 30 2  o 25.70000  0.2207000     25.70000  0.3121000     25.71000  0.3120000     -0.1082000E-01 0.4413000 
1 1 1 12 30 3  o 29.62000  0.2477000     29.51000  0.3493000     29.74000  0.3512000     -0.2327000     0.4953000 
1 1 1 12 30 4  o 25.48000  0.2201000     25.19000  0.3084000     25.77000  0.3141000     -0.5801000     0.4402000 
1 1 1 12 30 5  o 7.916000  0.1551000     7.726000  0.2206000     8.107000  0.2181000     -0.3811000     0.3102000 
1 1 1 12 30 6  o 12.01000  0.1546000     11.92000  0.2181000     12.11000  0.2191000     -0.1871000     0.3092000 
1 1 1 12 30 7  o 14.08000  0.1781000     14.31000  0.2720000     13.84000  0.2301000     0.4658000      0.3562000 
1 1 1 12 30 8  o 1.052000  0.3479000     0.9545000 0.4676000     1.149000  0.5152000     -0.1949000     0.6957000 
1 1 1 12 30 9  o 5.393000  0.2658000     5.262000  0.3627000     5.525000  0.3886000     -0.2636000     0.5316000 
1 1 1 12 30 10 o 12.01000  0.2396000     12.13000  0.3386000     11.90000  0.3392000     0.2214000      0.4793000 
1 1 1 12 30 11 o 16.75000  0.1969000     17.06000  0.2646000     16.44000  0.2915000     0.6172000      0.3937000 
1 1 1 12 30 12 o 2.732000  0.4557000     2.728000  0.6186000     2.736000  0.6694000     -0.7618000E-02 0.9115000 
1 1 1 12 30 13 o 7.022000  0.2336000     6.959000  0.3204000     7.084000  0.3399000     -0.1245000     0.4671000 
1 1 1 12 30 14 o 1.818000  0.4812000     1.423000  0.6205000     2.214000  0.7356000     -0.7917000     0.9624000 
1 1 1 12 30 15 o 2.693000  0.4937000     2.752000  0.6921000     2.634000  0.7043000     0.1176000      0.9875000 
1 1 1 12 30 16 o 10.13000  0.2064000     10.07000  0.2905000     10.19000  0.2932000     -0.1230000     0.4128000 
1 1 1 12 30 17 o 6.494000  0.5704000     6.306000  1.061000      6.682000  0.4181000     -0.3763000     1.141000  
1 1 1 12 30 18 o 3.117000  0.5246000     2.921000  0.7538000     3.312000  0.7299000     -0.3909000     1.049000  
1 1 1 12 30 19 o 3.105000  0.4533000     4.258000  0.5079000     1.951000  0.7510000     2.307000       0.9066000 
1 1 1 12 30 20 o 1.316000  0.4320000     1.188000  0.5691000     1.444000  0.6500000     -0.2560000     0.8639000 
1 1 1 12 30 21 o 2.103000  0.5190000     1.511000  0.6745000     2.696000  0.7891000     -1.185000      1.038000  
1 1 1 12 30 22 o 2.145000  0.5058000     2.598000  0.7132000     1.692000  0.7175000     0.9056000      1.012000  
1 1 1 12 30 23 o 1.319000  0.4306000     1.111000  0.5392000     1.528000  0.6715000     -0.4176000     0.8612000 
1 1 1 12 31 0  o 7.237000  0.2186000     7.237000  0.2186000     7.237000  0.2186000     -0.000000      0.000000  
1 1 1 12 31 1  o 14.65000  0.1573000     14.78000  0.2231000     14.52000  0.2219000     0.2550000      0.3147000 
1 1 1 12 31 2  o 29.32000  0.2458000     29.04000  0.3448000     29.60000  0.3503000     -0.5605000     0.4916000 
1 1 1 12 31 3  o 24.53000  0.2139000     24.82000  0.3050000     24.24000  0.3000000     0.5710000      0.4278000 
1 1 1 12 31 4  o 24.83000  0.2166000     25.12000  0.3092000     24.54000  0.3036000     0.5740000      0.4333000 
1 1 1 12 31 5  o 6.755000  0.1679000     6.900000  0.2331000     6.611000  0.2418000     0.2891000      0.3359000 
1 1 1 12 31 6  o 19.07000  0.1846000     19.06000  0.2605000     19.09000  0.2617000     -0.2994000E-01 0.3692000 
1 1 1 12 31 7  o 8.382000  0.1791000     8.734000  0.2729000     8.030000  0.2321000     0.7035000      0.3582000 
1 1 1 12 31 8  o 29.14000  0.3533000     28.76000  0.4975000     29.51000  0.5018000     -0.7499000     0.7066000 
1 1 1 12 31 9  o 23.73000  0.3098000     24.14000  0.4372000     23.33000  0.4391000     0.8108000      0.6196000 
1 1 1 12 31 10 o 8.356000  0.2376000     8.234000  0.3820000     8.478000  0.2826000     -0.2440000     0.4752000 
1 1 1 12 31 11 o 4.803000  0.2771000     4.837000  0.3744000     4.768000  0.4086000     0.6968000E-01  0.5542000 
1 1 1 12 31 12 o 1.835000  0.4765000     1.428000  0.6218000     2.242000  0.7223000     -0.8133000     0.9531000 
1 1 1 12 31 13 o 5.442000  0.2769000     5.465000  0.3657000     5.419000  0.4158000     0.4582000E-01  0.5537000 
1 1 1 12 31 14 f 4.706000  0.3093000     4.663000  0.4355000     4.749000  0.4394000     -0.8672000E-01 0.6186000 
1 1 1 12 31 15 o 8.001000  0.2790000     8.178000  0.4531000     7.824000  0.3255000     0.3545000      0.5579000 
1 1 1 12 31 16 o 7.948000  0.2368000     7.900000  0.3190000     7.996000  0.3500000     -0.9572000E-01 0.4736000 
1 1 1 12 31 17 o 2.969000  0.5335000     2.607000  0.8696000     3.331000  0.6182000     -0.7236000     1.067000  
1 1 1 12 31 18 o 2.962000  0.5052000     2.372000  0.7784000     3.551000  0.6443000     -1.180000      1.010000  
1 1 1 12 31 19 f 1.702000  0.4967000     1.448000  0.6499000     1.956000  0.7512000     -0.5088000     0.9933000 
1 1 1 12 31 20 o 2.107000  0.5289000     2.229000  0.7499000     1.986000  0.7462000     0.2433000      1.058000  
1 1 1 12 31 21 o 1.613000  0.5408000     1.428000  0.6557000     1.798000  0.8602000     -0.3705000     1.082000  
1 1 1 12 31 22 o 1.315000  0.4365000     1.594000  0.7047000     1.037000  0.5154000     0.5571000      0.8730000 
1 1 1 12 31 23 o 1.001000  0.3511000     0.8406000 0.4264000     1.162000  0.5578000     -0.3215000     0.7021000 
1 1 1 12 32 0  o 12.08000  0.2119000     12.08000  0.2119000     12.08000  0.2119000     -0.000000      0.000000  
1 1 1 12 32 1  o 14.36000  0.1571000     14.25000  0.2215000     14.47000  0.2228000     -0.2153000     0.3141000 
1 1 1 12 32 2  o 8.735000  0.1503000     8.721000  0.2119000     8.750000  0.2132000     -0.2891000E-01 0.3006000 
1 1 1 12 32 3  o 4.977000  0.1928000     4.859000  0.2726000     5.095000  0.2726000     -0.2354000     0.3855000 
1 1 1 12 32 4  o 9.622000  0.1527000     9.748000  0.2147000     9.496000  0.2171000     0.2515000      0.3053000 
1 1 1 12 32 5  o 3.584000  0.2587000     3.898000  0.3358000     3.270000  0.3936000     0.6277000      0.5174000 
1 1 1 12 32 6  o 18.62000  0.1836000     18.57000  0.2591000     18.67000  0.2601000     -0.1004000     0.3672000 
1 1 1 12 32 7  o 17.81000  0.2234000     17.86000  0.3648000     17.75000  0.2582000     0.1108000      0.4469000 
1 1 1 12 32 8  o 12.38000  0.2077000     12.22000  0.2748000     12.54000  0.3115000     -0.3206000     0.4154000 
1 1 1 12 32 9  o 6.033000  0.4049000     5.630000  0.7575000     6.436000  0.2863000     -0.8057000     0.8098000 
1 1 1 12 32 10 o 10.26000  0.1780000     10.19000  0.2512000     10.34000  0.2524000     -0.1504000     0.3561000 
1 1 1 12 32 11 o 8.112000  0.2014000     8.152000  0.2737000     8.073000  0.2956000     0.7844000E-01  0.4029000 
1 1 1 12 32 12 o 3.906000  0.3602000     4.064000  0.4509000     3.748000  0.5619000     0.3151000      0.7205000 
1 1 1 12 32 13 o 2.198000  0.5174000     2.123000  0.7124000     2.273000  0.7506000     -0.1502000     1.035000  
1 1 1 12 32 14 o 2.629000  0.4940000     2.911000  0.6736000     2.348000  0.7229000     0.5632000      0.9880000 
1 1 1 12 32 15 o 6.360000  0.3087000     6.245000  0.3489000     6.475000  0.5094000     -0.2298000     0.6174000 
1 1 1 12 32 16 o 3.698000  0.5300000     3.985000  0.5777000     3.412000  0.8887000     0.5730000      1.060000  
1 1 1 12 32 17 o 3.516000  0.4351000     4.055000  0.5225000     2.978000  0.6960000     1.077000       0.8703000 
1 1 1 12 32 18 o 2.067000  0.5392000     2.036000  0.7600000     2.099000  0.7652000     -0.6326000E-01 1.078000  
1 1 1 12 32 19 o 1.955000  0.4967000     2.382000  0.7317000     1.528000  0.6720000     0.8535000      0.9935000 
1 1 1 12 32 20 o 1.611000  0.4826000     1.620000  0.6877000     1.603000  0.6773000     0.1691000E-01  0.9652000 
1 1 1 12 32 21 f 1.584000  0.5115000     1.224000  0.5816000     1.944000  0.8415000     -0.7207000     1.023000  
1 1 1 12 32 22 f 1.601000  0.5421000     1.808000  0.8781000     1.395000  0.6358000     0.4137000      1.084000  
1 1 1 12 32 23 o 1.327000  0.4314000     1.244000  0.5859000     1.409000  0.6333000     -0.1645000     0.8628000 
1 1 1 12 33 0  o 7.121000  0.2287000     7.121000  0.2287000     7.121000  0.2287000     0.000000       0.000000  
1 1 1 12 33 1  o 13.64000  0.1565000     13.53000  0.2207000     13.76000  0.2220000     -0.2257000     0.3131000 
1 1 1 12 33 2  o 4.459000  0.2116000     4.728000  0.2797000     4.190000  0.3177000     0.5379000      0.4233000 
1 1 1 12 33 3  o 22.00000  0.2003000     21.98000  0.2827000     22.01000  0.2838000     -0.3792000E-01 0.4006000 
1 1 1 12 33 4  o 23.91000  0.2127000     24.04000  0.3016000     23.77000  0.2999000     0.2682000      0.4254000 
1 1 1 12 33 5  o 4.632000  0.2152000     4.660000  0.2997000     4.604000  0.3088000     0.5544000E-01  0.4303000 
1 1 1 12 33 6  o 3.231000  0.3805000     3.139000  0.6414000     3.322000  0.4097000     -0.1837000     0.7610000 
1 1 1 12 33 7  o 15.58000  0.2695000     15.78000  0.2871000     15.37000  0.4563000     0.4140000      0.5391000 
1 1 1 12 33 8  o 7.622000  0.3263000     7.468000  0.5756000     7.776000  0.3073000     -0.3079000     0.6525000 
1 1 1 12 33 9  o 8.971000  0.1954000     9.499000  0.2948000     8.443000  0.2565000     1.056000       0.3908000 
1 1 1 12 33 10 o 9.957000  0.1806000     10.17000  0.2504000     9.745000  0.2602000     0.4221000      0.3611000 
1 1 1 12 33 11 o 4.049000  0.3245000     3.645000  0.4761000     4.453000  0.4412000     -0.8087000     0.6491000 
1 1 1 12 33 12 o 3.283000  0.4130000     3.325000  0.5369000     3.241000  0.6276000     0.8343000E-01  0.8259000 
1 1 1 12 33 13 o 5.270000  0.2913000     5.417000  0.3781000     5.123000  0.4432000     0.2940000      0.5826000 
1 1 1 12 33 14 o 5.709000  0.3075000     6.222000  0.4501000     5.197000  0.4191000     1.026000       0.6150000 
1 1 1 12 33 15 o 7.086000  0.2394000     7.156000  0.3357000     7.016000  0.3415000     0.1399000      0.4789000 
1 1 1 12 33 16 o 3.424000  0.5005000     2.319000  0.8825000     4.529000  0.4724000     -2.210000      1.001000  
1 1 1 12 33 17 o 2.473000  0.4923000     1.863000  0.7239000     3.084000  0.6673000     -1.222000      0.9845000 
1 1 1 12 33 18 f 1.774000  0.5087000     2.131000  0.8070000     1.417000  0.6196000     0.7139000      1.017000  
1 1 1 12 33 19 o 1.405000  0.4366000     0.9845000 0.4895000     1.825000  0.7232000     -0.8400000     0.8733000 
1 1 1 12 33 20 o 2.365000  0.5099000     2.650000  0.7066000     2.079000  0.7354000     0.5709000      1.020000  
1 1 1 12 33 21 f 1.586000  0.4758000     1.345000  0.6177000     1.828000  0.7237000     -0.4837000     0.9515000 
1 1 1 12 33 22 o 1.496000  0.4722000     1.296000  0.6282000     1.696000  0.7053000     -0.4001000     0.9445000 
1 1 1 12 33 23 o 1.446000  0.5116000     1.362000  0.6897000     1.531000  0.7557000     -0.1698000     1.023000  
1 1 1 12 34 0  o 8.478000  0.2590000     8.478000  0.2590000     8.478000  0.2590000     -0.000000      0.000000  
1 1 1 12 34 1  o 1.767000  0.3833000     1.346000  0.5434000     2.188000  0.5408000     -0.8419000     0.7666000 
1 1 1 12 34 2  o 20.64000  0.1928000     20.63000  0.2724000     20.66000  0.2731000     -0.2523000E-01 0.3857000 
1 1 1 12 34 3  o 16.62000  0.1725000     16.77000  0.2442000     16.47000  0.2437000     0.3015000      0.3450000 
1 1 1 12 34 4  o 4.773000  0.2107000     4.974000  0.2888000     4.571000  0.3070000     0.4030000      0.4215000 
1 1 1 12 34 5  o 8.052000  0.2036000     7.713000  0.3317000     8.391000  0.2362000     -0.6772000     0.4072000 
1 1 1 12 34 6  o 18.86000  0.2976000     18.70000  0.3030000     19.03000  0.5123000     -0.3299000     0.5952000 
1 1 1 12 34 7  o 6.100000  0.2940000     5.931000  0.4221000     6.269000  0.4094000     -0.3381000     0.5881000 
1 1 1 12 34 8  o 10.91000  0.1891000     11.08000  0.2925000     10.75000  0.2397000     0.3335000      0.3782000 
1 1 1 12 34 9  o 3.127000  0.4069000     3.497000  0.5601000     2.757000  0.5905000     0.7393000      0.8138000 
1 1 1 12 34 10 o 4.467000  0.2777000     4.151000  0.4121000     4.782000  0.3724000     -0.6315000     0.5554000 
1 1 1 12 34 11 o 14.25000  0.1937000     14.40000  0.2611000     14.10000  0.2862000     0.3022000      0.3875000 
1 1 1 12 34 12 o 1.654000  0.4749000     1.845000  0.6888000     1.464000  0.6540000     0.3807000      0.9498000 
1 1 1 12 34 13 o 5.119000  0.2993000     5.256000  0.3962000     4.983000  0.4487000     0.2732000      0.5986000 
1 1 1 12 34 14 o 5.111000  0.4044000     4.930000  0.5902000     5.293000  0.5529000     -0.3626000     0.8088000 
1 1 1 12 34 15 o 2.147000  0.5710000     1.613000  0.6875000     2.680000  0.9118000     -1.066000      1.142000  
1 1 1 12 34 16 o 3.172000  0.4776000     3.637000  0.6026000     2.708000  0.7411000     0.9295000      0.9552000 
1 1 1 12 34 17 o 1.822000  0.5015000     1.661000  0.6834000     1.982000  0.7342000     -0.3205000     1.003000  
1 1 1 12 34 18 o 1.371000  0.4410000     1.336000  0.6313000     1.406000  0.6159000     -0.6988000E-01 0.8820000 
1 1 1 12 34 19 o 1.353000  0.4389000     1.291000  0.6012000     1.416000  0.6395000     -0.1248000     0.8778000 
1 1 1 12 34 20 o 1.749000  0.5476000     1.670000  0.7167000     1.828000  0.8281000     -0.1587000     1.095000  
1 1 1 12 34 21 o 2.028000  0.5290000     2.006000  0.7262000     2.050000  0.7695000     -0.4465000E-01 1.058000  
1 1 1 12 34 22 o 1.290000  0.4235000     1.489000  0.6589000     1.092000  0.5322000     0.3962000      0.8469000 
1 1 1 12 35 0  o 10.99000  0.2198000     10.99000  0.2198000     10.99000  0.2198000     -0.000000      0.000000  
1 1 1 12 35 1  o 2.184000  0.3800000     1.763000  0.5815000     2.605000  0.4894000     -0.8419000     0.7600000 
1 1 1 12 35 2  o 6.586000  0.1767000     6.775000  0.2467000     6.398000  0.2531000     0.3769000      0.3535000 
1 1 1 12 35 3  o 7.613000  0.1676000     7.652000  0.2341000     7.574000  0.2398000     0.7721000E-01  0.3351000 
1 1 1 12 35 4  o 14.58000  0.2054000     14.64000  0.3363000     14.52000  0.2359000     0.1281000      0.4108000 
1 1 1 12 35 5  o 18.14000  0.2940000     18.02000  0.2977000     18.25000  0.5070000     -0.2278000     0.5880000 
1 1 1 12 35 6  o 12.87000  0.2191000     12.66000  0.2728000     13.09000  0.3430000     -0.4349000     0.4382000 
1 1 1 12 35 7  o 14.48000  0.2216000     14.80000  0.3709000     14.16000  0.2427000     0.6393000      0.4432000 
1 1 1 12 35 8  o 5.391000  0.2492000     5.536000  0.3795000     5.247000  0.3230000     0.2884000      0.4983000 
1 1 1 12 35 9  o 8.574000  0.2017000     8.484000  0.3078000     8.665000  0.2606000     -0.1814000     0.4033000 
1 1 1 12 35 10 o 4.838000  0.2663000     4.703000  0.3869000     4.973000  0.3659000     -0.2706000     0.5325000 
1 1 1 12 35 11 f 8.729000  0.2075000     8.983000  0.2789000     8.476000  0.3074000     0.5067000      0.4151000 
1 1 1 12 35 12 o 8.226000  0.2213000     8.404000  0.2984000     8.047000  0.3269000     0.3569000      0.4426000 
1 1 1 12 35 13 o 6.065000  0.2706000     5.848000  0.3796000     6.281000  0.3858000     -0.4331000     0.5412000 
1 1 1 12 35 14 o 4.861000  0.3701000     4.257000  0.4995000     5.464000  0.5462000     -1.207000      0.7402000 
1 1 1 12 35 15 f 5.324000  0.3940000     5.250000  0.5919000     5.398000  0.5202000     -0.1486000     0.7880000 
1 1 1 12 35 16 o 2.424000  0.5221000     2.166000  0.7363000     2.682000  0.7406000     -0.5157000     1.044000  
1 1 1 12 35 17 o 2.045000  0.5016000     2.473000  0.7331000     1.617000  0.6847000     0.8562000      1.003000  
1 1 1 12 35 18 o 2.989000  0.4448000     3.065000  0.6381000     2.913000  0.6199000     0.1514000      0.8896000 
1 1 1 12 35 19 o 1.884000  0.5077000     2.347000  0.7923000     1.420000  0.6352000     0.9263000      1.015000  
1 1 1 12 35 20 o 2.000000  0.5839000     1.814000  0.7588000     2.186000  0.8877000     -0.3725000     1.168000  
1 1 1 12 35 21 o 1.864000  0.5287000     1.510000  0.7047000     2.218000  0.7883000     -0.7078000     1.057000  
1 1 1 12 35 22 o 1.184000  0.3999000     1.233000  0.5790000     1.134000  0.5517000     0.9919000E-01  0.7997000 
1 1 1 12 36 0  o 8.773000  0.2276000     8.773000  0.2276000     8.773000  0.2276000     0.000000       0.000000  
1 1 1 12 36 1  f 9.721000  0.1598000     9.950000  0.2272000     9.492000  0.2248000     0.4578000      0.3196000 
1 1 1 12 36 2  o 3.779000  0.2833000     4.030000  0.4090000     3.527000  0.3921000     0.5030000      0.5666000 
1 1 1 12 36 3  o 8.782000  0.2329000     8.922000  0.3326000     8.641000  0.3262000     0.2809000      0.4659000 
1 1 1 12 36 4  o 11.76000  0.2332000     11.76000  0.2332000     ?         ?             ?              ?         
1 1 1 12 36 5  o 17.23000  0.2342000     17.19000  0.3587000     17.27000  0.3013000     -0.7112000E-01 0.4684000 
1 1 1 12 36 6  o 7.004000  0.2065000     7.125000  0.3139000     6.882000  0.2686000     0.2422000      0.4131000 
1 1 1 12 36 7  o 7.564000  0.2034000     7.596000  0.3111000     7.533000  0.2621000     0.6367000E-01  0.4068000 
1 1 1 12 36 8  o 2.071000  0.4551000     1.632000  0.6745000     2.511000  0.6111000     -0.8795000     0.9102000 
1 1 1 12 36 9  o 12.74000  0.1952000     12.29000  0.2975000     13.20000  0.2527000     -0.9055000     0.3903000 
1 1 1 12 36 10 o 8.259000  0.1967000     8.155000  0.2793000     8.363000  0.2771000     -0.2081000     0.3935000 
1 1 1 12 36 11 f 13.89000  0.1973000     13.73000  0.2656000     14.05000  0.2919000     -0.3219000     0.3947000 
1 1 1 12 36 12 o 6.279000  0.2576000     6.337000  0.3465000     6.220000  0.3812000     0.1169000      0.5151000 
1 1 1 12 36 13 f 1.883000  0.5463000     2.179000  0.8405000     1.588000  0.6980000     0.5908000      1.093000  
1 1 1 12 36 14 o 4.030000  0.4116000     3.904000  0.5232000     4.156000  0.6354000     -0.2511000     0.8231000 
1 1 1 12 36 15 o 3.522000  0.4808000     3.452000  0.7655000     3.593000  0.5820000     -0.1412000     0.9616000 
1 1 1 12 36 16 o 1.988000  0.5121000     2.231000  0.7369000     1.746000  0.7112000     0.4847000      1.024000  
1 1 1 12 36 17 o 4.787000  0.3161000     4.439000  0.4694000     5.135000  0.4234000     -0.6966000     0.6321000 
1 1 1 12 36 18 o 3.941000  0.3509000     3.573000  0.5291000     4.309000  0.4611000     -0.7357000     0.7018000 
1 1 1 12 36 19 o 3.285000  0.4402000     3.859000  0.6224000     2.711000  0.6226000     1.148000       0.8803000 
1 1 1 12 36 20 o 1.330000  0.4261000     1.651000  0.6904000     1.009000  0.4995000     0.6422000      0.8521000 
1 1 1 12 36 21 f 1.537000  0.5148000     1.619000  0.7986000     1.454000  0.6497000     0.1657000      1.030000  
1 1 1 12 36 22 o 1.181000  0.4000000     1.233000  0.5839000     1.128000  0.5470000     0.1048000      0.8001000 
1 1 1 12 37 0  o 5.211000  0.5978000     5.211000  0.5978000     5.211000  0.5978000     0.000000       0.000000  
1 1 1 12 37 1  o 15.13000  0.3473000     15.19000  0.4856000     15.07000  0.4966000     0.1146000      0.6946000 
1 1 1 12 37 2  o 16.31000  0.3476000     16.31000  0.3476000     ?         ?             ?              ?         
1 1 1 12 37 3  o 7.500000  0.2496000     7.588000  0.3391000     7.413000  0.3665000     0.1749000      0.4993000 
1 1 1 12 37 4  o 8.857000  0.2034000     8.806000  0.3300000     8.907000  0.2380000     -0.1014000     0.4069000 
1 1 1 12 37 5  o 13.55000  0.1697000     13.55000  0.2398000     13.55000  0.2402000     -0.4051000E-02 0.3394000 
1 1 1 12 37 6  o 10.96000  0.1705000     11.03000  0.2405000     10.88000  0.2419000     0.1559000      0.3411000 
1 1 1 12 37 7  o 7.255000  0.2128000     7.439000  0.3212000     7.070000  0.2792000     0.3693000      0.4256000 
1 1 1 12 37 8  o 4.964000  0.2695000     5.082000  0.4056000     4.847000  0.3550000     0.2343000      0.5390000 
1 1 1 12 37 9  o 2.948000  0.4459000     2.653000  0.7066000     3.242000  0.5441000     -0.5889000     0.8918000 
1 1 1 12 37 10 o 1.873000  0.4855000     1.634000  0.6662000     2.112000  0.7063000     -0.4781000     0.9709000 
1 1 1 12 37 11 o 6.266000  0.2449000     6.084000  0.3545000     6.448000  0.3381000     -0.3642000     0.4899000 
1 1 1 12 37 12 o 2.312000  0.4686000     3.090000  0.6517000     1.535000  0.6735000     1.555000       0.9371000 
1 1 1 12 37 13 o 1.976000  0.5506000     1.501000  0.6628000     2.450000  0.8795000     -0.9492000     1.101000  
1 1 1 12 37 14 o 9.007000  0.3224000     8.815000  0.3452000     9.200000  0.5446000     -0.3856000     0.6448000 
1 1 1 12 37 15 o 3.078000  0.4687000     3.307000  0.6314000     2.849000  0.6928000     0.4581000      0.9373000 
1 1 1 12 37 16 o 4.581000  0.3370000     4.621000  0.4708000     4.541000  0.4822000     0.7992000E-01  0.6739000 
1 1 1 12 37 17 o 5.407000  0.2799000     5.473000  0.3907000     5.340000  0.4009000     0.1333000      0.5598000 
1 1 1 12 37 18 o 1.323000  0.4187000     1.337000  0.5954000     1.310000  0.5888000     0.2768000E-01  0.8374000 
1 1 1 12 37 19 o 1.831000  0.5176000     1.844000  0.7836000     1.818000  0.6765000     0.2599000E-01  1.035000  
1 1 1 12 37 20 o 2.200000  0.5357000     1.946000  0.7217000     2.455000  0.7919000     -0.5096000     1.071000  
1 1 1 12 37 21 o 1.266000  0.4190000     1.206000  0.5731000     1.326000  0.6114000     -0.1196000     0.8380000 
1 1 1 12 38 0  o 17.38000  0.2948000     17.38000  0.2948000     17.38000  0.2948000     -0.000000      0.000000  
1 1 1 12 38 1  o 14.39000  0.1948000     14.68000  0.2774000     14.10000  0.2736000     0.5763000      0.3896000 
1 1 1 12 38 2  o 5.082000  0.2393000     4.737000  0.3746000     5.428000  0.2980000     -0.6908000     0.4787000 
1 1 1 12 38 3  o 5.883000  0.2002000     5.963000  0.2829000     5.804000  0.2834000     0.1592000      0.4004000 
1 1 1 12 38 4  o 10.82000  0.1668000     11.03000  0.2339000     10.61000  0.2379000     0.4238000      0.3336000 
1 1 1 12 38 5  o 10.81000  0.1708000     10.81000  0.2406000     10.82000  0.2426000     -0.1377000E-01 0.3417000 
1 1 1 12 38 6  o 12.91000  0.1734000     12.60000  0.2444000     13.22000  0.2460000     -0.6201000     0.3467000 
1 1 1 12 38 7  o 16.65000  0.2021000     16.60000  0.3066000     16.70000  0.2634000     -0.1031000     0.4042000 
1 1 1 12 38 8  o 3.892000  0.3455000     3.559000  0.5508000     4.224000  0.4173000     -0.6648000     0.6910000 
1 1 1 12 38 9  o 5.636000  0.2688000     5.441000  0.4233000     5.831000  0.3314000     -0.3899000     0.5376000 
1 1 1 12 38 10 f 6.970000  0.2201000     7.183000  0.3106000     6.758000  0.3119000     0.4254000      0.4401000 
1 1 1 12 38 11 o 7.640000  0.2206000     7.475000  0.3165000     7.805000  0.3075000     -0.3298000     0.4413000 
1 1 1 12 38 12 o 7.678000  0.2766000     7.633000  0.4333000     7.722000  0.3438000     -0.8854000E-01 0.5532000 
1 1 1 12 38 13 o 3.382000  0.4809000     4.267000  0.5020000     2.498000  0.8204000     1.770000       0.9618000 
1 1 1 12 38 14 o 3.040000  0.5417000     3.085000  0.8027000     2.996000  0.7277000     0.8937000E-01  1.083000  
1 1 1 12 38 15 f 1.783000  0.4953000     1.514000  0.6547000     2.052000  0.7434000     -0.5376000     0.9906000 
1 1 1 12 38 16 o 4.595000  0.3224000     4.647000  0.4443000     4.543000  0.4674000     0.1034000      0.6449000 
1 1 1 12 38 17 o 1.748000  0.4878000     1.816000  0.6873000     1.681000  0.6922000     0.1356000      0.9755000 
1 1 1 12 38 18 o 1.609000  0.4632000     1.472000  0.6336000     1.746000  0.6758000     -0.2743000     0.9263000 
1 1 1 12 38 19 o 1.394000  0.4450000     1.386000  0.6149000     1.402000  0.6435000     -0.1551000E-01 0.8900000 
1 1 1 12 38 20 o 1.356000  0.4516000     1.521000  0.6956000     1.192000  0.5760000     0.3282000      0.9031000 
1 1 1 12 38 21 o 1.842000  0.5080000     1.730000  0.6966000     1.955000  0.7397000     -0.2247000     1.016000  
1 1 1 12 39 0  o 14.69000  0.2426000     14.69000  0.2426000     14.69000  0.2426000     0.000000       0.000000  
1 1 1 12 39 1  o 2.716000  0.3778000     1.995000  0.6281000     3.437000  0.4199000     -1.441000      0.7556000 
1 1 1 12 39 2  o 3.532000  0.3065000     3.221000  0.4673000     3.844000  0.3968000     -0.6230000     0.6130000 
1 1 1 12 39 3  o 6.133000  0.2007000     6.221000  0.2779000     6.045000  0.2896000     0.1762000      0.4014000 
1 1 1 12 39 4  o 11.26000  0.1699000     11.41000  0.2405000     11.10000  0.2399000     0.3101000      0.3397000 
1 1 1 12 39 5  o 1.819000  0.4530000     1.951000  0.6422000     1.688000  0.6392000     0.2627000      0.9061000 
1 1 1 12 39 6  o 15.77000  0.1811000     15.67000  0.2555000     15.88000  0.2565000     -0.2164000     0.3621000 
1 1 1 12 39 7  o 10.97000  0.1945000     10.73000  0.2991000     11.20000  0.2488000     -0.4697000     0.3890000 
1 1 1 12 39 8  o 9.923000  0.1989000     10.03000  0.3023000     9.821000  0.2586000     0.2044000      0.3978000 
1 1 1 12 39 9  o 4.711000  0.3238000     4.225000  0.5249000     5.197000  0.3793000     -0.9720000     0.6475000 
1 1 1 12 39 10 o 8.704000  0.2056000     8.937000  0.2918000     8.472000  0.2897000     0.4649000      0.4112000 
1 1 1 12 39 11 o 6.379000  0.2481000     6.304000  0.3553000     6.455000  0.3464000     -0.1507000     0.4962000 
1 1 1 12 39 12 o 5.126000  0.3631000     5.489000  0.4028000     4.763000  0.6043000     0.7264000      0.7262000 
1 1 1 12 39 13 o 3.199000  0.6074000     2.384000  0.7821000     4.014000  0.9297000     -1.630000      1.215000  
1 1 1 12 39 14 o 5.659000  0.2943000     5.919000  0.3793000     5.399000  0.4501000     0.5199000      0.5886000 
1 1 1 12 39 15 o 4.111000  0.3792000     3.668000  0.5910000     4.554000  0.4753000     -0.8870000     0.7584000 
1 1 1 12 39 16 o 4.102000  0.3626000     4.061000  0.5276000     4.144000  0.4975000     -0.8253000E-01 0.7251000 
1 1 1 12 39 17 o 1.931000  0.4910000     1.685000  0.6723000     2.177000  0.7159000     -0.4916000     0.9821000 
1 1 1 12 39 18 o 2.342000  0.4811000     2.659000  0.6656000     2.025000  0.6950000     0.6338000      0.9623000 
1 1 1 12 39 19 o 1.723000  0.4792000     1.639000  0.6648000     1.807000  0.6904000     -0.1679000     0.9585000 
1 1 1 12 39 20 o 1.495000  0.5050000     1.739000  0.8360000     1.252000  0.5668000     0.4875000      1.010000  
1 1 1 12 39 21 f 1.031000  0.3594000     0.9855000 0.4888000     1.076000  0.5270000     -0.9040000E-01 0.7188000 
1 1 1 12 40 0  o 9.887000  0.2424000     9.887000  0.2424000     9.887000  0.2424000     0.000000       0.000000  
1 1 1 12 40 1  o 6.774000  0.1944000     6.415000  0.2846000     7.132000  0.2649000     -0.7171000     0.3888000 
1 1 1 12 40 2  o 10.35000  0.1706000     10.49000  0.2401000     10.20000  0.2424000     0.2989000      0.3412000 
1 1 1 12 40 3  o 8.669000  0.1776000     9.205000  0.2444000     8.134000  0.2578000     1.072000       0.3553000 
1 1 1 12 40 4  o 13.25000  0.1738000     13.46000  0.2447000     13.03000  0.2467000     0.4262000      0.3475000 
1 1 1 12 40 5  o 14.02000  0.1769000     13.81000  0.2486000     14.22000  0.2517000     -0.4133000     0.3537000 
1 1 1 12 40 6  o 9.535000  0.1791000     9.459000  0.2553000     9.610000  0.2513000     -0.1515000     0.3582000 
1 1 1 12 40 7  o 5.071000  0.2597000     4.744000  0.3951000     5.398000  0.3370000     -0.6539000     0.5193000 
1 1 1 12 40 8  o 4.493000  0.3277000     4.577000  0.5097000     4.410000  0.4119000     0.1670000      0.6553000 
1 1 1 12 40 9  o 4.455000  0.3252000     4.318000  0.5033000     4.592000  0.4121000     -0.2746000     0.6505000 
1 1 1 12 40 10 f 2.608000  0.4988000     2.173000  0.7623000     3.042000  0.6434000     -0.8692000     0.9975000 
1 1 1 12 40 11 o 1.812000  0.5355000     1.675000  0.7474000     1.949000  0.7670000     -0.2740000     1.071000  
1 1 1 12 40 12 o 2.812000  0.6133000     2.799000  0.7251000     2.824000  0.9892000     -0.2456000E-01 1.227000  
1 1 1 12 40 13 o 4.695000  0.3809000     4.686000  0.5751000     4.703000  0.4996000     -0.1755000E-01 0.7618000 
1 1 1 12 40 14 o 1.996000  0.5236000     2.097000  0.7289000     1.895000  0.7519000     0.2023000      1.047000  
1 1 1 12 40 15 o 1.791000  0.5052000     1.948000  0.7290000     1.634000  0.6997000     0.3142000      1.010000  
1 1 1 12 40 16 f 2.615000  0.4869000     2.111000  0.7390000     3.119000  0.6341000     -1.009000      0.9738000 
1 1 1 12 40 17 o 3.083000  0.4396000     3.094000  0.6253000     3.072000  0.6180000     0.2188000E-01  0.8792000 
1 1 1 12 40 18 o 1.606000  0.4988000     1.976000  0.8158000     1.236000  0.5742000     0.7398000      0.9977000 
1 1 1 12 40 19 o 1.748000  0.4875000     1.775000  0.6846000     1.720000  0.6943000     0.5525000E-01  0.9751000 
1 1 1 12 40 20 o 1.852000  0.4903000     1.834000  0.6929000     1.871000  0.6939000     -0.3650000E-01 0.9806000 
1 1 1 12 40 21 o 1.061000  0.3838000     1.016000  0.5205000     1.107000  0.5641000     -0.9154000E-01 0.7675000 
1 1 1 12 41 0  o 7.156000  0.2805000     7.156000  0.2805000     7.156000  0.2805000     0.000000       0.000000  
1 1 1 12 41 1  o 4.602000  0.2560000     4.332000  0.3782000     4.873000  0.3451000     -0.5405000     0.5120000 
1 1 1 12 41 2  o 6.115000  0.2108000     5.829000  0.3017000     6.402000  0.2945000     -0.5736000     0.4216000 
1 1 1 12 41 3  o 1.289000  0.4029000     1.275000  0.5666000     1.302000  0.5730000     -0.2689000E-01 0.8058000 
1 1 1 12 41 4  o 8.981000  0.1806000     9.059000  0.2545000     8.902000  0.2563000     0.1570000      0.3612000 
1 1 1 12 41 5  o 7.800000  0.1922000     7.830000  0.2698000     7.770000  0.2737000     0.5983000E-01  0.3843000 
1 1 1 12 41 6  o 1.816000  0.4464000     1.349000  0.5923000     2.283000  0.6680000     -0.9336000     0.8928000 
1 1 1 12 41 7  o 5.484000  0.2487000     5.812000  0.3401000     5.157000  0.3629000     0.6549000      0.4974000 
1 1 1 12 41 8  o 9.342000  0.2114000     9.208000  0.3277000     9.476000  0.2672000     -0.2680000     0.4228000 
1 1 1 12 41 9  o 9.614000  0.2198000     9.381000  0.3437000     9.848000  0.2741000     -0.4672000     0.4397000 
1 1 1 12 41 10 o 1.355000  0.4410000     1.619000  0.7070000     1.091000  0.5273000     0.5277000      0.8820000 
1 1 1 12 41 11 o 5.681000  0.3393000     6.016000  0.3882000     5.346000  0.5566000     0.6702000      0.6786000 
1 1 1 12 41 12 o 2.225000  0.5999000     2.377000  0.9006000     2.072000  0.7929000     0.3051000      1.200000  
1 1 1 12 41 13 o 2.342000  0.5252000     2.612000  0.7207000     2.072000  0.7641000     0.5403000      1.050000  
1 1 1 12 41 14 o 4.267000  0.3830000     5.139000  0.4261000     3.394000  0.6366000     1.745000       0.7660000 
1 1 1 12 41 15 o 2.351000  0.5157000     2.657000  0.7110000     2.044000  0.7472000     0.6128000      1.031000  
1 1 1 12 41 16 o 2.588000  0.4813000     3.207000  0.6458000     1.968000  0.7138000     1.239000       0.9626000 
1 1 1 12 41 17 o 1.273000  0.4162000     1.295000  0.5953000     1.251000  0.5817000     0.4411000E-01  0.8323000 
1 1 1 12 41 18 o 1.424000  0.4537000     1.299000  0.5910000     1.549000  0.6884000     -0.2493000     0.9073000 
1 1 1 12 41 19 o 1.756000  0.5202000     1.424000  0.6315000     2.088000  0.8268000     -0.6639000     1.040000  
1 1 1 12 41 20 o 1.324000  0.4210000     1.261000  0.5792000     1.387000  0.6111000     -0.1257000     0.8419000 
1 1 1 12 42 0  o 1.665000  0.8015000     1.665000  0.8015000     1.665000  0.8015000     -0.000000      0.000000  
1 1 1 12 42 1  o 6.849000  0.2003000     7.036000  0.2784000     6.663000  0.2882000     0.3731000      0.4007000 
1 1 1 12 42 2  o 6.088000  0.2159000     5.879000  0.3070000     6.297000  0.3037000     -0.4179000     0.4318000 
1 1 1 12 42 3  o 13.14000  0.1894000     13.05000  0.2470000     13.23000  0.2871000     -0.1811000     0.3787000 
1 1 1 12 42 4  o 8.704000  0.1848000     8.577000  0.2631000     8.830000  0.2596000     -0.2526000     0.3696000 
1 1 1 12 42 5  o 4.898000  0.2572000     4.853000  0.3617000     4.943000  0.3658000     -0.9016000E-01 0.5144000 
1 1 1 12 42 6  o 12.61000  0.1813000     12.83000  0.2558000     12.38000  0.2571000     0.4544000      0.3626000 
1 1 1 12 42 7  o 10.38000  0.1888000     10.18000  0.2700000     10.58000  0.2641000     -0.4014000     0.3777000 
1 1 1 12 42 8  o 4.968000  0.3085000     4.999000  0.4726000     4.938000  0.3967000     0.6145000E-01  0.6170000 
1 1 1 12 42 9  o 7.708000  0.2366000     7.793000  0.3590000     7.622000  0.3081000     0.1708000      0.4731000 
1 1 1 12 42 10 o 5.371000  0.4041000     4.897000  0.6326000     5.846000  0.5030000     -0.9496000     0.8082000 
1 1 1 12 42 11 o 7.480000  0.3075000     8.116000  0.3609000     6.844000  0.4980000     1.272000       0.6151000 
1 1 1 12 42 12 o 1.187000  0.4010000     1.199000  0.5743000     1.174000  0.5599000     0.2510000E-01  0.8020000 
1 1 1 12 42 13 o 6.610000  0.2919000     6.935000  0.4238000     6.286000  0.4015000     0.6492000      0.5838000 
1 1 1 12 42 14 o 4.604000  0.3459000     4.268000  0.5011000     4.940000  0.4768000     -0.6717000     0.6917000 
1 1 1 12 42 15 o 1.883000  0.4923000     2.286000  0.7291000     1.479000  0.6616000     0.8068000      0.9845000 
1 1 1 12 42 16 o 2.581000  0.4870000     2.115000  0.7387000     3.046000  0.6347000     -0.9312000     0.9739000 
1 1 1 12 42 17 o 2.840000  0.5635000     2.919000  0.8870000     2.760000  0.6952000     0.1593000      1.127000  
1 1 1 12 42 18 o 1.369000  0.4239000     1.686000  0.6766000     1.052000  0.5109000     0.6344000      0.8478000 
1 1 1 12 42 19 o 1.728000  0.4825000     1.466000  0.6618000     1.990000  0.7024000     -0.5241000     0.9651000 
1 1 1 12 42 20 o 3.281000  0.4163000     2.773000  0.6518000     3.789000  0.5179000     -1.016000      0.8325000 
1 1 1 12 43 0  o 1.233000  0.7284000     1.233000  0.7284000     1.233000  0.7284000     -0.000000      0.000000  
1 1 1 12 43 1  o 7.004000  0.2044000     7.166000  0.2828000     6.842000  0.2951000     0.3238000      0.4088000 
1 1 1 12 43 2  o 2.934000  0.4016000     3.024000  0.5431000     2.845000  0.5918000     0.1788000      0.8033000 
1 1 1 12 43 3  o 1.254000  0.4017000     1.249000  0.5674000     1.259000  0.5690000     -0.1020000E-01 0.8035000 
1 1 1 12 43 4  o 6.002000  0.2272000     6.001000  0.3200000     6.004000  0.3226000     -0.2227000E-02 0.4544000 
1 1 1 12 43 5  o 7.896000  0.1994000     7.933000  0.2823000     7.860000  0.2816000     0.7282000E-01  0.3988000 
1 1 1 12 43 6  o 4.896000  0.2744000     5.024000  0.3746000     4.768000  0.4010000     0.2550000      0.5488000 
1 1 1 12 43 7  o 6.211000  0.2425000     5.956000  0.3554000     6.466000  0.3300000     -0.5102000     0.4850000 
1 1 1 12 43 8  o 3.094000  0.4843000     2.753000  0.7866000     3.434000  0.5652000     -0.6809000     0.9686000 
1 1 1 12 43 9  o 4.835000  0.3966000     4.963000  0.6108000     4.708000  0.5061000     0.2547000      0.7932000 
1 1 1 12 43 10 o 3.784000  0.5018000     3.830000  0.6395000     3.739000  0.7736000     0.9111000E-01  1.004000  
1 1 1 12 43 11 o 5.975000  0.3079000     6.136000  0.4854000     5.814000  0.3791000     0.3227000      0.6159000 
1 1 1 12 43 12 o 4.148000  0.3580000     4.127000  0.5131000     4.169000  0.4995000     -0.4121000E-01 0.7160000 
1 1 1 12 43 13 o 5.178000  0.3117000     5.333000  0.4178000     5.023000  0.4625000     0.3095000      0.6233000 
1 1 1 12 43 14 o 4.575000  0.3566000     3.856000  0.5562000     5.295000  0.4463000     -1.439000      0.7131000 
1 1 1 12 43 15 o 3.947000  0.3862000     4.046000  0.5157000     3.848000  0.5751000     0.1978000      0.7725000 
1 1 1 12 43 16 o 3.644000  0.3949000     3.737000  0.5273000     3.551000  0.5881000     0.1860000      0.7899000 
1 1 1 12 43 17 o 1.420000  0.4726000     1.562000  0.7202000     1.278000  0.6121000     0.2832000      0.9452000 
1 1 1 12 43 18 o 2.014000  0.5544000     1.640000  0.6822000     2.388000  0.8741000     -0.7476000     1.109000  
1 1 1 12 43 19 f 1.227000  0.4029000     1.258000  0.5777000     1.197000  0.5618000     0.6099000E-01  0.8059000 
1 1 1 12 44 0  o 1.122000  0.6938000     1.122000  0.6938000     1.122000  0.6938000     0.000000       0.000000  
1 1 1 12 44 1  o 4.221000  0.2939000     4.494000  0.3922000     3.947000  0.4378000     0.5461000      0.5878000 
1 1 1 12 44 2  o 7.358000  0.2030000     7.337000  0.2867000     7.379000  0.2876000     -0.4241000E-01 0.4061000 
1 1 1 12 44 3  o 5.342000  0.2502000     5.238000  0.3542000     5.447000  0.3534000     -0.2093000     0.5003000 
1 1 1 12 44 4  o 5.173000  0.2579000     5.185000  0.3601000     5.160000  0.3693000     0.2471000E-01  0.5158000 
1 1 1 12 44 5  o 6.930000  0.2181000     7.028000  0.3074000     6.832000  0.3094000     0.1959000      0.4361000 
1 1 1 12 44 6  o 2.652000  0.4694000     2.737000  0.6540000     2.567000  0.6735000     0.1699000      0.9388000 
1 1 1 12 44 7  o 1.872000  0.4764000     2.345000  0.7199000     1.398000  0.6243000     0.9463000      0.9529000 
1 1 1 12 44 8  o 1.375000  0.4506000     1.333000  0.6460000     1.417000  0.6284000     -0.8407000E-01 0.9013000 
1 1 1 12 44 9  o 4.050000  0.5542000     3.941000  0.6352000     4.158000  0.9082000     -0.2168000     1.108000  
1 1 1 12 44 10 o 9.232000  0.3593000     9.710000  0.6473000     8.754000  0.3121000     0.9560000      0.7186000 
1 1 1 12 44 11 o 3.887000  0.3815000     3.986000  0.5334000     3.788000  0.5455000     0.1981000      0.7629000 
1 1 1 12 44 12 o 6.112000  0.2596000     5.982000  0.3744000     6.242000  0.3598000     -0.2593000     0.5193000 
1 1 1 12 44 13 o 1.423000  0.4555000     1.433000  0.6423000     1.412000  0.6461000     0.2083000E-01  0.9111000 
1 1 1 12 44 14 o 2.176000  0.5039000     2.578000  0.7060000     1.774000  0.7191000     0.8045000      1.008000  
1 1 1 12 44 15 o 2.926000  0.4749000     2.137000  0.7281000     3.716000  0.6098000     -1.579000      0.9498000 
1 1 1 12 44 16 o 2.135000  0.5206000     2.314000  0.7350000     1.956000  0.7373000     0.3581000      1.041000  
1 1 1 12 44 17 o 2.330000  0.5282000     2.109000  0.7262000     2.552000  0.7672000     -0.4437000     1.056000  
1 1 1 12 44 18 o 1.166000  0.3967000     1.175000  0.5697000     1.158000  0.5522000     0.1670000E-01  0.7934000 
1 1 1 12 44 19 o 1.389000  0.4371000     1.483000  0.6385000     1.296000  0.5970000     0.1868000      0.8741000 
1 1 1 12 45 0  o 5.342000  0.3511000     5.342000  0.3511000     5.342000  0.3511000     0.000000       0.000000  
1 1 1 12 45 1  o 4.820000  0.2751000     5.077000  0.3725000     4.564000  0.4051000     0.5125000      0.5503000 
1 1 1 12 45 2  o 3.844000  0.3323000     3.802000  0.4784000     3.886000  0.4612000     -0.8361000E-01 0.6646000 
1 1 1 12 45 3  o 4.733000  0.2795000     4.573000  0.3989000     4.893000  0.3915000     -0.3203000     0.5589000 
1 1 1 12 45 4  o 7.007000  0.2158000     6.868000  0.3089000     7.147000  0.3015000     -0.2790000     0.4317000 
1 1 1 12 45 5  o 6.169000  0.2382000     6.160000  0.3394000     6.178000  0.3342000     -0.1794000E-01 0.4763000 
1 1 1 12 45 6  o 1.811000  0.4817000     1.527000  0.6500000     2.096000  0.7112000     -0.5693000     0.9635000 
1 1 1 12 45 7  o 2.923000  0.5422000     3.533000  0.8261000     2.314000  0.7026000     1.219000       1.084000  
1 1 1 12 45 8  o 9.930000  0.3145000     10.51000  0.3372000     9.351000  0.5309000     1.157000       0.6289000 
1 1 1 12 45 9  o 4.470000  0.5782000     4.841000  0.9910000     4.099000  0.5958000     0.7423000      1.156000  
1 1 1 12 45 10 o 1.912000  0.5196000     1.759000  0.7508000     2.065000  0.7186000     -0.3054000     1.039000  
1 1 1 12 45 11 o 4.968000  0.3047000     4.909000  0.4408000     5.028000  0.4207000     -0.1192000     0.6093000 
1 1 1 12 45 12 o 1.530000  0.4708000     1.416000  0.6379000     1.645000  0.6928000     -0.2288000     0.9417000 
1 1 1 12 45 13 o 2.752000  0.5001000     2.322000  0.7331000     3.182000  0.6804000     -0.8597000     1.000000  
1 1 1 12 45 14 o 2.040000  0.5151000     1.734000  0.6956000     2.347000  0.7600000     -0.6139000     1.030000  
1 1 1 12 45 15 o 1.800000  0.4966000     1.997000  0.7223000     1.603000  0.6816000     0.3942000      0.9931000 
1 1 1 12 45 16 o 2.038000  0.5431000     1.389000  0.6645000     2.686000  0.8593000     -1.297000      1.086000  
1 1 1 12 45 17 o 3.073000  0.5532000     3.189000  0.6098000     2.958000  0.9231000     0.2304000      1.106000  
1 1 1 12 45 18 o 1.516000  0.4523000     1.722000  0.6787000     1.310000  0.5981000     0.4127000      0.9046000 
1 1 1 12 45 19 o 1.588000  0.4680000     1.819000  0.7143000     1.357000  0.6048000     0.4614000      0.9360000 
1 1 1 12 46 0  o 11.30000  0.2615000     11.30000  0.2615000     11.30000  0.2615000     0.000000       0.000000  
1 1 1 12 46 1  o 3.116000  0.4145000     3.309000  0.5552000     2.923000  0.6156000     0.3856000      0.8290000 
1 1 1 12 46 2  o 2.316000  0.4720000     2.729000  0.6463000     1.903000  0.6880000     0.8266000      0.9440000 
1 1 1 12 46 3  o 7.895000  0.2079000     8.064000  0.2903000     7.726000  0.2976000     0.3383000      0.4157000 
1 1 1 12 46 4  o 7.922000  0.2098000     8.211000  0.2912000     7.634000  0.3022000     0.5771000      0.4196000 
1 1 1 12 46 5  o 4.973000  0.2875000     4.754000  0.4227000     5.192000  0.3897000     -0.4376000     0.5750000 
1 1 1 12 46 6  o 4.605000  0.3759000     4.869000  0.5955000     4.340000  0.4590000     0.5294000      0.7519000 
1 1 1 12 46 7  o 5.758000  0.3983000     5.758000  0.3983000     ?         ?             ?              ?         
1 1 1 12 46 8  o 4.125000  0.6091000     3.762000  1.103000      4.487000  0.5171000     -0.7258000     1.218000  
1 1 1 12 46 9  o 2.392000  0.4805000     1.648000  0.7288000     3.137000  0.6264000     -1.489000      0.9611000 
1 1 1 12 46 10 o 1.924000  0.5218000     1.620000  0.7557000     2.228000  0.7197000     -0.6077000     1.044000  
1 1 1 12 46 11 o 1.267000  0.4173000     1.396000  0.6309000     1.139000  0.5463000     0.2578000      0.8346000 
1 1 1 12 46 12 o 1.819000  0.4921000     1.539000  0.6644000     2.099000  0.7260000     -0.5602000     0.9841000 
1 1 1 12 46 13 o 2.196000  0.5112000     2.436000  0.7221000     1.955000  0.7239000     0.4817000      1.022000  
1 1 1 12 46 14 o 4.731000  0.3243000     4.767000  0.4426000     4.695000  0.4742000     0.7178000E-01  0.6486000 
1 1 1 12 46 15 o 2.031000  0.5139000     1.853000  0.7095000     2.210000  0.7436000     -0.3576000     1.028000  
1 1 1 12 46 16 o 1.768000  0.4970000     2.024000  0.7118000     1.513000  0.6937000     0.5108000      0.9939000 
1 1 1 12 46 17 o 1.982000  0.5662000     1.923000  0.7850000     2.040000  0.8162000     -0.1173000     1.132000  
1 1 1 12 46 18 o 2.186000  0.4802000     1.733000  0.6922000     2.639000  0.6657000     -0.9065000     0.9603000 
1 1 1 12 47 0  o 2.980000  0.6640000     2.980000  0.6640000     2.980000  0.6640000     -0.000000      0.000000  
1 1 1 12 47 1  o 3.149000  0.4222000     3.891000  0.4784000     2.407000  0.6957000     1.485000       0.8443000 
1 1 1 12 47 2  f 4.317000  0.3139000     4.208000  0.4542000     4.426000  0.4335000     -0.2183000     0.6279000 
1 1 1 12 47 3  o 7.493000  0.2167000     7.632000  0.3023000     7.353000  0.3105000     0.2788000      0.4333000 
1 1 1 12 47 4  o 6.988000  0.2475000     6.655000  0.3903000     7.321000  0.3046000     -0.6656000     0.4951000 
1 1 1 12 47 5  o 8.952000  0.2922000     8.767000  0.4322000     9.138000  0.3933000     -0.3717000     0.5844000 
1 1 1 12 47 6  o 6.383000  0.4143000     6.383000  0.4143000     ?         ?             ?              ?         
1 1 1 12 47 7  o 9.006000  0.2863000     9.038000  0.4522000     8.974000  0.3513000     0.6363000E-01  0.5726000 
1 1 1 12 47 8  f 2.115000  0.5347000     1.995000  0.7938000     2.235000  0.7166000     -0.2399000     1.069000  
1 1 1 12 47 9  o 4.902000  0.3380000     5.038000  0.5223000     4.766000  0.4292000     0.2726000      0.6760000 
1 1 1 12 47 10 o 4.956000  0.3403000     5.578000  0.4708000     4.333000  0.4916000     1.244000       0.6807000 
1 1 1 12 47 11 o 4.559000  0.3295000     4.744000  0.4618000     4.374000  0.4702000     0.3701000      0.6591000 
1 1 1 12 47 12 o 2.581000  0.4942000     2.889000  0.6660000     2.273000  0.7302000     0.6159000      0.9883000 
1 1 1 12 47 13 o 2.602000  0.5023000     2.645000  0.7051000     2.560000  0.7154000     0.8572000E-01  1.005000  
1 1 1 12 47 14 o 1.717000  0.4769000     2.041000  0.7173000     1.394000  0.6286000     0.6478000      0.9538000 
1 1 1 12 47 15 o 2.089000  0.5883000     2.146000  0.8627000     2.032000  0.8001000     0.1136000      1.177000  
1 1 1 12 47 16 o 3.355000  0.6087000     3.481000  0.5935000     3.229000  1.063000      0.2514000      1.217000  
1 1 1 12 47 17 o 1.879000  0.4873000     1.493000  0.6621000     2.266000  0.7151000     -0.7726000     0.9745000 
1 1 1 12 47 18 o 2.434000  0.5090000     2.437000  0.7163000     2.431000  0.7233000     0.6354000E-02  1.018000  
1 1 1 12 48 0  o 1.257000  0.7680000     1.257000  0.7680000     1.257000  0.7680000     -0.000000      0.000000  
1 1 1 12 48 1  o 5.892000  0.2713000     5.916000  0.4052000     5.868000  0.3609000     0.4745000E-01  0.5426000 
1 1 1 12 48 2  o 4.950000  0.3451000     5.252000  0.4655000     4.648000  0.5095000     0.6036000      0.6901000 
1 1 1 12 48 3  o 5.545000  0.3818000     6.305000  0.4973000     4.786000  0.5794000     1.519000       0.7636000 
1 1 1 12 48 4  o 1.929000  0.7674000     1.929000  0.7674000     ?         ?             ?              ?         
1 1 1 12 48 5  o 5.067000  0.4510000     5.331000  0.6071000     4.803000  0.6671000     0.5283000      0.9021000 
1 1 1 12 48 6  o 7.121000  0.2720000     6.875000  0.4409000     7.368000  0.3187000     -0.4927000     0.5440000 
1 1 1 12 48 7  o 1.448000  0.4533000     1.319000  0.6124000     1.577000  0.6685000     -0.2576000     0.9066000 
1 1 1 12 48 8  o 2.795000  0.5280000     2.948000  0.7983000     2.642000  0.6913000     0.3056000      1.056000  
1 1 1 12 48 9  o 3.029000  0.5170000     3.047000  0.8071000     3.011000  0.6463000     0.3629000E-01  1.034000  
1 1 1 12 48 10 o 2.937000  0.5114000     2.623000  0.8249000     3.252000  0.6046000     -0.6290000     1.023000  
1 1 1 12 48 11 o 2.575000  0.5069000     2.344000  0.7583000     2.807000  0.6730000     -0.4622000     1.014000  
1 1 1 12 48 12 o 4.653000  0.3194000     4.334000  0.4776000     4.972000  0.4244000     -0.6381000     0.6389000 
1 1 1 12 48 13 o 1.288000  0.4155000     1.464000  0.6361000     1.111000  0.5348000     0.3538000      0.8311000 
1 1 1 12 48 14 o 1.212000  0.4106000     1.221000  0.5921000     1.204000  0.5690000     0.1696000E-01  0.8212000 
1 1 1 12 48 15 o 3.994000  0.4206000     3.786000  0.5356000     4.201000  0.6488000     -0.4159000     0.8413000 
1 1 1 12 48 16 o 1.720000  0.5311000     1.775000  0.7547000     1.665000  0.7473000     0.1095000      1.062000  
1 1 1 12 48 17 o 2.933000  0.4816000     2.709000  0.6901000     3.157000  0.6718000     -0.4477000     0.9631000 
1 1 1 12 49 0  o 4.713000  0.9359000     4.713000  0.9359000     4.713000  0.9359000     0.000000       0.000000  
1 1 1 12 49 1  o 2.706000  0.8899000     2.706000  0.8899000     ?         ?             ?              ?         
1 1 1 12 49 2  o 7.098000  0.4827000     7.192000  0.5274000     7.004000  0.8087000     0.1883000      0.9655000 
1 1 1 12 49 3  o 6.160000  0.3836000     6.103000  0.5431000     6.218000  0.5418000     -0.1147000     0.7672000 
1 1 1 12 49 4  o 1.917000  0.5513000     2.289000  0.8817000     1.546000  0.6620000     0.7432000      1.103000  
1 1 1 12 49 5  o 3.791000  0.4096000     3.230000  0.6793000     4.353000  0.4577000     -1.122000      0.8191000 
1 1 1 12 49 6  o 2.790000  0.4973000     2.763000  0.7050000     2.817000  0.7015000     -0.5363000E-01 0.9946000 
1 1 1 12 49 7  o 2.148000  0.4883000     2.668000  0.6978000     1.628000  0.6833000     1.039000       0.9767000 
1 1 1 12 49 8  o 1.916000  0.5071000     2.127000  0.7416000     1.706000  0.6919000     0.4212000      1.014000  
1 1 1 12 49 9  f 2.048000  0.5368000     1.895000  0.7815000     2.200000  0.7360000     -0.3048000     1.074000  
1 1 1 12 49 10 f 3.581000  0.4657000     2.903000  0.7975000     4.258000  0.4811000     -1.355000      0.9314000 
1 1 1 12 49 11 o 2.227000  0.5276000     1.977000  0.7883000     2.477000  0.7016000     -0.5001000     1.055000  
1 1 1 12 49 12 o 1.303000  0.4237000     1.357000  0.6132000     1.249000  0.5849000     0.1080000      0.8474000 
1 1 1 12 49 13 o 1.768000  0.4742000     2.143000  0.7208000     1.392000  0.6164000     0.7519000      0.9484000 
1 1 1 12 49 14 o 2.078000  0.5678000     1.708000  0.7736000     2.447000  0.8314000     -0.7392000     1.136000  
1 1 1 12 49 15 o 1.333000  0.4542000     1.203000  0.5657000     1.462000  0.7107000     -0.2586000     0.9083000 
1 1 1 12 49 16 o 2.667000  0.4929000     2.294000  0.7180000     3.039000  0.6756000     -0.7449000     0.9859000 
1 1 1 12 49 17 o 1.267000  0.4156000     1.274000  0.5858000     1.260000  0.5896000     0.1319000E-01  0.8311000 
1 1 1 12 50 0  o 5.615000  0.4829000     5.615000  0.4829000     5.615000  0.4829000     0.000000       0.000000  
1 1 1 12 50 1  o 9.595000  0.2654000     9.869000  0.4160000     9.321000  0.3299000     0.5479000      0.5309000 
1 1 1 12 50 2  o 2.023000  0.4876000     1.570000  0.6737000     2.476000  0.7052000     -0.9057000     0.9753000 
1 1 1 12 50 3  o 6.726000  0.2471000     6.992000  0.3474000     6.460000  0.3515000     0.5327000      0.4943000 
1 1 1 12 50 4  o 7.946000  0.2255000     7.857000  0.3275000     8.035000  0.3102000     -0.1785000     0.4510000 
1 1 1 12 50 5  o 3.813000  0.3747000     4.241000  0.4843000     3.384000  0.5719000     0.8570000      0.7494000 
1 1 1 12 50 6  o 2.833000  0.4666000     3.262000  0.5935000     2.405000  0.7201000     0.8570000      0.9331000 
1 1 1 12 50 7  o 5.196000  0.2841000     5.140000  0.4037000     5.252000  0.3998000     -0.1120000     0.5682000 
1 1 1 12 50 8  o 7.105000  0.2457000     7.278000  0.3514000     6.931000  0.3436000     0.3472000      0.4915000 
1 1 1 12 50 9  o 5.446000  0.3214000     5.503000  0.5013000     5.389000  0.4023000     0.1146000      0.6428000 
1 1 1 12 50 10 o 1.695000  0.5042000     1.664000  0.7281000     1.726000  0.6976000     -0.6169000E-01 1.008000  
1 1 1 12 50 11 o 5.167000  0.3580000     4.420000  0.6052000     5.914000  0.3824000     -1.494000      0.7159000 
1 1 1 12 50 12 o 3.506000  0.4182000     3.747000  0.5466000     3.264000  0.6331000     0.4839000      0.8364000 
1 1 1 12 50 13 o 4.551000  0.4524000     4.034000  0.8112000     5.068000  0.4007000     -1.034000      0.9047000 
1 1 1 12 50 14 o 1.892000  0.5114000     1.318000  0.6046000     2.466000  0.8251000     -1.148000      1.023000  
1 1 1 12 50 15 o 1.292000  0.4327000     1.589000  0.7109000     0.9947000 0.4934000     0.5943000      0.8654000 
1 1 1 12 50 16 o 1.421000  0.4459000     1.387000  0.6244000     1.456000  0.6368000     -0.6914000E-01 0.8918000 
1 1 1 12 51 0  o 0.8739000 0.6035000     0.8739000 0.6035000     0.8739000 0.6035000     -0.000000      0.000000  
1 1 1 12 51 1  o 1.580000  0.4697000     1.402000  0.6271000     1.759000  0.6994000     -0.3566000     0.9394000 
1 1 1 12 51 2  o 3.862000  0.3797000     3.599000  0.5808000     4.124000  0.4893000     -0.5254000     0.7594000 
1 1 1 12 51 3  o 5.507000  0.2810000     5.277000  0.4158000     5.737000  0.3783000     -0.4600000     0.5621000 
1 1 1 12 51 4  o 3.116000  0.4465000     2.897000  0.6615000     3.335000  0.6000000     -0.4374000     0.8931000 
1 1 1 12 51 5  o 5.028000  0.2888000     5.190000  0.3895000     4.865000  0.4266000     0.3248000      0.5776000 
1 1 1 12 51 6  o 4.554000  0.3167000     4.522000  0.4431000     4.585000  0.4527000     -0.6302000E-01 0.6334000 
1 1 1 12 51 7  o 1.937000  0.5007000     1.695000  0.6905000     2.179000  0.7253000     -0.4838000     1.001000  
1 1 1 12 51 8  o 2.344000  0.5124000     2.635000  0.7208000     2.053000  0.7285000     0.5813000      1.025000  
1 1 1 12 51 9  o 1.827000  0.5003000     2.423000  0.8198000     1.230000  0.5738000     1.192000       1.001000  
1 1 1 12 51 10 o 2.935000  0.4682000     1.940000  0.7849000     3.930000  0.5109000     -1.990000      0.9365000 
1 1 1 12 51 11 o 5.148000  0.3329000     5.569000  0.4960000     4.727000  0.4442000     0.8419000      0.6658000 
1 1 1 12 51 12 o 3.384000  0.4288000     3.014000  0.6674000     3.755000  0.5386000     -0.7409000     0.8576000 
1 1 1 12 51 13 o 1.296000  0.4317000     1.423000  0.6469000     1.170000  0.5719000     0.2537000      0.8635000 
1 1 1 12 51 14 o 2.865000  0.5827000     3.168000  0.7141000     2.562000  0.9211000     0.6062000      1.165000  
1 1 1 12 51 15 o 1.266000  0.4168000     1.131000  0.5426000     1.401000  0.6328000     -0.2702000     0.8336000 
1 1 1 12 51 16 o 2.425000  0.5110000     2.036000  0.7222000     2.813000  0.7232000     -0.7774000     1.022000  
1 1 1 12 52 0  f 3.386000  0.6062000     3.386000  0.6062000     3.386000  0.6062000     0.000000       0.000000  
1 1 1 12 52 1  o 7.462000  0.2261000     7.376000  0.3156000     7.549000  0.3238000     -0.1734000     0.4522000 
1 1 1 12 52 2  o 2.517000  0.4942000     2.578000  0.6884000     2.456000  0.7094000     0.1222000      0.9885000 
1 1 1 12 52 3  o 6.406000  0.2476000     6.632000  0.3425000     6.181000  0.3576000     0.4511000      0.4951000 
1 1 1 12 52 4  o 8.187000  0.2213000     8.294000  0.3126000     8.080000  0.3134000     0.2142000      0.4426000 
1 1 1 12 52 5  o 6.356000  0.2483000     6.062000  0.3600000     6.649000  0.3420000     -0.5867000     0.4966000 
1 1 1 12 52 6  o 6.551000  0.2460000     6.458000  0.3488000     6.645000  0.3471000     -0.1875000     0.4921000 
1 1 1 12 52 7  o 2.594000  0.4542000     1.727000  0.6954000     3.461000  0.5846000     -1.733000      0.9085000 
1 1 1 12 52 8  o 3.702000  0.4038000     3.341000  0.6322000     4.063000  0.5024000     -0.7227000     0.8076000 
1 1 1 12 52 9  o 2.036000  0.5422000     2.121000  0.8115000     1.951000  0.7194000     0.1697000      1.084000  
1 1 1 12 52 10 o 2.196000  0.4813000     1.470000  0.6788000     2.921000  0.6824000     -1.451000      0.9626000 
1 1 1 12 52 11 o 4.162000  0.4435000     3.358000  0.7708000     4.967000  0.4388000     -1.609000      0.8869000 
1 1 1 12 52 12 o 2.330000  0.5885000     2.304000  0.8829000     2.356000  0.7784000     -0.5111000E-01 1.177000  
1 1 1 12 52 13 o 3.204000  0.5432000     3.630000  0.5695000     2.779000  0.9251000     0.8511000      1.086000  
1 1 1 12 52 14 o 1.791000  0.5039000     1.755000  0.7274000     1.826000  0.6976000     -0.7067000E-01 1.008000  
1 1 1 12 52 15 o 1.496000  0.4569000     1.170000  0.5551000     1.823000  0.7258000     -0.6527000     0.9138000 
1 1 1 12 53 0  o 2.673000  0.7827000     2.673000  0.7827000     2.673000  0.7827000     -0.000000      0.000000  
1 1 1 12 53 1  o 5.588000  0.2680000     5.285000  0.3977000     5.890000  0.3593000     -0.6056000     0.5360000 
1 1 1 12 53 2  o 7.055000  0.2383000     7.002000  0.3369000     7.109000  0.3372000     -0.1075000     0.4767000 
1 1 1 12 53 3  o 5.571000  0.2789000     5.172000  0.4184000     5.970000  0.3690000     -0.7979000     0.5579000 
1 1 1 12 53 4  o 2.215000  0.5006000     1.840000  0.7117000     2.591000  0.7042000     -0.7514000     1.001000  
1 1 1 12 53 5  o 4.807000  0.3049000     4.663000  0.4441000     4.950000  0.4177000     -0.2874000     0.6097000 
1 1 1 12 53 6  o 2.608000  0.4971000     2.604000  0.7043000     2.612000  0.7017000     -0.7983000E-02 0.9942000 
1 1 1 12 53 7  o 1.721000  0.4817000     1.938000  0.7023000     1.504000  0.6595000     0.4345000      0.9634000 
1 1 1 12 53 8  o 2.822000  0.4844000     2.822000  0.6803000     2.823000  0.6896000     -0.7279000E-03 0.9687000 
1 1 1 12 53 9  o 1.555000  0.4826000     1.774000  0.7509000     1.337000  0.6065000     0.4371000      0.9653000 
1 1 1 12 53 10 o 1.849000  0.5078000     2.338000  0.8090000     1.360000  0.6140000     0.9778000      1.016000  
1 1 1 12 53 11 o 2.752000  0.5697000     3.488000  0.8748000     2.017000  0.7299000     1.471000       1.139000  
1 1 1 12 53 12 o 1.369000  0.4511000     1.340000  0.6147000     1.398000  0.6603000     -0.5805000E-01 0.9022000 
1 1 1 12 53 13 f 1.223000  0.4111000     1.125000  0.5563000     1.321000  0.6053000     -0.1961000     0.8221000 
1 1 1 12 53 14 o 3.452000  0.4329000     4.369000  0.4822000     2.536000  0.7190000     1.833000       0.8657000 
1 1 1 12 53 15 o 1.306000  0.4197000     1.548000  0.6593000     1.063000  0.5194000     0.4844000      0.8393000 
1 1 1 12 54 0  f 2.567000  0.8227000     2.567000  0.8227000     2.567000  0.8227000     0.000000       0.000000  
1 1 1 12 54 1  o 3.047000  0.4476000     2.957000  0.6613000     3.137000  0.6034000     -0.1805000     0.8952000 
1 1 1 12 54 2  o 3.460000  0.4334000     2.659000  0.7131000     4.261000  0.4927000     -1.602000      0.8668000 
1 1 1 12 54 3  o 3.958000  0.3643000     4.266000  0.4733000     3.650000  0.5538000     0.6160000      0.7285000 
1 1 1 12 54 4  o 2.144000  0.4956000     2.475000  0.7035000     1.812000  0.6983000     0.6627000      0.9912000 
1 1 1 12 54 5  o 3.664000  0.3899000     3.976000  0.5017000     3.353000  0.5970000     0.6234000      0.7798000 
1 1 1 12 54 6  o 2.005000  0.5012000     1.746000  0.6976000     2.263000  0.7197000     -0.5166000     1.002000  
1 1 1 12 54 7  o 1.954000  0.5037000     2.076000  0.7201000     1.831000  0.7045000     0.2456000      1.007000  
1 1 1 12 54 8  f 1.978000  0.5126000     1.774000  0.7027000     2.181000  0.7465000     -0.4073000     1.025000  
1 1 1 12 54 9  o 1.784000  0.5056000     2.275000  0.8175000     1.292000  0.5951000     0.9822000      1.011000  
1 1 1 12 54 10 o 1.540000  0.4898000     1.986000  0.8240000     1.095000  0.5296000     0.8914000      0.9795000 
1 1 1 12 54 11 o 1.903000  0.5436000     2.324000  0.8175000     1.482000  0.7168000     0.8425000      1.087000  
1 1 1 12 54 12 o 1.991000  0.5587000     2.108000  0.8164000     1.875000  0.7628000     0.2330000      1.117000  
1 1 1 12 54 13 f 1.593000  0.4708000     1.605000  0.6747000     1.580000  0.6570000     0.2487000E-01  0.9417000 
1 1 1 12 54 14 o 1.129000  0.3836000     1.149000  0.5504000     1.109000  0.5346000     0.4078000E-01  0.7673000 
1 1 1 12 55 0  o 3.034000  0.7009000     3.034000  0.7009000     3.034000  0.7009000     -0.000000      0.000000  
1 1 1 12 55 1  o 5.265000  0.2899000     5.517000  0.3984000     5.013000  0.4212000     0.5041000      0.5798000 
1 1 1 12 55 2  o 6.910000  0.2423000     7.094000  0.3369000     6.727000  0.3484000     0.3669000      0.4846000 
1 1 1 12 55 3  o 1.643000  0.4783000     1.714000  0.6898000     1.572000  0.6628000     0.1423000      0.9566000 
1 1 1 12 55 4  o 3.319000  0.4183000     3.112000  0.6186000     3.525000  0.5632000     -0.4125000     0.8366000 
1 1 1 12 55 5  o 6.692000  0.2466000     6.543000  0.3505000     6.840000  0.3469000     -0.2970000     0.4932000 
1 1 1 12 55 6  o 2.362000  0.5048000     2.150000  0.7231000     2.574000  0.7044000     -0.4241000     1.010000  
1 1 1 12 55 7  o 2.991000  0.4745000     2.918000  0.6763000     3.063000  0.6656000     -0.1448000     0.9489000 
1 1 1 12 55 8  o 1.283000  0.4173000     1.062000  0.5204000     1.504000  0.6526000     -0.4420000     0.8347000 
1 1 1 12 55 9  o 1.653000  0.4844000     1.361000  0.6440000     1.944000  0.7239000     -0.5823000     0.9689000 
1 1 1 12 55 10 o 2.761000  0.6103000     3.159000  0.8113000     2.363000  0.9119000     0.7954000      1.221000  
1 1 1 12 55 11 f 3.180000  0.6043000     3.664000  0.8901000     2.696000  0.8177000     0.9685000      1.209000  
1 1 1 12 55 12 o 1.908000  0.4998000     1.665000  0.6915000     2.150000  0.7219000     -0.4848000     0.9996000 
1 1 1 12 55 13 o 2.276000  0.5187000     2.285000  0.7406000     2.267000  0.7265000     0.1782000E-01  1.037000  
1 1 1 12 56 0  o 3.647000  0.6116000     3.647000  0.6116000     3.647000  0.6116000     0.000000       0.000000  
1 1 1 12 56 1  o 2.912000  0.4727000     3.357000  0.6080000     2.467000  0.7241000     0.8900000      0.9455000 
1 1 1 12 56 2  o 4.293000  0.3554000     4.857000  0.4380000     3.728000  0.5598000     1.128000       0.7108000 
1 1 1 12 56 3  o 7.111000  0.2411000     7.281000  0.3363000     6.940000  0.3454000     0.3414000      0.4821000 
1 1 1 12 56 4  o 5.726000  0.2794000     5.708000  0.3899000     5.744000  0.4002000     -0.3652000E-01 0.5587000 
1 1 1 12 56 5  o 1.759000  0.4906000     1.680000  0.6862000     1.838000  0.7014000     -0.1580000     0.9813000 
1 1 1 12 56 6  o 2.331000  0.5127000     2.110000  0.7317000     2.553000  0.7184000     -0.4428000     1.025000  
1 1 1 12 56 7  o 2.296000  0.5169000     2.003000  0.7261000     2.590000  0.7358000     -0.5869000     1.034000  
1 1 1 12 56 8  o 2.115000  0.5511000     1.861000  0.8218000     2.369000  0.7346000     -0.5083000     1.102000  
1 1 1 12 56 9  o 1.915000  0.5836000     1.550000  0.6971000     2.279000  0.9361000     -0.7284000     1.167000  
1 1 1 12 56 10 o 1.730000  0.5357000     1.714000  0.7692000     1.745000  0.7457000     -0.3057000E-01 1.071000  
1 1 1 12 56 11 o 1.621000  0.4772000     1.263000  0.6236000     1.978000  0.7225000     -0.7145000     0.9545000 
1 1 1 12 56 12 o 2.109000  0.5073000     1.617000  0.7239000     2.601000  0.7109000     -0.9833000     1.015000  
1 1 1 12 56 13 o 1.241000  0.4141000     1.286000  0.6009000     1.195000  0.5700000     0.9109000E-01  0.8282000 
1 1 1 12 57 0  o 1.964000  0.8972000     1.964000  0.8972000     1.964000  0.8972000     -0.000000      0.000000  
1 1 1 12 57 1  o 1.326000  0.4209000     0.9780000 0.4856000     1.675000  0.6875000     -0.6970000     0.8417000 
1 1 1 12 57 2  o 6.514000  0.2608000     6.374000  0.3724000     6.655000  0.3652000     -0.2813000     0.5216000 
1 1 1 12 57 3  o 6.424000  0.2644000     6.456000  0.3777000     6.392000  0.3702000     0.6386000E-01  0.5289000 
1 1 1 12 57 4  o 2.705000  0.4876000     2.301000  0.7176000     3.109000  0.6602000     -0.8082000     0.9751000 
1 1 1 12 57 5  o 4.169000  0.3554000     4.475000  0.4666000     3.863000  0.5362000     0.6122000      0.7108000 
1 1 1 12 57 6  o 3.241000  0.4400000     2.982000  0.6758000     3.500000  0.5638000     -0.5182000     0.8801000 
1 1 1 12 57 7  o 1.417000  0.4697000     1.596000  0.7358000     1.237000  0.5839000     0.3586000      0.9394000 
1 1 1 12 57 8  o 2.841000  0.6179000     3.088000  0.6986000     2.594000  1.019000      0.4936000      1.236000  
1 1 1 12 57 9  o 1.433000  0.4741000     1.475000  0.6940000     1.391000  0.6462000     0.8416000E-01  0.9483000 
1 1 1 12 57 10 o 2.136000  0.5533000     2.962000  0.9242000     1.310000  0.6086000     1.652000       1.107000  
1 1 1 12 57 11 o 1.824000  0.5157000     2.151000  0.7963000     1.497000  0.6556000     0.6540000      1.031000  
1 1 1 12 57 12 o 1.224000  0.4155000     1.272000  0.6127000     1.176000  0.5615000     0.9692000E-01  0.8311000 
1 1 1 12 58 0  o 1.813000  0.8822000     1.813000  0.8822000     1.813000  0.8822000     -0.000000      0.000000  
1 1 1 12 58 1  o 1.564000  0.4720000     1.696000  0.6935000     1.432000  0.6404000     0.2642000      0.9439000 
1 1 1 12 58 2  o 1.939000  0.4980000     1.563000  0.6682000     2.316000  0.7386000     -0.7523000     0.9960000 
1 1 1 12 58 3  o 1.745000  0.4620000     2.288000  0.7285000     1.202000  0.5683000     1.086000       0.9240000 
1 1 1 12 58 4  o 2.386000  0.4781000     3.030000  0.6489000     1.742000  0.7022000     1.289000       0.9561000 
1 1 1 12 58 5  o 1.408000  0.4489000     1.254000  0.6003000     1.562000  0.6677000     -0.3084000     0.8978000 
1 1 1 12 58 6  o 3.031000  0.5885000     3.934000  0.8152000     2.128000  0.8491000     1.806000       1.177000  
1 1 1 12 58 7  o 2.352000  0.7569000     2.352000  0.7569000     ?         ?             ?              ?         
1 1 1 12 58 8  o 1.558000  0.4861000     1.192000  0.5873000     1.925000  0.7748000     -0.7334000     0.9722000 
1 1 1 12 58 9  o 3.895000  0.3992000     4.145000  0.5539000     3.645000  0.5749000     0.4996000      0.7983000 
1 1 1 12 58 10 o 1.303000  0.4349000     1.532000  0.6960000     1.074000  0.5216000     0.4580000      0.8698000 
1 1 1 12 58 11 o 2.176000  0.5063000     1.660000  0.7216000     2.692000  0.7103000     -1.032000      1.013000  
1 1 1 12 59 0  o 1.992000  0.8972000     1.992000  0.8972000     1.992000  0.8972000     0.000000       0.000000  
1 1 1 12 59 1  o 2.630000  0.4708000     3.423000  0.6036000     1.836000  0.7228000     1.587000       0.9417000 
1 1 1 12 59 2  o 4.167000  0.3774000     4.880000  0.4469000     3.455000  0.6082000     1.425000       0.7548000 
1 1 1 12 59 3  o 1.252000  0.4202000     1.588000  0.7039000     0.9160000 0.4593000     0.6720000      0.8404000 
1 1 1 12 59 4  o 2.148000  0.5862000     2.020000  0.8451000     2.276000  0.8126000     -0.2555000     1.172000  
1 1 1 12 59 5  o 1.591000  0.6989000     1.591000  0.6989000     ?         ?             ?              ?         
1 1 1 12 59 6  o 1.566000  0.5029000     1.569000  0.6981000     1.563000  0.7242000     0.6116000E-02  1.006000  
1 1 1 12 59 7  o 2.177000  0.5622000     2.635000  0.8850000     1.718000  0.6937000     0.9174000      1.124000  
1 1 1 12 59 8  o 3.295000  0.4591000     2.922000  0.7115000     3.668000  0.5803000     -0.7463000     0.9182000 
1 1 1 12 59 9  o 1.396000  0.4471000     1.389000  0.6330000     1.403000  0.6317000     -0.1343000E-01 0.8943000 
1 1 1 12 59 10 o 1.961000  0.5400000     1.908000  0.7864000     2.014000  0.7402000     -0.1060000     1.080000  
1 1 1 12 60 0  o 3.373000  1.034000      3.373000  1.034000      3.373000  1.034000      -0.000000      0.000000  
1 1 1 12 60 1  f 2.076000  0.6228000     2.332000  0.9055000     1.820000  0.8552000     0.5124000      1.246000  
1 1 1 12 60 2  f 2.114000  0.6612000     1.864000  0.8589000     2.364000  1.006000      -0.4994000     1.322000  
1 1 1 12 60 3  o 1.084000  0.5440000     1.084000  0.5440000     ?         ?             ?              ?         
1 1 1 12 60 4  o 3.112000  0.5977000     3.806000  0.7855000     2.418000  0.9011000     1.387000       1.195000  
1 1 1 12 60 5  o 5.807000  0.3400000     6.308000  0.5220000     5.306000  0.4359000     1.002000       0.6801000 
1 1 1 12 60 6  o 2.838000  0.4968000     2.803000  0.7231000     2.872000  0.6815000     -0.6915000E-01 0.9937000 
1 1 1 12 60 7  o 2.218000  0.5178000     2.430000  0.7293000     2.006000  0.7354000     0.4245000      1.036000  
1 1 1 12 60 8  o 1.746000  0.4919000     1.482000  0.6484000     2.009000  0.7398000     -0.5275000     0.9837000 
1 1 1 12 60 9  o 1.720000  0.4882000     1.982000  0.7338000     1.458000  0.6441000     0.5241000      0.9764000 
1 1 1 12 61 0  o 1.345000  0.8289000     1.345000  0.8289000     1.345000  0.8289000     -0.000000      0.000000  
1 1 1 12 61 1  f 3.584000  0.5038000     4.284000  0.6156000     2.884000  0.7976000     1.400000       1.008000  
1 1 1 12 61 2  o 3.252000  0.5165000     3.782000  0.6395000     2.723000  0.8113000     1.059000       1.033000  
1 1 1 12 61 3  o 1.615000  0.4856000     1.925000  0.7593000     1.305000  0.6056000     0.6201000      0.9712000 
1 1 1 12 61 4  o 1.652000  0.4845000     1.749000  0.7090000     1.555000  0.6606000     0.1935000      0.9690000 
1 1 1 12 61 5  o 1.561000  0.4727000     1.603000  0.6777000     1.518000  0.6591000     0.8523000E-01  0.9453000 
1 1 1 12 61 6  f 2.731000  0.4813000     3.278000  0.6102000     2.184000  0.7445000     1.094000       0.9626000 
1 1 1 12 61 7  o 1.723000  0.4973000     1.787000  0.7103000     1.660000  0.6962000     0.1272000      0.9946000 
1 1 1 12 61 8  o 1.484000  0.4636000     1.427000  0.6408000     1.542000  0.6701000     -0.1152000     0.9272000 
1 1 1 12 62 0  o 3.519000  0.6610000     3.519000  0.6610000     3.519000  0.6610000     -0.000000      0.000000  
1 1 1 12 62 1  o 2.744000  0.5119000     2.517000  0.7536000     2.970000  0.6932000     -0.4524000     1.024000  
1 1 1 12 62 2  o 1.528000  0.4538000     1.941000  0.7292000     1.116000  0.5405000     0.8251000      0.9077000 
1 1 1 12 62 3  o 2.404000  0.5196000     2.719000  0.7208000     2.090000  0.7486000     0.6288000      1.039000  
1 1 1 12 62 4  o 3.126000  0.4643000     3.104000  0.6619000     3.148000  0.6513000     -0.4402000E-01 0.9286000 
1 1 1 12 62 5  o 1.991000  0.5139000     2.105000  0.7303000     1.878000  0.7233000     0.2266000      1.028000  
1 1 1 12 62 6  o 1.362000  0.4394000     1.307000  0.6041000     1.418000  0.6382000     -0.1112000     0.8788000 
1 1 1 12 62 7  o 1.558000  0.4730000     1.727000  0.7017000     1.390000  0.6345000     0.3373000      0.9460000 
1 1 1 12 63 0  o 4.910000  0.4601000     4.910000  0.4601000     4.910000  0.4601000     -0.000000      0.000000  
1 1 1 12 63 1  o 1.506000  0.4633000     1.714000  0.7032000     1.299000  0.6035000     0.4150000      0.9267000 
1 1 1 12 63 2  o 1.569000  0.4770000     1.494000  0.6558000     1.644000  0.6929000     -0.1490000     0.9541000 
1 1 1 12 63 3  o 2.572000  0.5018000     3.037000  0.6716000     2.107000  0.7458000     0.9306000      1.004000  
1 1 1 12 63 4  f 1.676000  0.4541000     1.055000  0.5181000     2.297000  0.7458000     -1.242000      0.9081000 
1 1 1 12 63 5  o 1.509000  0.4679000     1.502000  0.6567000     1.516000  0.6667000     -0.1316000E-01 0.9358000 
1 1 1 12 64 0  o 4.347000  0.5217000     4.347000  0.5217000     4.347000  0.5217000     -0.000000      0.000000  
1 1 1 12 64 1  o 2.609000  0.5208000     2.602000  0.7476000     2.616000  0.7254000     -0.1398000E-01 1.042000  
1 1 1 12 64 2  o 1.864000  0.5137000     1.885000  0.7229000     1.842000  0.7300000     0.4282000E-01  1.027000  
1 1 1 12 64 3  o 1.594000  0.5053000     1.867000  0.7794000     1.321000  0.6435000     0.5463000      1.011000  
1 1 1 13 0  1  o 15.50000  0.2508000     15.50000  0.2508000     15.50000  0.2508000     -0.000000      0.000000  
1 1 1 13 0  2  o 15.30000  0.2066000     15.30000  0.2066000     15.30000  0.2066000     0.000000       0.000000  
1 1 1 13 0  3  o 5.485000  0.1334000     5.485000  0.1334000     5.485000  0.1334000     -0.000000      0.000000  
1 1 1 13 0  4  o 14.59000  0.1849000     14.59000  0.1849000     14.59000  0.1849000     0.000000       0.000000  
1 1 1 13 0  5  o 17.13000  0.2136000     17.13000  0.2136000     17.13000  0.2136000     0.000000       0.000000  
1 1 1 13 0  6  o 3.826000  0.4174000     3.826000  0.4174000     3.826000  0.4174000     -0.000000      0.000000  
1 1 1 13 0  7  o 9.482000  0.1946000     9.482000  0.1946000     9.482000  0.1946000     0.000000       0.000000  
1 1 1 13 0  8  o 7.631000  0.2158000     7.631000  0.2158000     7.631000  0.2158000     -0.000000      0.000000  
1 1 1 13 0  9  o 1.260000  0.7055000     1.260000  0.7055000     1.260000  0.7055000     0.000000       0.000000  
1 1 1 13 0  10 o 11.46000  0.2754000     11.46000  0.2754000     11.46000  0.2754000     0.000000       0.000000  
1 1 1 13 0  11 o 2.440000  0.8736000     2.440000  0.8736000     2.440000  0.8736000     0.000000       0.000000  
1 1 1 13 0  12 o 5.926000  0.3531000     5.926000  0.3531000     5.926000  0.3531000     -0.000000      0.000000  
1 1 1 13 0  13 o 9.166000  0.2963000     9.166000  0.2963000     9.166000  0.2963000     0.000000       0.000000  
1 1 1 13 0  14 o 7.453000  0.3534000     7.453000  0.3534000     7.453000  0.3534000     0.000000       0.000000  
1 1 1 13 0  15 o 19.64000  0.3605000     19.64000  0.3605000     19.64000  0.3605000     0.000000       0.000000  
1 1 1 13 0  16 o 3.840000  0.9684000     3.840000  0.9684000     3.840000  0.9684000     0.000000       0.000000  
1 1 1 13 0  17 o 1.325000  0.8681000     1.325000  0.8681000     1.325000  0.8681000     0.000000       0.000000  
1 1 1 13 0  18 o 1.218000  0.8421000     1.218000  0.8421000     1.218000  0.8421000     0.000000       0.000000  
1 1 1 13 0  19 o 1.491000  0.9702000     1.491000  0.9702000     1.491000  0.9702000     0.000000       0.000000  
1 1 1 13 0  20 o 1.248000  0.8578000     1.248000  0.8578000     1.248000  0.8578000     -0.000000      0.000000  
1 1 1 13 0  21 o 1.076000  0.7688000     1.076000  0.7688000     1.076000  0.7688000     0.000000       0.000000  
1 1 1 13 0  22 o 1.122000  0.7409000     1.122000  0.7409000     1.122000  0.7409000     -0.000000      0.000000  
1 1 1 13 0  23 o 1.545000  0.8872000     1.545000  0.8872000     1.545000  0.8872000     0.000000       0.000000  
1 1 1 13 0  24 o 0.7622000 0.5487000     0.7622000 0.5487000     0.7622000 0.5487000     0.000000       0.000000  
1 1 1 13 0  25 o 1.664000  0.9093000     1.664000  0.9093000     1.664000  0.9093000     0.000000       0.000000  
1 1 1 13 0  26 o 1.418000  0.8775000     1.418000  0.8775000     1.418000  0.8775000     0.000000       0.000000  
1 1 1 13 1  0  o 16.48000  0.3672000     16.48000  0.3672000     16.48000  0.3672000     0.000000       0.000000  
1 1 1 13 1  1  o 9.541000  0.1515000     9.710000  0.2493000     9.371000  0.1724000     0.3387000      0.3031000 
1 1 1 13 1  2  o 35.43000  0.2842000     35.30000  0.3457000     35.57000  0.4512000     -0.2703000     0.5684000 
1 1 1 13 1  3  o 35.77000  0.2785000     35.56000  0.3915000     35.99000  0.3962000     -0.4324000     0.5570000 
1 1 1 13 1  4  o 18.38000  0.1549000     18.38000  0.2192000     18.39000  0.2191000     -0.1786000E-01 0.3099000 
1 1 1 13 1  5  o 7.828000  0.1149000     7.849000  0.1623000     7.807000  0.1627000     0.4234000E-01  0.2298000 
1 1 1 13 1  6  o 6.752000  0.1986000     6.699000  0.2781000     6.806000  0.2835000     -0.1073000     0.3971000 
1 1 1 13 1  7  f 5.973000  0.1579000     6.015000  0.2206000     5.931000  0.2261000     0.8371000E-01  0.3159000 
1 1 1 13 1  8  o 8.375000  0.1507000     8.275000  0.2134000     8.475000  0.2127000     -0.2005000     0.3014000 
1 1 1 13 1  9  o 6.190000  0.1896000     6.257000  0.2673000     6.123000  0.2690000     0.1339000      0.3793000 
1 1 1 13 1  10 o 9.404000  0.1989000     9.281000  0.2826000     9.526000  0.2799000     -0.2451000     0.3977000 
1 1 1 13 1  11 o 4.929000  0.3206000     4.445000  0.4797000     5.414000  0.4254000     -0.9687000     0.6412000 
1 1 1 13 1  12 o 8.274000  0.2044000     8.556000  0.2833000     7.991000  0.2947000     0.5651000      0.4088000 
1 1 1 13 1  13 o 6.913000  0.2360000     7.398000  0.3168000     6.427000  0.3498000     0.9705000      0.4720000 
1 1 1 13 1  14 o 7.089000  0.2567000     7.048000  0.3614000     7.129000  0.3645000     -0.8078000E-01 0.5133000 
1 1 1 13 1  15 o 4.455000  0.4662000     4.330000  0.6662000     4.580000  0.6524000     -0.2496000     0.9324000 
1 1 1 13 1  16 o 2.385000  0.6332000     2.753000  0.9288000     2.018000  0.8608000     0.7352000      1.266000  
1 1 1 13 1  17 o 2.097000  0.5816000     1.660000  0.7589000     2.534000  0.8814000     -0.8738000     1.163000  
1 1 1 13 1  18 o 9.175000  0.3302000     9.774000  0.4505000     8.576000  0.4828000     1.198000       0.6604000 
1 1 1 13 1  19 o 2.431000  0.6767000     2.289000  0.9390000     2.573000  0.9747000     -0.2830000     1.353000  
1 1 1 13 1  20 o 2.632000  0.6549000     1.992000  0.8828000     3.271000  0.9675000     -1.279000      1.310000  
1 1 1 13 1  21 o 2.198000  0.6274000     1.386000  0.6908000     3.010000  1.047000      -1.624000      1.255000  
1 1 1 13 1  22 o 1.792000  0.5276000     1.685000  0.7288000     1.898000  0.7630000     -0.2137000     1.055000  
1 1 1 13 1  23 o 1.362000  0.4479000     1.416000  0.6508000     1.307000  0.6154000     0.1083000      0.8957000 
1 1 1 13 1  24 o 2.237000  0.5376000     1.857000  0.7434000     2.617000  0.7767000     -0.7596000     1.075000  
1 1 1 13 1  25 o 1.565000  0.4832000     1.299000  0.6108000     1.832000  0.7490000     -0.5328000     0.9665000 
1 1 1 13 1  26 o 1.692000  0.5350000     1.493000  0.6990000     1.890000  0.8102000     -0.3970000     1.070000  
1 1 1 13 2  0  o 23.81000  0.5249000     23.81000  0.5249000     23.81000  0.5249000     -0.000000      0.000000  
1 1 1 13 2  1  o 13.31000  0.1171000     13.61000  0.1792000     13.00000  0.1509000     0.6066000      0.2343000 
1 1 1 13 2  2  o 15.24000  0.1247000     15.25000  0.1751000     15.24000  0.1776000     0.1049000E-01  0.2494000 
1 1 1 13 2  3  o 19.82000  0.1673000     19.67000  0.2012000     19.97000  0.2672000     -0.2961000     0.3345000 
1 1 1 13 2  4  o 9.508000  0.1070000     9.380000  0.1508000     9.636000  0.1519000     -0.2559000     0.2140000 
1 1 1 13 2  5  o 13.62000  0.1310000     13.75000  0.1865000     13.50000  0.1841000     0.2518000      0.2621000 
1 1 1 13 2  6  o 18.50000  0.2377000     18.46000  0.3348000     18.55000  0.3376000     -0.9321000E-01 0.4754000 
1 1 1 13 2  7  o 2.518000  0.3138000     2.500000  0.4482000     2.536000  0.4393000     -0.3540000E-01 0.6276000 
1 1 1 13 2  8  o 9.103000  0.1491000     9.137000  0.2096000     9.068000  0.2122000     0.6831000E-01  0.2982000 
1 1 1 13 2  9  o 6.012000  0.1920000     6.048000  0.2666000     5.977000  0.2765000     0.7045000E-01  0.3841000 
1 1 1 13 2  10 o 13.61000  0.1953000     13.72000  0.2760000     13.50000  0.2764000     0.2197000      0.3906000 
1 1 1 13 2  11 o 12.45000  0.2068000     12.52000  0.2927000     12.38000  0.2922000     0.1399000      0.4136000 
1 1 1 13 2  12 o 12.44000  0.1835000     12.41000  0.2595000     12.47000  0.2594000     -0.5503000E-01 0.3669000 
1 1 1 13 2  13 o 8.516000  0.2112000     8.520000  0.2967000     8.512000  0.3005000     0.7972000E-02  0.4223000 
1 1 1 13 2  14 o 12.00000  0.2044000     12.01000  0.2889000     11.99000  0.2893000     0.1510000E-01  0.4088000 
1 1 1 13 2  15 o 4.982000  0.4268000     5.544000  0.5509000     4.421000  0.6520000     1.124000       0.8536000 
1 1 1 13 2  16 o 4.528000  0.5238000     4.803000  0.6872000     4.254000  0.7907000     0.5499000      1.048000  
1 1 1 13 2  17 o 4.911000  0.4493000     4.622000  0.6626000     5.200000  0.6071000     -0.5779000     0.8986000 
1 1 1 13 2  18 o 3.074000  0.7007000     3.450000  0.9821000     2.698000  0.9996000     0.7518000      1.401000  
1 1 1 13 2  19 o 2.904000  0.7040000     3.225000  0.9925000     2.583000  0.9986000     0.6424000      1.408000  
1 1 1 13 2  20 o 2.630000  0.6985000     2.804000  1.009000      2.456000  0.9658000     0.3476000      1.397000  
1 1 1 13 2  21 o 1.802000  0.5927000     1.513000  0.7452000     2.091000  0.9217000     -0.5783000     1.185000  
1 1 1 13 2  22 o 1.834000  0.5205000     1.431000  0.6606000     2.236000  0.8045000     -0.8051000     1.041000  
1 1 1 13 2  23 o 1.592000  0.4816000     1.173000  0.5703000     2.010000  0.7761000     -0.8366000     0.9631000 
1 1 1 13 2  24 o 1.835000  0.5258000     1.810000  0.7414000     1.861000  0.7459000     -0.5068000E-01 1.052000  
1 1 1 13 2  25 o 1.876000  0.5284000     1.898000  0.7518000     1.855000  0.7427000     0.4300000E-01  1.057000  
1 1 1 13 2  26 o 1.492000  0.4942000     1.440000  0.6806000     1.544000  0.7168000     -0.1047000     0.9885000 
1 1 1 13 3  0  o 18.96000  0.2106000     18.96000  0.2106000     18.96000  0.2106000     -0.000000      0.000000  
1 1 1 13 3  1  o 26.62000  0.2236000     26.71000  0.3391000     26.53000  0.2915000     0.1801000      0.4472000 
1 1 1 13 3  2  o 5.817000  0.7487000E-01 5.784000  0.1020000     5.849000  0.1096000     -0.6516000E-01 0.1497000 
1 1 1 13 3  3  o 15.17000  0.1289000     15.14000  0.1804000     15.20000  0.1841000     -0.6083000E-01 0.2577000 
1 1 1 13 3  4  o 19.20000  0.1668000     19.06000  0.2000000     19.34000  0.2670000     -0.2782000     0.3336000 
1 1 1 13 3  5  o 21.37000  0.1791000     21.30000  0.2527000     21.45000  0.2539000     -0.1594000     0.3582000 
1 1 1 13 3  6  o 11.64000  0.1544000     11.65000  0.2186000     11.64000  0.2181000     0.1179000E-01  0.3088000 
1 1 1 13 3  7  o 3.578000  0.2290000     3.292000  0.3462000     3.864000  0.2998000     -0.5722000     0.4580000 
1 1 1 13 3  8  o 2.881000  0.3110000     2.951000  0.4378000     2.811000  0.4419000     0.1398000      0.6220000 
1 1 1 13 3  9  o 3.402000  0.3051000     3.308000  0.4383000     3.497000  0.4245000     -0.1888000     0.6102000 
1 1 1 13 3  10 o 6.479000  0.2383000     6.699000  0.3322000     6.259000  0.3419000     0.4393000      0.4767000 
1 1 1 13 3  11 o 6.600000  0.2985000     6.446000  0.4714000     6.755000  0.3662000     -0.3093000     0.5969000 
1 1 1 13 3  12 o 12.22000  0.1870000     12.69000  0.2609000     11.75000  0.2681000     0.9356000      0.3741000 
1 1 1 13 3  13 o 11.58000  0.1967000     11.68000  0.2749000     11.48000  0.2813000     0.2024000      0.3933000 
1 1 1 13 3  14 o 12.19000  0.2050000     12.01000  0.2875000     12.38000  0.2922000     -0.3745000     0.4099000 
1 1 1 13 3  15 o 12.90000  0.2504000     12.91000  0.3509000     12.89000  0.3574000     0.2146000E-01  0.5009000 
1 1 1 13 3  16 o 7.561000  0.3400000     7.645000  0.4835000     7.477000  0.4780000     0.1688000      0.6799000 
1 1 1 13 3  17 o 2.168000  0.6130000     2.284000  0.8801000     2.052000  0.8536000     0.2321000      1.226000  
1 1 1 13 3  18 o 2.002000  0.6295000     1.860000  0.8515000     2.145000  0.9274000     -0.2848000     1.259000  
1 1 1 13 3  19 o 3.516000  0.6827000     2.761000  1.015000      4.272000  0.9127000     -1.511000      1.365000  
1 1 1 13 3  20 o 5.687000  0.4929000     5.235000  0.7392000     6.140000  0.6523000     -0.9049000     0.9858000 
1 1 1 13 3  21 o 2.199000  0.6572000     1.793000  0.8531000     2.606000  0.9998000     -0.8132000     1.314000  
1 1 1 13 3  22 o 1.670000  0.5151000     1.574000  0.7044000     1.766000  0.7518000     -0.1920000     1.030000  
1 1 1 13 3  23 o 1.249000  0.4218000     1.351000  0.6313000     1.146000  0.5596000     0.2051000      0.8436000 
1 1 1 13 3  24 o 1.645000  0.4972000     1.534000  0.6795000     1.757000  0.7261000     -0.2227000     0.9944000 
1 1 1 13 3  25 o 1.806000  0.5256000     1.881000  0.7584000     1.731000  0.7281000     0.1494000      1.051000  
1 1 1 13 3  26 o 1.292000  0.4459000     1.276000  0.6244000     1.308000  0.6366000     -0.3193000E-01 0.8918000 
1 1 1 13 4  0  o 52.19000  0.5674000     52.19000  0.5674000     52.19000  0.5674000     -0.000000      0.000000  
1 1 1 13 4  1  o 11.67000  0.1067000     12.00000  0.1651000     11.33000  0.1353000     0.6784000      0.2134000 
1 1 1 13 4  2  o 10.67000  0.1490000     10.89000  0.2592000     10.45000  0.1471000     0.4316000      0.2980000 
1 1 1 13 4  3  o 16.26000  0.1367000     16.13000  0.1909000     16.38000  0.1959000     -0.2476000     0.2735000 
1 1 1 13 4  4  o 15.81000  0.1779000     15.93000  0.2215000     15.68000  0.2785000     0.2494000      0.3558000 
1 1 1 13 4  5  o 9.118000  0.1192000     9.155000  0.1385000     9.080000  0.1940000     0.7489000E-01  0.2384000 
1 1 1 13 4  6  o 9.035000  0.1502000     8.821000  0.2132000     9.250000  0.2118000     -0.4299000     0.3005000 
1 1 1 13 4  7  f 7.361000  0.1451000     7.544000  0.2035000     7.177000  0.2069000     0.3671000      0.2901000 
1 1 1 13 4  8  o 4.833000  0.2011000     5.204000  0.2768000     4.463000  0.2917000     0.7413000      0.4021000 
1 1 1 13 4  9  o 8.486000  0.1660000     8.462000  0.2342000     8.509000  0.2353000     -0.4722000E-01 0.3320000 
1 1 1 13 4  10 o 9.287000  0.1753000     9.240000  0.2475000     9.335000  0.2482000     -0.9523000E-01 0.3505000 
1 1 1 13 4  11 o 7.069000  0.3146000     6.675000  0.4552000     7.463000  0.4345000     -0.7878000     0.6293000 
1 1 1 13 4  12 o 7.073000  0.2265000     7.191000  0.3171000     6.955000  0.3234000     0.2365000      0.4529000 
1 1 1 13 4  13 o 11.56000  0.1979000     11.45000  0.2819000     11.68000  0.2778000     -0.2260000     0.3958000 
1 1 1 13 4  14 o 11.75000  0.2078000     11.63000  0.2964000     11.88000  0.2913000     -0.2485000     0.4155000 
1 1 1 13 4  15 o 9.133000  0.2781000     9.002000  0.3923000     9.265000  0.3943000     -0.2634000     0.5562000 
1 1 1 13 4  16 o 2.605000  0.6655000     2.687000  0.9548000     2.522000  0.9272000     0.1654000      1.331000  
1 1 1 13 4  17 o 3.028000  0.6425000     2.802000  0.9243000     3.255000  0.8926000     -0.4529000     1.285000  
1 1 1 13 4  18 o 2.827000  0.7124000     2.915000  1.016000      2.739000  0.9992000     0.1756000      1.425000  
1 1 1 13 4  19 o 7.352000  0.4060000     8.045000  0.5309000     6.659000  0.6143000     1.386000       0.8119000 
1 1 1 13 4  20 o 2.862000  0.7123000     2.813000  1.005000      2.911000  1.010000      -0.9818000E-01 1.425000  
1 1 1 13 4  21 o 2.484000  0.7988000     2.595000  1.169000      2.372000  1.089000      0.2228000      1.598000  
1 1 1 13 4  22 o 1.714000  0.4865000     1.132000  0.5557000     2.297000  0.7986000     -1.165000      0.9729000 
1 1 1 13 4  23 o 1.399000  0.4572000     1.565000  0.6956000     1.234000  0.5935000     0.3311000      0.9144000 
1 1 1 13 4  24 f 1.193000  0.4080000     1.216000  0.5845000     1.171000  0.5694000     0.4429000E-01  0.8160000 
1 1 1 13 4  25 o 1.543000  0.4841000     1.620000  0.7047000     1.466000  0.6641000     0.1538000      0.9683000 
1 1 1 13 4  26 o 1.378000  0.4674000     1.309000  0.6309000     1.448000  0.6897000     -0.1397000     0.9347000 
1 1 1 13 5  0  o 24.54000  0.2708000     24.54000  0.2708000     24.54000  0.2708000     0.000000       0.000000  
1 1 1 13 5  1  o 25.67000  0.2005000     25.65000  0.2832000     25.70000  0.2839000     -0.4343000E-01 0.4010000 
1 1 1 13 5  2  o 4.285000  0.7796000E-01 4.291000  0.1117000     4.279000  0.1088000     0.1154000E-01  0.1559000 
1 1 1 13 5  3  o 5.535000  0.9094000E-01 5.443000  0.1447000     5.628000  0.1102000     -0.1855000     0.1819000 
1 1 1 13 5  4  o 12.86000  0.1571000     12.58000  0.1871000     13.14000  0.2523000     -0.5625000     0.3142000 
1 1 1 13 5  5  o 12.42000  0.1349000     12.46000  0.1741000     12.37000  0.2061000     0.9259000E-01  0.2699000 
1 1 1 13 5  6  o 5.263000  0.1496000     4.914000  0.1713000     5.611000  0.2453000     -0.6967000     0.2992000 
1 1 1 13 5  7  o 4.430000  0.1947000     4.688000  0.2669000     4.172000  0.2836000     0.5164000      0.3895000 
1 1 1 13 5  8  o 6.392000  0.1675000     6.457000  0.2385000     6.328000  0.2353000     0.1287000      0.3351000 
1 1 1 13 5  9  o 12.95000  0.1613000     12.81000  0.2283000     13.09000  0.2281000     -0.2807000     0.3227000 
1 1 1 13 5  10 o 5.157000  0.2371000     5.149000  0.3411000     5.165000  0.3295000     -0.1590000E-01 0.4743000 
1 1 1 13 5  11 o 10.60000  0.2719000     10.91000  0.3762000     10.30000  0.3926000     0.6117000      0.5437000 
1 1 1 13 5  12 o 12.40000  0.1869000     12.89000  0.2642000     11.91000  0.2644000     0.9855000      0.3738000 
1 1 1 13 5  13 o 6.250000  0.2619000     6.034000  0.3796000     6.465000  0.3609000     -0.4310000     0.5238000 
1 1 1 13 5  14 o 6.266000  0.2923000     6.649000  0.3938000     5.884000  0.4322000     0.7650000      0.5847000 
1 1 1 13 5  15 o 7.366000  0.3189000     6.862000  0.4713000     7.869000  0.4297000     -1.007000      0.6378000 
1 1 1 13 5  16 o 3.873000  0.6833000     3.470000  1.104000      4.276000  0.8047000     -0.8067000     1.367000  
1 1 1 13 5  17 o 3.729000  0.5934000     3.372000  0.8897000     4.087000  0.7855000     -0.7151000     1.187000  
1 1 1 13 5  18 o 2.694000  0.6298000     1.902000  0.8636000     3.486000  0.9168000     -1.583000      1.260000  
1 1 1 13 5  19 o 3.319000  0.7140000     2.913000  1.016000      3.725000  1.004000      -0.8128000     1.428000  
1 1 1 13 5  20 o 6.312000  0.4482000     5.805000  0.6850000     6.820000  0.5783000     -1.016000      0.8965000 
1 1 1 13 5  21 o 3.113000  0.8826000     2.829000  1.218000      3.396000  1.278000      -0.5672000     1.765000  
1 1 1 13 5  22 o 2.113000  0.5683000     2.293000  0.8051000     1.933000  0.8023000     0.3602000      1.137000  
1 1 1 13 5  23 o 2.067000  0.5106000     2.656000  0.7672000     1.478000  0.6739000     1.178000       1.021000  
1 1 1 13 5  24 o 1.165000  0.4004000     1.072000  0.5303000     1.259000  0.6000000     -0.1877000     0.8008000 
1 1 1 13 5  25 o 1.357000  0.4481000     1.269000  0.6073000     1.444000  0.6590000     -0.1751000     0.8961000 
1 1 1 13 5  26 o 1.735000  0.5334000     1.416000  0.6744000     2.054000  0.8267000     -0.6378000     1.067000  
1 1 1 13 6  0  o 51.66000  0.5623000     51.66000  0.5623000     51.66000  0.5623000     -0.000000      0.000000  
1 1 1 13 6  1  f 13.92000  0.1161000     13.92000  0.1639000     13.91000  0.1645000     0.9415000E-02  0.2322000 
1 1 1 13 6  2  o 10.97000  0.9969000E-01 10.97000  0.1412000     10.97000  0.1408000     0.5541000E-03  0.1994000 
1 1 1 13 6  3  o 32.13000  0.2609000     32.24000  0.4138000     32.01000  0.3178000     0.2267000      0.5217000 
1 1 1 13 6  4  o 10.83000  0.1788000     10.61000  0.1719000     11.05000  0.3136000     -0.4473000     0.3576000 
1 1 1 13 6  5  o 11.11000  0.1279000     11.17000  0.1654000     11.05000  0.1951000     0.1221000      0.2558000 
1 1 1 13 6  6  o 1.993000  0.2733000     2.011000  0.3615000     1.975000  0.4099000     0.3650000E-01  0.5466000 
1 1 1 13 6  7  o 6.056000  0.1590000     6.213000  0.1756000     5.898000  0.2651000     0.3145000      0.3180000 
1 1 1 13 6  8  o 7.348000  0.1582000     7.404000  0.2250000     7.292000  0.2224000     0.1119000      0.3164000 
1 1 1 13 6  9  o 4.275000  0.2565000     4.509000  0.3479000     4.041000  0.3770000     0.4674000      0.5130000 
1 1 1 13 6  10 o 8.692000  0.1784000     8.591000  0.2551000     8.793000  0.2494000     -0.2019000     0.3567000 
1 1 1 13 6  11 o 15.87000  0.2162000     15.53000  0.3042000     16.22000  0.3073000     -0.6857000     0.4324000 
1 1 1 13 6  12 o 14.46000  0.1867000     14.38000  0.2622000     14.54000  0.2658000     -0.1613000     0.3734000 
1 1 1 13 6  13 f 12.30000  0.1978000     12.45000  0.2801000     12.16000  0.2793000     0.2902000      0.3956000 
1 1 1 13 6  14 o 16.71000  0.2067000     16.91000  0.2937000     16.51000  0.2910000     0.3998000      0.4135000 
1 1 1 13 6  15 o 7.380000  0.2807000     7.542000  0.3946000     7.219000  0.3993000     0.3229000      0.5614000 
1 1 1 13 6  16 o 5.947000  0.5282000     6.117000  0.7593000     5.777000  0.7345000     0.3400000      1.056000  
1 1 1 13 6  17 o 2.440000  0.6382000     2.297000  0.8919000     2.583000  0.9132000     -0.2858000     1.276000  
1 1 1 13 6  18 o 7.682000  0.3610000     7.434000  0.5496000     7.931000  0.4683000     -0.4963000     0.7220000 
1 1 1 13 6  19 o 4.254000  0.6633000     4.012000  0.9633000     4.495000  0.9122000     -0.4835000     1.327000  
1 1 1 13 6  20 o 1.497000  0.5162000     1.564000  0.7569000     1.430000  0.7022000     0.1347000      1.032000  
1 1 1 13 6  21 o 2.423000  0.7708000     1.774000  0.8858000     3.072000  1.262000      -1.298000      1.542000  
1 1 1 13 6  22 o 1.557000  0.4963000     1.617000  0.7065000     1.497000  0.6972000     0.1199000      0.9926000 
1 1 1 13 6  23 o 1.688000  0.5000000     1.963000  0.7622000     1.413000  0.6474000     0.5502000      1.000000  
1 1 1 13 6  24 o 2.120000  0.5362000     2.723000  0.8200000     1.516000  0.6912000     1.207000       1.072000  
1 1 1 13 6  25 o 1.556000  0.4881000     1.535000  0.6862000     1.576000  0.6942000     -0.4102000E-01 0.9761000 
1 1 1 13 6  26 o 1.291000  0.4451000     1.018000  0.5130000     1.564000  0.7275000     -0.5459000     0.8902000 
1 1 1 13 7  0  o 28.45000  0.3139000     28.45000  0.3139000     28.45000  0.3139000     -0.000000      0.000000  
1 1 1 13 7  1  o 26.26000  0.2062000     26.22000  0.2910000     26.30000  0.2921000     -0.7553000E-01 0.4123000 
1 1 1 13 7  2  o 16.93000  0.1401000     16.84000  0.1971000     17.01000  0.1991000     -0.1648000     0.2802000 
1 1 1 13 7  3  o 18.17000  0.1507000     18.14000  0.2129000     18.21000  0.2134000     -0.6942000E-01 0.3015000 
1 1 1 13 7  4  o 15.41000  0.1573000     15.55000  0.2256000     15.27000  0.2193000     0.2791000      0.3146000 
1 1 1 13 7  5  o 1.535000  0.3252000     1.391000  0.4559000     1.680000  0.4639000     -0.2888000     0.6504000 
1 1 1 13 7  6  o 9.312000  0.1211000     9.208000  0.1674000     9.417000  0.1751000     -0.2092000     0.2422000 
1 1 1 13 7  7  o 10.35000  0.1316000     10.56000  0.1856000     10.15000  0.1866000     0.4028000      0.2632000 
1 1 1 13 7  8  o 3.897000  0.2259000     3.599000  0.2602000     4.195000  0.3693000     -0.5960000     0.4517000 
1 1 1 13 7  9  o 2.643000  0.4446000     2.726000  0.6065000     2.559000  0.6504000     0.1668000      0.8893000 
1 1 1 13 7  10 o 5.660000  0.2239000     5.697000  0.3163000     5.623000  0.3170000     0.7408000E-01  0.4478000 
1 1 1 13 7  11 o 8.155000  0.2313000     8.000000  0.3317000     8.310000  0.3224000     -0.3094000     0.4626000 
1 1 1 13 7  12 o 9.544000  0.1969000     9.715000  0.2744000     9.373000  0.2825000     0.3422000      0.3938000 
1 1 1 13 7  13 o 7.679000  0.2300000     7.855000  0.3186000     7.503000  0.3318000     0.3518000      0.4600000 
1 1 1 13 7  14 o 5.720000  0.3040000     5.525000  0.4309000     5.915000  0.4290000     -0.3900000     0.6080000 
1 1 1 13 7  15 o 9.580000  0.2391000     9.626000  0.3362000     9.535000  0.3402000     0.9140000E-01  0.4783000 
1 1 1 13 7  16 o 2.478000  0.6998000     2.236000  0.9447000     2.720000  1.033000      -0.4833000     1.400000  
1 1 1 13 7  17 o 1.929000  0.5886000     1.910000  0.8337000     1.949000  0.8311000     -0.3925000E-01 1.177000  
1 1 1 13 7  18 o 7.544000  0.3654000     7.507000  0.5487000     7.582000  0.4827000     -0.7409000E-01 0.7308000 
1 1 1 13 7  19 o 2.616000  0.7030000     2.902000  1.020000      2.331000  0.9680000     0.5712000      1.406000  
1 1 1 13 7  20 o 2.994000  0.7013000     2.746000  0.9855000     3.242000  0.9981000     -0.4956000     1.403000  
1 1 1 13 7  21 o 2.786000  0.8184000     3.377000  1.323000      2.195000  0.9643000     1.182000       1.637000  
1 1 1 13 7  22 o 1.402000  0.4658000     1.423000  0.6602000     1.381000  0.6574000     0.4223000E-01  0.9316000 
1 1 1 13 7  23 o 1.741000  0.4953000     2.131000  0.7639000     1.350000  0.6308000     0.7814000      0.9907000 
1 1 1 13 7  24 o 1.708000  0.5220000     1.828000  0.7605000     1.587000  0.7153000     0.2419000      1.044000  
1 1 1 13 7  25 f 1.948000  0.4947000     1.262000  0.6014000     2.634000  0.7857000     -1.372000      0.9894000 
1 1 1 13 7  26 o 1.650000  0.5046000     1.922000  0.7611000     1.377000  0.6625000     0.5446000      1.009000  
1 1 1 13 8  0  o 21.94000  0.2472000     21.94000  0.2472000     21.94000  0.2472000     -0.000000      0.000000  
1 1 1 13 8  1  o 10.79000  0.9974000E-01 10.79000  0.1404000     10.78000  0.1417000     0.1057000E-01  0.1995000 
1 1 1 13 8  2  o 8.892000  0.9323000E-01 8.985000  0.1326000     8.798000  0.1311000     0.1870000      0.1865000 
1 1 1 13 8  3  o 23.02000  0.2275000     23.05000  0.3718000     23.00000  0.2625000     0.5451000E-01  0.4551000 
1 1 1 13 8  4  f 11.81000  0.1149000     11.96000  0.1645000     11.65000  0.1605000     0.3109000      0.2298000 
1 1 1 13 8  5  o 14.24000  0.2227000     14.25000  0.4110000     14.23000  0.1718000     0.2225000E-01  0.4454000 
1 1 1 13 8  6  o 12.04000  0.1314000     11.90000  0.1830000     12.18000  0.1886000     -0.2788000     0.2628000 
1 1 1 13 8  7  o 2.560000  0.2459000     2.400000  0.3594000     2.720000  0.3357000     -0.3200000     0.4918000 
1 1 1 13 8  8  o 8.245000  0.1404000     8.310000  0.1944000     8.180000  0.2026000     0.1303000      0.2808000 
1 1 1 13 8  9  o 7.588000  0.2090000     7.792000  0.2090000     7.384000  0.3620000     0.4081000      0.4180000 
1 1 1 13 8  10 o 9.502000  0.1745000     9.371000  0.2491000     9.633000  0.2443000     -0.2620000     0.3489000 
1 1 1 13 8  11 o 2.459000  0.4630000     3.122000  0.5808000     1.797000  0.7211000     1.325000       0.9260000 
1 1 1 13 8  12 o 5.703000  0.2658000     5.053000  0.4011000     6.353000  0.3489000     -1.299000      0.5316000 
1 1 1 13 8  13 o 2.974000  0.4754000     2.383000  0.7456000     3.566000  0.5900000     -1.184000      0.9508000 
1 1 1 13 8  14 o 1.916000  0.5288000     1.573000  0.6992000     2.258000  0.7935000     -0.6852000     1.058000  
1 1 1 13 8  15 o 8.359000  0.2571000     8.867000  0.3513000     7.851000  0.3754000     1.016000       0.5142000 
1 1 1 13 8  16 o 7.095000  0.3636000     6.775000  0.5316000     7.415000  0.4961000     -0.6401000     0.7272000 
1 1 1 13 8  17 o 8.614000  0.2919000     8.645000  0.4145000     8.584000  0.4112000     0.6065000E-01  0.5838000 
1 1 1 13 8  18 f 2.254000  0.6471000     2.092000  0.9072000     2.416000  0.9231000     -0.3239000     1.294000  
1 1 1 13 8  19 o 3.144000  0.7028000     3.720000  0.9849000     2.569000  1.003000      1.151000       1.406000  
1 1 1 13 8  20 o 2.508000  0.6852000     2.269000  0.9372000     2.748000  0.9999000     -0.4788000     1.370000  
1 1 1 13 8  21 o 2.162000  0.6441000     1.614000  0.7576000     2.709000  1.042000      -1.096000      1.288000  
1 1 1 13 8  22 o 1.703000  0.5213000     1.750000  0.7368000     1.656000  0.7377000     0.9480000E-01  1.043000  
1 1 1 13 8  23 o 1.861000  0.5315000     1.825000  0.7438000     1.898000  0.7596000     -0.7286000E-01 1.063000  
1 1 1 13 8  24 o 1.399000  0.4633000     1.356000  0.6411000     1.441000  0.6689000     -0.8505000E-01 0.9265000 
1 1 1 13 8  25 o 1.634000  0.5001000     1.809000  0.7499000     1.459000  0.6618000     0.3502000      1.000000  
1 1 1 13 8  26 o 1.245000  0.4199000     1.329000  0.6225000     1.160000  0.5636000     0.1694000      0.8397000 
1 1 1 13 9  0  o 4.637000  0.1244000     4.637000  0.1244000     4.637000  0.1244000     -0.000000      0.000000  
1 1 1 13 9  1  o 6.314000  0.8627000E-01 6.336000  0.1212000     6.293000  0.1228000     0.4268000E-01  0.1725000 
1 1 1 13 9  2  o 18.36000  0.1519000     18.36000  0.2150000     18.36000  0.2148000     0.4070000E-02  0.3039000 
1 1 1 13 9  3  o 5.112000  0.1313000     5.199000  0.1909000     5.025000  0.1804000     0.1746000      0.2627000 
1 1 1 13 9  4  o 24.28000  0.2132000     24.31000  0.2792000     24.25000  0.3224000     0.6493000E-01  0.4265000 
1 1 1 13 9  5  o 16.13000  0.1526000     16.36000  0.2449000     15.90000  0.1823000     0.4632000      0.3053000 
1 1 1 13 9  6  o 2.322000  0.2537000     2.106000  0.3718000     2.538000  0.3453000     -0.4320000     0.5074000 
1 1 1 13 9  7  o 3.549000  0.1881000     3.241000  0.2717000     3.858000  0.2603000     -0.6173000     0.3762000 
1 1 1 13 9  8  o 8.470000  0.1417000     8.559000  0.1945000     8.380000  0.2061000     0.1789000      0.2834000 
1 1 1 13 9  9  o 10.36000  0.2544000     10.76000  0.2347000     9.948000  0.4513000     0.8154000      0.5087000 
1 1 1 13 9  10 o 10.07000  0.1770000     9.717000  0.1987000     10.43000  0.2930000     -0.7127000     0.3540000 
1 1 1 13 9  11 o 4.198000  0.3411000     4.080000  0.4654000     4.317000  0.4989000     -0.2367000     0.6823000 
1 1 1 13 9  12 o 14.43000  0.1873000     14.46000  0.2660000     14.39000  0.2638000     0.7274000E-01  0.3747000 
1 1 1 13 9  13 o 9.507000  0.2107000     9.519000  0.3017000     9.495000  0.2942000     0.2435000E-01  0.4214000 
1 1 1 13 9  14 f 6.957000  0.3080000     6.917000  0.4435000     6.997000  0.4274000     -0.7987000E-01 0.6159000 
1 1 1 13 9  15 o 3.962000  0.4829000     3.735000  0.7301000     4.189000  0.6323000     -0.4532000     0.9658000 
1 1 1 13 9  16 o 2.866000  0.6498000     3.338000  0.9241000     2.394000  0.9138000     0.9449000      1.300000  
1 1 1 13 9  17 o 8.344000  0.3032000     7.925000  0.4486000     8.763000  0.4080000     -0.8378000     0.6064000 
1 1 1 13 9  18 o 2.652000  0.6922000     2.770000  1.010000      2.535000  0.9472000     0.2348000      1.384000  
1 1 1 13 9  19 o 3.496000  0.6984000     4.037000  0.9218000     2.955000  1.049000      1.082000       1.397000  
1 1 1 13 9  20 o 2.767000  0.6949000     3.079000  0.9993000     2.454000  0.9659000     0.6245000      1.390000  
1 1 1 13 9  21 o 2.996000  0.7030000     2.853000  0.9164000     3.138000  1.066000      -0.2849000     1.406000  
1 1 1 13 9  22 o 1.736000  0.5198000     2.017000  0.7855000     1.455000  0.6810000     0.5617000      1.040000  
1 1 1 13 9  23 o 1.774000  0.5210000     1.758000  0.7330000     1.790000  0.7406000     -0.3168000E-01 1.042000  
1 1 1 13 9  24 o 1.801000  0.5234000     2.157000  0.8041000     1.445000  0.6701000     0.7128000      1.047000  
1 1 1 13 9  25 o 1.163000  0.3990000     1.383000  0.6416000     0.9422000 0.4747000     0.4408000      0.7981000 
1 1 1 13 9  26 o 1.096000  0.3815000     1.154000  0.5632000     1.038000  0.5147000     0.1157000      0.7630000 
1 1 1 13 10 0  f 6.116000  0.1249000     6.116000  0.1249000     6.116000  0.1249000     0.000000       0.000000  
1 1 1 13 10 1  o 10.69000  0.1033000     10.57000  0.1446000     10.80000  0.1475000     -0.2281000     0.2066000 
1 1 1 13 10 2  o 4.180000  0.1125000     4.263000  0.1707000     4.098000  0.1466000     0.1655000      0.2251000 
1 1 1 13 10 3  o 27.68000  0.2386000     27.30000  0.3085000     28.05000  0.3640000     -0.7513000     0.4771000 
1 1 1 13 10 4  f 11.58000  0.1544000     11.44000  0.2354000     11.71000  0.1998000     -0.2716000     0.3087000 
1 1 1 13 10 5  o 8.270000  0.1091000     8.197000  0.1538000     8.343000  0.1548000     -0.1458000     0.2183000 
1 1 1 13 10 6  o 13.00000  0.1384000     13.16000  0.2210000     12.83000  0.1667000     0.3333000      0.2768000 
1 1 1 13 10 7  o 7.636000  0.1344000     7.489000  0.1876000     7.783000  0.1926000     -0.2935000     0.2688000 
1 1 1 13 10 8  o 8.953000  0.1424000     8.938000  0.1994000     8.967000  0.2035000     -0.2899000E-01 0.2849000 
1 1 1 13 10 9  o 15.16000  0.2234000     15.32000  0.2843000     15.01000  0.3446000     0.3041000      0.4468000 
1 1 1 13 10 10 o 3.928000  0.2677000     3.422000  0.4047000     4.434000  0.3504000     -1.012000      0.5353000 
1 1 1 13 10 11 o 3.412000  0.3591000     3.162000  0.4109000     3.663000  0.5890000     -0.5011000     0.7182000 
1 1 1 13 10 12 o 12.23000  0.1928000     12.16000  0.2229000     12.29000  0.3146000     -0.1330000     0.3855000 
1 1 1 13 10 13 f 18.09000  0.2035000     18.38000  0.2906000     17.81000  0.2848000     0.5620000      0.4069000 
1 1 1 13 10 14 o 5.274000  0.4007000     4.403000  0.6534000     6.144000  0.4641000     -1.741000      0.8014000 
1 1 1 13 10 15 o 2.029000  0.5678000     1.812000  0.7793000     2.247000  0.8259000     -0.4351000     1.136000  
1 1 1 13 10 16 o 9.718000  0.2830000     9.861000  0.3699000     9.575000  0.4285000     0.2867000      0.5660000 
1 1 1 13 10 17 o 11.93000  0.2521000     11.82000  0.3638000     12.04000  0.3489000     -0.2197000     0.5041000 
1 1 1 13 10 18 o 5.995000  0.4378000     6.204000  0.6323000     5.787000  0.6056000     0.4165000      0.8755000 
1 1 1 13 10 19 o 4.355000  0.7469000     3.821000  1.114000      4.890000  0.9953000     -1.068000      1.494000  
1 1 1 13 10 20 o 3.571000  0.6557000     2.783000  0.9859000     4.359000  0.8649000     -1.576000      1.311000  
1 1 1 13 10 21 o 2.769000  0.6898000     2.976000  0.8993000     2.563000  1.046000      0.4130000      1.380000  
1 1 1 13 10 22 o 1.672000  0.5081000     1.986000  0.7843000     1.357000  0.6462000     0.6291000      1.016000  
1 1 1 13 10 23 o 1.905000  0.5289000     2.123000  0.7778000     1.687000  0.7170000     0.4364000      1.058000  
1 1 1 13 10 24 o 1.510000  0.4898000     1.627000  0.7236000     1.393000  0.6603000     0.2339000      0.9796000 
1 1 1 13 10 25 o 1.820000  0.5143000     1.594000  0.6922000     2.046000  0.7607000     -0.4520000     1.029000  
1 1 1 13 10 26 f 1.827000  0.5146000     1.554000  0.6819000     2.100000  0.7709000     -0.5459000     1.029000  
1 1 1 13 11 0  o 8.114000  0.1331000     8.114000  0.1331000     8.114000  0.1331000     -0.000000      0.000000  
1 1 1 13 11 1  o 9.562000  0.1089000     9.654000  0.1651000     9.469000  0.1420000     0.1850000      0.2178000 
1 1 1 13 11 2  o 1.401000  0.2714000     1.015000  0.3814000     1.788000  0.3863000     -0.7731000     0.5428000 
1 1 1 13 11 3  o 8.434000  0.1348000     8.537000  0.1638000     8.331000  0.2143000     0.2061000      0.2697000 
1 1 1 13 11 4  o 15.85000  0.1545000     15.90000  0.2355000     15.80000  0.2000000     0.1012000      0.3090000 
1 1 1 13 11 5  o 8.140000  0.1101000     8.040000  0.1550000     8.241000  0.1565000     -0.2007000     0.2202000 
1 1 1 13 11 6  o 7.248000  0.1162000     7.262000  0.1639000     7.235000  0.1646000     0.2769000E-01  0.2323000 
1 1 1 13 11 7  f 10.64000  0.1346000     10.66000  0.2135000     10.61000  0.1642000     0.5797000E-01  0.2693000 
1 1 1 13 11 8  o 6.053000  0.1613000     6.219000  0.2198000     5.887000  0.2361000     0.3318000      0.3226000 
1 1 1 13 11 9  o 5.199000  0.2698000     5.356000  0.2484000     5.042000  0.4791000     0.3141000      0.5397000 
1 1 1 13 11 10 o 3.100000  0.3436000     2.969000  0.4865000     3.231000  0.4852000     -0.2624000     0.6871000 
1 1 1 13 11 11 o 11.69000  0.1675000     11.96000  0.2342000     11.42000  0.2395000     0.5446000      0.3350000 
1 1 1 13 11 12 o 6.601000  0.2410000     6.463000  0.2585000     6.738000  0.4067000     -0.2752000     0.4819000 
1 1 1 13 11 13 o 3.594000  0.4254000     3.557000  0.4448000     3.632000  0.7253000     -0.7483000E-01 0.8508000 
1 1 1 13 11 14 o 3.096000  0.5854000     3.618000  0.7870000     2.575000  0.8669000     1.042000       1.171000  
1 1 1 13 11 15 o 7.219000  0.2918000     6.876000  0.4280000     7.562000  0.3969000     -0.6856000     0.5837000 
1 1 1 13 11 16 o 1.886000  0.5679000     2.081000  0.8447000     1.692000  0.7594000     0.3885000      1.136000  
1 1 1 13 11 17 o 3.573000  0.6305000     3.327000  0.9599000     3.819000  0.8176000     -0.4913000     1.261000  
1 1 1 13 11 18 o 4.700000  0.5528000     5.046000  0.7908000     4.354000  0.7727000     0.6918000      1.106000  
1 1 1 13 11 19 o 2.602000  0.7523000     2.726000  1.082000      2.478000  1.046000      0.2480000      1.505000  
1 1 1 13 11 20 o 2.044000  0.6276000     1.910000  0.8567000     2.179000  0.9175000     -0.2697000     1.255000  
1 1 1 13 11 21 o 2.603000  0.5486000     1.491000  0.6882000     3.714000  0.8545000     -2.223000      1.097000  
1 1 1 13 11 22 o 1.443000  0.4722000     1.358000  0.6324000     1.529000  0.7015000     -0.1716000     0.9444000 
1 1 1 13 11 23 f 1.569000  0.4865000     1.681000  0.7137000     1.456000  0.6614000     0.2254000      0.9731000 
1 1 1 13 11 24 o 1.627000  0.5321000     1.673000  0.7760000     1.582000  0.7282000     0.9153000E-01  1.064000  
1 1 1 13 11 25 o 1.306000  0.4387000     1.377000  0.6410000     1.235000  0.5992000     0.1416000      0.8775000 
1 1 1 13 11 26 o 1.355000  0.4483000     1.409000  0.6532000     1.302000  0.6143000     0.1069000      0.8967000 
1 1 1 13 12 0  o 4.910000  0.2062000     4.910000  0.2062000     4.910000  0.2062000     0.000000       0.000000  
1 1 1 13 12 1  o 4.313000  0.1923000     4.449000  0.2082000     4.177000  0.3233000     0.2723000      0.3845000 
1 1 1 13 12 2  o 14.65000  0.2109000     15.02000  0.2156000     14.27000  0.3625000     0.7489000      0.4218000 
1 1 1 13 12 3  o 18.05000  0.1895000     18.09000  0.3099000     18.01000  0.2181000     0.7686000E-01  0.3790000 
1 1 1 13 12 4  o 7.491000  0.1070000     7.625000  0.1511000     7.357000  0.1514000     0.2684000      0.2139000 
1 1 1 13 12 5  o 3.001000  0.1764000     3.421000  0.2139000     2.581000  0.2806000     0.8399000      0.3528000 
1 1 1 13 12 6  o 3.724000  0.1511000     3.520000  0.2184000     3.928000  0.2089000     -0.4076000     0.3022000 
1 1 1 13 12 7  o 9.847000  0.1341000     9.965000  0.2125000     9.728000  0.1638000     0.2373000      0.2683000 
1 1 1 13 12 8  o 9.119000  0.1463000     9.098000  0.2029000     9.141000  0.2107000     -0.4272000E-01 0.2925000 
1 1 1 13 12 9  o 9.736000  0.1512000     9.765000  0.2092000     9.706000  0.2183000     0.5875000E-01  0.3024000 
1 1 1 13 12 10 o 11.86000  0.2790000     12.08000  0.5083000     11.63000  0.2304000     0.4432000      0.5581000 
1 1 1 13 12 11 f 6.584000  0.1867000     6.833000  0.2536000     6.336000  0.2742000     0.4964000      0.3735000 
1 1 1 13 12 12 o 10.09000  0.1776000     10.28000  0.2493000     9.910000  0.2531000     0.3689000      0.3553000 
1 1 1 13 12 13 o 3.417000  0.3599000     3.559000  0.4677000     3.276000  0.5471000     0.2827000      0.7198000 
1 1 1 13 12 14 o 2.758000  0.5640000     3.327000  0.5722000     2.189000  0.9721000     1.138000       1.128000  
1 1 1 13 12 15 o 10.15000  0.2827000     10.03000  0.2565000     10.26000  0.5039000     -0.2356000     0.5655000 
1 1 1 13 12 16 o 8.153000  0.2885000     8.445000  0.4002000     7.861000  0.4156000     0.5837000      0.5770000 
1 1 1 13 12 17 f 2.810000  0.6857000     2.819000  0.9893000     2.800000  0.9497000     0.1983000E-01  1.371000  
1 1 1 13 12 18 o 9.362000  0.3201000     9.446000  0.4835000     9.279000  0.4197000     0.1669000      0.6403000 
1 1 1 13 12 19 o 2.936000  0.7830000     2.848000  1.092000      3.024000  1.122000      -0.1761000     1.566000  
1 1 1 13 12 20 o 2.190000  0.6477000     1.987000  0.8813000     2.393000  0.9493000     -0.4063000     1.295000  
1 1 1 13 12 21 o 1.812000  0.5585000     1.859000  0.7857000     1.765000  0.7940000     0.9419000E-01  1.117000  
1 1 1 13 12 22 o 1.725000  0.5220000     1.614000  0.7067000     1.836000  0.7684000     -0.2223000     1.044000  
1 1 1 13 12 23 o 1.623000  0.4947000     1.766000  0.7304000     1.480000  0.6674000     0.2865000      0.9894000 
1 1 1 13 12 24 o 1.775000  0.5466000     1.947000  0.8083000     1.603000  0.7361000     0.3437000      1.093000  
1 1 1 13 12 25 o 1.677000  0.5072000     1.322000  0.6274000     2.033000  0.7971000     -0.7107000     1.014000  
1 1 1 13 12 26 o 1.677000  0.5129000     1.935000  0.7817000     1.419000  0.6641000     0.5160000      1.026000  
1 1 1 13 13 0  o 4.669000  0.2137000     4.669000  0.2137000     4.669000  0.2137000     -0.000000      0.000000  
1 1 1 13 13 1  o 7.285000  0.1391000     7.456000  0.1971000     7.115000  0.1962000     0.3411000      0.2781000 
1 1 1 13 13 2  o 10.08000  0.1187000     10.21000  0.1810000     9.951000  0.1537000     0.2603000      0.2374000 
1 1 1 13 13 3  f 3.843000  0.1305000     4.047000  0.1824000     3.640000  0.1867000     0.4076000      0.2611000 
1 1 1 13 13 4  o 7.699000  0.1088000     7.554000  0.1532000     7.844000  0.1546000     -0.2907000     0.2176000 
1 1 1 13 13 5  o 10.61000  0.1197000     10.74000  0.1696000     10.48000  0.1690000     0.2606000      0.2394000 
1 1 1 13 13 6  f 6.771000  0.1200000     6.710000  0.1714000     6.832000  0.1681000     -0.1225000     0.2401000 
1 1 1 13 13 7  o 8.322000  0.1263000     8.389000  0.1783000     8.254000  0.1788000     0.1351000      0.2525000 
1 1 1 13 13 8  o 2.068000  0.3699000     2.285000  0.5560000     1.851000  0.4879000     0.4340000      0.7397000 
1 1 1 13 13 9  o 7.572000  0.1606000     7.658000  0.2197000     7.485000  0.2344000     0.1726000      0.3213000 
1 1 1 13 13 10 o 10.50000  0.2331000     10.10000  0.3576000     10.91000  0.2989000     -0.8060000     0.4661000 
1 1 1 13 13 11 o 9.438000  0.1710000     9.473000  0.2360000     9.402000  0.2476000     0.7041000E-01  0.3421000 
1 1 1 13 13 12 o 8.080000  0.1894000     8.116000  0.2663000     8.044000  0.2694000     0.7170000E-01  0.3788000 
1 1 1 13 13 13 o 7.824000  0.2010000     7.863000  0.2830000     7.786000  0.2856000     0.7683000E-01  0.4021000 
1 1 1 13 13 14 o 8.443000  0.2906000     8.498000  0.2851000     8.389000  0.5064000     0.1089000      0.5811000 
1 1 1 13 13 15 o 6.006000  0.3924000     5.693000  0.3800000     6.318000  0.6866000     -0.6245000     0.7848000 
1 1 1 13 13 16 o 3.435000  0.5408000     2.928000  0.6574000     3.942000  0.8589000     -1.014000      1.082000  
1 1 1 13 13 17 o 3.107000  0.6253000     2.270000  0.9455000     3.944000  0.8185000     -1.673000      1.251000  
1 1 1 13 13 18 o 7.677000  0.3545000     8.230000  0.5025000     7.124000  0.5002000     1.106000       0.7090000 
1 1 1 13 13 19 o 6.994000  0.4949000     6.263000  0.7657000     7.726000  0.6270000     -1.463000      0.9897000 
1 1 1 13 13 20 o 2.337000  0.6543000     2.811000  0.9793000     1.862000  0.8679000     0.9489000      1.309000  
1 1 1 13 13 21 o 1.635000  0.5242000     1.684000  0.7512000     1.587000  0.7314000     0.9728000E-01  1.048000  
1 1 1 13 13 22 o 1.447000  0.4726000     1.213000  0.5847000     1.680000  0.7427000     -0.4664000     0.9452000 
1 1 1 13 13 23 o 1.956000  0.5118000     2.435000  0.7689000     1.477000  0.6758000     0.9575000      1.024000  
1 1 1 13 13 24 o 1.646000  0.5183000     1.590000  0.7265000     1.701000  0.7394000     -0.1104000     1.037000  
1 1 1 13 13 25 o 1.281000  0.4356000     1.448000  0.6756000     1.115000  0.5501000     0.3336000      0.8712000 
1 1 1 13 13 26 f 1.000000  0.3615000     0.9775000 0.5035000     1.023000  0.5188000     -0.4535000E-01 0.7230000 
1 1 1 13 14 0  o 16.39000  0.2024000     16.39000  0.2024000     16.39000  0.2024000     0.000000       0.000000  
1 1 1 13 14 1  o 12.24000  0.1188000     12.21000  0.1677000     12.26000  0.1684000     -0.4965000E-01 0.2377000 
1 1 1 13 14 2  o 11.15000  0.1148000     11.27000  0.1625000     11.03000  0.1623000     0.2370000      0.2297000 
1 1 1 13 14 3  o 11.07000  0.1171000     11.20000  0.1662000     10.93000  0.1650000     0.2671000      0.2342000 
1 1 1 13 14 4  o 8.128000  0.1119000     8.165000  0.1582000     8.090000  0.1584000     0.7487000E-01  0.2238000 
1 1 1 13 14 5  o 3.250000  0.1693000     3.436000  0.2286000     3.064000  0.2499000     0.3720000      0.3386000 
1 1 1 13 14 6  o 2.117000  0.2670000     1.688000  0.4411000     2.546000  0.3007000     -0.8581000     0.5339000 
1 1 1 13 14 7  o 5.087000  0.1472000     5.309000  0.1987000     4.864000  0.2173000     0.4455000      0.2944000 
1 1 1 13 14 8  o 7.830000  0.1859000     7.739000  0.2706000     7.922000  0.2550000     -0.1829000     0.3718000 
1 1 1 13 14 9  o 17.04000  0.1879000     17.00000  0.2431000     17.08000  0.2866000     -0.7322000E-01 0.3759000 
1 1 1 13 14 10 o 14.45000  0.1683000     14.43000  0.2356000     14.46000  0.2404000     -0.2592000E-01 0.3366000 
1 1 1 13 14 11 o 16.33000  0.1804000     16.30000  0.2537000     16.37000  0.2565000     -0.7263000E-01 0.3608000 
1 1 1 13 14 12 o 3.121000  0.3753000     2.616000  0.5812000     3.626000  0.4750000     -1.010000      0.7506000 
1 1 1 13 14 13 o 11.97000  0.1842000     12.01000  0.2598000     11.92000  0.2612000     0.8372000E-01  0.3684000 
1 1 1 13 14 14 f 3.283000  0.4431000     3.141000  0.5968000     3.425000  0.6551000     -0.2833000     0.8862000 
1 1 1 13 14 15 o 4.643000  0.3701000     4.367000  0.5531000     4.919000  0.4920000     -0.5512000     0.7403000 
1 1 1 13 14 16 o 5.819000  0.2874000     6.077000  0.3855000     5.561000  0.4264000     0.5164000      0.5748000 
1 1 1 13 14 17 o 2.924000  0.6173000     2.277000  0.7893000     3.572000  0.9492000     -1.295000      1.235000  
1 1 1 13 14 18 o 2.451000  0.6053000     2.754000  0.7844000     2.149000  0.9222000     0.6049000      1.211000  
1 1 1 13 14 19 o 2.371000  0.6710000     2.124000  0.9237000     2.618000  0.9736000     -0.4943000     1.342000  
1 1 1 13 14 20 f 1.892000  0.6203000     2.000000  0.9157000     1.784000  0.8370000     0.2155000      1.241000  
1 1 1 13 14 21 o 1.808000  0.5451000     1.596000  0.7103000     2.020000  0.8270000     -0.4234000     1.090000  
1 1 1 13 14 22 o 2.010000  0.5492000     2.094000  0.7744000     1.925000  0.7789000     0.1694000      1.098000  
1 1 1 13 14 23 o 1.416000  0.4605000     1.519000  0.6767000     1.314000  0.6249000     0.2044000      0.9211000 
1 1 1 13 14 24 o 1.408000  0.4678000     1.732000  0.7656000     1.084000  0.5377000     0.6474000      0.9356000 
1 1 1 13 14 25 o 1.339000  0.4441000     1.071000  0.5337000     1.607000  0.7100000     -0.5352000     0.8882000 
1 1 1 13 15 0  f 3.408000  0.1992000     3.408000  0.1992000     3.408000  0.1992000     -0.000000      0.000000  
1 1 1 13 15 1  o 13.87000  0.1294000     14.01000  0.1838000     13.73000  0.1821000     0.2833000      0.2587000 
1 1 1 13 15 2  o 10.51000  0.1141000     10.36000  0.1595000     10.67000  0.1633000     -0.3142000     0.2283000 
1 1 1 13 15 3  o 8.293000  0.1108000     8.276000  0.1571000     8.311000  0.1564000     -0.3526000E-01 0.2216000 
1 1 1 13 15 4  o 4.943000  0.1275000     4.860000  0.1838000     5.027000  0.1769000     -0.1673000     0.2551000 
1 1 1 13 15 5  o 4.107000  0.1448000     4.068000  0.2109000     4.145000  0.1985000     -0.7710000E-01 0.2896000 
1 1 1 13 15 6  o 7.461000  0.1250000     7.544000  0.1749000     7.378000  0.1788000     0.1668000      0.2501000 
1 1 1 13 15 7  o 10.83000  0.1337000     10.71000  0.1875000     10.94000  0.1906000     -0.2314000     0.2674000 
1 1 1 13 15 8  o 6.983000  0.1676000     7.142000  0.1922000     6.824000  0.2746000     0.3179000      0.3351000 
1 1 1 13 15 9  o 6.282000  0.2164000     6.477000  0.3054000     6.087000  0.3068000     0.3892000      0.4329000 
1 1 1 13 15 10 o 14.32000  0.1693000     14.47000  0.2375000     14.18000  0.2412000     0.2871000      0.3386000 
1 1 1 13 15 11 o 9.436000  0.1733000     9.534000  0.2385000     9.337000  0.2515000     0.1964000      0.3466000 
1 1 1 13 15 12 o 2.634000  0.4217000     2.792000  0.5532000     2.476000  0.6366000     0.3159000      0.8434000 
1 1 1 13 15 13 o 8.993000  0.2065000     8.828000  0.2710000     9.158000  0.3117000     -0.3292000     0.4130000 
1 1 1 13 15 14 o 9.601000  0.1993000     9.847000  0.2741000     9.355000  0.2894000     0.4914000      0.3986000 
1 1 1 13 15 15 o 7.055000  0.4880000     6.750000  0.9082000     7.360000  0.3576000     -0.6097000     0.9760000 
1 1 1 13 15 16 o 7.762000  0.2406000     7.603000  0.3440000     7.920000  0.3366000     -0.3169000     0.4813000 
1 1 1 13 15 17 o 4.997000  0.3427000     5.139000  0.4625000     4.855000  0.5058000     0.2843000      0.6853000 
1 1 1 13 15 18 o 5.066000  0.3575000     5.233000  0.4630000     4.899000  0.5448000     0.3333000      0.7149000 
1 1 1 13 15 19 o 5.368000  0.5811000     6.744000  0.4016000     3.993000  1.091000      2.751000       1.162000  
1 1 1 13 15 20 o 2.038000  0.6677000     1.706000  0.7495000     2.369000  1.105000      -0.6631000     1.335000  
1 1 1 13 15 21 o 1.332000  0.4489000     1.349000  0.6386000     1.314000  0.6311000     0.3467000E-01  0.8979000 
1 1 1 13 15 22 o 3.475000  0.4910000     3.284000  0.6920000     3.665000  0.6967000     -0.3814000     0.9819000 
1 1 1 13 15 23 o 1.975000  0.5460000     1.907000  0.7470000     2.042000  0.7966000     -0.1350000     1.092000  
1 1 1 13 15 24 o 1.180000  0.4112000     1.308000  0.6344000     1.053000  0.5234000     0.2552000      0.8224000 
1 1 1 13 15 25 o 1.293000  0.4471000     1.472000  0.7015000     1.114000  0.5544000     0.3576000      0.8941000 
1 1 1 13 16 0  f 6.635000  0.1539000     6.635000  0.1539000     6.635000  0.1539000     -0.000000      0.000000  
1 1 1 13 16 1  o 1.984000  0.2372000     2.188000  0.3018000     1.779000  0.3659000     0.4099000      0.4743000 
1 1 1 13 16 2  o 12.79000  0.1265000     12.63000  0.1770000     12.95000  0.1807000     -0.3234000     0.2530000 
1 1 1 13 16 3  o 4.028000  0.1388000     4.180000  0.1895000     3.875000  0.2027000     0.3043000      0.2775000 
1 1 1 13 16 4  o 12.16000  0.1272000     12.10000  0.1796000     12.21000  0.1801000     -0.1059000     0.2544000 
1 1 1 13 16 5  o 4.167000  0.1489000     4.143000  0.2087000     4.191000  0.2123000     -0.4754000E-01 0.2978000 
1 1 1 13 16 6  o 4.969000  0.1448000     4.942000  0.2041000     4.996000  0.2055000     -0.5383000E-01 0.2896000 
1 1 1 13 16 7  o 8.433000  0.1577000     8.336000  0.2553000     8.531000  0.1853000     -0.1949000     0.3155000 
1 1 1 13 16 8  o 12.06000  0.1425000     12.16000  0.2018000     11.97000  0.2013000     0.1941000      0.2851000 
1 1 1 13 16 9  o 13.66000  0.1881000     13.85000  0.3102000     13.47000  0.2128000     0.3796000      0.3761000 
1 1 1 13 16 10 o 13.05000  0.1779000     12.99000  0.2659000     13.11000  0.2364000     -0.1235000     0.3558000 
1 1 1 13 16 11 o 13.24000  0.1733000     13.24000  0.2436000     13.25000  0.2466000     -0.1466000E-01 0.3467000 
1 1 1 13 16 12 o 15.39000  0.2072000     15.13000  0.2590000     15.65000  0.3235000     -0.5202000     0.4144000 
1 1 1 13 16 13 o 17.04000  0.2197000     17.00000  0.3110000     17.07000  0.3105000     -0.7087000E-01 0.4394000 
1 1 1 13 16 14 o 7.698000  0.2329000     7.693000  0.3389000     7.703000  0.3197000     -0.9164000E-02 0.4659000 
1 1 1 13 16 15 o 7.703000  0.3811000     7.832000  0.5898000     7.575000  0.4826000     0.2565000      0.7621000 
1 1 1 13 16 16 o 6.461000  0.2765000     6.645000  0.3755000     6.276000  0.4059000     0.3689000      0.5529000 
1 1 1 13 16 17 o 8.813000  0.2408000     8.325000  0.3510000     9.301000  0.3297000     -0.9764000     0.4816000 
1 1 1 13 16 18 o 3.184000  0.5337000     3.023000  0.7399000     3.345000  0.7692000     -0.3215000     1.067000  
1 1 1 13 16 19 o 2.542000  0.5605000     2.776000  0.7854000     2.309000  0.7998000     0.4666000      1.121000  
1 1 1 13 16 20 o 2.222000  0.7061000     2.469000  1.138000      1.975000  0.8360000     0.4932000      1.412000  
1 1 1 13 16 21 o 3.065000  0.5952000     2.780000  0.6528000     3.350000  0.9953000     -0.5707000     1.190000  
1 1 1 13 16 22 o 1.704000  0.5304000     1.407000  0.6148000     2.000000  0.8644000     -0.5932000     1.061000  
1 1 1 13 16 23 o 2.226000  0.4978000     2.718000  0.5887000     1.734000  0.8030000     0.9846000      0.9957000 
1 1 1 13 16 24 o 1.443000  0.4621000     1.428000  0.6535000     1.457000  0.6533000     -0.2913000E-01 0.9241000 
1 1 1 13 16 25 o 1.297000  0.4499000     1.290000  0.6365000     1.305000  0.6359000     -0.1496000E-01 0.8998000 
1 1 1 13 17 0  o 29.00000  0.3302000     29.00000  0.3302000     29.00000  0.3302000     0.000000       0.000000  
1 1 1 13 17 1  o 6.995000  0.1117000     6.904000  0.1577000     7.086000  0.1582000     -0.1811000     0.2234000 
1 1 1 13 17 2  o 2.608000  0.1968000     2.418000  0.2928000     2.798000  0.2630000     -0.3793000     0.3936000 
1 1 1 13 17 3  o 4.302000  0.1372000     4.275000  0.1941000     4.330000  0.1941000     -0.5466000E-01 0.2745000 
1 1 1 13 17 4  o 8.006000  0.1182000     7.982000  0.1683000     8.030000  0.1660000     -0.4800000E-01 0.2364000 
1 1 1 13 17 5  o 5.629000  0.1346000     5.479000  0.1928000     5.779000  0.1880000     -0.3002000     0.2693000 
1 1 1 13 17 6  o 6.980000  0.1333000     6.957000  0.1877000     7.002000  0.1892000     -0.4507000E-01 0.2666000 
1 1 1 13 17 7  o 10.89000  0.1862000     10.81000  0.2665000     10.97000  0.2600000     -0.1664000     0.3723000 
1 1 1 13 17 8  o 13.04000  0.1596000     12.99000  0.2076000     13.09000  0.2426000     -0.9911000E-01 0.3193000 
1 1 1 13 17 9  o 9.813000  0.1444000     9.427000  0.2068000     10.20000  0.2016000     -0.7719000     0.2888000 
1 1 1 13 17 10 o 14.48000  0.1716000     14.49000  0.2730000     14.46000  0.2080000     0.2986000E-01  0.3432000 
1 1 1 13 17 11 o 18.37000  0.1900000     18.34000  0.2679000     18.41000  0.2694000     -0.6925000E-01 0.3800000 
1 1 1 13 17 12 o 7.674000  0.1975000     7.689000  0.2702000     7.659000  0.2881000     0.3055000E-01  0.3950000 
1 1 1 13 17 13 o 15.90000  0.2570000     16.18000  0.3030000     15.63000  0.4152000     0.5469000      0.5140000 
1 1 1 13 17 14 o 15.05000  0.1968000     15.19000  0.2749000     14.91000  0.2818000     0.2788000      0.3937000 
1 1 1 13 17 15 o 5.608000  0.3047000     6.327000  0.3734000     4.889000  0.4815000     1.439000       0.6093000 
1 1 1 13 17 16 o 5.994000  0.2972000     6.735000  0.3784000     5.253000  0.4583000     1.483000       0.5943000 
1 1 1 13 17 17 o 2.389000  0.5499000     2.082000  0.7847000     2.696000  0.7706000     -0.6144000     1.100000  
1 1 1 13 17 18 o 2.274000  0.5420000     2.770000  0.7938000     1.778000  0.7381000     0.9927000      1.084000  
1 1 1 13 17 19 o 2.397000  0.5685000     2.269000  0.7952000     2.526000  0.8127000     -0.2570000     1.137000  
1 1 1 13 17 20 o 2.220000  0.6133000     1.904000  0.8862000     2.536000  0.8481000     -0.6323000     1.227000  
1 1 1 13 17 21 o 1.504000  0.4735000     1.597000  0.6831000     1.410000  0.6561000     0.1869000      0.9471000 
1 1 1 13 17 22 o 2.978000  0.5037000     2.798000  0.6905000     3.159000  0.7336000     -0.3609000     1.007000  
1 1 1 13 17 23 o 2.530000  0.5465000     2.808000  0.5922000     2.252000  0.9187000     0.5558000      1.093000  
1 1 1 13 17 24 o 1.471000  0.4701000     1.400000  0.6151000     1.541000  0.7112000     -0.1411000     0.9403000 
1 1 1 13 17 25 f 1.255000  0.4308000     0.9924000 0.5008000     1.518000  0.7010000     -0.5256000     0.8615000 
1 1 1 13 18 0  o 5.064000  0.1765000     5.064000  0.1765000     5.064000  0.1765000     0.000000       0.000000  
1 1 1 13 18 1  f 8.679000  0.1137000     8.831000  0.1607000     8.527000  0.1609000     0.3040000      0.2274000 
1 1 1 13 18 2  o 13.61000  0.1332000     13.47000  0.1869000     13.74000  0.1899000     -0.2650000     0.2665000 
1 1 1 13 18 3  o 14.54000  0.1396000     14.36000  0.1957000     14.71000  0.1991000     -0.3410000     0.2791000 
1 1 1 13 18 4  o 4.718000  0.1415000     4.494000  0.2064000     4.941000  0.1935000     -0.4467000     0.2829000 
1 1 1 13 18 5  o 8.038000  0.1270000     8.161000  0.1796000     7.916000  0.1796000     0.2452000      0.2540000 
1 1 1 13 18 6  o 14.88000  0.1631000     14.62000  0.2463000     15.14000  0.2139000     -0.5267000     0.3262000 
1 1 1 13 18 7  o 13.42000  0.1554000     13.27000  0.2051000     13.57000  0.2336000     -0.3006000     0.3109000 
1 1 1 13 18 8  o 11.31000  0.2806000     11.10000  0.4742000     11.52000  0.3001000     -0.4251000     0.5612000 
1 1 1 13 18 9  o 6.755000  0.1551000     6.790000  0.2178000     6.720000  0.2210000     0.7000000E-01  0.3103000 
1 1 1 13 18 10 o 10.18000  0.1507000     10.14000  0.2134000     10.21000  0.2127000     -0.7699000E-01 0.3013000 
1 1 1 13 18 11 o 12.99000  0.1719000     13.11000  0.2713000     12.87000  0.2112000     0.2345000      0.3438000 
1 1 1 13 18 12 o 10.98000  0.1813000     11.03000  0.2534000     10.94000  0.2594000     0.9613000E-01  0.3626000 
1 1 1 13 18 13 o 2.688000  0.5817000     2.553000  0.6527000     2.823000  0.9630000     -0.2696000     1.163000  
1 1 1 13 18 14 o 3.482000  0.4486000     2.679000  0.7135000     4.286000  0.5440000     -1.607000      0.8973000 
1 1 1 13 18 15 o 4.086000  0.3964000     4.280000  0.5077000     3.892000  0.6089000     0.3879000      0.7928000 
1 1 1 13 18 16 o 6.209000  0.2992000     6.217000  0.4222000     6.202000  0.4240000     0.1489000E-01  0.5984000 
1 1 1 13 18 17 o 6.473000  0.2916000     6.723000  0.4026000     6.223000  0.4220000     0.5001000      0.5833000 
1 1 1 13 18 18 o 3.041000  0.5761000     2.818000  0.8331000     3.264000  0.7960000     -0.4456000     1.152000  
1 1 1 13 18 19 o 2.273000  0.5444000     2.828000  0.7917000     1.718000  0.7475000     1.110000       1.089000  
1 1 1 13 18 20 o 3.519000  0.6187000     3.063000  1.057000      3.975000  0.6433000     -0.9120000     1.237000  
1 1 1 13 18 21 o 2.905000  0.5151000     2.044000  0.7544000     3.766000  0.7017000     -1.722000      1.030000  
1 1 1 13 18 22 o 1.387000  0.4457000     1.278000  0.5904000     1.497000  0.6679000     -0.2191000     0.8915000 
1 1 1 13 18 23 o 1.341000  0.4380000     1.214000  0.5680000     1.467000  0.6670000     -0.2530000     0.8761000 
1 1 1 13 18 24 o 1.874000  0.4987000     2.105000  0.7109000     1.643000  0.6995000     0.4615000      0.9973000 
1 1 1 13 18 25 o 1.332000  0.4316000     1.125000  0.5465000     1.538000  0.6683000     -0.4133000     0.8633000 
1 1 1 13 19 0  o 19.20000  0.2356000     19.20000  0.2356000     19.20000  0.2356000     0.000000       0.000000  
1 1 1 13 19 1  o 10.09000  0.1194000     10.06000  0.1689000     10.12000  0.1687000     -0.6329000E-01 0.2387000 
1 1 1 13 19 2  o 5.973000  0.1229000     5.898000  0.1747000     6.049000  0.1729000     -0.1509000     0.2458000 
1 1 1 13 19 3  o 6.013000  0.1276000     6.152000  0.1771000     5.874000  0.1839000     0.2779000      0.2553000 
1 1 1 13 19 4  f 7.538000  0.1247000     7.529000  0.1771000     7.548000  0.1758000     -0.1901000E-01 0.2495000 
1 1 1 13 19 5  o 14.26000  0.1448000     14.02000  0.2039000     14.50000  0.2058000     -0.4763000     0.2897000 
1 1 1 13 19 6  o 12.17000  0.2058000     11.68000  0.2732000     12.65000  0.3079000     -0.9676000     0.4116000 
1 1 1 13 19 7  o 14.53000  0.1637000     14.53000  0.2156000     14.53000  0.2464000     -0.8831000E-03 0.3275000 
1 1 1 13 19 8  o 9.986000  0.1600000     9.988000  0.2485000     9.984000  0.2016000     0.4257000E-02  0.3199000 
1 1 1 13 19 9  o 12.23000  0.1696000     12.42000  0.2378000     12.04000  0.2418000     0.3832000      0.3392000 
1 1 1 13 19 10 o 3.875000  0.2242000     3.452000  0.3380000     4.298000  0.2947000     -0.8453000     0.4484000 
1 1 1 13 19 11 o 6.431000  0.1974000     6.355000  0.3142000     6.507000  0.2391000     -0.1517000     0.3948000 
1 1 1 13 19 12 o 7.578000  0.2011000     7.552000  0.2755000     7.604000  0.2931000     -0.5251000E-01 0.4022000 
1 1 1 13 19 13 o 3.565000  0.4224000     4.065000  0.4526000     3.066000  0.7133000     0.9990000      0.8448000 
1 1 1 13 19 14 o 10.18000  0.3788000     10.20000  0.6792000     10.16000  0.3357000     0.4291000E-01  0.7576000 
1 1 1 13 19 15 o 11.71000  0.2069000     11.47000  0.2910000     11.95000  0.2941000     -0.4715000     0.4138000 
1 1 1 13 19 16 f 3.225000  0.5178000     3.848000  0.5932000     2.601000  0.8488000     1.247000       1.036000  
1 1 1 13 19 17 o 5.753000  0.3244000     5.579000  0.4529000     5.928000  0.4645000     -0.3487000     0.6488000 
1 1 1 13 19 18 o 1.983000  0.6022000     2.103000  0.8225000     1.863000  0.8797000     0.2391000      1.204000  
1 1 1 13 19 19 o 3.096000  0.5208000     3.730000  0.6484000     2.461000  0.8152000     1.269000       1.042000  
1 1 1 13 19 20 o 2.471000  0.5575000     2.691000  0.7514000     2.251000  0.8238000     0.4405000      1.115000  
1 1 1 13 19 21 o 2.958000  0.5182000     3.285000  0.6382000     2.631000  0.8166000     0.6543000      1.036000  
1 1 1 13 19 22 o 1.547000  0.4730000     1.485000  0.6424000     1.609000  0.6944000     -0.1241000     0.9460000 
1 1 1 13 19 23 o 1.265000  0.4260000     0.9976000 0.4895000     1.532000  0.6973000     -0.5340000     0.8519000 
1 1 1 13 19 24 o 1.260000  0.4185000     1.239000  0.5784000     1.280000  0.6050000     -0.4066000E-01 0.8370000 
1 1 1 13 19 25 o 1.310000  0.4277000     1.157000  0.5514000     1.462000  0.6539000     -0.3048000     0.8554000 
1 1 1 13 20 0  o 5.045000  0.1885000     5.045000  0.1885000     5.045000  0.1885000     -0.000000      0.000000  
1 1 1 13 20 1  o 14.77000  0.1416000     14.87000  0.2011000     14.67000  0.1995000     0.1944000      0.2833000 
1 1 1 13 20 2  o 7.160000  0.1215000     7.357000  0.1710000     6.962000  0.1726000     0.3953000      0.2430000 
1 1 1 13 20 3  o 8.886000  0.1238000     8.998000  0.1735000     8.774000  0.1767000     0.2235000      0.2476000 
1 1 1 13 20 4  o 7.791000  0.1270000     7.708000  0.1803000     7.875000  0.1789000     -0.1667000     0.2540000 
1 1 1 13 20 5  o 16.33000  0.1706000     16.59000  0.2616000     16.08000  0.2191000     0.5146000      0.3413000 
1 1 1 13 20 6  o 7.195000  0.1622000     7.112000  0.1971000     7.279000  0.2576000     -0.1665000     0.3244000 
1 1 1 13 20 7  o 13.11000  0.1921000     13.13000  0.2372000     13.09000  0.3022000     0.4873000E-01  0.3842000 
1 1 1 13 20 8  o 8.112000  0.1724000     8.122000  0.2505000     8.102000  0.2368000     0.2006000E-01  0.3448000 
1 1 1 13 20 9  o 4.432000  0.1988000     4.339000  0.2854000     4.524000  0.2768000     -0.1846000     0.3975000 
1 1 1 13 20 10 o 8.679000  0.1548000     8.769000  0.2192000     8.589000  0.2186000     0.1793000      0.3096000 
1 1 1 13 20 11 f 4.323000  0.2322000     4.375000  0.3172000     4.271000  0.3391000     0.1039000      0.4643000 
1 1 1 13 20 12 o 13.30000  0.2035000     13.20000  0.3295000     13.40000  0.2388000     -0.2004000     0.4069000 
1 1 1 13 20 13 o 12.50000  0.1898000     12.43000  0.2655000     12.57000  0.2714000     -0.1389000     0.3796000 
1 1 1 13 20 14 o 6.153000  0.5038000     6.841000  0.9153000     5.464000  0.4213000     1.377000       1.008000  
1 1 1 13 20 15 o 4.782000  0.3400000     4.073000  0.5253000     5.490000  0.4319000     -1.417000      0.6801000 
1 1 1 13 20 16 o 6.137000  0.2990000     5.985000  0.4204000     6.289000  0.4252000     -0.3037000     0.5979000 
1 1 1 13 20 17 o 2.953000  0.5450000     3.311000  0.7096000     2.595000  0.8275000     0.7159000      1.090000  
1 1 1 13 20 18 o 2.173000  0.6388000     2.316000  0.8340000     2.030000  0.9678000     0.2853000      1.278000  
1 1 1 13 20 19 o 1.492000  0.4835000     1.429000  0.6578000     1.554000  0.7089000     -0.1247000     0.9671000 
1 1 1 13 20 20 o 1.882000  0.5385000     1.848000  0.7430000     1.917000  0.7796000     -0.6964000E-01 1.077000  
1 1 1 13 20 21 o 1.403000  0.4494000     1.021000  0.5053000     1.784000  0.7434000     -0.7624000     0.8989000 
1 1 1 13 20 22 o 1.595000  0.4791000     1.244000  0.5805000     1.947000  0.7622000     -0.7033000     0.9581000 
1 1 1 13 20 23 o 2.255000  0.6691000     1.578000  0.6650000     2.932000  1.161000      -1.354000      1.338000  
1 1 1 13 20 24 o 1.513000  0.4756000     1.470000  0.6416000     1.556000  0.7022000     -0.8638000E-01 0.9512000 
1 1 1 13 20 25 o 1.314000  0.4262000     1.356000  0.6126000     1.273000  0.5927000     0.8248000E-01  0.8524000 
1 1 1 13 21 0  o 13.15000  0.1916000     13.15000  0.1916000     13.15000  0.1916000     0.000000       0.000000  
1 1 1 13 21 1  o 10.34000  0.1253000     10.28000  0.1768000     10.40000  0.1775000     -0.1182000     0.2505000 
1 1 1 13 21 2  o 15.15000  0.1466000     15.16000  0.2073000     15.14000  0.2073000     0.1589000E-01  0.2932000 
1 1 1 13 21 3  o 7.617000  0.1280000     7.447000  0.1790000     7.788000  0.1832000     -0.3404000     0.2561000 
1 1 1 13 21 4  o 17.40000  0.1616000     17.40000  0.2283000     17.40000  0.2287000     -0.6271000E-02 0.3232000 
1 1 1 13 21 5  o 2.668000  0.3403000     2.462000  0.5303000     2.875000  0.4267000     -0.4136000     0.6807000 
1 1 1 13 21 6  o 8.275000  0.1742000     8.199000  0.1949000     8.352000  0.2887000     -0.1537000     0.3483000 
1 1 1 13 21 7  o 9.193000  0.1579000     8.982000  0.2421000     9.405000  0.2028000     -0.4236000     0.3158000 
1 1 1 13 21 8  o 5.994000  0.1637000     6.087000  0.2248000     5.900000  0.2381000     0.1870000      0.3274000 
1 1 1 13 21 9  o 23.42000  0.2082000     23.38000  0.2944000     23.47000  0.2946000     -0.8804000E-01 0.4165000 
1 1 1 13 21 10 o 2.518000  0.3592000     2.360000  0.5242000     2.676000  0.4912000     -0.3154000     0.7184000 
1 1 1 13 21 11 o 9.583000  0.1583000     9.751000  0.2232000     9.415000  0.2244000     0.3363000      0.3165000 
1 1 1 13 21 12 o 13.02000  0.2243000     12.90000  0.3428000     13.15000  0.2893000     -0.2496000     0.4485000 
1 1 1 13 21 13 o 17.81000  0.2036000     17.77000  0.2848000     17.86000  0.2911000     -0.8736000E-01 0.4072000 
1 1 1 13 21 14 o 15.76000  0.2032000     15.64000  0.2856000     15.88000  0.2891000     -0.2329000     0.4064000 
1 1 1 13 21 15 o 3.252000  0.4906000     3.448000  0.6563000     3.056000  0.7293000     0.3923000      0.9811000 
1 1 1 13 21 16 o 1.618000  0.5005000     1.425000  0.6540000     1.811000  0.7577000     -0.3863000     1.001000  
1 1 1 13 21 17 f 2.524000  0.5729000     2.117000  0.8053000     2.932000  0.8150000     -0.8157000     1.146000  
1 1 1 13 21 18 o 2.164000  0.6347000     2.069000  0.7845000     2.259000  0.9980000     -0.1901000     1.269000  
1 1 1 13 21 19 o 4.622000  0.4549000     4.992000  0.6188000     4.252000  0.6671000     0.7404000      0.9099000 
1 1 1 13 21 20 o 2.493000  0.5122000     3.079000  0.6906000     1.908000  0.7565000     1.171000       1.024000  
1 1 1 13 21 21 o 2.380000  0.5446000     2.190000  0.7445000     2.569000  0.7951000     -0.3786000     1.089000  
1 1 1 13 21 22 o 2.029000  0.5187000     1.701000  0.6911000     2.358000  0.7736000     -0.6564000     1.037000  
1 1 1 13 21 23 o 1.560000  0.5082000     1.430000  0.6379000     1.689000  0.7912000     -0.2589000     1.016000  
1 1 1 13 21 24 o 1.279000  0.4285000     1.144000  0.5579000     1.414000  0.6504000     -0.2697000     0.8569000 
1 1 1 13 21 25 o 1.751000  0.4703000     2.392000  0.7680000     1.109000  0.5430000     1.283000       0.9406000 
1 1 1 13 22 0  o 13.37000  0.1951000     13.37000  0.1951000     13.37000  0.1951000     -0.000000      0.000000  
1 1 1 13 22 1  o 8.137000  0.1254000     8.074000  0.1778000     8.201000  0.1768000     -0.1276000     0.2508000 
1 1 1 13 22 2  o 5.071000  0.1464000     4.972000  0.2085000     5.169000  0.2056000     -0.1968000     0.2928000 
1 1 1 13 22 3  o 3.477000  0.1917000     3.540000  0.2662000     3.414000  0.2759000     0.1256000      0.3834000 
1 1 1 13 22 4  o 4.231000  0.2302000     3.993000  0.3722000     4.469000  0.2709000     -0.4759000     0.4604000 
1 1 1 13 22 5  o 19.91000  0.2161000     20.24000  0.2564000     19.58000  0.3478000     0.6618000      0.4321000 
1 1 1 13 22 6  o 9.737000  0.1831000     9.864000  0.2813000     9.610000  0.2345000     0.2538000      0.3662000 
1 1 1 13 22 7  o 13.80000  0.1525000     13.84000  0.2154000     13.76000  0.2160000     0.7888000E-01  0.3050000 
1 1 1 13 22 8  o 25.52000  0.2204000     25.21000  0.3086000     25.82000  0.3148000     -0.6090000     0.4408000 
1 1 1 13 22 9  o 12.44000  0.1540000     12.47000  0.2185000     12.40000  0.2171000     0.6798000E-01  0.3081000 
1 1 1 13 22 10 o 21.83000  0.2018000     22.13000  0.2875000     21.53000  0.2832000     0.6067000      0.4036000 
1 1 1 13 22 11 o 10.16000  0.1616000     9.842000  0.2268000     10.48000  0.2303000     -0.6392000     0.3232000 
1 1 1 13 22 12 o 6.489000  0.2333000     6.591000  0.2704000     6.387000  0.3802000     0.2046000      0.4665000 
1 1 1 13 22 13 o 9.286000  0.2398000     9.378000  0.3272000     9.193000  0.3506000     0.1855000      0.4796000 
1 1 1 13 22 14 o 9.008000  0.2169000     8.734000  0.3034000     9.281000  0.3100000     -0.5465000     0.4337000 
1 1 1 13 22 15 o 3.126000  0.4914000     3.537000  0.6318000     2.716000  0.7527000     0.8205000      0.9827000 
1 1 1 13 22 16 o 8.640000  0.2448000     8.708000  0.3346000     8.571000  0.3575000     0.1376000      0.4897000 
1 1 1 13 22 17 o 5.866000  0.3227000     6.180000  0.4331000     5.553000  0.4785000     0.6267000      0.6454000 
1 1 1 13 22 18 o 5.314000  0.3413000     5.405000  0.4639000     5.224000  0.5006000     0.1805000      0.6825000 
1 1 1 13 22 19 o 2.233000  0.6428000     2.099000  0.9997000     2.367000  0.8084000     -0.2680000     1.286000  
1 1 1 13 22 20 o 1.634000  0.4952000     1.432000  0.6504000     1.837000  0.7469000     -0.4055000     0.9904000 
1 1 1 13 22 21 o 1.466000  0.4703000     1.443000  0.6503000     1.489000  0.6796000     -0.4621000E-01 0.9406000 
1 1 1 13 22 22 o 1.441000  0.4547000     1.553000  0.6609000     1.328000  0.6247000     0.2256000      0.9094000 
1 1 1 13 22 23 o 1.363000  0.4446000     1.418000  0.6359000     1.308000  0.6215000     0.1093000      0.8892000 
1 1 1 13 22 24 o 1.405000  0.4803000     1.337000  0.6791000     1.473000  0.6794000     -0.1360000     0.9606000 
1 1 1 13 23 0  o 5.341000  0.2060000     5.341000  0.2060000     5.341000  0.2060000     -0.000000      0.000000  
1 1 1 13 23 1  o 5.136000  0.1461000     4.985000  0.2108000     5.288000  0.2022000     -0.3033000     0.2921000 
1 1 1 13 23 2  o 8.257000  0.1292000     8.259000  0.1837000     8.255000  0.1818000     0.4278000E-02  0.2584000 
1 1 1 13 23 3  o 6.251000  0.1744000     6.078000  0.2876000     6.424000  0.1972000     -0.3464000     0.3487000 
1 1 1 13 23 4  o 14.98000  0.2325000     14.79000  0.2112000     15.17000  0.4143000     -0.3819000     0.4650000 
1 1 1 13 23 5  o 7.558000  0.1813000     7.713000  0.2728000     7.403000  0.2389000     0.3099000      0.3627000 
1 1 1 13 23 6  o 21.04000  0.1892000     20.99000  0.2673000     21.09000  0.2677000     -0.9931000E-01 0.3783000 
1 1 1 13 23 7  o 11.71000  0.1465000     11.67000  0.2083000     11.75000  0.2060000     -0.8004000E-01 0.2929000 
1 1 1 13 23 8  o 16.46000  0.1675000     16.47000  0.2372000     16.45000  0.2367000     0.1772000E-01  0.3351000 
1 1 1 13 23 9  o 6.606000  0.1763000     6.334000  0.2628000     6.879000  0.2351000     -0.5449000     0.3525000 
1 1 1 13 23 10 o 8.079000  0.1642000     8.009000  0.2339000     8.150000  0.2305000     -0.1406000     0.3284000 
1 1 1 13 23 11 o 15.31000  0.1910000     14.90000  0.2909000     15.72000  0.2475000     -0.8173000     0.3819000 
1 1 1 13 23 12 o 2.793000  0.3867000     2.710000  0.5538000     2.876000  0.5397000     -0.1663000     0.7733000 
1 1 1 13 23 13 o 3.061000  0.5736000     2.249000  1.002000      3.873000  0.5587000     -1.624000      1.147000  
1 1 1 13 23 14 o 13.37000  0.2024000     13.32000  0.2841000     13.43000  0.2885000     -0.1071000     0.4049000 
1 1 1 13 23 15 o 6.415000  0.2833000     6.325000  0.3862000     6.506000  0.4146000     -0.1815000     0.5666000 
1 1 1 13 23 16 o 3.494000  0.5031000     3.488000  0.6709000     3.499000  0.7499000     -0.1131000E-01 1.006000  
1 1 1 13 23 17 o 7.632000  0.2941000     7.746000  0.4142000     7.518000  0.4178000     0.2285000      0.5883000 
1 1 1 13 23 18 o 4.317000  0.3992000     4.036000  0.6029000     4.599000  0.5235000     -0.5638000     0.7984000 
1 1 1 13 23 19 o 1.854000  0.5853000     2.110000  0.9314000     1.598000  0.7089000     0.5118000      1.171000  
1 1 1 13 23 20 o 1.651000  0.4897000     1.856000  0.7261000     1.446000  0.6572000     0.4098000      0.9793000 
1 1 1 13 23 21 o 2.199000  0.5464000     2.186000  0.7522000     2.211000  0.7928000     -0.2479000E-01 1.093000  
1 1 1 13 23 22 o 3.941000  0.4213000     3.593000  0.5929000     4.290000  0.5988000     -0.6970000     0.8426000 
1 1 1 13 23 23 o 1.666000  0.4876000     1.825000  0.7075000     1.507000  0.6712000     0.3177000      0.9752000 
1 1 1 13 23 24 o 1.525000  0.5084000     1.508000  0.7593000     1.542000  0.6763000     -0.3439000E-01 1.017000  
1 1 1 13 24 0  o 10.35000  0.1898000     10.35000  0.1898000     10.35000  0.1898000     0.000000       0.000000  
1 1 1 13 24 1  o 1.731000  0.3604000     1.723000  0.5343000     1.738000  0.4837000     -0.1483000E-01 0.7207000 
1 1 1 13 24 2  o 7.533000  0.1921000     7.474000  0.2721000     7.592000  0.2711000     -0.1180000     0.3841000 
1 1 1 13 24 3  o 18.33000  0.2400000     18.33000  0.2400000     ?         ?             ?              ?         
1 1 1 13 24 4  o 13.02000  0.1869000     13.29000  0.2878000     12.75000  0.2384000     0.5348000      0.3737000 
1 1 1 13 24 5  o 6.970000  0.1568000     6.996000  0.2423000     6.944000  0.1992000     0.5205000E-01  0.3136000 
1 1 1 13 24 6  o 18.47000  0.1740000     18.56000  0.2466000     18.38000  0.2454000     0.1852000      0.3479000 
1 1 1 13 24 7  o 17.40000  0.1710000     17.32000  0.2413000     17.48000  0.2423000     -0.1633000     0.3420000 
1 1 1 13 24 8  o 20.50000  0.1904000     20.13000  0.2665000     20.87000  0.2721000     -0.7481000     0.3809000 
1 1 1 13 24 9  o 6.303000  0.1740000     6.357000  0.2485000     6.249000  0.2435000     0.1080000      0.3479000 
1 1 1 13 24 10 o 9.784000  0.1596000     9.900000  0.2242000     9.668000  0.2273000     0.2318000      0.3192000 
1 1 1 13 24 11 o 3.007000  0.4538000     2.791000  0.6645000     3.223000  0.6181000     -0.4318000     0.9075000 
1 1 1 13 24 12 o 2.164000  0.4308000     2.587000  0.5658000     1.741000  0.6498000     0.8462000      0.8616000 
1 1 1 13 24 13 o 10.39000  0.2071000     10.25000  0.3237000     10.54000  0.2583000     -0.2829000     0.4141000 
1 1 1 13 24 14 o 2.394000  0.4491000     1.644000  0.7038000     3.143000  0.5582000     -1.499000      0.8983000 
1 1 1 13 24 15 o 5.037000  0.3473000     5.457000  0.4324000     4.616000  0.5435000     0.8409000      0.6945000 
1 1 1 13 24 16 o 7.313000  0.2721000     7.196000  0.3776000     7.430000  0.3920000     -0.2340000     0.5443000 
1 1 1 13 24 17 o 1.985000  0.6067000     2.054000  0.8310000     1.916000  0.8841000     0.1383000      1.213000  
1 1 1 13 24 18 o 1.685000  0.5126000     1.662000  0.7179000     1.708000  0.7320000     -0.4619000E-01 1.025000  
1 1 1 13 24 19 o 1.842000  0.5201000     1.710000  0.7006000     1.973000  0.7688000     -0.2630000     1.040000  
1 1 1 13 24 20 o 1.365000  0.4436000     1.187000  0.5696000     1.544000  0.6803000     -0.3568000     0.8873000 
1 1 1 13 24 21 o 1.640000  0.4989000     1.524000  0.6601000     1.757000  0.7482000     -0.2331000     0.9978000 
1 1 1 13 24 22 o 1.434000  0.4627000     1.316000  0.6160000     1.551000  0.6905000     -0.2351000     0.9253000 
1 1 1 13 24 23 o 1.442000  0.4551000     1.142000  0.5514000     1.743000  0.7243000     -0.6005000     0.9103000 
1 1 1 13 24 24 o 1.354000  0.4642000     1.551000  0.7406000     1.157000  0.5599000     0.3942000      0.9284000 
1 1 1 13 25 0  o 6.124000  0.4173000     6.124000  0.4173000     6.124000  0.4173000     -0.000000      0.000000  
1 1 1 13 25 1  o 6.388000  0.2807000     6.388000  0.2807000     ?         ?             ?              ?         
1 1 1 13 25 2  o 10.56000  0.1905000     10.58000  0.2657000     10.55000  0.2731000     0.2917000E-01  0.3810000 
1 1 1 13 25 3  o 7.093000  0.1711000     6.706000  0.2797000     7.481000  0.1972000     -0.7759000     0.3422000 
1 1 1 13 25 4  o 18.06000  0.1697000     18.01000  0.2396000     18.11000  0.2403000     -0.9792000E-01 0.3393000 
1 1 1 13 25 5  o 12.74000  0.1458000     12.81000  0.2070000     12.68000  0.2054000     0.1314000      0.2916000 
1 1 1 13 25 6  o 10.73000  0.1436000     10.88000  0.2023000     10.58000  0.2039000     0.3009000      0.2872000 
1 1 1 13 25 7  o 9.254000  0.1478000     9.450000  0.2086000     9.058000  0.2094000     0.3917000      0.2956000 
1 1 1 13 25 8  o 19.69000  0.1863000     19.72000  0.2638000     19.67000  0.2631000     0.5205000E-01  0.3726000 
1 1 1 13 25 9  o 19.42000  0.1874000     19.24000  0.2645000     19.60000  0.2656000     -0.3662000     0.3748000 
1 1 1 13 25 10 o 1.584000  0.4202000     1.703000  0.6069000     1.465000  0.5814000     0.2382000      0.8404000 
1 1 1 13 25 11 o 17.22000  0.2191000     17.41000  0.2597000     17.04000  0.3530000     0.3708000      0.4382000 
1 1 1 13 25 12 o 7.376000  0.2550000     7.865000  0.2765000     6.887000  0.4284000     0.9774000      0.5099000 
1 1 1 13 25 13 o 10.71000  0.1801000     10.79000  0.2522000     10.64000  0.2572000     0.1464000      0.3602000 
1 1 1 13 25 14 o 5.747000  0.2709000     5.933000  0.4197000     5.562000  0.3426000     0.3707000      0.5417000 
1 1 1 13 25 15 o 1.873000  0.5350000     1.832000  0.7365000     1.914000  0.7761000     -0.8174000E-01 1.070000  
1 1 1 13 25 16 o 4.954000  0.3699000     5.142000  0.4831000     4.765000  0.5603000     0.3765000      0.7398000 
1 1 1 13 25 17 o 2.394000  0.6716000     2.171000  0.7994000     2.617000  1.079000      -0.4457000     1.343000  
1 1 1 13 25 18 o 1.973000  0.5518000     2.057000  0.7918000     1.889000  0.7687000     0.1680000      1.104000  
1 1 1 13 25 19 o 4.305000  0.4805000     4.993000  0.4635000     3.617000  0.8418000     1.376000       0.9609000 
1 1 1 13 25 20 o 2.221000  0.5388000     2.056000  0.7452000     2.386000  0.7785000     -0.3298000     1.078000  
1 1 1 13 25 21 f 1.840000  0.5035000     1.492000  0.6540000     2.188000  0.7657000     -0.6961000     1.007000  
1 1 1 13 25 22 o 1.579000  0.4875000     1.085000  0.5331000     2.073000  0.8164000     -0.9885000     0.9750000 
1 1 1 13 25 23 o 1.797000  0.5088000     1.443000  0.6490000     2.150000  0.7838000     -0.7070000     1.018000  
1 1 1 13 25 24 o 1.027000  0.3603000     0.9518000 0.4743000     1.103000  0.5426000     -0.1508000     0.7207000 
1 1 1 13 26 0  o 2.454000  0.5061000     2.454000  0.5061000     2.454000  0.5061000     -0.000000      0.000000  
1 1 1 13 26 1  o 5.795000  0.1629000     5.795000  0.2464000     5.794000  0.2131000     0.3290000E-03  0.3257000 
1 1 1 13 26 2  f 9.695000  0.1363000     9.729000  0.1939000     9.661000  0.1917000     0.6808000E-01  0.2727000 
1 1 1 13 26 3  o 17.76000  0.1677000     17.45000  0.2348000     18.06000  0.2395000     -0.6107000     0.3354000 
1 1 1 13 26 4  f 8.637000  0.1399000     8.983000  0.1963000     8.290000  0.1994000     0.6936000      0.2798000 
1 1 1 13 26 5  o 10.62000  0.1429000     10.86000  0.2030000     10.38000  0.2012000     0.4780000      0.2858000 
1 1 1 13 26 6  o 12.83000  0.1503000     12.98000  0.2132000     12.68000  0.2120000     0.2973000      0.3007000 
1 1 1 13 26 7  o 8.614000  0.1515000     8.555000  0.2137000     8.672000  0.2148000     -0.1162000     0.3030000 
1 1 1 13 26 8  o 10.23000  0.1524000     10.15000  0.2164000     10.30000  0.2147000     -0.1506000     0.3048000 
1 1 1 13 26 9  o 18.83000  0.1855000     18.67000  0.2616000     19.00000  0.2632000     -0.3324000     0.3711000 
1 1 1 13 26 10 o 13.06000  0.2370000     12.61000  0.4109000     13.52000  0.2365000     -0.9066000     0.4741000 
1 1 1 13 26 11 o 9.471000  0.1708000     9.756000  0.2387000     9.187000  0.2442000     0.5682000      0.3415000 
1 1 1 13 26 12 o 4.466000  0.3654000     4.923000  0.4746000     4.008000  0.5557000     0.9147000      0.7307000 
1 1 1 13 26 13 o 7.057000  0.2086000     7.229000  0.2865000     6.885000  0.3034000     0.3445000      0.4173000 
1 1 1 13 26 14 o 2.256000  0.4890000     2.465000  0.6743000     2.048000  0.7084000     0.4167000      0.9780000 
1 1 1 13 26 15 o 7.744000  0.2858000     7.666000  0.4421000     7.822000  0.3622000     -0.1558000     0.5716000 
1 1 1 13 26 16 o 2.071000  0.5590000     2.113000  0.7912000     2.029000  0.7899000     0.8371000E-01  1.118000  
1 1 1 13 26 17 o 1.716000  0.5223000     1.837000  0.7519000     1.594000  0.7250000     0.2429000      1.045000  
1 1 1 13 26 18 o 2.436000  0.7102000     3.449000  1.255000      1.423000  0.6652000     2.026000       1.420000  
1 1 1 13 26 19 o 2.004000  0.5179000     1.630000  0.6975000     2.379000  0.7658000     -0.7488000     1.036000  
1 1 1 13 26 20 o 1.862000  0.5191000     1.830000  0.7184000     1.894000  0.7496000     -0.6453000E-01 1.038000  
1 1 1 13 26 21 o 1.809000  0.5045000     1.568000  0.6677000     2.051000  0.7564000     -0.4832000     1.009000  
1 1 1 13 26 22 o 1.656000  0.5267000     1.785000  0.7332000     1.527000  0.7564000     0.2576000      1.053000  
1 1 1 13 26 23 o 1.260000  0.4231000     0.9737000 0.4845000     1.546000  0.6938000     -0.5721000     0.8462000 
1 1 1 13 26 24 o 1.496000  0.4697000     1.527000  0.6652000     1.465000  0.6633000     0.6165000E-01  0.9394000 
1 1 1 13 27 0  o 26.91000  0.3195000     26.91000  0.3195000     26.91000  0.3195000     -0.000000      0.000000  
1 1 1 13 27 1  o 22.35000  0.1960000     22.49000  0.2781000     22.20000  0.2761000     0.2904000      0.3919000 
1 1 1 13 27 2  o 8.210000  0.1384000     8.198000  0.1959000     8.222000  0.1955000     -0.2404000E-01 0.2767000 
1 1 1 13 27 3  o 12.68000  0.1452000     12.96000  0.2066000     12.40000  0.2040000     0.5605000      0.2904000 
1 1 1 13 27 4  o 17.01000  0.1664000     17.27000  0.2368000     16.76000  0.2338000     0.5162000      0.3327000 
1 1 1 13 27 5  o 24.44000  0.2124000     24.46000  0.3003000     24.42000  0.3006000     0.3401000E-01  0.4249000 
1 1 1 13 27 6  o 22.36000  0.1999000     22.60000  0.2847000     22.12000  0.2807000     0.4867000      0.3998000 
1 1 1 13 27 7  o 6.540000  0.1669000     6.343000  0.2408000     6.736000  0.2312000     -0.3928000     0.3338000 
1 1 1 13 27 8  o 2.119000  0.3915000     2.207000  0.5511000     2.030000  0.5563000     0.1773000      0.7831000 
1 1 1 13 27 9  o 2.978000  0.3265000     3.142000  0.4384000     2.814000  0.4839000     0.3279000      0.6530000 
1 1 1 13 27 10 o 2.534000  0.5015000     2.475000  0.7249000     2.593000  0.6933000     -0.1188000     1.003000  
1 1 1 13 27 11 o 3.349000  0.4293000     3.295000  0.4700000     3.403000  0.7186000     -0.1082000     0.8586000 
1 1 1 13 27 12 o 15.51000  0.1849000     15.15000  0.2606000     15.88000  0.2624000     -0.7300000     0.3698000 
1 1 1 13 27 13 o 7.797000  0.2010000     7.322000  0.2905000     8.272000  0.2777000     -0.9499000     0.4019000 
1 1 1 13 27 14 o 8.772000  0.2005000     9.003000  0.2810000     8.542000  0.2861000     0.4610000      0.4011000 
1 1 1 13 27 15 o 3.743000  0.4156000     3.776000  0.6394000     3.710000  0.5312000     0.6568000E-01  0.8312000 
1 1 1 13 27 16 o 7.568000  0.2988000     7.565000  0.4222000     7.571000  0.4229000     -0.6392000E-02 0.5975000 
1 1 1 13 27 17 o 1.944000  0.5441000     1.926000  0.7692000     1.963000  0.7698000     -0.3646000E-01 1.088000  
1 1 1 13 27 18 o 2.677000  0.5566000     1.927000  0.8933000     3.427000  0.6641000     -1.500000      1.113000  
1 1 1 13 27 19 o 3.378000  0.4601000     3.721000  0.5876000     3.035000  0.7080000     0.6863000      0.9201000 
1 1 1 13 27 20 o 1.637000  0.4839000     1.866000  0.7233000     1.407000  0.6430000     0.4585000      0.9678000 
1 1 1 13 27 21 o 1.864000  0.5126000     1.679000  0.6933000     2.049000  0.7551000     -0.3705000     1.025000  
1 1 1 13 27 22 o 1.797000  0.5539000     1.339000  0.6119000     2.254000  0.9235000     -0.9149000     1.108000  
1 1 1 13 27 23 o 1.814000  0.5365000     1.606000  0.7234000     2.023000  0.7924000     -0.4170000     1.073000  
1 1 1 13 27 24 o 1.283000  0.4354000     1.268000  0.6081000     1.299000  0.6233000     -0.3013000E-01 0.8708000 
1 1 1 13 28 0  o 21.21000  0.2677000     21.21000  0.2677000     21.21000  0.2677000     -0.000000      0.000000  
1 1 1 13 28 1  o 27.34000  0.2298000     27.07000  0.3224000     27.61000  0.3275000     -0.5428000     0.4596000 
1 1 1 13 28 2  o 10.31000  0.1401000     10.35000  0.1984000     10.26000  0.1980000     0.9182000E-01  0.2802000 
1 1 1 13 28 3  o 2.400000  0.3182000     1.914000  0.5176000     2.887000  0.3702000     -0.9734000     0.6363000 
1 1 1 13 28 4  o 6.130000  0.1607000     6.129000  0.2227000     6.132000  0.2316000     -0.3056000E-02 0.3213000 
1 1 1 13 28 5  o 8.819000  0.1478000     8.802000  0.2093000     8.836000  0.2087000     -0.3460000E-01 0.2955000 
1 1 1 13 28 6  o 22.65000  0.2024000     22.62000  0.2856000     22.68000  0.2868000     -0.6293000E-01 0.4048000 
1 1 1 13 28 7  o 11.93000  0.1540000     11.97000  0.2173000     11.90000  0.2182000     0.6947000E-01  0.3079000 
1 1 1 13 28 8  o 23.60000  0.2124000     23.93000  0.3035000     23.28000  0.2971000     0.6576000      0.4248000 
1 1 1 13 28 9  o 10.50000  0.1793000     10.49000  0.2753000     10.50000  0.2300000     -0.1248000E-01 0.3587000 
1 1 1 13 28 10 o 16.65000  0.1901000     16.75000  0.2540000     16.55000  0.2829000     0.1970000      0.3802000 
1 1 1 13 28 11 o 1.619000  0.4868000     1.565000  0.6945000     1.673000  0.6824000     -0.1086000     0.9736000 
1 1 1 13 28 12 o 5.045000  0.2537000     5.206000  0.3453000     4.884000  0.3718000     0.3219000      0.5074000 
1 1 1 13 28 13 o 6.319000  0.2297000     6.698000  0.3040000     5.940000  0.3445000     0.7584000      0.4595000 
1 1 1 13 28 14 o 9.135000  0.1997000     9.084000  0.2812000     9.185000  0.2838000     -0.1008000     0.3995000 
1 1 1 13 28 15 o 7.028000  0.2357000     7.507000  0.3162000     6.549000  0.3497000     0.9580000      0.4715000 
1 1 1 13 28 16 o 4.921000  0.5203000     4.542000  0.6125000     5.301000  0.8413000     -0.7591000     1.041000  
1 1 1 13 28 17 o 2.170000  0.5696000     2.270000  0.7881000     2.070000  0.8227000     0.1996000      1.139000  
1 1 1 13 28 18 o 2.421000  0.5466000     1.994000  0.7708000     2.848000  0.7751000     -0.8538000     1.093000  
1 1 1 13 28 19 o 1.781000  0.5064000     1.751000  0.7067000     1.812000  0.7254000     -0.6110000E-01 1.013000  
1 1 1 13 28 20 o 2.203000  0.5110000     2.645000  0.7196000     1.760000  0.7257000     0.8852000      1.022000  
1 1 1 13 28 21 o 2.169000  0.4940000     1.586000  0.6836000     2.753000  0.7135000     -1.167000      0.9881000 
1 1 1 13 28 22 o 3.328000  0.4770000     3.990000  0.5435000     2.667000  0.7841000     1.322000       0.9540000 
1 1 1 13 28 23 f 1.520000  0.5080000     1.552000  0.7684000     1.488000  0.6648000     0.6388000E-01  1.016000  
1 1 1 13 29 0  o 7.069000  0.2110000     7.069000  0.2110000     7.069000  0.2110000     0.000000       0.000000  
1 1 1 13 29 1  o 9.570000  0.1422000     9.815000  0.2021000     9.324000  0.2002000     0.4917000      0.2845000 
1 1 1 13 29 2  o 6.420000  0.1529000     6.363000  0.2174000     6.478000  0.2151000     -0.1155000     0.3058000 
1 1 1 13 29 3  o 20.34000  0.1860000     20.34000  0.2629000     20.35000  0.2631000     -0.1024000E-01 0.3720000 
1 1 1 13 29 4  o 10.09000  0.1453000     9.978000  0.2049000     10.20000  0.2062000     -0.2184000     0.2907000 
1 1 1 13 29 5  o 19.26000  0.1819000     19.16000  0.2564000     19.37000  0.2581000     -0.2111000     0.3638000 
1 1 1 13 29 6  o 16.49000  0.1810000     16.21000  0.2703000     16.77000  0.2408000     -0.5608000     0.3620000 
1 1 1 13 29 7  o 25.12000  0.2210000     25.72000  0.3175000     24.51000  0.3076000     1.215000       0.4421000 
1 1 1 13 29 8  o 7.725000  0.1689000     7.574000  0.2398000     7.875000  0.2378000     -0.3005000     0.3377000 
1 1 1 13 29 9  o 9.552000  0.2282000     9.542000  0.3333000     9.562000  0.3117000     -0.2057000E-01 0.4563000 
1 1 1 13 29 10 o 14.74000  0.1913000     15.04000  0.2502000     14.45000  0.2895000     0.5940000      0.3827000 
1 1 1 13 29 11 o 10.90000  0.2154000     10.77000  0.3031000     11.04000  0.3061000     -0.2728000     0.4308000 
1 1 1 13 29 12 f 9.352000  0.1882000     9.455000  0.2667000     9.248000  0.2656000     0.2067000      0.3764000 
1 1 1 13 29 13 o 5.126000  0.3227000     5.611000  0.3562000     4.641000  0.5383000     0.9692000      0.6455000 
1 1 1 13 29 14 o 9.139000  0.2034000     9.235000  0.2834000     9.043000  0.2917000     0.1921000      0.4067000 
1 1 1 13 29 15 o 1.777000  0.4482000     2.467000  0.7243000     1.087000  0.5282000     1.380000       0.8964000 
1 1 1 13 29 16 o 5.816000  0.3442000     6.418000  0.4513000     5.215000  0.5199000     1.203000       0.6885000 
1 1 1 13 29 17 o 2.634000  0.5883000     2.245000  0.8584000     3.023000  0.8048000     -0.7783000     1.177000  
1 1 1 13 29 18 o 2.379000  0.5464000     2.605000  0.7629000     2.153000  0.7824000     0.4523000      1.093000  
1 1 1 13 29 19 o 1.630000  0.4870000     1.780000  0.7137000     1.480000  0.6628000     0.3000000      0.9740000 
1 1 1 13 29 20 o 1.468000  0.4612000     1.351000  0.6193000     1.584000  0.6837000     -0.2328000     0.9225000 
1 1 1 13 29 21 o 2.626000  0.5512000     2.413000  0.7897000     2.839000  0.7692000     -0.4255000     1.102000  
1 1 1 13 29 22 o 1.635000  0.4887000     1.808000  0.7252000     1.462000  0.6553000     0.3459000      0.9774000 
1 1 1 13 29 23 o 1.519000  0.4933000     1.584000  0.7293000     1.453000  0.6643000     0.1316000      0.9865000 
1 1 1 13 30 0  o 7.594000  0.2103000     7.594000  0.2103000     7.594000  0.2103000     0.000000       0.000000  
1 1 1 13 30 1  o 10.52000  0.1437000     10.73000  0.2042000     10.31000  0.2022000     0.4210000      0.2874000 
1 1 1 13 30 2  o 22.66000  0.2007000     22.72000  0.2841000     22.61000  0.2835000     0.1187000      0.4013000 
1 1 1 13 30 3  o 5.914000  0.1630000     5.851000  0.2312000     5.978000  0.2299000     -0.1276000     0.3260000 
1 1 1 13 30 4  o 12.38000  0.1511000     12.43000  0.2124000     12.33000  0.2150000     0.9579000E-01  0.3022000 
1 1 1 13 30 5  o 17.48000  0.1734000     17.51000  0.2447000     17.45000  0.2456000     0.5090000E-01  0.3467000 
1 1 1 13 30 6  o 6.268000  0.1761000     6.053000  0.2556000     6.483000  0.2421000     -0.4298000     0.3521000 
1 1 1 13 30 7  f 10.41000  0.1569000     10.70000  0.2215000     10.12000  0.2223000     0.5744000      0.3138000 
1 1 1 13 30 8  o 12.05000  0.1999000     12.25000  0.3278000     11.84000  0.2290000     0.4095000      0.3999000 
1 1 1 13 30 9  o 12.24000  0.1749000     11.76000  0.2347000     12.71000  0.2593000     -0.9470000     0.3497000 
1 1 1 13 30 10 o 7.819000  0.2468000     7.769000  0.3753000     7.869000  0.3207000     -0.1003000     0.4937000 
1 1 1 13 30 11 o 7.273000  0.2058000     6.999000  0.2982000     7.548000  0.2838000     -0.5490000     0.4116000 
1 1 1 13 30 12 o 4.356000  0.3014000     4.258000  0.4319000     4.454000  0.4205000     -0.1956000     0.6028000 
1 1 1 13 30 13 o 9.474000  0.1925000     9.047000  0.2763000     9.901000  0.2681000     -0.8539000     0.3850000 
1 1 1 13 30 14 o 4.317000  0.3285000     4.566000  0.4196000     4.068000  0.5056000     0.4983000      0.6570000 
1 1 1 13 30 15 o 4.783000  0.3528000     4.906000  0.5358000     4.661000  0.4592000     0.2451000      0.7057000 
1 1 1 13 30 16 o 3.733000  0.4093000     3.825000  0.5899000     3.641000  0.5676000     0.1841000      0.8186000 
1 1 1 13 30 17 o 6.270000  0.5641000     5.987000  1.062000      6.552000  0.3815000     -0.5646000     1.128000  
1 1 1 13 30 18 o 3.148000  0.4762000     2.673000  0.7367000     3.623000  0.6035000     -0.9495000     0.9523000 
1 1 1 13 30 19 o 1.379000  0.4437000     1.644000  0.7003000     1.115000  0.5451000     0.5288000      0.8874000 
1 1 1 13 30 20 o 1.813000  0.4894000     2.163000  0.7281000     1.463000  0.6540000     0.6995000      0.9787000 
1 1 1 13 30 21 o 1.606000  0.5021000     1.861000  0.7507000     1.351000  0.6669000     0.5094000      1.004000  
1 1 1 13 30 22 o 1.909000  0.5090000     1.450000  0.6477000     2.367000  0.7853000     -0.9166000     1.018000  
1 1 1 13 30 23 o 1.293000  0.4287000     1.152000  0.5538000     1.435000  0.6545000     -0.2825000     0.8573000 
1 1 1 13 31 0  o 13.36000  0.2148000     13.36000  0.2148000     13.36000  0.2148000     -0.000000      0.000000  
1 1 1 13 31 1  o 25.52000  0.2194000     25.51000  0.3101000     25.53000  0.3105000     -0.1823000E-01 0.4389000 
1 1 1 13 31 2  o 16.96000  0.1684000     17.11000  0.2391000     16.82000  0.2371000     0.2880000      0.3367000 
1 1 1 13 31 3  o 17.07000  0.1698000     17.05000  0.2397000     17.10000  0.2406000     -0.5445000E-01 0.3397000 
1 1 1 13 31 4  o 9.459000  0.1506000     9.455000  0.2126000     9.463000  0.2134000     -0.7968000E-02 0.3012000 
1 1 1 13 31 5  o 11.77000  0.1531000     11.53000  0.2143000     12.01000  0.2188000     -0.4812000     0.3062000 
1 1 1 13 31 6  o 16.07000  0.1702000     15.88000  0.2403000     16.25000  0.2411000     -0.3655000     0.3404000 
1 1 1 13 31 7  o 22.40000  0.2061000     22.52000  0.2926000     22.28000  0.2903000     0.2444000      0.4122000 
1 1 1 13 31 8  o 7.904000  0.2116000     7.904000  0.2751000     7.904000  0.3216000     -0.6485000E-03 0.4232000 
1 1 1 13 31 9  o 11.35000  0.2130000     11.28000  0.2423000     11.41000  0.3504000     -0.1318000     0.4260000 
1 1 1 13 31 10 o 6.565000  0.2314000     6.633000  0.3604000     6.498000  0.2903000     0.1350000      0.4628000 
1 1 1 13 31 11 o 6.580000  0.2190000     6.227000  0.3173000     6.934000  0.3019000     -0.7072000     0.4380000 
1 1 1 13 31 12 o 9.835000  0.1896000     9.782000  0.2666000     9.889000  0.2695000     -0.1072000     0.3791000 
1 1 1 13 31 13 o 4.008000  0.3444000     4.034000  0.4673000     3.983000  0.5061000     0.5088000E-01  0.6888000 
1 1 1 13 31 14 o 4.335000  0.3280000     4.416000  0.4586000     4.253000  0.4691000     0.1634000      0.6561000 
1 1 1 13 31 15 o 2.647000  0.5926000     2.577000  0.8636000     2.718000  0.8117000     -0.1408000     1.185000  
1 1 1 13 31 16 o 1.425000  0.4557000     1.297000  0.6108000     1.553000  0.6764000     -0.2556000     0.9113000 
1 1 1 13 31 17 o 3.821000  0.5642000     3.165000  1.036000      4.477000  0.4460000     -1.312000      1.128000  
1 1 1 13 31 18 o 1.510000  0.4688000     1.632000  0.6898000     1.388000  0.6350000     0.2436000      0.9376000 
1 1 1 13 31 19 o 2.958000  0.4670000     1.988000  0.7375000     3.928000  0.5729000     -1.940000      0.9339000 
1 1 1 13 31 20 o 1.528000  0.4597000     1.730000  0.6849000     1.326000  0.6133000     0.4041000      0.9194000 
1 1 1 13 31 21 o 2.164000  0.5852000     2.160000  0.7518000     2.169000  0.8970000     -0.9100000E-02 1.170000  
1 1 1 13 31 22 o 1.358000  0.4441000     1.145000  0.5578000     1.572000  0.6913000     -0.4266000     0.8882000 
1 1 1 13 31 23 o 1.136000  0.3899000     1.190000  0.5678000     1.082000  0.5344000     0.1074000      0.7798000 
1 1 1 13 32 0  o 16.11000  0.2330000     16.11000  0.2330000     16.11000  0.2330000     -0.000000      0.000000  
1 1 1 13 32 1  f 10.57000  0.1483000     10.67000  0.2107000     10.48000  0.2089000     0.1932000      0.2967000 
1 1 1 13 32 2  o 7.317000  0.1568000     7.554000  0.2193000     7.081000  0.2243000     0.4729000      0.3137000 
1 1 1 13 32 3  o 16.01000  0.1664000     15.83000  0.2340000     16.19000  0.2367000     -0.3571000     0.3329000 
1 1 1 13 32 4  o 13.41000  0.1577000     13.45000  0.2238000     13.37000  0.2222000     0.7935000E-01  0.3154000 
1 1 1 13 32 5  o 1.380000  0.3937000     1.371000  0.5533000     1.389000  0.5603000     -0.1773000E-01 0.7875000 
1 1 1 13 32 6  o 18.59000  0.1836000     18.64000  0.2600000     18.54000  0.2593000     0.1013000      0.3672000 
1 1 1 13 32 7  o 15.74000  0.2259000     15.86000  0.3509000     15.62000  0.2845000     0.2372000      0.4517000 
1 1 1 13 32 8  o 21.44000  0.2430000     21.76000  0.2901000     21.11000  0.3900000     0.6490000      0.4860000 
1 1 1 13 32 9  o 3.008000  0.4504000     3.242000  0.7112000     2.774000  0.5530000     0.4677000      0.9009000 
1 1 1 13 32 10 o 4.669000  0.2586000     4.759000  0.3649000     4.580000  0.3666000     0.1788000      0.5172000 
1 1 1 13 32 11 o 7.801000  0.2019000     7.583000  0.2884000     8.018000  0.2826000     -0.4350000     0.4037000 
1 1 1 13 32 12 o 15.43000  0.1894000     15.68000  0.2667000     15.17000  0.2690000     0.5121000      0.3788000 
1 1 1 13 32 13 o 9.476000  0.1973000     9.218000  0.2788000     9.734000  0.2794000     -0.5159000     0.3947000 
1 1 1 13 32 14 o 5.124000  0.2981000     5.302000  0.4045000     4.946000  0.4380000     0.3565000      0.5962000 
1 1 1 13 32 15 o 3.624000  0.4927000     3.704000  0.5817000     3.544000  0.7953000     0.1596000      0.9853000 
1 1 1 13 32 16 o 2.166000  0.5328000     2.758000  0.7826000     1.575000  0.7232000     1.183000       1.066000  
1 1 1 13 32 17 o 4.536000  0.3519000     4.697000  0.5462000     4.376000  0.4440000     0.3214000      0.7039000 
1 1 1 13 32 18 o 2.809000  0.5075000     2.802000  0.7030000     2.815000  0.7322000     -0.1314000E-01 1.015000  
1 1 1 13 32 19 o 1.835000  0.5074000     1.827000  0.7083000     1.844000  0.7268000     -0.1771000E-01 1.015000  
1 1 1 13 32 20 o 1.407000  0.4438000     1.383000  0.6216000     1.432000  0.6337000     -0.4850000E-01 0.8877000 
1 1 1 13 32 21 o 1.754000  0.5063000     1.954000  0.7438000     1.554000  0.6870000     0.4002000      1.013000  
1 1 1 13 32 22 o 1.650000  0.5014000     1.327000  0.6722000     1.973000  0.7442000     -0.6464000     1.003000  
1 1 1 13 32 23 o 1.267000  0.6466000     1.267000  0.6466000     ?         ?             ?              ?         
1 1 1 13 33 0  o 3.377000  0.3610000     3.377000  0.3610000     3.377000  0.3610000     -0.000000      0.000000  
1 1 1 13 33 1  o 7.345000  0.1587000     7.476000  0.2236000     7.214000  0.2253000     0.2617000      0.3174000 
1 1 1 13 33 2  o 6.510000  0.1686000     6.462000  0.2406000     6.559000  0.2362000     -0.9689000E-01 0.3372000 
1 1 1 13 33 3  o 10.80000  0.1537000     10.69000  0.2169000     10.90000  0.2177000     -0.2082000     0.3073000 
1 1 1 13 33 4  o 11.90000  0.1553000     11.88000  0.2196000     11.92000  0.2195000     -0.4222000E-01 0.3105000 
1 1 1 13 33 5  o 5.740000  0.1890000     6.011000  0.2588000     5.469000  0.2754000     0.5426000      0.3779000 
1 1 1 13 33 6  o 5.049000  0.2693000     5.042000  0.4514000     5.055000  0.2939000     -0.1313000E-01 0.5387000 
1 1 1 13 33 7  o 12.73000  0.2471000     12.91000  0.2330000     12.56000  0.4358000     0.3484000      0.4942000 
1 1 1 13 33 8  o 16.16000  0.2319000     16.41000  0.3558000     15.91000  0.2977000     0.4995000      0.4639000 
1 1 1 13 33 9  o 6.036000  0.2128000     5.714000  0.3122000     6.357000  0.2894000     -0.6427000     0.4257000 
1 1 1 13 33 10 o 10.53000  0.1797000     10.53000  0.2534000     10.54000  0.2548000     -0.8286000E-02 0.3593000 
1 1 1 13 33 11 o 2.840000  0.4372000     3.035000  0.5825000     2.645000  0.6521000     0.3897000      0.8744000 
1 1 1 13 33 12 o 4.508000  0.3014000     4.611000  0.4066000     4.404000  0.4451000     0.2072000      0.6028000 
1 1 1 13 33 13 f 4.208000  0.3404000     3.825000  0.5136000     4.591000  0.4470000     -0.7659000     0.6808000 
1 1 1 13 33 14 f 9.878000  0.2498000     9.858000  0.4079000     9.898000  0.2884000     -0.4008000E-01 0.4995000 
1 1 1 13 33 15 o 5.797000  0.2735000     5.629000  0.4094000     5.965000  0.3627000     -0.3358000     0.5469000 
1 1 1 13 33 16 o 3.989000  0.4610000     4.552000  0.7057000     3.426000  0.5934000     1.126000       0.9221000 
1 1 1 13 33 17 o 2.347000  0.5164000     2.415000  0.7236000     2.278000  0.7369000     0.1373000      1.033000  
1 1 1 13 33 18 o 3.002000  0.4655000     3.408000  0.6930000     2.596000  0.6218000     0.8124000      0.9311000 
1 1 1 13 33 19 o 1.520000  0.4658000     1.407000  0.6243000     1.633000  0.6915000     -0.2260000     0.9316000 
1 1 1 13 33 20 f 1.706000  0.4970000     1.449000  0.6557000     1.963000  0.7471000     -0.5146000     0.9940000 
1 1 1 13 33 21 o 1.733000  0.4705000     2.232000  0.7388000     1.234000  0.5830000     0.9975000      0.9411000 
1 1 1 13 33 22 o 1.320000  0.4489000     1.365000  0.6717000     1.274000  0.5957000     0.9155000E-01  0.8978000 
1 1 1 13 34 0  o 1.163000  0.6470000     1.163000  0.6470000     1.163000  0.6470000     -0.000000      0.000000  
1 1 1 13 34 1  o 17.16000  0.1736000     17.25000  0.2462000     17.08000  0.2447000     0.1732000      0.3472000 
1 1 1 13 34 2  o 12.59000  0.1566000     12.88000  0.2217000     12.31000  0.2214000     0.5746000      0.3133000 
1 1 1 13 34 3  o 9.071000  0.1573000     9.241000  0.2212000     8.901000  0.2238000     0.3397000      0.3147000 
1 1 1 13 34 4  o 21.72000  0.2002000     21.75000  0.2833000     21.69000  0.2829000     0.5544000E-01  0.4003000 
1 1 1 13 34 5  o 6.302000  0.2275000     6.434000  0.3674000     6.170000  0.2685000     0.2640000      0.4550000 
1 1 1 13 34 6  o 18.41000  0.2871000     18.31000  0.2639000     18.51000  0.5101000     -0.1961000     0.5743000 
1 1 1 13 34 7  o 9.830000  0.2173000     9.785000  0.2609000     9.875000  0.3475000     -0.9024000E-01 0.4345000 
1 1 1 13 34 8  o 4.737000  0.2735000     4.792000  0.4256000     4.682000  0.3436000     0.1102000      0.5470000 
1 1 1 13 34 9  o 7.106000  0.2000000     7.184000  0.2827000     7.028000  0.2831000     0.1555000      0.4001000 
1 1 1 13 34 10 o 15.21000  0.1838000     15.40000  0.2601000     15.02000  0.2598000     0.3720000      0.3676000 
1 1 1 13 34 11 o 1.839000  0.4758000     2.137000  0.6890000     1.541000  0.6563000     0.5965000      0.9516000 
1 1 1 13 34 12 o 4.478000  0.3118000     4.439000  0.4343000     4.516000  0.4474000     -0.7690000E-01 0.6235000 
1 1 1 13 34 13 o 4.029000  0.3553000     3.826000  0.5153000     4.233000  0.4893000     -0.4077000     0.7106000 
1 1 1 13 34 14 o 4.191000  0.4720000     4.324000  0.6479000     4.058000  0.6866000     0.2662000      0.9440000 
1 1 1 13 34 15 f 5.221000  0.3271000     5.557000  0.4145000     4.885000  0.5061000     0.6722000      0.6542000 
1 1 1 13 34 16 o 2.307000  0.5124000     2.049000  0.7253000     2.564000  0.7241000     -0.5147000     1.025000  
1 1 1 13 34 17 o 4.023000  0.3631000     4.192000  0.4874000     3.853000  0.5382000     0.3392000      0.7261000 
1 1 1 13 34 18 o 1.686000  0.4881000     1.601000  0.7099000     1.772000  0.6702000     -0.1713000     0.9762000 
1 1 1 13 34 19 o 1.210000  0.4021000     1.392000  0.6237000     1.029000  0.5077000     0.3629000      0.8042000 
1 1 1 13 34 20 f 2.321000  0.6753000     1.699000  0.7132000     2.942000  1.147000      -1.243000      1.351000  
1 1 1 13 34 21 o 1.165000  0.3984000     1.109000  0.5388000     1.220000  0.5869000     -0.1103000     0.7968000 
1 1 1 13 34 22 o 1.171000  0.3971000     0.9680000 0.4839000     1.373000  0.6298000     -0.4054000     0.7942000 
1 1 1 13 35 0  o 14.34000  0.2308000     14.34000  0.2308000     14.34000  0.2308000     -0.000000      0.000000  
1 1 1 13 35 1  o 3.022000  0.3031000     3.094000  0.4226000     2.950000  0.4345000     0.1443000      0.6061000 
1 1 1 13 35 2  o 10.15000  0.1569000     10.16000  0.2225000     10.14000  0.2212000     0.1863000E-01  0.3138000 
1 1 1 13 35 3  o 24.75000  0.2193000     24.72000  0.3097000     24.78000  0.3106000     -0.5966000E-01 0.4386000 
1 1 1 13 35 4  o 15.52000  0.2094000     15.37000  0.3424000     15.66000  0.2413000     -0.2889000     0.4189000 
1 1 1 13 35 5  o 2.350000  0.5196000     2.222000  0.6331000     2.478000  0.8242000     -0.2565000     1.039000  
1 1 1 13 35 6  o 3.482000  0.4227000     4.275000  0.3903000     2.689000  0.7498000     1.586000       0.8453000 
1 1 1 13 35 7  o 11.02000  0.1841000     10.79000  0.2826000     11.26000  0.2360000     -0.4700000     0.3682000 
1 1 1 13 35 8  f 4.727000  0.2506000     4.739000  0.3556000     4.715000  0.3532000     0.2385000E-01  0.5011000 
1 1 1 13 35 9  o 6.384000  0.2160000     6.381000  0.3048000     6.386000  0.3061000     -0.4913000E-02 0.4320000 
1 1 1 13 35 10 o 8.907000  0.2020000     9.124000  0.2957000     8.690000  0.2752000     0.4336000      0.4039000 
1 1 1 13 35 11 o 4.130000  0.3246000     3.863000  0.4818000     4.397000  0.4352000     -0.5335000     0.6492000 
1 1 1 13 35 12 o 5.981000  0.2540000     6.212000  0.3415000     5.749000  0.3762000     0.4627000      0.5081000 
1 1 1 13 35 13 o 9.501000  0.2078000     9.909000  0.2887000     9.092000  0.2991000     0.8166000      0.4157000 
1 1 1 13 35 14 o 4.518000  0.3968000     4.513000  0.4824000     4.523000  0.6302000     -0.1051000E-01 0.7936000 
1 1 1 13 35 15 o 1.872000  0.5578000     1.760000  0.7986000     1.984000  0.7789000     -0.2233000     1.116000  
1 1 1 13 35 16 o 4.429000  0.3302000     4.317000  0.4596000     4.541000  0.4743000     -0.2240000     0.6604000 
1 1 1 13 35 17 o 1.897000  0.4673000     2.385000  0.6943000     1.408000  0.6258000     0.9769000      0.9347000 
1 1 1 13 35 18 o 3.587000  0.3859000     3.664000  0.5235000     3.510000  0.5671000     0.1549000      0.7717000 
1 1 1 13 35 19 o 1.755000  0.4400000     2.460000  0.7138000     1.049000  0.5148000     1.411000       0.8801000 
1 1 1 13 35 20 o 1.476000  0.4821000     1.398000  0.6350000     1.555000  0.7257000     -0.1567000     0.9642000 
1 1 1 13 35 21 o 1.951000  0.5579000     2.119000  0.8360000     1.783000  0.7391000     0.3358000      1.116000  
1 1 1 13 35 22 o 3.035000  0.5047000     3.065000  0.7225000     3.005000  0.7048000     0.5981000E-01  1.009000  
1 1 1 13 36 0  o 17.61000  0.2527000     17.61000  0.2527000     17.61000  0.2527000     0.000000       0.000000  
1 1 1 13 36 1  o 16.27000  0.1730000     16.63000  0.2477000     15.92000  0.2414000     0.7133000      0.3459000 
1 1 1 13 36 2  o 8.309000  0.1804000     8.201000  0.2759000     8.418000  0.2325000     -0.2176000     0.3608000 
1 1 1 13 36 3  o 4.750000  0.3189000     4.772000  0.4471000     4.728000  0.4549000     0.4441000E-01  0.6378000 
1 1 1 13 36 4  o 2.183000  0.5943000     2.183000  0.5943000     ?         ?             ?              ?         
1 1 1 13 36 5  o 10.88000  0.2126000     10.79000  0.3236000     10.98000  0.2759000     -0.1886000     0.4253000 
1 1 1 13 36 6  o 10.51000  0.1841000     10.60000  0.2782000     10.42000  0.2412000     0.1784000      0.3682000 
1 1 1 13 36 7  o 6.341000  0.2028000     6.197000  0.2885000     6.486000  0.2850000     -0.2886000     0.4055000 
1 1 1 13 36 8  o 11.49000  0.1750000     11.62000  0.2466000     11.37000  0.2485000     0.2481000      0.3501000 
1 1 1 13 36 9  o 6.182000  0.2227000     6.447000  0.3062000     5.917000  0.3236000     0.5298000      0.4455000 
1 1 1 13 36 10 o 1.664000  0.4681000     1.620000  0.6554000     1.707000  0.6687000     -0.8711000E-01 0.9363000 
1 1 1 13 36 11 o 6.620000  0.2335000     6.175000  0.3437000     7.066000  0.3161000     -0.8910000     0.4670000 
1 1 1 13 36 12 o 8.612000  0.2091000     8.307000  0.2972000     8.917000  0.2942000     -0.6101000     0.4182000 
1 1 1 13 36 13 o 8.872000  0.2790000     8.999000  0.4199000     8.745000  0.3674000     0.2542000      0.5580000 
1 1 1 13 36 14 o 3.681000  0.4313000     3.755000  0.5972000     3.607000  0.6225000     0.1471000      0.8626000 
1 1 1 13 36 15 o 2.448000  0.5220000     2.082000  0.7971000     2.814000  0.6742000     -0.7318000     1.044000  
1 1 1 13 36 16 o 2.050000  0.5003000     1.690000  0.6757000     2.411000  0.7379000     -0.7210000     1.001000  
1 1 1 13 36 17 o 2.620000  0.4684000     3.091000  0.6014000     2.149000  0.7182000     0.9422000      0.9368000 
1 1 1 13 36 18 o 1.510000  0.4544000     1.550000  0.6522000     1.471000  0.6329000     0.7817000E-01  0.9088000 
1 1 1 13 36 19 o 1.525000  0.4589000     1.471000  0.6657000     1.578000  0.6317000     -0.1072000     0.9177000 
1 1 1 13 36 20 o 1.250000  0.4116000     1.397000  0.6258000     1.103000  0.5347000     0.2943000      0.8231000 
1 1 1 13 36 21 o 1.911000  0.5921000     2.068000  0.9535000     1.753000  0.7023000     0.3149000      1.184000  
1 1 1 13 37 0  o 1.812000  0.9954000     1.812000  0.9954000     1.812000  0.9954000     -0.000000      0.000000  
1 1 1 13 37 1  o 5.320000  0.4134000     5.014000  0.5823000     5.626000  0.5870000     -0.6117000     0.8268000 
1 1 1 13 37 2  o 6.106000  0.3685000     6.106000  0.3685000     ?         ?             ?              ?         
1 1 1 13 37 3  o 8.198000  0.2403000     8.290000  0.3315000     8.106000  0.3479000     0.1834000      0.4806000 
1 1 1 13 37 4  o 7.176000  0.2207000     7.047000  0.3615000     7.305000  0.2534000     -0.2579000     0.4415000 
1 1 1 13 37 5  o 4.680000  0.2421000     4.597000  0.3464000     4.762000  0.3384000     -0.1651000     0.4843000 
1 1 1 13 37 6  o 5.816000  0.2171000     6.109000  0.2945000     5.524000  0.3191000     0.5857000      0.4343000 
1 1 1 13 37 7  o 12.51000  0.1743000     12.60000  0.2485000     12.41000  0.2446000     0.1868000      0.3487000 
1 1 1 13 37 8  o 6.999000  0.2036000     7.096000  0.2900000     6.903000  0.2859000     0.1934000      0.4072000 
1 1 1 13 37 9  o 5.864000  0.2321000     6.077000  0.3173000     5.651000  0.3388000     0.4263000      0.4642000 
1 1 1 13 37 10 o 17.75000  0.1974000     17.70000  0.2785000     17.80000  0.2798000     -0.9841000E-01 0.3947000 
1 1 1 13 37 11 o 9.728000  0.1987000     10.02000  0.2800000     9.439000  0.2820000     0.5787000      0.3974000 
1 1 1 13 37 12 o 3.523000  0.4127000     3.770000  0.5478000     3.277000  0.6173000     0.4931000      0.8253000 
1 1 1 13 37 13 o 8.072000  0.2696000     8.412000  0.3234000     7.732000  0.4314000     0.6802000      0.5392000 
1 1 1 13 37 14 o 2.025000  0.5720000     2.031000  0.7846000     2.019000  0.8327000     0.1280000E-01  1.144000  
1 1 1 13 37 15 o 1.979000  0.5025000     2.257000  0.7258000     1.701000  0.6951000     0.5564000      1.005000  
1 1 1 13 37 16 o 2.026000  0.5139000     1.799000  0.7040000     2.254000  0.7489000     -0.4547000     1.028000  
1 1 1 13 37 17 o 4.233000  0.3328000     4.307000  0.4713000     4.159000  0.4700000     0.1482000      0.6656000 
1 1 1 13 37 18 o 2.169000  0.4297000     2.999000  0.6136000     1.339000  0.6017000     1.660000       0.8594000 
1 1 1 13 37 19 o 1.788000  0.5232000     2.222000  0.8405000     1.354000  0.6232000     0.8681000      1.046000  
1 1 1 13 37 20 o 1.806000  0.4628000     2.467000  0.7375000     1.146000  0.5594000     1.320000       0.9257000 
1 1 1 13 37 21 o 1.353000  0.4387000     1.267000  0.5969000     1.438000  0.6432000     -0.1706000     0.8775000 
1 1 1 13 38 0  o 19.08000  0.3082000     19.08000  0.3082000     19.08000  0.3082000     0.000000       0.000000  
1 1 1 13 38 1  o 2.774000  0.4201000     2.551000  0.6476000     2.998000  0.5352000     -0.4466000     0.8401000 
1 1 1 13 38 2  o 6.559000  0.2044000     6.483000  0.3128000     6.634000  0.2630000     -0.1514000     0.4087000 
1 1 1 13 38 3  o 8.535000  0.1720000     8.522000  0.2434000     8.547000  0.2429000     -0.2522000E-01 0.3439000 
1 1 1 13 38 4  o 4.059000  0.2645000     4.209000  0.3565000     3.910000  0.3908000     0.2988000      0.5290000 
1 1 1 13 38 5  o 4.580000  0.2556000     4.253000  0.3788000     4.906000  0.3434000     -0.6533000     0.5113000 
1 1 1 13 38 6  o 6.010000  0.2136000     5.944000  0.3056000     6.076000  0.2985000     -0.1324000     0.4272000 
1 1 1 13 38 7  o 8.604000  0.1856000     8.737000  0.2648000     8.472000  0.2600000     0.2651000      0.3711000 
1 1 1 13 38 8  o 4.395000  0.2963000     3.982000  0.4517000     4.808000  0.3835000     -0.8256000     0.5926000 
1 1 1 13 38 9  o 7.159000  0.2112000     7.214000  0.2961000     7.103000  0.3013000     0.1101000      0.4224000 
1 1 1 13 38 10 o 1.937000  0.4893000     1.872000  0.6864000     2.002000  0.6974000     -0.1303000     0.9786000 
1 1 1 13 38 11 o 4.677000  0.3094000     4.634000  0.4404000     4.719000  0.4347000     -0.8454000E-01 0.6188000 
1 1 1 13 38 12 o 6.572000  0.3232000     6.523000  0.4999000     6.621000  0.4097000     -0.9779000E-01 0.6464000 
1 1 1 13 38 13 o 5.900000  0.2979000     6.484000  0.3868000     5.316000  0.4531000     1.168000       0.5957000 
1 1 1 13 38 14 f 2.341000  0.5664000     2.392000  0.8633000     2.289000  0.7335000     0.1029000      1.133000  
1 1 1 13 38 15 o 1.493000  0.4574000     1.706000  0.6931000     1.280000  0.5970000     0.4265000      0.9148000 
1 1 1 13 38 16 o 2.382000  0.5040000     2.126000  0.7162000     2.638000  0.7092000     -0.5115000     1.008000  
1 1 1 13 38 17 o 3.351000  0.4130000     3.294000  0.5759000     3.408000  0.5921000     -0.1140000     0.8260000 
1 1 1 13 38 18 o 1.640000  0.4636000     1.483000  0.6288000     1.797000  0.6815000     -0.3136000     0.9273000 
1 1 1 13 38 19 o 1.722000  0.4941000     2.224000  0.7932000     1.219000  0.5895000     1.005000       0.9883000 
1 1 1 13 38 20 o 1.633000  0.5056000     1.883000  0.7797000     1.383000  0.6439000     0.5005000      1.011000  
1 1 1 13 38 21 o 1.501000  0.4638000     1.717000  0.7077000     1.285000  0.5998000     0.4320000      0.9277000 
1 1 1 13 39 0  o 6.874000  0.2644000     6.874000  0.2644000     6.874000  0.2644000     -0.000000      0.000000  
1 1 1 13 39 1  o 11.05000  0.1669000     11.04000  0.2363000     11.06000  0.2358000     -0.1921000E-01 0.3338000 
1 1 1 13 39 2  o 8.974000  0.1707000     9.184000  0.2379000     8.764000  0.2450000     0.4204000      0.3415000 
1 1 1 13 39 3  o 11.79000  0.1680000     11.52000  0.2361000     12.06000  0.2391000     -0.5411000     0.3360000 
1 1 1 13 39 4  o 9.401000  0.1727000     9.550000  0.2389000     9.251000  0.2493000     0.2985000      0.3453000 
1 1 1 13 39 5  o 8.447000  0.1832000     8.484000  0.2589000     8.411000  0.2592000     0.7355000E-01  0.3663000 
1 1 1 13 39 6  o 2.147000  0.4335000     1.628000  0.6360000     2.666000  0.5892000     -1.038000      0.8670000 
1 1 1 13 39 7  f 9.170000  0.1848000     9.365000  0.2609000     8.974000  0.2618000     0.3911000      0.3696000 
1 1 1 13 39 8  o 4.174000  0.3021000     4.065000  0.4429000     4.283000  0.4109000     -0.2182000     0.6042000 
1 1 1 13 39 9  o 9.754000  0.1900000     9.810000  0.2680000     9.699000  0.2694000     0.1110000      0.3800000 
1 1 1 13 39 10 o 5.967000  0.2457000     5.944000  0.3503000     5.991000  0.3446000     -0.4697000E-01 0.4914000 
1 1 1 13 39 11 o 7.646000  0.2258000     7.907000  0.3148000     7.385000  0.3238000     0.5227000      0.4516000 
1 1 1 13 39 12 o 5.104000  0.3587000     5.285000  0.4203000     4.923000  0.5814000     0.3622000      0.7174000 
1 1 1 13 39 13 o 1.921000  0.5306000     2.375000  0.8045000     1.466000  0.6921000     0.9089000      1.061000  
1 1 1 13 39 14 o 1.652000  0.4738000     1.265000  0.5898000     2.039000  0.7417000     -0.7741000     0.9476000 
1 1 1 13 39 15 o 1.582000  0.4600000     1.870000  0.6983000     1.293000  0.5991000     0.5773000      0.9201000 
1 1 1 13 39 16 o 3.207000  0.4190000     3.200000  0.5966000     3.214000  0.5884000     -0.1364000E-01 0.8380000 
1 1 1 13 39 17 o 1.068000  0.3663000     1.042000  0.5076000     1.094000  0.5284000     -0.5188000E-01 0.7327000 
1 1 1 13 39 18 o 3.036000  0.4819000     2.830000  0.7859000     3.242000  0.5579000     -0.4120000     0.9638000 
1 1 1 13 39 19 o 1.279000  0.4238000     1.411000  0.6528000     1.147000  0.5405000     0.2636000      0.8475000 
1 1 1 13 39 20 o 1.505000  0.5031000     1.675000  0.8151000     1.335000  0.5901000     0.3402000      1.006000  
1 1 1 13 39 21 o 1.516000  0.5219000     1.280000  0.6203000     1.752000  0.8396000     -0.4715000     1.044000  
1 1 1 13 40 0  o 9.501000  0.2436000     9.501000  0.2436000     9.501000  0.2436000     -0.000000      0.000000  
1 1 1 13 40 1  o 2.492000  0.4128000     2.057000  0.6362000     2.927000  0.5261000     -0.8708000     0.8255000 
1 1 1 13 40 2  o 12.67000  0.1705000     12.70000  0.2402000     12.64000  0.2420000     0.6228000E-01  0.3410000 
1 1 1 13 40 3  o 6.051000  0.2089000     6.213000  0.2875000     5.890000  0.3031000     0.3232000      0.4178000 
1 1 1 13 40 4  o 8.221000  0.1816000     8.303000  0.2540000     8.140000  0.2595000     0.1629000      0.3632000 
1 1 1 13 40 5  o 8.461000  0.1836000     8.475000  0.2562000     8.447000  0.2630000     0.2813000E-01  0.3672000 
1 1 1 13 40 6  o 12.15000  0.1761000     12.39000  0.2477000     11.91000  0.2504000     0.4834000      0.3522000 
1 1 1 13 40 7  o 6.583000  0.2198000     6.569000  0.3115000     6.597000  0.3102000     -0.2798000E-01 0.4396000 
1 1 1 13 40 8  o 8.852000  0.1954000     8.710000  0.2812000     8.994000  0.2713000     -0.2840000     0.3907000 
1 1 1 13 40 9  o 8.539000  0.2006000     8.438000  0.2840000     8.641000  0.2834000     -0.2028000     0.4012000 
1 1 1 13 40 10 o 8.673000  0.2033000     8.821000  0.2834000     8.524000  0.2914000     0.2972000      0.4065000 
1 1 1 13 40 11 o 5.000000  0.3785000     5.014000  0.5878000     4.986000  0.4769000     0.2750000E-01  0.7569000 
1 1 1 13 40 12 o 3.355000  0.4726000     3.223000  0.6896000     3.487000  0.6463000     -0.2636000     0.9452000 
1 1 1 13 40 13 o 3.819000  0.4607000     3.779000  0.7528000     3.859000  0.5312000     -0.7978000E-01 0.9213000 
1 1 1 13 40 14 o 3.536000  0.4149000     3.417000  0.5948000     3.656000  0.5784000     -0.2395000     0.8297000 
1 1 1 13 40 15 o 3.589000  0.3936000     3.669000  0.5237000     3.508000  0.5878000     0.1608000      0.7873000 
1 1 1 13 40 16 o 1.611000  0.4743000     1.419000  0.6256000     1.804000  0.7130000     -0.3851000     0.9485000 
1 1 1 13 40 17 o 2.307000  0.5040000     2.292000  0.7080000     2.321000  0.7175000     -0.2857000E-01 1.008000  
1 1 1 13 40 18 o 1.478000  0.4812000     1.682000  0.7504000     1.274000  0.6026000     0.4083000      0.9624000 
1 1 1 13 40 19 o 2.090000  0.5353000     2.311000  0.8049000     1.869000  0.7058000     0.4421000      1.071000  
1 1 1 13 40 20 o 1.422000  0.4541000     1.415000  0.6577000     1.429000  0.6262000     -0.1394000E-01 0.9082000 
1 1 1 13 41 0  o 12.75000  0.2431000     12.75000  0.2431000     12.75000  0.2431000     -0.000000      0.000000  
1 1 1 13 41 1  o 12.72000  0.1726000     12.47000  0.2432000     12.98000  0.2449000     -0.5008000     0.3452000 
1 1 1 13 41 2  o 5.648000  0.2175000     5.673000  0.3062000     5.622000  0.3091000     0.5079000E-01  0.4351000 
1 1 1 13 41 3  o 6.631000  0.2016000     6.563000  0.2858000     6.699000  0.2844000     -0.1363000     0.4032000 
1 1 1 13 41 4  o 8.557000  0.1832000     8.349000  0.2574000     8.764000  0.2607000     -0.4143000     0.3663000 
1 1 1 13 41 5  o 4.078000  0.3054000     3.734000  0.4575000     4.421000  0.4045000     -0.6872000     0.6107000 
1 1 1 13 41 6  o 16.73000  0.1884000     16.56000  0.2651000     16.90000  0.2678000     -0.3371000     0.3769000 
1 1 1 13 41 7  o 12.82000  0.1835000     12.65000  0.2606000     13.00000  0.2585000     -0.3474000     0.3671000 
1 1 1 13 41 8  o 6.061000  0.2369000     6.038000  0.3386000     6.084000  0.3314000     -0.4530000E-01 0.4738000 
1 1 1 13 41 9  o 4.080000  0.3369000     4.252000  0.4588000     3.908000  0.4934000     0.3438000      0.6738000 
1 1 1 13 41 10 o 3.805000  0.4351000     4.412000  0.6311000     3.199000  0.5991000     1.213000       0.8702000 
1 1 1 13 41 11 o 7.968000  0.2827000     7.494000  0.3930000     8.441000  0.4066000     -0.9471000     0.5655000 
1 1 1 13 41 12 o 3.643000  0.5605000     2.958000  0.9688000     4.329000  0.5638000     -1.371000      1.121000  
1 1 1 13 41 13 o 9.183000  0.2127000     9.209000  0.3007000     9.158000  0.3009000     0.5076000E-01  0.4254000 
1 1 1 13 41 14 o 2.262000  0.5152000     2.078000  0.7304000     2.446000  0.7269000     -0.3685000     1.030000  
1 1 1 13 41 15 o 1.706000  0.4809000     1.799000  0.6904000     1.613000  0.6697000     0.1863000      0.9618000 
1 1 1 13 41 16 o 2.560000  0.4999000     2.409000  0.7088000     2.710000  0.7052000     -0.3017000     0.9999000 
1 1 1 13 41 17 o 3.521000  0.4457000     3.066000  0.7370000     3.977000  0.5013000     -0.9114000     0.8914000 
1 1 1 13 41 18 o 2.909000  0.5159000     2.711000  0.6702000     3.108000  0.7844000     -0.3968000     1.032000  
1 1 1 13 41 19 o 1.437000  0.4782000     1.568000  0.7189000     1.307000  0.6307000     0.2610000      0.9564000 
1 1 1 13 41 20 o 1.102000  0.3802000     1.175000  0.5727000     1.028000  0.5003000     0.1476000      0.7604000 
1 1 1 13 42 0  o 3.337000  0.4976000     3.337000  0.4976000     3.337000  0.4976000     0.000000       0.000000  
1 1 1 13 42 1  o 1.478000  0.4348000     1.428000  0.6033000     1.529000  0.6262000     -0.1015000     0.8695000 
1 1 1 13 42 2  o 11.15000  0.1743000     11.26000  0.2458000     11.04000  0.2471000     0.2282000      0.3485000 
1 1 1 13 42 3  o 4.287000  0.2795000     4.050000  0.4048000     4.524000  0.3854000     -0.4737000     0.5590000 
1 1 1 13 42 4  o 7.833000  0.1979000     7.628000  0.2819000     8.038000  0.2778000     -0.4110000     0.3958000 
1 1 1 13 42 5  o 2.074000  0.4746000     2.296000  0.6663000     1.851000  0.6760000     0.4450000      0.9492000 
1 1 1 13 42 6  o 15.27000  0.1868000     15.48000  0.2629000     15.06000  0.2654000     0.4199000      0.3736000 
1 1 1 13 42 7  o 10.03000  0.1898000     10.07000  0.2694000     9.983000  0.2675000     0.8884000E-01  0.3796000 
1 1 1 13 42 8  o 5.328000  0.2667000     5.511000  0.3735000     5.145000  0.3808000     0.3659000      0.5334000 
1 1 1 13 42 9  f 3.697000  0.3831000     4.263000  0.4582000     3.131000  0.6141000     1.133000       0.7663000 
1 1 1 13 42 10 o 6.683000  0.2982000     6.419000  0.3966000     6.948000  0.4455000     -0.5287000     0.5964000 
1 1 1 13 42 11 o 8.043000  0.3455000     8.200000  0.3620000     7.886000  0.5885000     0.3139000      0.6909000 
1 1 1 13 42 12 o 3.516000  0.4640000     3.034000  0.7802000     3.998000  0.5026000     -0.9638000     0.9281000 
1 1 1 13 42 13 o 3.460000  0.4210000     3.624000  0.5540000     3.296000  0.6340000     0.3284000      0.8419000 
1 1 1 13 42 14 o 2.620000  0.4832000     3.149000  0.6291000     2.091000  0.7337000     1.058000       0.9665000 
1 1 1 13 42 15 f 2.248000  0.5017000     2.561000  0.6981000     1.934000  0.7207000     0.6274000      1.003000  
1 1 1 13 42 16 o 1.200000  0.3998000     1.196000  0.5621000     1.205000  0.5686000     -0.8615000E-02 0.7995000 
1 1 1 13 42 17 o 1.634000  0.5037000     1.690000  0.7620000     1.578000  0.6589000     0.1112000      1.007000  
1 1 1 13 42 18 o 1.407000  0.4360000     1.591000  0.6613000     1.223000  0.5685000     0.3684000      0.8721000 
1 1 1 13 42 19 o 1.665000  0.5377000     1.856000  0.8717000     1.475000  0.6299000     0.3814000      1.075000  
1 1 1 13 43 0  o 11.60000  0.2497000     11.60000  0.2497000     11.60000  0.2497000     -0.000000      0.000000  
1 1 1 13 43 1  o 9.306000  0.1832000     9.667000  0.2562000     8.945000  0.2620000     0.7221000      0.3664000 
1 1 1 13 43 2  o 4.242000  0.2871000     4.226000  0.4106000     4.259000  0.4013000     -0.3248000E-01 0.5741000 
1 1 1 13 43 3  o 4.485000  0.2817000     4.459000  0.3988000     4.512000  0.3978000     -0.5341000E-01 0.5633000 
1 1 1 13 43 4  o 1.985000  0.4018000     1.142000  0.5358000     2.829000  0.5988000     -1.687000      0.8035000 
1 1 1 13 43 5  o 7.809000  0.2024000     7.591000  0.2863000     8.026000  0.2860000     -0.4348000     0.4047000 
1 1 1 13 43 6  o 6.215000  0.2345000     5.930000  0.3402000     6.500000  0.3227000     -0.5703000     0.4689000 
1 1 1 13 43 7  o 4.485000  0.3122000     4.928000  0.4013000     4.043000  0.4784000     0.8858000      0.6244000 
1 1 1 13 43 8  o 2.793000  0.4461000     3.558000  0.5439000     2.029000  0.7072000     1.529000       0.8922000 
1 1 1 13 43 9  o 7.419000  0.2902000     7.638000  0.4487000     7.199000  0.3683000     0.4396000      0.5805000 
1 1 1 13 43 10 o 2.733000  0.5345000     3.294000  0.6337000     2.172000  0.8609000     1.122000       1.069000  
1 1 1 13 43 11 o 2.563000  0.5722000     2.490000  0.9176000     2.637000  0.6839000     -0.1469000     1.144000  
1 1 1 13 43 12 o 2.823000  0.4579000     3.502000  0.5553000     2.144000  0.7283000     1.358000       0.9159000 
1 1 1 13 43 13 o 3.263000  0.4356000     3.313000  0.5993000     3.214000  0.6324000     0.9900000E-01  0.8713000 
1 1 1 13 43 14 o 3.009000  0.4571000     2.698000  0.6961000     3.321000  0.5927000     -0.6227000     0.9143000 
1 1 1 13 43 15 o 5.566000  0.2771000     5.590000  0.3951000     5.542000  0.3887000     0.4763000E-01  0.5542000 
1 1 1 13 43 16 f 1.589000  0.4627000     1.710000  0.6768000     1.469000  0.6311000     0.2414000      0.9254000 
1 1 1 13 43 17 o 2.333000  0.5443000     1.911000  0.7433000     2.755000  0.7953000     -0.8440000     1.089000  
1 1 1 13 43 18 o 2.067000  0.5488000     2.092000  0.6953000     2.042000  0.8493000     0.4957000E-01  1.098000  
1 1 1 13 43 19 o 1.514000  0.4461000     1.212000  0.5694000     1.816000  0.6868000     -0.6038000     0.8922000 
1 1 1 13 44 0  o 15.05000  0.2588000     15.05000  0.2588000     15.05000  0.2588000     -0.000000      0.000000  
1 1 1 13 44 1  o 1.337000  0.4178000     1.439000  0.6168000     1.235000  0.5638000     0.2037000      0.8357000 
1 1 1 13 44 2  o 5.467000  0.2454000     5.545000  0.3441000     5.390000  0.3499000     0.1549000      0.4907000 
1 1 1 13 44 3  o 13.74000  0.1814000     13.47000  0.2555000     14.01000  0.2575000     -0.5453000     0.3627000 
1 1 1 13 44 4  o 7.948000  0.2029000     8.048000  0.2855000     7.849000  0.2883000     0.1985000      0.4057000 
1 1 1 13 44 5  o 13.60000  0.1853000     13.53000  0.2599000     13.68000  0.2642000     -0.1536000     0.3706000 
1 1 1 13 44 6  o 4.595000  0.3006000     4.398000  0.4315000     4.792000  0.4186000     -0.3937000     0.6012000 
1 1 1 13 44 7  o 7.961000  0.2137000     7.666000  0.3097000     8.255000  0.2945000     -0.5890000     0.4273000 
1 1 1 13 44 8  o 4.384000  0.4258000     4.264000  0.7243000     4.504000  0.4480000     -0.2401000     0.8517000 
1 1 1 13 44 9  o 1.737000  0.4899000     1.076000  0.5272000     2.399000  0.8260000     -1.323000      0.9799000 
1 1 1 13 44 10 o 3.358000  0.5657000     3.155000  0.9099000     3.562000  0.6724000     -0.4063000     1.131000  
1 1 1 13 44 11 o 1.306000  0.4230000     1.475000  0.6480000     1.137000  0.5438000     0.3385000      0.8459000 
1 1 1 13 44 12 o 2.500000  0.4955000     2.096000  0.7246000     2.905000  0.6760000     -0.8095000     0.9910000 
1 1 1 13 44 13 o 3.488000  0.4078000     3.266000  0.6014000     3.710000  0.5509000     -0.4445000     0.8155000 
1 1 1 13 44 14 o 3.243000  0.4394000     2.898000  0.6747000     3.588000  0.5629000     -0.6900000     0.8787000 
1 1 1 13 44 15 o 1.246000  0.4094000     1.344000  0.6090000     1.149000  0.5472000     0.1951000      0.8187000 
1 1 1 13 44 16 o 2.144000  0.5345000     2.603000  0.8187000     1.685000  0.6873000     0.9186000      1.069000  
1 1 1 13 44 17 o 1.871000  0.4927000     1.948000  0.6885000     1.795000  0.7049000     0.1534000      0.9854000 
1 1 1 13 44 18 o 1.362000  0.4513000     1.536000  0.6918000     1.187000  0.5796000     0.3487000      0.9026000 
1 1 1 13 44 19 o 3.710000  0.3774000     3.436000  0.5633000     3.983000  0.5024000     -0.5470000     0.7548000 
1 1 1 13 45 0  o 9.349000  0.2686000     9.349000  0.2686000     9.349000  0.2686000     -0.000000      0.000000  
1 1 1 13 45 1  o 5.423000  0.2511000     5.678000  0.3405000     5.168000  0.3690000     0.5094000      0.5021000 
1 1 1 13 45 2  o 6.734000  0.2200000     6.486000  0.3182000     6.982000  0.3039000     -0.4957000     0.4400000 
1 1 1 13 45 3  o 9.278000  0.1915000     9.361000  0.2678000     9.196000  0.2738000     0.1649000      0.3829000 
1 1 1 13 45 4  o 4.679000  0.2857000     4.551000  0.4018000     4.808000  0.4063000     -0.2569000     0.5714000 
1 1 1 13 45 5  o 3.199000  0.4072000     3.403000  0.5402000     2.996000  0.6093000     0.4070000      0.8143000 
1 1 1 13 45 6  o 7.430000  0.2173000     7.691000  0.3012000     7.170000  0.3132000     0.5204000      0.4345000 
1 1 1 13 45 7  o 1.888000  0.5320000     2.338000  0.8504000     1.438000  0.6394000     0.8999000      1.064000  
1 1 1 13 45 8  o 2.652000  0.5557000     3.221000  0.6611000     2.082000  0.8934000     1.139000       1.111000  
1 1 1 13 45 9  o 2.347000  0.6064000     2.529000  0.9232000     2.165000  0.7864000     0.3642000      1.213000  
1 1 1 13 45 10 o 3.329000  0.4275000     2.736000  0.6976000     3.922000  0.4945000     -1.186000      0.8551000 
1 1 1 13 45 11 o 1.325000  0.4246000     1.484000  0.6436000     1.166000  0.5541000     0.3181000      0.8493000 
1 1 1 13 45 12 o 2.879000  0.4736000     2.949000  0.6445000     2.809000  0.6942000     0.1405000      0.9473000 
1 1 1 13 45 13 o 2.669000  0.4916000     2.674000  0.6894000     2.663000  0.7009000     0.1103000E-01  0.9832000 
1 1 1 13 45 14 o 1.920000  0.4950000     1.719000  0.6856000     2.121000  0.7143000     -0.4018000     0.9901000 
1 1 1 13 45 15 o 2.479000  0.4631000     1.833000  0.7110000     3.126000  0.5937000     -1.293000      0.9263000 
1 1 1 13 45 16 o 1.645000  0.5191000     1.594000  0.7340000     1.696000  0.7342000     -0.1023000     1.038000  
1 1 1 13 45 17 o 2.473000  0.5638000     1.816000  0.6994000     3.130000  0.8844000     -1.314000      1.128000  
1 1 1 13 45 18 o 1.683000  0.4777000     1.883000  0.7078000     1.483000  0.6417000     0.3993000      0.9554000 
1 1 1 13 46 0  o 1.642000  0.8310000     1.642000  0.8310000     1.642000  0.8310000     0.000000       0.000000  
1 1 1 13 46 1  o 2.441000  0.4704000     2.921000  0.6304000     1.961000  0.6984000     0.9609000      0.9408000 
1 1 1 13 46 2  f 2.347000  0.4946000     2.216000  0.7091000     2.478000  0.6898000     -0.2612000     0.9893000 
1 1 1 13 46 3  o 7.953000  0.2067000     8.129000  0.2871000     7.778000  0.2975000     0.3512000      0.4134000 
1 1 1 13 46 4  o 4.346000  0.3112000     4.245000  0.4456000     4.447000  0.4346000     -0.2028000     0.6224000 
1 1 1 13 46 5  o 6.193000  0.2458000     6.006000  0.3571000     6.380000  0.3378000     -0.3739000     0.4915000 
1 1 1 13 46 6  o 4.821000  0.3863000     4.939000  0.5928000     4.702000  0.4954000     0.2366000      0.7726000 
1 1 1 13 46 7  o 5.633000  0.4487000     5.986000  0.3892000     5.280000  0.8087000     0.7066000      0.8974000 
1 1 1 13 46 8  o 1.832000  0.5540000     2.080000  0.8642000     1.584000  0.6934000     0.4964000      1.108000  
1 1 1 13 46 9  o 2.161000  0.4998000     1.795000  0.7174000     2.527000  0.6960000     -0.7323000     0.9995000 
1 1 1 13 46 10 o 4.964000  0.2990000     4.793000  0.4353000     5.135000  0.4099000     -0.3417000     0.5979000 
1 1 1 13 46 11 o 3.998000  0.3620000     4.326000  0.4646000     3.670000  0.5553000     0.6561000      0.7240000 
1 1 1 13 46 12 o 3.219000  0.4372000     3.115000  0.6434000     3.323000  0.5922000     -0.2078000     0.8744000 
1 1 1 13 46 13 o 1.542000  0.4590000     1.282000  0.5921000     1.801000  0.7015000     -0.5188000     0.9180000 
1 1 1 13 46 14 o 1.527000  0.4581000     1.635000  0.6733000     1.419000  0.6214000     0.2151000      0.9162000 
1 1 1 13 46 15 o 3.104000  0.4944000     3.114000  0.7634000     3.093000  0.6285000     0.2138000E-01  0.9888000 
1 1 1 13 46 16 o 2.738000  0.4832000     2.863000  0.6542000     2.614000  0.7113000     0.2494000      0.9664000 
1 1 1 13 46 17 o 1.599000  0.5076000     1.576000  0.7147000     1.622000  0.7209000     -0.4550000E-01 1.015000  
1 1 1 13 46 18 o 1.783000  0.4895000     1.683000  0.6733000     1.882000  0.7108000     -0.1986000     0.9791000 
1 1 1 13 47 0  o 1.334000  0.7821000     1.334000  0.7821000     1.334000  0.7821000     -0.000000      0.000000  
1 1 1 13 47 1  o 6.300000  0.2401000     6.425000  0.3356000     6.174000  0.3436000     0.2502000      0.4803000 
1 1 1 13 47 2  o 7.493000  0.2158000     7.240000  0.3089000     7.746000  0.3015000     -0.5058000     0.4316000 
1 1 1 13 47 3  f 5.380000  0.2617000     5.283000  0.3725000     5.476000  0.3678000     -0.1936000     0.5234000 
1 1 1 13 47 4  o 4.859000  0.3245000     4.317000  0.5316000     5.402000  0.3722000     -1.086000      0.6490000 
1 1 1 13 47 5  o 2.060000  0.5449000     1.535000  0.7116000     2.585000  0.8255000     -1.050000      1.090000  
1 1 1 13 47 6  o 3.554000  0.6631000     3.554000  0.6631000     ?         ?             ?              ?         
1 1 1 13 47 7  o 2.549000  0.6043000     3.098000  0.9265000     1.999000  0.7759000     1.099000       1.209000  
1 1 1 13 47 8  o 6.617000  0.2493000     6.767000  0.3685000     6.467000  0.3357000     0.3000000      0.4985000 
1 1 1 13 47 9  o 1.226000  0.4058000     1.195000  0.5659000     1.256000  0.5817000     -0.6098000E-01 0.8116000 
1 1 1 13 47 10 o 1.660000  0.4621000     2.104000  0.7237000     1.217000  0.5748000     0.8867000      0.9242000 
1 1 1 13 47 11 o 1.987000  0.4849000     1.507000  0.6504000     2.468000  0.7195000     -0.9604000     0.9699000 
1 1 1 13 47 12 o 2.052000  0.4929000     2.373000  0.7087000     1.731000  0.6853000     0.6414000      0.9859000 
1 1 1 13 47 13 o 1.690000  0.4790000     1.491000  0.6433000     1.889000  0.7097000     -0.3976000     0.9579000 
1 1 1 13 47 14 o 1.717000  0.4756000     1.517000  0.6443000     1.917000  0.6997000     -0.4006000     0.9511000 
1 1 1 13 47 15 o 1.618000  0.4925000     1.308000  0.6372000     1.928000  0.7512000     -0.6196000     0.9850000 
1 1 1 13 47 16 o 2.251000  0.5613000     2.307000  0.7099000     2.195000  0.8696000     0.1117000      1.123000  
1 1 1 13 47 17 o 1.959000  0.5157000     1.953000  0.7488000     1.966000  0.7091000     -0.1303000E-01 1.031000  
1 1 1 13 48 0  o 12.27000  0.2755000     12.27000  0.2755000     12.27000  0.2755000     -0.000000      0.000000  
1 1 1 13 48 1  o 6.728000  0.2560000     6.433000  0.3958000     7.023000  0.3247000     -0.5901000     0.5120000 
1 1 1 13 48 2  o 2.396000  0.5601000     2.102000  0.8277000     2.690000  0.7548000     -0.5879000     1.120000  
1 1 1 13 48 3  o 6.401000  0.3471000     7.082000  0.4650000     5.720000  0.5155000     1.361000       0.6943000 
1 1 1 13 48 4  o 4.229000  0.5565000     4.229000  0.5565000     ?         ?             ?              ?         
1 1 1 13 48 5  o 1.837000  0.5567000     2.075000  0.8383000     1.600000  0.7328000     0.4759000      1.113000  
1 1 1 13 48 6  o 1.746000  0.5105000     1.693000  0.7423000     1.800000  0.7011000     -0.1062000     1.021000  
1 1 1 13 48 7  f 5.659000  0.2777000     5.414000  0.4169000     5.905000  0.3669000     -0.4909000     0.5553000 
1 1 1 13 48 8  o 3.953000  0.3643000     4.194000  0.4958000     3.713000  0.5340000     0.4809000      0.7287000 
1 1 1 13 48 9  o 1.826000  0.4729000     1.298000  0.5983000     2.353000  0.7325000     -1.055000      0.9458000 
1 1 1 13 48 10 o 1.593000  0.4731000     1.529000  0.6557000     1.657000  0.6821000     -0.1278000     0.9461000 
1 1 1 13 48 11 o 1.796000  0.4727000     1.433000  0.6283000     2.159000  0.7063000     -0.7252000     0.9453000 
1 1 1 13 48 12 f 4.772000  0.3049000     4.425000  0.4577000     5.119000  0.4030000     -0.6946000     0.6098000 
1 1 1 13 48 13 o 1.478000  0.4181000     2.059000  0.7062000     0.8961000 0.4479000     1.163000       0.8363000 
1 1 1 13 48 14 o 1.398000  0.4510000     1.583000  0.7014000     1.213000  0.5672000     0.3709000      0.9020000 
1 1 1 13 48 15 o 1.458000  0.4505000     1.160000  0.5504000     1.757000  0.7135000     -0.5975000     0.9011000 
1 1 1 13 48 16 o 1.615000  0.5037000     1.827000  0.7686000     1.403000  0.6513000     0.4240000      1.007000  
1 1 1 13 48 17 o 1.288000  0.4157000     1.068000  0.5159000     1.508000  0.6519000     -0.4400000     0.8314000 
1 1 1 13 49 0  o 1.207000  0.8369000     1.207000  0.8369000     1.207000  0.8369000     -0.000000      0.000000  
1 1 1 13 49 1  o 2.527000  0.8750000     2.527000  0.8750000     ?         ?             ?              ?         
1 1 1 13 49 2  o 4.268000  0.6045000     3.996000  0.7410000     4.541000  0.9552000     -0.5448000     1.209000  
1 1 1 13 49 3  o 5.432000  0.4047000     5.433000  0.5710000     5.432000  0.5736000     0.3591000E-03  0.8094000 
1 1 1 13 49 4  o 4.173000  0.4327000     5.175000  0.5935000     3.170000  0.6298000     2.005000       0.8654000 
1 1 1 13 49 5  o 4.506000  0.3653000     5.286000  0.4916000     3.726000  0.5404000     1.560000       0.7306000 
1 1 1 13 49 6  o 3.395000  0.4275000     3.138000  0.6583000     3.652000  0.5456000     -0.5142000     0.8550000 
1 1 1 13 49 7  o 6.618000  0.2409000     6.692000  0.3374000     6.543000  0.3440000     0.1488000      0.4818000 
1 1 1 13 49 8  o 5.420000  0.2763000     5.525000  0.3918000     5.314000  0.3896000     0.2109000      0.5526000 
1 1 1 13 49 9  o 1.811000  0.4940000     1.613000  0.6837000     2.009000  0.7131000     -0.3957000     0.9879000 
1 1 1 13 49 10 o 2.455000  0.5062000     2.172000  0.7380000     2.739000  0.6931000     -0.5671000     1.012000  
1 1 1 13 49 11 o 5.534000  0.2761000     5.536000  0.3885000     5.533000  0.3923000     0.3340000E-02  0.5521000 
1 1 1 13 49 12 o 1.646000  0.4648000     1.319000  0.5998000     1.974000  0.7103000     -0.6548000     0.9296000 
1 1 1 13 49 13 o 1.958000  0.4879000     1.632000  0.6731000     2.284000  0.7066000     -0.6517000     0.9759000 
1 1 1 13 49 14 o 1.465000  0.4742000     1.522000  0.6785000     1.408000  0.6626000     0.1139000      0.9483000 
1 1 1 13 49 15 o 1.298000  0.4413000     1.104000  0.5334000     1.491000  0.7032000     -0.3870000     0.8826000 
1 1 1 13 49 16 o 1.767000  0.4969000     1.982000  0.7464000     1.553000  0.6560000     0.4291000      0.9938000 
1 1 1 13 49 17 o 1.504000  0.5196000     1.414000  0.6964000     1.595000  0.7715000     -0.1812000     1.039000  
1 1 1 13 50 0  o 1.446000  0.8559000     1.446000  0.8559000     1.446000  0.8559000     0.000000       0.000000  
1 1 1 13 50 1  o 6.833000  0.2621000     6.952000  0.3982000     6.713000  0.3409000     0.2390000      0.5243000 
1 1 1 13 50 2  o 7.359000  0.2360000     7.418000  0.3395000     7.299000  0.3277000     0.1183000      0.4719000 
1 1 1 13 50 3  o 5.629000  0.2797000     5.905000  0.3839000     5.353000  0.4070000     0.5514000      0.5595000 
1 1 1 13 50 4  o 5.526000  0.2797000     5.571000  0.4022000     5.481000  0.3887000     0.9001000E-01  0.5593000 
1 1 1 13 50 5  o 5.483000  0.2804000     5.746000  0.3867000     5.219000  0.4062000     0.5269000      0.5608000 
1 1 1 13 50 6  o 1.350000  0.4331000     1.291000  0.5970000     1.409000  0.6277000     -0.1182000     0.8663000 
1 1 1 13 50 7  o 1.289000  0.4229000     1.187000  0.5663000     1.392000  0.6283000     -0.2049000     0.8458000 
1 1 1 13 50 8  o 2.612000  0.4679000     3.232000  0.6210000     1.992000  0.7000000     1.241000       0.9358000 
1 1 1 13 50 9  o 2.207000  0.5062000     2.412000  0.7167000     2.002000  0.7151000     0.4094000      1.012000  
1 1 1 13 50 10 o 2.863000  0.4652000     2.424000  0.7239000     3.302000  0.5844000     -0.8777000     0.9303000 
1 1 1 13 50 11 o 4.344000  0.3399000     3.769000  0.5325000     4.919000  0.4226000     -1.150000      0.6798000 
1 1 1 13 50 12 o 1.953000  0.4738000     2.460000  0.7023000     1.447000  0.6361000     1.013000       0.9476000 
1 1 1 13 50 13 o 1.560000  0.4878000     1.474000  0.6943000     1.646000  0.6854000     -0.1719000     0.9756000 
1 1 1 13 50 14 o 1.485000  0.4684000     1.411000  0.6282000     1.560000  0.6950000     -0.1496000     0.9368000 
1 1 1 13 50 15 o 1.875000  0.5239000     1.884000  0.7770000     1.865000  0.7029000     0.1829000E-01  1.048000  
1 1 1 13 50 16 o 1.222000  0.4028000     1.369000  0.6143000     1.075000  0.5212000     0.2936000      0.8056000 
1 1 1 13 51 0  o 5.408000  0.3951000     5.408000  0.3951000     5.408000  0.3951000     -0.000000      0.000000  
1 1 1 13 51 1  o 4.031000  0.3733000     4.616000  0.4519000     3.446000  0.5943000     1.170000       0.7466000 
1 1 1 13 51 2  o 5.522000  0.2767000     5.345000  0.4046000     5.699000  0.3777000     -0.3542000     0.5535000 
1 1 1 13 51 3  o 5.096000  0.2894000     4.979000  0.4242000     5.213000  0.3939000     -0.2343000     0.5789000 
1 1 1 13 51 4  o 1.824000  0.4771000     2.244000  0.7205000     1.404000  0.6254000     0.8402000      0.9541000 
1 1 1 13 51 5  o 1.528000  0.4606000     1.368000  0.6179000     1.687000  0.6832000     -0.3191000     0.9212000 
1 1 1 13 51 6  o 3.207000  0.4398000     3.209000  0.6224000     3.206000  0.6215000     0.3322000E-02  0.8796000 
1 1 1 13 51 7  o 3.876000  0.3677000     3.744000  0.5431000     4.008000  0.4958000     -0.2639000     0.7353000 
1 1 1 13 51 8  o 3.394000  0.4327000     4.148000  0.4913000     2.639000  0.7124000     1.508000       0.8654000 
1 1 1 13 51 9  o 3.006000  0.4600000     3.404000  0.6003000     2.607000  0.6972000     0.7971000      0.9200000 
1 1 1 13 51 10 o 4.608000  0.3220000     4.391000  0.4703000     4.824000  0.4398000     -0.4326000     0.6439000 
1 1 1 13 51 11 o 1.364000  0.4315000     1.131000  0.5428000     1.598000  0.6710000     -0.4660000     0.8631000 
1 1 1 13 51 12 o 1.375000  0.4454000     1.706000  0.7325000     1.043000  0.5071000     0.6633000      0.8909000 
1 1 1 13 51 13 o 1.511000  0.4740000     1.565000  0.6671000     1.457000  0.6735000     0.1083000      0.9479000 
1 1 1 13 51 14 o 2.059000  0.5154000     2.616000  0.7529000     1.502000  0.7039000     1.114000       1.031000  
1 1 1 13 51 15 o 1.246000  0.4094000     1.230000  0.5745000     1.263000  0.5833000     -0.3303000E-01 0.8188000 
1 1 1 13 52 0  o 7.289000  0.3253000     7.289000  0.3253000     7.289000  0.3253000     -0.000000      0.000000  
1 1 1 13 52 1  f 3.315000  0.4224000     3.023000  0.6366000     3.607000  0.5553000     -0.5836000     0.8448000 
1 1 1 13 52 2  o 7.476000  0.2302000     7.545000  0.3225000     7.408000  0.3286000     0.1370000      0.4604000 
1 1 1 13 52 3  o 4.359000  0.3285000     4.480000  0.4599000     4.238000  0.4694000     0.2419000      0.6571000 
1 1 1 13 52 4  o 8.170000  0.2804000     8.120000  0.4642000     8.221000  0.3147000     -0.1011000     0.5608000 
1 1 1 13 52 5  f 6.028000  0.2625000     6.320000  0.3547000     5.737000  0.3870000     0.5827000      0.5250000 
1 1 1 13 52 6  o 3.630000  0.3924000     3.668000  0.5500000     3.592000  0.5597000     0.7635000E-01  0.7847000 
1 1 1 13 52 7  o 1.592000  0.4744000     1.609000  0.6750000     1.576000  0.6669000     0.3338000E-01  0.9488000 
1 1 1 13 52 8  o 3.022000  0.4660000     2.785000  0.6902000     3.259000  0.6262000     -0.4741000     0.9319000 
1 1 1 13 52 9  f 1.622000  0.4744000     1.575000  0.6621000     1.670000  0.6797000     -0.9551000E-01 0.9489000 
1 1 1 13 52 10 o 1.559000  0.4685000     1.504000  0.6487000     1.615000  0.6760000     -0.1108000     0.9369000 
1 1 1 13 52 11 o 4.596000  0.3248000     4.712000  0.4470000     4.479000  0.4714000     0.2337000      0.6496000 
1 1 1 13 52 12 o 2.097000  0.5583000     1.840000  0.7981000     2.354000  0.7810000     -0.5141000     1.117000  
1 1 1 13 52 13 o 1.746000  0.5227000     1.702000  0.6828000     1.791000  0.7917000     -0.8905000E-01 1.045000  
1 1 1 13 52 14 o 1.535000  0.4598000     2.021000  0.7650000     1.048000  0.5104000     0.9732000      0.9197000 
1 1 1 13 52 15 f 1.295000  0.4204000     1.420000  0.6316000     1.169000  0.5551000     0.2508000      0.8409000 
1 1 1 13 53 0  o 1.500000  0.8310000     1.500000  0.8310000     1.500000  0.8310000     -0.000000      0.000000  
1 1 1 13 53 1  o 1.582000  0.4750000     1.528000  0.6613000     1.636000  0.6820000     -0.1084000     0.9500000 
1 1 1 13 53 2  o 5.446000  0.2843000     5.632000  0.3872000     5.261000  0.4164000     0.3714000      0.5686000 
1 1 1 13 53 3  o 9.241000  0.2106000     8.976000  0.2999000     9.506000  0.2958000     -0.5297000     0.4212000 
1 1 1 13 53 4  o 5.070000  0.2916000     5.446000  0.3878000     4.695000  0.4356000     0.7510000      0.5832000 
1 1 1 13 53 5  o 4.069000  0.3451000     4.084000  0.4959000     4.054000  0.4802000     0.3002000E-01  0.6903000 
1 1 1 13 53 6  o 5.612000  0.2748000     5.342000  0.3992000     5.882000  0.3776000     -0.5397000     0.5495000 
1 1 1 13 53 7  o 2.755000  0.4845000     2.916000  0.6613000     2.594000  0.7083000     0.3224000      0.9690000 
1 1 1 13 53 8  o 1.483000  0.4494000     1.786000  0.7019000     1.181000  0.5616000     0.6047000      0.8989000 
1 1 1 13 53 9  o 2.017000  0.4628000     1.388000  0.6262000     2.646000  0.6815000     -1.258000      0.9255000 
1 1 1 13 53 10 o 1.973000  0.5052000     1.978000  0.7211000     1.967000  0.7078000     0.1092000E-01  1.010000  
1 1 1 13 53 11 o 2.197000  0.5538000     2.010000  0.8301000     2.385000  0.7333000     -0.3750000     1.108000  
1 1 1 13 53 12 o 3.833000  0.4781000     4.964000  0.4266000     2.702000  0.8557000     2.263000       0.9562000 
1 1 1 13 53 13 o 1.266000  0.4187000     1.121000  0.5551000     1.410000  0.6269000     -0.2892000     0.8373000 
1 1 1 13 53 14 o 1.815000  0.4945000     1.945000  0.7110000     1.685000  0.6874000     0.2596000      0.9890000 
1 1 1 13 54 0  o 1.531000  0.8327000     1.531000  0.8327000     1.531000  0.8327000     0.000000       0.000000  
1 1 1 13 54 1  o 3.559000  0.3983000     3.420000  0.5881000     3.698000  0.5374000     -0.2778000     0.7966000 
1 1 1 13 54 2  o 2.708000  0.4819000     2.877000  0.6617000     2.540000  0.7007000     0.3371000      0.9637000 
1 1 1 13 54 3  o 2.456000  0.4870000     2.988000  0.6558000     1.925000  0.7202000     1.063000       0.9740000 
1 1 1 13 54 4  o 5.846000  0.2614000     5.933000  0.3642000     5.759000  0.3749000     0.1737000      0.5227000 
1 1 1 13 54 5  o 2.437000  0.4980000     2.711000  0.6909000     2.163000  0.7173000     0.5480000      0.9959000 
1 1 1 13 54 6  o 2.217000  0.5062000     2.456000  0.7037000     1.979000  0.7278000     0.4763000      1.012000  
1 1 1 13 54 7  o 2.607000  0.4676000     3.273000  0.5911000     1.940000  0.7247000     1.333000       0.9352000 
1 1 1 13 54 8  o 3.305000  0.4401000     3.642000  0.5495000     2.968000  0.6876000     0.6732000      0.8802000 
1 1 1 13 54 9  o 1.791000  0.4897000     2.093000  0.7349000     1.488000  0.6476000     0.6051000      0.9795000 
1 1 1 13 54 10 o 1.768000  0.5178000     1.611000  0.7468000     1.925000  0.7175000     -0.3135000     1.036000  
1 1 1 13 54 11 o 1.917000  0.4976000     2.415000  0.7194000     1.419000  0.6875000     0.9962000      0.9951000 
1 1 1 13 54 12 f 2.299000  0.6563000     3.033000  1.110000      1.565000  0.7000000     1.468000       1.313000  
1 1 1 13 54 13 o 1.477000  0.4512000     1.727000  0.6961000     1.228000  0.5744000     0.4985000      0.9025000 
1 1 1 13 54 14 o 1.708000  0.4899000     1.769000  0.7065000     1.648000  0.6789000     0.1210000      0.9798000 
1 1 1 13 55 0  o 5.344000  0.4011000     5.344000  0.4011000     5.344000  0.4011000     -0.000000      0.000000  
1 1 1 13 55 1  o 7.171000  0.2390000     6.913000  0.3470000     7.428000  0.3288000     -0.5158000     0.4780000 
1 1 1 13 55 2  o 4.854000  0.3036000     4.704000  0.4365000     5.005000  0.4220000     -0.3011000     0.6072000 
1 1 1 13 55 3  o 6.525000  0.2449000     6.377000  0.3505000     6.674000  0.3423000     -0.2976000     0.4899000 
1 1 1 13 55 4  o 4.250000  0.3389000     4.185000  0.4857000     4.316000  0.4729000     -0.1309000     0.6779000 
1 1 1 13 55 5  o 2.029000  0.5055000     1.943000  0.7131000     2.114000  0.7167000     -0.1713000     1.011000  
1 1 1 13 55 6  o 3.366000  0.4295000     4.025000  0.5084000     2.708000  0.6925000     1.317000       0.8591000 
1 1 1 13 55 7  o 2.112000  0.5123000     2.325000  0.7248000     1.900000  0.7244000     0.4244000      1.025000  
1 1 1 13 55 8  o 1.589000  0.4753000     1.468000  0.6425000     1.710000  0.7005000     -0.2418000     0.9506000 
1 1 1 13 55 9  o 2.500000  0.5465000     3.526000  0.8796000     1.474000  0.6488000     2.052000       1.093000  
1 1 1 13 55 10 o 2.878000  0.5296000     3.625000  0.5620000     2.131000  0.8978000     1.495000       1.059000  
1 1 1 13 55 11 o 2.449000  0.5637000     2.398000  0.7754000     2.499000  0.8184000     -0.1012000     1.127000  
1 1 1 13 55 12 o 2.545000  0.4962000     2.610000  0.7107000     2.481000  0.6927000     0.1288000      0.9924000 
1 1 1 13 55 13 f 2.454000  0.5013000     2.014000  0.7272000     2.894000  0.6902000     -0.8805000     1.003000  
1 1 1 13 56 0  o 3.607000  0.5844000     3.607000  0.5844000     3.607000  0.5844000     0.000000       0.000000  
1 1 1 13 56 1  o 2.914000  0.4727000     3.078000  0.6416000     2.750000  0.6944000     0.3280000      0.9455000 
1 1 1 13 56 2  o 4.314000  0.3435000     4.653000  0.4482000     3.976000  0.5206000     0.6774000      0.6870000 
1 1 1 13 56 3  o 6.302000  0.2585000     6.272000  0.3635000     6.331000  0.3675000     -0.5936000E-01 0.5169000 
1 1 1 13 56 4  o 3.186000  0.4457000     3.725000  0.5384000     2.647000  0.7103000     1.078000       0.8913000 
1 1 1 13 56 5  o 4.748000  0.3170000     4.740000  0.4491000     4.756000  0.4475000     -0.1640000E-01 0.6340000 
1 1 1 13 56 6  o 1.380000  0.4378000     1.503000  0.6517000     1.257000  0.5847000     0.2464000      0.8756000 
1 1 1 13 56 7  o 3.385000  0.4392000     3.626000  0.5707000     3.144000  0.6678000     0.4824000      0.8784000 
1 1 1 13 56 8  o 3.893000  0.4999000     3.475000  0.8769000     4.311000  0.4803000     -0.8364000     0.9998000 
1 1 1 13 56 9  o 2.417000  0.6057000     2.529000  0.7404000     2.306000  0.9588000     0.2224000      1.211000  
1 1 1 13 56 10 o 1.318000  0.4401000     1.155000  0.5605000     1.480000  0.6787000     -0.3255000     0.8802000 
1 1 1 13 56 11 o 2.325000  0.5399000     2.513000  0.7778000     2.137000  0.7492000     0.3759000      1.080000  
1 1 1 13 56 12 o 1.288000  0.4202000     1.371000  0.6184000     1.205000  0.5689000     0.1653000      0.8403000 
1 1 1 13 57 0  o 1.014000  0.6717000     1.014000  0.6717000     1.014000  0.6717000     0.000000       0.000000  
1 1 1 13 57 1  o 1.344000  0.4325000     1.466000  0.6442000     1.222000  0.5772000     0.2437000      0.8650000 
1 1 1 13 57 2  o 5.641000  0.2839000     5.364000  0.4120000     5.917000  0.3905000     -0.5532000     0.5677000 
1 1 1 13 57 3  o 3.674000  0.4019000     3.273000  0.6267000     4.075000  0.5033000     -0.8021000     0.8038000 
1 1 1 13 57 4  o 2.514000  0.4956000     2.078000  0.7291000     2.950000  0.6715000     -0.8728000     0.9912000 
1 1 1 13 57 5  o 2.697000  0.4972000     2.615000  0.7145000     2.779000  0.6915000     -0.1637000     0.9944000 
1 1 1 13 57 6  o 3.146000  0.4628000     3.138000  0.6496000     3.153000  0.6593000     -0.1465000E-01 0.9256000 
1 1 1 13 57 7  o 3.169000  0.5578000     3.620000  0.8658000     2.717000  0.7036000     0.9029000      1.116000  
1 1 1 13 57 8  o 4.740000  0.5408000     5.336000  0.4393000     4.143000  0.9885000     1.193000       1.082000  
1 1 1 13 57 9  f 1.216000  0.4181000     1.408000  0.6607000     1.025000  0.5126000     0.3832000      0.8362000 
1 1 1 13 57 10 o 2.577000  0.4960000     1.903000  0.7654000     3.251000  0.6309000     -1.349000      0.9919000 
1 1 1 13 57 11 o 1.566000  0.4706000     1.687000  0.6925000     1.444000  0.6374000     0.2431000      0.9412000 
1 1 1 13 57 12 o 1.133000  0.4088000     1.121000  0.5730000     1.146000  0.5832000     -0.2507000E-01 0.8175000 
1 1 1 13 58 0  f 2.645000  0.8161000     2.645000  0.8161000     2.645000  0.8161000     -0.000000      0.000000  
1 1 1 13 58 1  o 3.626000  0.4276000     2.999000  0.6927000     4.253000  0.5015000     -1.254000      0.8552000 
1 1 1 13 58 2  o 5.425000  0.2931000     5.420000  0.4095000     5.429000  0.4195000     -0.8639000E-02 0.5862000 
1 1 1 13 58 3  o 3.216000  0.4545000     3.100000  0.6648000     3.333000  0.6201000     -0.2324000     0.9091000 
1 1 1 13 58 4  o 5.227000  0.2982000     5.604000  0.3968000     4.850000  0.4451000     0.7544000      0.5964000 
1 1 1 13 58 5  o 1.985000  0.5378000     1.917000  0.7866000     2.053000  0.7336000     -0.1357000     1.076000  
1 1 1 13 58 6  o 1.880000  0.5595000     2.263000  0.8740000     1.498000  0.6988000     0.7651000      1.119000  
1 1 1 13 58 7  o 2.012000  0.7814000     2.012000  0.7814000     ?         ?             ?              ?         
1 1 1 13 58 8  o 3.899000  0.5085000     3.935000  0.7534000     3.864000  0.6832000     0.7050000E-01  1.017000  
1 1 1 13 58 9  o 4.792000  0.3335000     4.747000  0.4855000     4.837000  0.4575000     -0.9034000E-01 0.6671000 
1 1 1 13 58 10 o 1.241000  0.4089000     1.430000  0.6360000     1.053000  0.5139000     0.3762000      0.8177000 
1 1 1 13 58 11 o 3.231000  0.4886000     2.702000  0.7398000     3.759000  0.6385000     -1.058000      0.9773000 
1 1 1 13 59 0  o 1.264000  0.7760000     1.264000  0.7760000     1.264000  0.7760000     0.000000       0.000000  
1 1 1 13 59 1  o 1.745000  0.4880000     1.445000  0.6423000     2.045000  0.7350000     -0.6004000     0.9761000 
1 1 1 13 59 2  o 4.620000  0.3415000     4.642000  0.4872000     4.597000  0.4788000     0.4527000E-01  0.6831000 
1 1 1 13 59 3  o 1.906000  0.5044000     1.561000  0.6928000     2.251000  0.7333000     -0.6899000     1.009000  
1 1 1 13 59 4  o 4.553000  0.5146000     4.736000  0.7105000     4.370000  0.7445000     0.3662000      1.029000  
1 1 1 13 59 5  o 2.718000  0.8263000     2.718000  0.8263000     ?         ?             ?              ?         
1 1 1 13 59 6  o 1.858000  0.5439000     1.439000  0.6541000     2.276000  0.8692000     -0.8367000     1.088000  
1 1 1 13 59 7  o 1.379000  0.4442000     1.243000  0.5967000     1.516000  0.6582000     -0.2729000     0.8884000 
1 1 1 13 59 8  o 1.324000  0.4297000     1.145000  0.5503000     1.503000  0.6601000     -0.3579000     0.8594000 
1 1 1 13 59 9  o 1.492000  0.4605000     1.650000  0.6926000     1.334000  0.6071000     0.3162000      0.9210000 
1 1 1 13 59 10 o 2.281000  0.5214000     2.429000  0.7452000     2.133000  0.7296000     0.2960000      1.043000  
1 1 1 13 60 0  o 1.210000  0.8390000     1.210000  0.8390000     1.210000  0.8390000     -0.000000      0.000000  
1 1 1 13 60 1  o 3.305000  0.7771000     3.724000  1.102000      2.885000  1.096000      0.8383000      1.554000  
1 1 1 13 60 2  o 1.532000  0.5149000     1.658000  0.7513000     1.406000  0.7042000     0.2526000      1.030000  
1 1 1 13 60 3  o 1.387000  0.6507000     1.387000  0.6507000     ?         ?             ?              ?         
1 1 1 13 60 4  o 1.719000  0.5381000     1.811000  0.7783000     1.627000  0.7433000     0.1849000      1.076000  
1 1 1 13 60 5  o 2.175000  0.5200000     1.747000  0.7682000     2.604000  0.7009000     -0.8568000     1.040000  
1 1 1 13 60 6  o 1.868000  0.5171000     2.053000  0.7704000     1.684000  0.6898000     0.3692000      1.034000  
1 1 1 13 60 7  o 1.580000  0.4588000     2.001000  0.7308000     1.160000  0.5551000     0.8412000      0.9177000 
1 1 1 13 60 8  o 2.115000  0.4975000     2.692000  0.7317000     1.538000  0.6743000     1.155000       0.9950000 
1 1 1 13 60 9  o 1.134000  0.3921000     1.192000  0.5815000     1.077000  0.5260000     0.1145000      0.7841000 
1 1 1 13 61 0  o 3.538000  0.7750000     3.538000  0.7750000     3.538000  0.7750000     -0.000000      0.000000  
1 1 1 13 61 1  o 4.628000  0.3955000     5.125000  0.5291000     4.130000  0.5879000     0.9946000      0.7909000 
1 1 1 13 61 2  o 2.036000  0.5358000     2.180000  0.7911000     1.892000  0.7227000     0.2875000      1.072000  
1 1 1 13 61 3  o 5.561000  0.3199000     5.219000  0.5030000     5.903000  0.3953000     -0.6844000     0.6397000 
1 1 1 13 61 4  o 2.599000  0.4941000     2.922000  0.6714000     2.276000  0.7251000     0.6469000      0.9882000 
1 1 1 13 61 5  o 1.454000  0.4532000     1.459000  0.6390000     1.449000  0.6428000     0.1004000E-01  0.9063000 
1 1 1 13 61 6  o 1.722000  0.4899000     1.797000  0.7111000     1.648000  0.6740000     0.1497000      0.9798000 
1 1 1 13 61 7  f 3.546000  0.4330000     3.633000  0.5912000     3.459000  0.6328000     0.1735000      0.8660000 
1 1 1 13 62 0  o 5.405000  0.4178000     5.405000  0.4178000     5.405000  0.4178000     0.000000       0.000000  
1 1 1 13 62 1  o 2.325000  0.4933000     2.869000  0.6914000     1.780000  0.7037000     1.089000       0.9865000 
1 1 1 13 62 2  f 4.813000  0.3298000     4.888000  0.4663000     4.739000  0.4665000     0.1494000      0.6596000 
1 1 1 13 62 3  o 1.445000  0.4498000     1.274000  0.5932000     1.615000  0.6764000     -0.3403000     0.8997000 
1 1 1 13 62 4  o 1.355000  0.4370000     1.286000  0.5985000     1.423000  0.6370000     -0.1379000     0.8740000 
1 1 1 13 62 5  o 3.107000  0.4864000     3.318000  0.6588000     2.895000  0.7158000     0.4231000      0.9728000 
1 1 1 13 62 6  o 3.015000  0.4511000     1.915000  0.7373000     4.116000  0.5198000     -2.201000      0.9021000 
1 1 1 13 63 0  o 3.526000  0.6471000     3.526000  0.6471000     3.526000  0.6471000     0.000000       0.000000  
1 1 1 13 63 1  o 3.024000  0.4863000     2.800000  0.7310000     3.248000  0.6416000     -0.4482000     0.9726000 
1 1 1 13 63 2  o 0.9225000 0.3266000     0.8100000 0.4119000     1.035000  0.5070000     -0.2249000     0.6533000 
1 1 1 13 63 3  o 1.624000  0.4818000     1.459000  0.6484000     1.788000  0.7129000     -0.3291000     0.9636000 
1 1 1 13 63 4  o 1.380000  0.4347000     1.070000  0.5243000     1.689000  0.6935000     -0.6197000     0.8694000 
1 1 1 14 0  1  o 11.39000  0.1962000     11.39000  0.1962000     11.39000  0.1962000     -0.000000      0.000000  
1 1 1 14 0  2  o 10.40000  0.1311000     10.40000  0.1311000     10.40000  0.1311000     -0.000000      0.000000  
1 1 1 14 0  3  o 21.14000  0.2407000     21.14000  0.2407000     21.14000  0.2407000     -0.000000      0.000000  
1 1 1 14 0  4  o 5.148000  0.1650000     5.148000  0.1650000     5.148000  0.1650000     0.000000       0.000000  
1 1 1 14 0  5  o 3.013000  0.2871000     3.013000  0.2871000     3.013000  0.2871000     0.000000       0.000000  
1 1 1 14 0  6  o 4.021000  0.4139000     4.021000  0.4139000     4.021000  0.4139000     0.000000       0.000000  
1 1 1 14 0  7  o 7.240000  0.2053000     7.240000  0.2053000     7.240000  0.2053000     -0.000000      0.000000  
1 1 1 14 0  8  o 11.93000  0.2113000     11.93000  0.2113000     11.93000  0.2113000     -0.000000      0.000000  
1 1 1 14 0  9  o 4.768000  0.3268000     4.768000  0.3268000     4.768000  0.3268000     0.000000       0.000000  
1 1 1 14 0  10 o 4.781000  0.4099000     4.781000  0.4099000     4.781000  0.4099000     0.000000       0.000000  
1 1 1 14 0  11 o 3.537000  0.6900000     3.537000  0.6900000     3.537000  0.6900000     -0.000000      0.000000  
1 1 1 14 0  12 o 7.679000  0.3040000     7.679000  0.3040000     7.679000  0.3040000     -0.000000      0.000000  
1 1 1 14 0  13 o 5.128000  0.4255000     5.128000  0.4255000     5.128000  0.4255000     0.000000       0.000000  
1 1 1 14 0  14 o 6.125000  0.4118000     6.125000  0.4118000     6.125000  0.4118000     0.000000       0.000000  
1 1 1 14 0  15 o 4.198000  0.7656000     4.198000  0.7656000     4.198000  0.7656000     0.000000       0.000000  
1 1 1 14 0  16 o 2.489000  1.158000      2.489000  1.158000      2.489000  1.158000      0.000000       0.000000  
1 1 1 14 0  17 o 10.51000  0.3711000     10.51000  0.3711000     10.51000  0.3711000     -0.000000      0.000000  
1 1 1 14 0  18 o 5.765000  0.5911000     5.765000  0.5911000     5.765000  0.5911000     0.000000       0.000000  
1 1 1 14 0  19 o 4.749000  0.7744000     4.749000  0.7744000     4.749000  0.7744000     0.000000       0.000000  
1 1 1 14 0  20 o 1.728000  1.046000      1.728000  1.046000      1.728000  1.046000      0.000000       0.000000  
1 1 1 14 0  21 o 0.8528000 0.6187000     0.8528000 0.6187000     0.8528000 0.6187000     -0.000000      0.000000  
1 1 1 14 0  22 o 0.8875000 0.6215000     0.8875000 0.6215000     0.8875000 0.6215000     0.000000       0.000000  
1 1 1 14 0  23 o 1.769000  0.9152000     1.769000  0.9152000     1.769000  0.9152000     -0.000000      0.000000  
1 1 1 14 0  24 o 0.9215000 0.6412000     0.9215000 0.6412000     0.9215000 0.6412000     0.000000       0.000000  
1 1 1 14 0  25 o 0.9323000 0.6420000     0.9323000 0.6420000     0.9323000 0.6420000     0.000000       0.000000  
1 1 1 14 0  26 o 1.515000  0.9158000     1.515000  0.9158000     1.515000  0.9158000     -0.000000      0.000000  
1 1 1 14 1  0  o 45.95000  1.021000      45.95000  1.021000      45.95000  1.021000      -0.000000      0.000000  
1 1 1 14 1  1  o 23.29000  0.3009000     23.51000  0.5247000     23.07000  0.2947000     0.4462000      0.6018000 
1 1 1 14 1  2  o 9.597000  0.9677000E-01 9.517000  0.1229000     9.676000  0.1495000     -0.1592000     0.1935000 
1 1 1 14 1  3  o 13.81000  0.1315000     13.77000  0.1703000     13.85000  0.2005000     -0.7369000E-01 0.2631000 
1 1 1 14 1  4  o 15.26000  0.1350000     15.33000  0.1919000     15.19000  0.1899000     0.1364000      0.2699000 
1 1 1 14 1  5  o 9.837000  0.1182000     9.812000  0.1673000     9.863000  0.1671000     -0.5015000E-01 0.2364000 
1 1 1 14 1  6  o 3.552000  0.3561000     4.482000  0.3757000     2.621000  0.6051000     1.861000       0.7122000 
1 1 1 14 1  7  o 7.996000  0.1423000     8.166000  0.1997000     7.825000  0.2027000     0.3412000      0.2846000 
1 1 1 14 1  8  o 1.820000  0.4125000     1.775000  0.5830000     1.865000  0.5836000     -0.9010000E-01 0.8249000 
1 1 1 14 1  9  o 3.758000  0.2743000     3.720000  0.3862000     3.796000  0.3896000     -0.7579000E-01 0.5486000 
1 1 1 14 1  10 o 7.796000  0.2116000     7.537000  0.3026000     8.056000  0.2958000     -0.5183000     0.4232000 
1 1 1 14 1  11 o 1.482000  0.4630000     1.526000  0.6614000     1.437000  0.6481000     0.8876000E-01  0.9260000 
1 1 1 14 1  12 o 3.120000  0.4343000     2.841000  0.6680000     3.398000  0.5552000     -0.5560000     0.8687000 
1 1 1 14 1  13 o 21.76000  0.2167000     21.67000  0.3054000     21.84000  0.3077000     -0.1652000     0.4335000 
1 1 1 14 1  14 o 10.05000  0.2156000     10.01000  0.3031000     10.09000  0.3067000     -0.7279000E-01 0.4312000 
1 1 1 14 1  15 o 2.005000  0.5840000     1.916000  0.8064000     2.094000  0.8451000     -0.1789000     1.168000  
1 1 1 14 1  16 o 8.180000  0.3657000     8.019000  0.4661000     8.340000  0.5637000     -0.3215000     0.7314000 
1 1 1 14 1  17 o 10.16000  0.2663000     10.10000  0.3821000     10.23000  0.3711000     -0.1266000     0.5327000 
1 1 1 14 1  18 o 4.198000  0.5568000     3.997000  0.8188000     4.400000  0.7547000     -0.4023000     1.114000  
1 1 1 14 1  19 f 3.919000  0.6063000     3.621000  0.9096000     4.218000  0.8019000     -0.5970000     1.213000  
1 1 1 14 1  20 o 3.113000  0.6975000     3.173000  0.9892000     3.052000  0.9837000     0.1214000      1.395000  
1 1 1 14 1  21 f 1.370000  0.4677000     1.464000  0.6938000     1.276000  0.6273000     0.1882000      0.9353000 
1 1 1 14 1  22 o 1.340000  0.4430000     1.467000  0.6668000     1.212000  0.5833000     0.2551000      0.8859000 
1 1 1 14 1  23 o 1.469000  0.4706000     1.480000  0.6682000     1.459000  0.6627000     0.2082000E-01  0.9411000 
1 1 1 14 1  24 f 1.239000  0.4196000     1.209000  0.5825000     1.269000  0.6041000     -0.6071000E-01 0.8392000 
1 1 1 14 1  25 o 1.300000  0.4344000     1.191000  0.5736000     1.410000  0.6527000     -0.2189000     0.8689000 
1 1 1 14 1  26 o 1.159000  0.4069000     1.210000  0.5957000     1.107000  0.5546000     0.1035000      0.8139000 
1 1 1 14 2  0  o 18.50000  0.4116000     18.50000  0.4116000     18.50000  0.4116000     -0.000000      0.000000  
1 1 1 14 2  1  o 2.711000  0.1509000     2.718000  0.2861000     2.705000  0.9606000E-01 0.1252000E-01  0.3018000 
1 1 1 14 2  2  f 10.52000  0.1168000     10.27000  0.1885000     10.78000  0.1381000     -0.5089000     0.2337000 
1 1 1 14 2  3  o 22.68000  0.1886000     22.54000  0.2275000     22.82000  0.3007000     -0.2815000     0.3771000 
1 1 1 14 2  4  o 11.26000  0.1133000     11.23000  0.1603000     11.29000  0.1602000     -0.5754000E-01 0.2267000 
1 1 1 14 2  5  o 2.676000  0.2301000     2.867000  0.3035000     2.485000  0.3460000     0.3813000      0.4603000 
1 1 1 14 2  6  o 6.225000  0.2156000     6.252000  0.3038000     6.199000  0.3059000     0.5260000E-01  0.4311000 
1 1 1 14 2  7  o 10.47000  0.1379000     10.24000  0.1948000     10.69000  0.1953000     -0.4514000     0.2758000 
1 1 1 14 2  8  o 7.199000  0.1621000     7.259000  0.2286000     7.139000  0.2298000     0.1203000      0.3242000 
1 1 1 14 2  9  o 11.15000  0.1594000     11.09000  0.2234000     11.21000  0.2275000     -0.1182000     0.3189000 
1 1 1 14 2  10 o 6.796000  0.2329000     6.897000  0.3197000     6.695000  0.3388000     0.2020000      0.4659000 
1 1 1 14 2  11 o 7.845000  0.2349000     7.835000  0.3296000     7.854000  0.3347000     -0.1890000E-01 0.4698000 
1 1 1 14 2  12 o 10.87000  0.1876000     10.71000  0.2643000     11.02000  0.2665000     -0.3031000     0.3753000 
1 1 1 14 2  13 o 3.640000  0.4191000     3.580000  0.6013000     3.700000  0.5838000     -0.1202000     0.8381000 
1 1 1 14 2  14 o 7.174000  0.2575000     7.272000  0.3633000     7.077000  0.3650000     0.1955000      0.5150000 
1 1 1 14 2  15 o 3.361000  0.6029000     3.634000  0.8046000     3.088000  0.8980000     0.5455000      1.206000  
1 1 1 14 2  16 o 4.212000  0.6170000     3.557000  1.020000      4.866000  0.6950000     -1.309000      1.234000  
1 1 1 14 2  17 o 11.54000  0.2500000     11.25000  0.3531000     11.82000  0.3541000     -0.5709000     0.5001000 
1 1 1 14 2  18 o 8.122000  0.3190000     7.974000  0.4493000     8.271000  0.4530000     -0.2976000     0.6380000 
1 1 1 14 2  19 o 3.979000  0.5966000     3.098000  0.9508000     4.860000  0.7208000     -1.762000      1.193000  
1 1 1 14 2  20 o 2.166000  0.6384000     2.500000  0.9606000     1.832000  0.8410000     0.6680000      1.277000  
1 1 1 14 2  21 o 1.583000  0.5191000     1.329000  0.6508000     1.837000  0.8089000     -0.5080000     1.038000  
1 1 1 14 2  22 o 1.730000  0.5167000     1.698000  0.7229000     1.761000  0.7384000     -0.6261000E-01 1.033000  
1 1 1 14 2  23 o 1.522000  0.4832000     1.541000  0.6870000     1.502000  0.6798000     0.3817000E-01  0.9664000 
1 1 1 14 2  24 o 1.453000  0.4671000     1.628000  0.7104000     1.278000  0.6067000     0.3504000      0.9342000 
1 1 1 14 2  25 o 1.149000  0.3968000     1.186000  0.5769000     1.112000  0.5451000     0.7405000E-01  0.7937000 
1 1 1 14 2  26 o 1.294000  0.4450000     1.489000  0.6992000     1.100000  0.5506000     0.3898000      0.8899000 
1 1 1 14 3  0  o 18.48000  0.2054000     18.48000  0.2054000     18.48000  0.2054000     0.000000       0.000000  
1 1 1 14 3  1  o 11.13000  0.1164000     11.28000  0.1902000     10.98000  0.1343000     0.2977000      0.2329000 
1 1 1 14 3  2  o 5.390000  0.7481000E-01 5.424000  0.1012000     5.355000  0.1102000     0.6958000E-01  0.1496000 
1 1 1 14 3  3  o 4.027000  0.1200000     3.723000  0.1942000     4.331000  0.1410000     -0.6075000     0.2400000 
1 1 1 14 3  4  o 12.24000  0.1455000     12.10000  0.1630000     12.37000  0.2411000     -0.2731000     0.2910000 
1 1 1 14 3  5  o 7.539000  0.1194000     7.545000  0.1697000     7.532000  0.1679000     0.1278000E-01  0.2387000 
1 1 1 14 3  6  o 9.307000  0.1748000     9.355000  0.2738000     9.259000  0.2175000     0.9564000E-01  0.3497000 
1 1 1 14 3  7  o 7.821000  0.1431000     7.834000  0.2046000     7.809000  0.2000000     0.2466000E-01  0.2861000 
1 1 1 14 3  8  o 6.936000  0.1650000     6.738000  0.2372000     7.134000  0.2294000     -0.3968000     0.3300000 
1 1 1 14 3  9  o 2.750000  0.3837000     2.987000  0.5081000     2.513000  0.5751000     0.4739000      0.7674000 
1 1 1 14 3  10 f 4.899000  0.2477000     4.897000  0.3501000     4.901000  0.3504000     -0.3704000E-02 0.4953000 
1 1 1 14 3  11 f 4.730000  0.3287000     4.655000  0.4695000     4.805000  0.4601000     -0.1501000     0.6573000 
1 1 1 14 3  12 o 2.458000  0.5114000     2.368000  0.7295000     2.548000  0.7169000     -0.1801000     1.023000  
1 1 1 14 3  13 o 3.895000  0.4236000     3.142000  0.6943000     4.649000  0.4856000     -1.507000      0.8472000 
1 1 1 14 3  14 o 8.019000  0.2440000     7.879000  0.3420000     8.159000  0.3482000     -0.2799000     0.4880000 
1 1 1 14 3  15 o 2.875000  0.6432000     2.865000  0.9044000     2.886000  0.9148000     -0.2137000E-01 1.286000  
1 1 1 14 3  16 o 3.269000  0.6164000     2.387000  0.9308000     4.151000  0.8083000     -1.763000      1.233000  
1 1 1 14 3  17 o 4.483000  0.4994000     4.838000  0.6417000     4.127000  0.7653000     0.7112000      0.9988000 
1 1 1 14 3  18 o 2.945000  0.6387000     3.629000  0.8939000     2.260000  0.9124000     1.369000       1.277000  
1 1 1 14 3  19 f 3.349000  0.6483000     3.003000  0.9610000     3.696000  0.8705000     -0.6933000     1.297000  
1 1 1 14 3  20 o 1.940000  0.5822000     1.682000  0.7645000     2.197000  0.8784000     -0.5148000     1.164000  
1 1 1 14 3  21 o 1.711000  0.5407000     2.117000  0.8714000     1.305000  0.6403000     0.8123000      1.081000  
1 1 1 14 3  22 o 2.585000  0.5076000     1.817000  0.7501000     3.353000  0.6841000     -1.536000      1.015000  
1 1 1 14 3  23 o 1.993000  0.5395000     2.179000  0.7779000     1.806000  0.7477000     0.3731000      1.079000  
1 1 1 14 3  24 o 1.263000  0.4299000     1.344000  0.6359000     1.182000  0.5786000     0.1619000      0.8598000 
1 1 1 14 3  25 o 1.119000  0.3880000     0.9988000 0.4997000     1.240000  0.5936000     -0.2413000     0.7759000 
1 1 1 14 3  26 o 1.281000  0.4430000     1.364000  0.6563000     1.198000  0.5953000     0.1656000      0.8861000 
1 1 1 14 4  0  o 35.45000  0.3871000     35.45000  0.3871000     35.45000  0.3871000     -0.000000      0.000000  
1 1 1 14 4  1  o 34.93000  0.2704000     34.90000  0.3823000     34.96000  0.3825000     -0.6235000E-01 0.5408000 
1 1 1 14 4  2  o 3.858000  0.8447000E-01 3.788000  0.1373000     3.929000  0.9847000E-01 -0.1419000     0.1689000 
1 1 1 14 4  3  o 14.51000  0.1257000     14.47000  0.1754000     14.55000  0.1800000     -0.8020000E-01 0.2513000 
1 1 1 14 4  4  o 11.90000  0.1298000     11.85000  0.1806000     11.94000  0.1866000     -0.8899000E-01 0.2597000 
1 1 1 14 4  5  o 12.81000  0.1344000     12.77000  0.1585000     12.84000  0.2172000     -0.7189000E-01 0.2688000 
1 1 1 14 4  6  o 11.48000  0.1573000     11.63000  0.2231000     11.34000  0.2218000     0.2908000      0.3145000 
1 1 1 14 4  7  o 7.878000  0.1433000     7.743000  0.2058000     8.013000  0.1994000     -0.2702000     0.2865000 
1 1 1 14 4  8  o 6.172000  0.1766000     5.898000  0.2600000     6.445000  0.2391000     -0.5464000     0.3532000 
1 1 1 14 4  9  o 8.216000  0.1716000     8.260000  0.2436000     8.173000  0.2417000     0.8679000E-01  0.3432000 
1 1 1 14 4  10 o 2.240000  0.4449000     1.805000  0.6540000     2.675000  0.6033000     -0.8701000     0.8898000 
1 1 1 14 4  11 o 7.309000  0.2739000     7.484000  0.4232000     7.134000  0.3479000     0.3502000      0.5478000 
1 1 1 14 4  12 o 8.847000  0.2026000     8.735000  0.2857000     8.959000  0.2873000     -0.2240000     0.4051000 
1 1 1 14 4  13 o 12.35000  0.1960000     12.21000  0.2788000     12.49000  0.2756000     -0.2771000     0.3920000 
1 1 1 14 4  14 o 10.90000  0.2145000     10.58000  0.3049000     11.21000  0.3019000     -0.6340000     0.4291000 
1 1 1 14 4  15 f 2.889000  0.6362000     2.919000  0.8915000     2.859000  0.9079000     0.6031000E-01  1.272000  
1 1 1 14 4  16 o 3.409000  0.6495000     3.912000  0.8754000     2.905000  0.9598000     1.007000       1.299000  
1 1 1 14 4  17 o 8.334000  0.3054000     7.815000  0.4575000     8.852000  0.4047000     -1.036000      0.6108000 
1 1 1 14 4  18 o 1.791000  0.5668000     2.178000  0.9039000     1.403000  0.6840000     0.7743000      1.134000  
1 1 1 14 4  19 f 2.369000  0.6595000     2.494000  0.9427000     2.243000  0.9225000     0.2505000      1.319000  
1 1 1 14 4  20 o 2.062000  0.5884000     2.442000  0.8926000     1.682000  0.7669000     0.7601000      1.177000  
1 1 1 14 4  21 o 1.801000  0.5685000     1.968000  0.8483000     1.634000  0.7571000     0.3338000      1.137000  
1 1 1 14 4  22 o 1.719000  0.5138000     1.652000  0.7110000     1.785000  0.7420000     -0.1336000     1.028000  
1 1 1 14 4  23 o 2.253000  0.5515000     1.975000  0.7689000     2.531000  0.7909000     -0.5555000     1.103000  
1 1 1 14 4  24 o 1.570000  0.4988000     1.434000  0.6594000     1.706000  0.7487000     -0.2718000     0.9977000 
1 1 1 14 4  25 o 1.319000  0.4332000     1.538000  0.6775000     1.100000  0.5400000     0.4384000      0.8664000 
1 1 1 14 4  26 o 1.690000  0.5240000     1.259000  0.6136000     2.121000  0.8497000     -0.8613000     1.048000  
1 1 1 14 5  0  o 37.16000  0.4057000     37.16000  0.4057000     37.16000  0.4057000     0.000000       0.000000  
1 1 1 14 5  1  o 41.00000  0.3171000     40.98000  0.4483000     41.02000  0.4487000     -0.3127000E-01 0.6342000 
1 1 1 14 5  2  o 16.20000  0.1383000     16.33000  0.2197000     16.07000  0.1679000     0.2533000      0.2765000 
1 1 1 14 5  3  o 8.523000  0.1024000     8.511000  0.1515000     8.534000  0.1379000     -0.2290000E-01 0.2049000 
1 1 1 14 5  4  o 5.645000  0.1618000     5.530000  0.2219000     5.759000  0.2356000     -0.2289000     0.3236000 
1 1 1 14 5  5  f 6.166000  0.1159000     6.154000  0.1618000     6.177000  0.1661000     -0.2328000E-01 0.2319000 
1 1 1 14 5  6  f 1.502000  0.3909000     1.598000  0.5449000     1.407000  0.5606000     0.1918000      0.7818000 
1 1 1 14 5  7  o 6.877000  0.1496000     6.842000  0.2127000     6.913000  0.2105000     -0.7155000E-01 0.2993000 
1 1 1 14 5  8  o 8.045000  0.1571000     7.780000  0.2269000     8.309000  0.2174000     -0.5284000     0.3142000 
1 1 1 14 5  9  o 7.803000  0.1725000     8.004000  0.2416000     7.602000  0.2462000     0.4023000      0.3450000 
1 1 1 14 5  10 o 10.73000  0.1700000     10.84000  0.2401000     10.61000  0.2408000     0.2239000      0.3401000 
1 1 1 14 5  11 o 12.01000  0.2603000     11.99000  0.3644000     12.03000  0.3718000     -0.3608000E-01 0.5206000 
1 1 1 14 5  12 o 8.452000  0.2089000     8.100000  0.3040000     8.804000  0.2865000     -0.7032000     0.4178000 
1 1 1 14 5  13 o 6.639000  0.2574000     6.825000  0.3585000     6.453000  0.3694000     0.3723000      0.5147000 
1 1 1 14 5  14 o 3.665000  0.4598000     3.928000  0.6136000     3.401000  0.6848000     0.5268000      0.9195000 
1 1 1 14 5  15 o 6.541000  0.3060000     6.602000  0.4309000     6.480000  0.4346000     0.1227000      0.6120000 
1 1 1 14 5  16 f 2.510000  0.6223000     3.211000  0.9404000     1.810000  0.8153000     1.401000       1.245000  
1 1 1 14 5  17 o 2.763000  0.6584000     2.557000  0.9194000     2.969000  0.9428000     -0.4118000     1.317000  
1 1 1 14 5  18 o 4.586000  0.5351000     5.020000  0.6721000     4.152000  0.8329000     0.8682000      1.070000  
1 1 1 14 5  19 o 4.941000  0.4917000     4.629000  0.7248000     5.253000  0.6648000     -0.6239000     0.9835000 
1 1 1 14 5  20 o 1.752000  0.5457000     1.432000  0.6835000     2.072000  0.8509000     -0.6409000     1.091000  
1 1 1 14 5  21 o 2.170000  0.6263000     1.864000  0.8471000     2.476000  0.9228000     -0.6125000     1.253000  
1 1 1 14 5  22 o 2.709000  0.5425000     2.257000  0.8010000     3.161000  0.7319000     -0.9035000     1.085000  
1 1 1 14 5  23 o 2.498000  0.5466000     2.195000  0.7859000     2.801000  0.7598000     -0.6062000     1.093000  
1 1 1 14 5  24 o 1.511000  0.4847000     1.702000  0.7352000     1.321000  0.6319000     0.3813000      0.9694000 
1 1 1 14 5  25 o 1.582000  0.4866000     1.754000  0.7282000     1.410000  0.6458000     0.3432000      0.9733000 
1 1 1 14 5  26 o 1.398000  0.4705000     1.215000  0.5981000     1.581000  0.7265000     -0.3665000     0.9410000 
1 1 1 14 6  0  o 6.060000  0.1056000     6.060000  0.1056000     6.060000  0.1056000     -0.000000      0.000000  
1 1 1 14 6  1  o 17.08000  0.1384000     17.06000  0.1951000     17.10000  0.1963000     -0.3818000E-01 0.2768000 
1 1 1 14 6  2  o 10.68000  0.9842000E-01 10.74000  0.1400000     10.62000  0.1384000     0.1223000      0.1968000 
1 1 1 14 6  3  o 10.69000  0.1086000     10.96000  0.1736000     10.43000  0.1305000     0.5253000      0.2171000 
1 1 1 14 6  4  o 2.320000  0.2765000     2.659000  0.2326000     1.981000  0.5018000     0.6784000      0.5530000 
1 1 1 14 6  5  o 4.497000  0.1433000     4.459000  0.1781000     4.535000  0.2244000     -0.7586000E-01 0.2865000 
1 1 1 14 6  6  o 17.07000  0.1563000     17.20000  0.2208000     16.94000  0.2212000     0.2611000      0.3126000 
1 1 1 14 6  7  o 10.36000  0.1423000     10.24000  0.1634000     10.49000  0.2330000     -0.2565000     0.2846000 
1 1 1 14 6  8  o 3.165000  0.3039000     2.831000  0.4790000     3.498000  0.3741000     -0.6672000     0.6078000 
1 1 1 14 6  9  o 5.993000  0.2029000     6.018000  0.2910000     5.969000  0.2827000     0.4950000E-01  0.4057000 
1 1 1 14 6  10 o 15.37000  0.1758000     15.24000  0.2479000     15.50000  0.2493000     -0.2667000     0.3516000 
1 1 1 14 6  11 o 5.799000  0.3300000     5.620000  0.5193000     5.979000  0.4073000     -0.3595000     0.6600000 
1 1 1 14 6  12 o 4.129000  0.3389000     4.233000  0.4617000     4.025000  0.4961000     0.2079000      0.6777000 
1 1 1 14 6  13 o 14.04000  0.1957000     13.98000  0.2767000     14.11000  0.2768000     -0.1326000     0.3913000 
1 1 1 14 6  14 o 5.468000  0.3417000     5.012000  0.4920000     5.924000  0.4743000     -0.9125000     0.6834000 
1 1 1 14 6  15 o 5.162000  0.3703000     5.458000  0.5015000     4.866000  0.5450000     0.5910000      0.7407000 
1 1 1 14 6  16 o 2.976000  0.6833000     2.390000  1.005000      3.563000  0.9258000     -1.173000      1.367000  
1 1 1 14 6  17 o 4.435000  0.5306000     5.450000  0.5778000     3.420000  0.8900000     2.030000       1.061000  
1 1 1 14 6  18 o 3.232000  0.6437000     3.745000  0.8746000     2.719000  0.9446000     1.026000       1.287000  
1 1 1 14 6  19 o 3.567000  0.6374000     3.535000  0.9079000     3.600000  0.8950000     -0.6495000E-01 1.275000  
1 1 1 14 6  20 o 3.006000  0.5887000     2.198000  0.8751000     3.814000  0.7876000     -1.616000      1.177000  
1 1 1 14 6  21 o 2.536000  0.7134000     2.536000  0.9886000     2.536000  1.029000      0.5121000E-03  1.427000  
1 1 1 14 6  22 o 1.543000  0.4816000     1.325000  0.6241000     1.761000  0.7337000     -0.4358000     0.9633000 
1 1 1 14 6  23 o 1.495000  0.4736000     1.366000  0.6362000     1.624000  0.7018000     -0.2581000     0.9472000 
1 1 1 14 6  24 o 1.480000  0.4806000     1.568000  0.7037000     1.391000  0.6546000     0.1777000      0.9611000 
1 1 1 14 6  25 o 1.391000  0.4524000     1.409000  0.6475000     1.373000  0.6320000     0.3633000E-01  0.9049000 
1 1 1 14 6  26 o 1.646000  0.5262000     1.764000  0.7785000     1.527000  0.7083000     0.2376000      1.052000  
1 1 1 14 7  0  o 31.88000  0.3506000     31.88000  0.3506000     31.88000  0.3506000     -0.000000      0.000000  
1 1 1 14 7  1  o 10.58000  0.9698000E-01 10.56000  0.1365000     10.60000  0.1378000     -0.3860000E-01 0.1940000 
1 1 1 14 7  2  o 12.12000  0.1086000     12.11000  0.1533000     12.13000  0.1539000     -0.2438000E-01 0.2172000 
1 1 1 14 7  3  o 5.367000  0.9024000E-01 5.466000  0.1278000     5.267000  0.1274000     0.1997000      0.1805000 
1 1 1 14 7  4  o 8.968000  0.1125000     9.040000  0.1730000     8.897000  0.1438000     0.1427000      0.2249000 
1 1 1 14 7  5  o 8.563000  0.1341000     8.569000  0.1842000     8.557000  0.1950000     0.1173000E-01  0.2683000 
1 1 1 14 7  6  o 2.409000  0.2458000     2.427000  0.3248000     2.391000  0.3691000     0.3660000E-01  0.4917000 
1 1 1 14 7  7  o 4.565000  0.1594000     4.608000  0.2207000     4.523000  0.2301000     0.8531000E-01  0.3188000 
1 1 1 14 7  8  o 5.965000  0.2022000     5.700000  0.2759000     6.230000  0.2958000     -0.5303000     0.4045000 
1 1 1 14 7  9  o 3.967000  0.3566000     4.228000  0.4128000     3.707000  0.5816000     0.5214000      0.7132000 
1 1 1 14 7  10 o 2.272000  0.4412000     1.792000  0.6575000     2.752000  0.5885000     -0.9601000     0.8824000 
1 1 1 14 7  11 o 4.421000  0.3438000     4.208000  0.5055000     4.633000  0.4660000     -0.4245000     0.6875000 
1 1 1 14 7  12 o 14.71000  0.1879000     14.86000  0.2642000     14.56000  0.2671000     0.2967000      0.3757000 
1 1 1 14 7  13 o 11.05000  0.1990000     11.01000  0.2802000     11.09000  0.2826000     -0.8490000E-01 0.3980000 
1 1 1 14 7  14 o 15.67000  0.2064000     15.81000  0.2936000     15.53000  0.2901000     0.2740000      0.4128000 
1 1 1 14 7  15 o 7.123000  0.2824000     6.686000  0.4134000     7.560000  0.3850000     -0.8737000     0.5649000 
1 1 1 14 7  16 o 3.017000  0.7382000     3.206000  1.061000      2.829000  1.027000      0.3773000      1.476000  
1 1 1 14 7  17 o 7.408000  0.3241000     7.127000  0.4651000     7.690000  0.4515000     -0.5630000     0.6483000 
1 1 1 14 7  18 o 3.297000  0.6461000     3.051000  0.9408000     3.542000  0.8858000     -0.4915000     1.292000  
1 1 1 14 7  19 o 2.474000  0.6587000     2.322000  0.9192000     2.627000  0.9436000     -0.3049000     1.317000  
1 1 1 14 7  20 o 2.721000  0.6363000     2.744000  0.8956000     2.697000  0.9041000     0.4652000E-01  1.273000  
1 1 1 14 7  21 o 1.723000  0.5589000     1.506000  0.7282000     1.940000  0.8480000     -0.4347000     1.118000  
1 1 1 14 7  22 o 2.464000  0.5554000     2.184000  0.7967000     2.745000  0.7741000     -0.5612000     1.111000  
1 1 1 14 7  23 o 1.449000  0.4662000     1.525000  0.6786000     1.372000  0.6394000     0.1529000      0.9324000 
1 1 1 14 7  24 o 1.868000  0.5425000     1.931000  0.7712000     1.806000  0.7632000     0.1245000      1.085000  
1 1 1 14 7  25 o 2.232000  0.5280000     2.692000  0.7700000     1.773000  0.7227000     0.9194000      1.056000  
1 1 1 14 7  26 o 1.455000  0.4762000     1.177000  0.5726000     1.733000  0.7611000     -0.5559000     0.9525000 
1 1 1 14 8  0  o 30.78000  0.3400000     30.78000  0.3400000     30.78000  0.3400000     0.000000       0.000000  
1 1 1 14 8  1  o 9.021000  0.9148000E-01 9.160000  0.1295000     8.883000  0.1292000     0.2768000      0.1830000 
1 1 1 14 8  2  o 16.12000  0.1359000     16.28000  0.1939000     15.96000  0.1905000     0.3156000      0.2718000 
1 1 1 14 8  3  o 9.866000  0.1243000     9.814000  0.2025000     9.919000  0.1441000     -0.1053000     0.2486000 
1 1 1 14 8  4  f 5.515000  0.1004000     5.512000  0.1455000     5.517000  0.1384000     -0.4881000E-02 0.2008000 
1 1 1 14 8  5  o 12.51000  0.2194000     12.90000  0.3998000     12.11000  0.1811000     0.7849000      0.4389000 
1 1 1 14 8  6  o 14.00000  0.1407000     14.23000  0.1987000     13.77000  0.1992000     0.4564000      0.2814000 
1 1 1 14 8  7  o 4.140000  0.1691000     4.273000  0.2286000     4.008000  0.2493000     0.2643000      0.3382000 
1 1 1 14 8  8  o 4.646000  0.1831000     4.391000  0.2621000     4.901000  0.2558000     -0.5097000     0.3663000 
1 1 1 14 8  9  o 2.368000  0.3894000     3.075000  0.3442000     1.662000  0.6987000     1.413000       0.7789000 
1 1 1 14 8  10 o 5.466000  0.2265000     5.524000  0.2318000     5.407000  0.3892000     0.1163000      0.4531000 
1 1 1 14 8  11 o 8.116000  0.2345000     7.829000  0.3364000     8.403000  0.3268000     -0.5738000     0.4690000 
1 1 1 14 8  12 o 14.74000  0.1874000     14.90000  0.2657000     14.58000  0.2642000     0.3168000      0.3747000 
1 1 1 14 8  13 o 8.979000  0.2143000     9.166000  0.2998000     8.792000  0.3062000     0.3737000      0.4285000 
1 1 1 14 8  14 o 2.935000  0.5486000     2.872000  0.7831000     2.997000  0.7684000     -0.1252000     1.097000  
1 1 1 14 8  15 o 1.846000  0.5405000     2.181000  0.8242000     1.511000  0.6995000     0.6695000      1.081000  
1 1 1 14 8  16 o 8.635000  0.3541000     8.685000  0.5485000     8.585000  0.4481000     0.1005000      0.7083000 
1 1 1 14 8  17 o 8.055000  0.3080000     7.647000  0.4494000     8.463000  0.4212000     -0.8159000     0.6160000 
1 1 1 14 8  18 o 2.168000  0.6267000     2.387000  0.9203000     1.949000  0.8510000     0.4378000      1.253000  
1 1 1 14 8  19 o 2.477000  0.5925000     3.370000  0.9169000     1.583000  0.7507000     1.787000       1.185000  
1 1 1 14 8  20 o 1.869000  0.5683000     2.080000  0.8482000     1.658000  0.7565000     0.4218000      1.137000  
1 1 1 14 8  21 o 2.394000  0.6241000     2.768000  0.8987000     2.019000  0.8663000     0.7493000      1.248000  
1 1 1 14 8  22 o 1.446000  0.4657000     1.611000  0.7060000     1.281000  0.6077000     0.3299000      0.9315000 
1 1 1 14 8  23 o 1.678000  0.5028000     1.820000  0.7384000     1.535000  0.6827000     0.2854000      1.006000  
1 1 1 14 8  24 o 1.564000  0.4959000     1.667000  0.7266000     1.462000  0.6751000     0.2049000      0.9918000 
1 1 1 14 8  25 o 1.920000  0.4553000     2.823000  0.7578000     1.016000  0.5047000     1.807000       0.9105000 
1 1 1 14 8  26 f 1.380000  0.4463000     1.707000  0.7237000     1.052000  0.5226000     0.6548000      0.8927000 
1 1 1 14 9  0  o 5.924000  0.1224000     5.924000  0.1224000     5.924000  0.1224000     0.000000       0.000000  
1 1 1 14 9  1  o 17.74000  0.1467000     17.75000  0.2073000     17.73000  0.2075000     0.2744000E-01  0.2933000 
1 1 1 14 9  2  o 9.092000  0.9707000E-01 9.114000  0.1376000     9.071000  0.1369000     0.4382000E-01  0.1941000 
1 1 1 14 9  3  o 7.149000  0.1305000     6.970000  0.1893000     7.327000  0.1797000     -0.3577000     0.2610000 
1 1 1 14 9  4  o 15.57000  0.1489000     15.60000  0.1958000     15.55000  0.2244000     0.5050000E-01  0.2978000 
1 1 1 14 9  5  o 12.59000  0.1590000     12.42000  0.2741000     12.77000  0.1613000     -0.3475000     0.3181000 
1 1 1 14 9  6  o 9.666000  0.1252000     9.592000  0.1740000     9.741000  0.1801000     -0.1489000     0.2504000 
1 1 1 14 9  7  o 7.308000  0.1363000     7.506000  0.1882000     7.110000  0.1973000     0.3957000      0.2727000 
1 1 1 14 9  8  o 11.80000  0.1444000     11.71000  0.2002000     11.89000  0.2080000     -0.1784000     0.2887000 
1 1 1 14 9  9  o 5.336000  0.3239000     5.359000  0.2655000     5.313000  0.5909000     0.4629000E-01  0.6478000 
1 1 1 14 9  10 o 3.429000  0.3568000     3.747000  0.3233000     3.112000  0.6361000     0.6348000      0.7135000 
1 1 1 14 9  11 o 9.221000  0.1901000     9.314000  0.2138000     9.128000  0.3145000     0.1863000      0.3803000 
1 1 1 14 9  12 o 10.19000  0.1934000     10.46000  0.2722000     9.922000  0.2747000     0.5344000      0.3867000 
1 1 1 14 9  13 o 11.36000  0.2011000     11.68000  0.2828000     11.04000  0.2859000     0.6409000      0.4021000 
1 1 1 14 9  14 o 8.864000  0.2705000     8.399000  0.3947000     9.329000  0.3701000     -0.9302000     0.5411000 
1 1 1 14 9  15 o 11.95000  0.2251000     12.11000  0.3168000     11.80000  0.3200000     0.3126000      0.4503000 
1 1 1 14 9  16 f 2.580000  0.6604000     2.877000  0.9578000     2.284000  0.9093000     0.5934000      1.321000  
1 1 1 14 9  17 o 6.127000  0.3819000     5.790000  0.5691000     6.464000  0.5093000     -0.6738000     0.7637000 
1 1 1 14 9  18 o 7.040000  0.3570000     6.973000  0.5165000     7.107000  0.4931000     -0.1341000     0.7141000 
1 1 1 14 9  19 o 2.780000  0.6871000     3.248000  0.9927000     2.311000  0.9504000     0.9372000      1.374000  
1 1 1 14 9  20 o 2.382000  0.6087000     2.059000  0.8406000     2.704000  0.8806000     -0.6454000     1.217000  
1 1 1 14 9  21 o 2.501000  0.6339000     2.434000  0.8600000     2.568000  0.9315000     -0.1340000     1.268000  
1 1 1 14 9  22 o 1.370000  0.4489000     1.344000  0.6265000     1.396000  0.6430000     -0.5208000E-01 0.8977000 
1 1 1 14 9  23 o 2.000000  0.5364000     2.135000  0.7766000     1.864000  0.7401000     0.2706000      1.073000  
1 1 1 14 9  24 o 1.420000  0.4744000     1.848000  0.8072000     0.9914000 0.4986000     0.8567000      0.9488000 
1 1 1 14 9  25 o 1.453000  0.4648000     1.435000  0.6457000     1.470000  0.6687000     -0.3535000E-01 0.9296000 
1 1 1 14 9  26 o 1.266000  0.4368000     1.147000  0.5662000     1.384000  0.6653000     -0.2374000     0.8736000 
1 1 1 14 10 0  o 16.41000  0.1959000     16.41000  0.1959000     16.41000  0.1959000     0.000000       0.000000  
1 1 1 14 10 1  o 19.84000  0.1625000     19.85000  0.2298000     19.83000  0.2299000     0.2192000E-01  0.3250000 
1 1 1 14 10 2  o 29.43000  0.2866000     29.63000  0.4704000     29.23000  0.3275000     0.4068000      0.5732000 
1 1 1 14 10 3  o 6.041000  0.1041000     6.031000  0.1405000     6.051000  0.1536000     -0.2057000E-01 0.2081000 
1 1 1 14 10 4  o 3.732000  0.1772000     3.460000  0.2212000     4.004000  0.2771000     -0.5440000     0.3545000 
1 1 1 14 10 5  o 6.686000  0.1103000     6.711000  0.1560000     6.661000  0.1560000     0.4953000E-01  0.2206000 
1 1 1 14 10 6  o 3.404000  0.1800000     3.435000  0.2841000     3.373000  0.2209000     0.6263000E-01  0.3599000 
1 1 1 14 10 7  o 10.49000  0.1375000     10.48000  0.1895000     10.50000  0.1993000     -0.1992000E-01 0.2750000 
1 1 1 14 10 8  o 8.709000  0.1426000     8.716000  0.1984000     8.702000  0.2049000     0.1387000E-01  0.2852000 
1 1 1 14 10 9  f 12.80000  0.1981000     12.76000  0.2172000     12.83000  0.3313000     -0.7321000E-01 0.3962000 
1 1 1 14 10 10 o 7.706000  0.1774000     7.693000  0.2325000     7.719000  0.2681000     -0.2518000E-01 0.3549000 
1 1 1 14 10 11 o 5.873000  0.2349000     5.797000  0.2521000     5.948000  0.3964000     -0.1510000     0.4698000 
1 1 1 14 10 12 o 6.793000  0.2588000     6.792000  0.3361000     6.794000  0.3938000     -0.2597000E-02 0.5177000 
1 1 1 14 10 13 o 9.584000  0.2147000     9.528000  0.3036000     9.639000  0.3037000     -0.1102000     0.4294000 
1 1 1 14 10 14 o 2.626000  0.6024000     2.283000  0.8662000     2.969000  0.8373000     -0.6860000     1.205000  
1 1 1 14 10 15 o 6.755000  0.3091000     7.089000  0.4229000     6.420000  0.4510000     0.6690000      0.6183000 
1 1 1 14 10 16 o 3.390000  0.6201000     4.208000  0.8154000     2.573000  0.9343000     1.635000       1.240000  
1 1 1 14 10 17 o 6.501000  0.3686000     6.324000  0.5401000     6.678000  0.5018000     -0.3542000     0.7372000 
1 1 1 14 10 18 o 2.593000  0.6656000     2.654000  0.9489000     2.532000  0.9336000     0.1223000      1.331000  
1 1 1 14 10 19 o 3.754000  0.6559000     4.365000  0.8855000     3.142000  0.9678000     1.224000       1.312000  
1 1 1 14 10 20 o 3.167000  0.5909000     3.403000  0.7937000     2.930000  0.8758000     0.4731000      1.182000  
1 1 1 14 10 21 o 2.172000  0.6089000     1.745000  0.7709000     2.599000  0.9427000     -0.8543000     1.218000  
1 1 1 14 10 22 o 1.708000  0.5080000     1.930000  0.7633000     1.485000  0.6704000     0.4447000      1.016000  
1 1 1 14 10 23 o 1.503000  0.4783000     1.497000  0.6738000     1.510000  0.6790000     -0.1311000E-01 0.9566000 
1 1 1 14 10 24 f 1.494000  0.4995000     1.614000  0.7496000     1.375000  0.6605000     0.2385000      0.9991000 
1 1 1 14 10 25 o 1.221000  0.4143000     1.184000  0.5735000     1.258000  0.5980000     -0.7409000E-01 0.8285000 
1 1 1 14 10 26 o 1.338000  0.6738000     1.338000  0.6738000     ?         ?             ?              ?         
1 1 1 14 11 0  o 0.7979000 0.4332000     0.7979000 0.4332000     0.7979000 0.4332000     0.000000       0.000000  
1 1 1 14 11 1  o 10.71000  0.1157000     10.90000  0.1768000     10.51000  0.1494000     0.3827000      0.2315000 
1 1 1 14 11 2  o 18.48000  0.1985000     18.49000  0.2519000     18.46000  0.3068000     0.2459000E-01  0.3970000 
1 1 1 14 11 3  o 13.38000  0.1565000     13.37000  0.1775000     13.39000  0.2578000     -0.1999000E-01 0.3130000 
1 1 1 14 11 4  o 7.892000  0.1194000     7.940000  0.1857000     7.844000  0.1502000     0.9614000E-01  0.2389000 
1 1 1 14 11 5  o 6.565000  0.1113000     6.677000  0.1570000     6.453000  0.1578000     0.2247000      0.2226000 
1 1 1 14 11 6  o 4.921000  0.1425000     4.856000  0.2239000     4.986000  0.1764000     -0.1301000     0.2850000 
1 1 1 14 11 7  o 12.54000  0.1528000     12.47000  0.2276000     12.60000  0.2039000     -0.1339000     0.3056000 
1 1 1 14 11 8  o 1.633000  0.3703000     1.256000  0.5044000     2.009000  0.5423000     -0.7536000     0.7406000 
1 1 1 14 11 9  o 2.633000  0.3498000     2.136000  0.5402000     3.129000  0.4446000     -0.9929000     0.6997000 
1 1 1 14 11 10 o 7.946000  0.1864000     7.949000  0.2556000     7.943000  0.2715000     0.6748000E-02  0.3729000 
1 1 1 14 11 11 o 13.70000  0.1684000     13.34000  0.2344000     14.06000  0.2418000     -0.7225000     0.3368000 
1 1 1 14 11 12 o 22.17000  0.2019000     22.05000  0.2695000     22.29000  0.3007000     -0.2396000     0.4038000 
1 1 1 14 11 13 o 4.969000  0.3640000     4.773000  0.3384000     5.165000  0.6445000     -0.3921000     0.7279000 
1 1 1 14 11 14 o 4.520000  0.5697000     5.067000  0.4250000     3.972000  1.057000      1.094000       1.139000  
1 1 1 14 11 15 o 9.817000  0.2443000     10.04000  0.3424000     9.595000  0.3484000     0.4439000      0.4885000 
1 1 1 14 11 16 o 4.035000  0.5639000     4.101000  0.7359000     3.969000  0.8545000     0.1321000      1.128000  
1 1 1 14 11 17 o 3.608000  0.5947000     4.193000  0.7676000     3.022000  0.9086000     1.171000       1.189000  
1 1 1 14 11 18 o 2.476000  0.6552000     2.359000  0.9200000     2.593000  0.9330000     -0.2341000     1.310000  
1 1 1 14 11 19 o 4.079000  0.6288000     4.144000  0.9027000     4.015000  0.8756000     0.1292000      1.258000  
1 1 1 14 11 20 o 1.870000  0.5332000     1.267000  0.6172000     2.474000  0.8697000     -1.207000      1.066000  
1 1 1 14 11 21 o 2.694000  0.5724000     1.882000  0.7624000     3.505000  0.8541000     -1.624000      1.145000  
1 1 1 14 11 22 o 3.049000  0.5089000     3.106000  0.7194000     2.992000  0.7199000     0.1140000      1.018000  
1 1 1 14 11 23 o 2.932000  0.5152000     2.644000  0.7695000     3.220000  0.6852000     -0.5758000     1.030000  
1 1 1 14 11 24 o 1.563000  0.5098000     1.883000  0.8176000     1.243000  0.6091000     0.6402000      1.020000  
1 1 1 14 11 25 o 1.260000  0.4229000     1.270000  0.6018000     1.251000  0.5944000     0.1873000E-01  0.8459000 
1 1 1 14 12 0  o 20.85000  0.3442000     20.85000  0.3442000     20.85000  0.3442000     -0.000000      0.000000  
1 1 1 14 12 1  o 9.132000  0.1678000     8.826000  0.1649000     9.438000  0.2923000     -0.6125000     0.3356000 
1 1 1 14 12 2  o 7.124000  0.1642000     7.145000  0.1596000     7.103000  0.2869000     0.4162000E-01  0.3283000 
1 1 1 14 12 3  o 9.981000  0.1354000     9.935000  0.2201000     10.03000  0.1576000     -0.9186000E-01 0.2707000 
1 1 1 14 12 4  o 14.66000  0.1359000     14.63000  0.1917000     14.69000  0.1926000     -0.5499000E-01 0.2718000 
1 1 1 14 12 5  o 5.240000  0.1277000     5.193000  0.1729000     5.287000  0.1881000     -0.9337000E-01 0.2555000 
1 1 1 14 12 6  o 1.664000  0.3018000     1.674000  0.4200000     1.654000  0.4334000     0.2045000E-01  0.6036000 
1 1 1 14 12 7  o 9.337000  0.1359000     9.570000  0.2153000     9.104000  0.1659000     0.4656000      0.2718000 
1 1 1 14 12 8  o 8.796000  0.1551000     9.186000  0.2030000     8.406000  0.2346000     0.7801000      0.3102000 
1 1 1 14 12 9  o 7.564000  0.1606000     7.814000  0.2193000     7.314000  0.2348000     0.5003000      0.3213000 
1 1 1 14 12 10 o 8.916000  0.2965000     8.619000  0.5430000     9.214000  0.2381000     -0.5955000     0.5929000 
1 1 1 14 12 11 o 11.10000  0.1640000     11.20000  0.2310000     11.01000  0.2330000     0.1895000      0.3281000 
1 1 1 14 12 12 o 10.12000  0.1773000     10.03000  0.2491000     10.21000  0.2524000     -0.1778000     0.3546000 
1 1 1 14 12 13 o 4.758000  0.2676000     5.160000  0.3465000     4.356000  0.4079000     0.8043000      0.5352000 
1 1 1 14 12 14 o 8.489000  0.3789000     9.290000  0.2975000     7.688000  0.6969000     1.602000       0.7578000 
1 1 1 14 12 15 o 10.33000  0.2410000     10.40000  0.2677000     10.26000  0.4009000     0.1354000      0.4820000 
1 1 1 14 12 16 o 4.113000  0.5184000     3.592000  0.8185000     4.633000  0.6365000     -1.041000      1.037000  
1 1 1 14 12 17 f 8.765000  0.2989000     8.857000  0.4243000     8.673000  0.4211000     0.1835000      0.5978000 
1 1 1 14 12 18 f 5.659000  0.4346000     5.225000  0.6608000     6.092000  0.5648000     -0.8670000     0.8693000 
1 1 1 14 12 19 o 3.164000  0.7601000     3.180000  1.107000      3.148000  1.042000      0.3222000E-01  1.520000  
1 1 1 14 12 20 o 4.362000  0.4606000     4.597000  0.6273000     4.127000  0.6745000     0.4696000      0.9211000 
1 1 1 14 12 21 o 1.997000  0.5255000     1.493000  0.6807000     2.500000  0.8009000     -1.007000      1.051000  
1 1 1 14 12 22 o 2.217000  0.4688000     1.282000  0.6087000     3.152000  0.7132000     -1.869000      0.9377000 
1 1 1 14 12 23 o 1.788000  0.4983000     1.330000  0.6240000     2.245000  0.7772000     -0.9149000     0.9967000 
1 1 1 14 12 24 o 1.243000  0.4245000     1.116000  0.5531000     1.370000  0.6441000     -0.2542000     0.8490000 
1 1 1 14 12 25 o 1.555000  0.4896000     1.580000  0.6847000     1.531000  0.7000000     0.4893000E-01  0.9792000 
1 1 1 14 13 0  o 17.87000  0.4284000     17.87000  0.4284000     17.87000  0.4284000     0.000000       0.000000  
1 1 1 14 13 1  o 10.66000  0.1553000     10.63000  0.2187000     10.69000  0.2205000     -0.5478000E-01 0.3106000 
1 1 1 14 13 2  o 12.96000  0.1510000     13.16000  0.2475000     12.75000  0.1731000     0.4142000      0.3020000 
1 1 1 14 13 3  o 6.972000  0.1073000     6.855000  0.1528000     7.090000  0.1507000     -0.2351000     0.2147000 
1 1 1 14 13 4  o 7.072000  0.1110000     7.404000  0.1560000     6.740000  0.1581000     0.6642000      0.2221000 
1 1 1 14 13 5  o 9.051000  0.1172000     9.068000  0.1664000     9.033000  0.1650000     0.3562000E-01  0.2343000 
1 1 1 14 13 6  o 13.93000  0.1391000     13.88000  0.1964000     13.99000  0.1971000     -0.1055000     0.2782000 
1 1 1 14 13 7  o 9.820000  0.1280000     9.759000  0.1800000     9.882000  0.1820000     -0.1225000     0.2559000 
1 1 1 14 13 8  o 7.313000  0.1690000     7.305000  0.2719000     7.322000  0.2009000     -0.1684000E-01 0.3380000 
1 1 1 14 13 9  o 2.101000  0.3908000     2.133000  0.5399000     2.069000  0.5651000     0.6376000E-01  0.7816000 
1 1 1 14 13 10 o 16.08000  0.2196000     16.04000  0.3636000     16.12000  0.2464000     -0.7458000E-01 0.4392000 
1 1 1 14 13 11 o 18.49000  0.1894000     18.08000  0.2632000     18.89000  0.2724000     -0.8146000     0.3788000 
1 1 1 14 13 12 o 13.94000  0.1791000     14.28000  0.2520000     13.60000  0.2545000     0.6795000      0.3581000 
1 1 1 14 13 13 o 4.466000  0.2899000     4.684000  0.3751000     4.248000  0.4421000     0.4368000      0.5797000 
1 1 1 14 13 14 o 9.640000  0.2823000     9.873000  0.2767000     9.408000  0.4922000     0.4653000      0.5646000 
1 1 1 14 13 15 o 4.861000  0.3188000     4.874000  0.4305000     4.848000  0.4705000     0.2607000E-01  0.6377000 
1 1 1 14 13 16 o 3.641000  0.5396000     3.390000  0.6070000     3.892000  0.8924000     -0.5023000     1.079000  
1 1 1 14 13 17 f 2.545000  0.6191000     2.467000  0.7612000     2.623000  0.9767000     -0.1558000     1.238000  
1 1 1 14 13 18 o 4.160000  0.5876000     4.541000  0.7573000     3.779000  0.8988000     0.7622000      1.175000  
1 1 1 14 13 19 o 2.786000  0.7181000     2.181000  0.9616000     3.391000  1.067000      -1.210000      1.436000  
1 1 1 14 13 20 o 1.454000  0.4860000     1.508000  0.7043000     1.400000  0.6699000     0.1082000      0.9720000 
1 1 1 14 13 21 o 1.764000  0.5207000     1.859000  0.7532000     1.669000  0.7191000     0.1903000      1.041000  
1 1 1 14 13 22 o 1.664000  0.4993000     1.573000  0.6917000     1.754000  0.7201000     -0.1803000     0.9985000 
1 1 1 14 13 23 o 2.018000  0.5142000     2.465000  0.7631000     1.572000  0.6895000     0.8926000      1.028000  
1 1 1 14 13 24 o 1.537000  0.4906000     1.797000  0.7671000     1.277000  0.6119000     0.5200000      0.9813000 
1 1 1 14 13 25 o 1.223000  0.4212000     1.393000  0.6591000     1.053000  0.5245000     0.3404000      0.8424000 
1 1 1 14 14 0  o 5.422000  0.1540000     5.422000  0.1540000     5.422000  0.1540000     0.000000       0.000000  
1 1 1 14 14 1  o 23.19000  0.1899000     23.26000  0.2694000     23.12000  0.2678000     0.1449000      0.3798000 
1 1 1 14 14 2  o 3.808000  0.1326000     3.951000  0.1815000     3.664000  0.1933000     0.2871000      0.2652000 
1 1 1 14 14 3  o 21.82000  0.1822000     21.81000  0.2575000     21.84000  0.2578000     -0.3428000E-01 0.3643000 
1 1 1 14 14 4  o 17.51000  0.1552000     17.39000  0.2186000     17.63000  0.2203000     -0.2403000     0.3103000 
1 1 1 14 14 5  o 7.526000  0.1181000     7.466000  0.1662000     7.585000  0.1677000     -0.1191000     0.2361000 
1 1 1 14 14 6  o 8.346000  0.1218000     8.401000  0.1721000     8.292000  0.1724000     0.1089000      0.2436000 
1 1 1 14 14 7  o 11.39000  0.1336000     11.29000  0.1883000     11.49000  0.1897000     -0.1964000     0.2673000 
1 1 1 14 14 8  o 8.221000  0.1750000     8.320000  0.2617000     8.123000  0.2324000     0.1971000      0.3500000 
1 1 1 14 14 9  o 4.435000  0.2321000     4.383000  0.3042000     4.487000  0.3507000     -0.1046000     0.4642000 
1 1 1 14 14 10 o 5.730000  0.1987000     5.557000  0.2825000     5.902000  0.2794000     -0.3444000     0.3974000 
1 1 1 14 14 11 o 2.164000  0.4286000     1.749000  0.6204000     2.580000  0.5916000     -0.8319000     0.8573000 
1 1 1 14 14 12 o 2.864000  0.3934000     2.791000  0.5450000     2.936000  0.5676000     -0.1447000     0.7868000 
1 1 1 14 14 13 o 6.895000  0.2132000     6.918000  0.2968000     6.873000  0.3061000     0.4474000E-01  0.4264000 
1 1 1 14 14 14 f 9.007000  0.2118000     9.107000  0.2838000     8.907000  0.3146000     0.1993000      0.4237000 
1 1 1 14 14 15 f 6.047000  0.3183000     6.830000  0.4292000     5.264000  0.4703000     1.566000       0.6367000 
1 1 1 14 14 16 o 2.183000  0.5205000     2.592000  0.7355000     1.773000  0.7366000     0.8193000      1.041000  
1 1 1 14 14 17 o 7.720000  0.3120000     7.888000  0.3398000     7.552000  0.5232000     0.3359000      0.6239000 
1 1 1 14 14 18 o 1.435000  0.4895000     1.149000  0.5606000     1.722000  0.8026000     -0.5730000     0.9790000 
1 1 1 14 14 19 o 2.212000  0.6388000     1.973000  0.7470000     2.450000  1.037000      -0.4773000     1.278000  
1 1 1 14 14 20 o 1.971000  0.5897000     2.057000  0.8397000     1.886000  0.8283000     0.1708000      1.179000  
1 1 1 14 14 21 o 2.166000  0.5475000     2.035000  0.7670000     2.297000  0.7814000     -0.2620000     1.095000  
1 1 1 14 14 22 o 1.438000  0.4623000     1.514000  0.6762000     1.362000  0.6305000     0.1517000      0.9245000 
1 1 1 14 14 23 o 1.754000  0.5070000     1.946000  0.7467000     1.562000  0.6860000     0.3838000      1.014000  
1 1 1 14 14 24 o 2.379000  0.5581000     3.049000  0.8419000     1.709000  0.7329000     1.340000       1.116000  
1 1 1 14 14 25 o 1.756000  0.5251000     1.555000  0.7011000     1.957000  0.7818000     -0.4017000     1.050000  
1 1 1 14 15 0  o 0.6027000 0.3943000     0.6027000 0.3943000     0.6027000 0.3943000     0.000000       0.000000  
1 1 1 14 15 1  f 4.973000  0.1174000     5.016000  0.1644000     4.930000  0.1676000     0.8615000E-01  0.2348000 
1 1 1 14 15 2  o 6.682000  0.1096000     6.828000  0.1533000     6.536000  0.1566000     0.2923000      0.2192000 
1 1 1 14 15 3  o 1.681000  0.2690000     2.074000  0.3254000     1.287000  0.4286000     0.7878000      0.5381000 
1 1 1 14 15 4  o 7.131000  0.1159000     7.245000  0.1637000     7.017000  0.1640000     0.2275000      0.2318000 
1 1 1 14 15 5  o 8.842000  0.1189000     8.864000  0.1676000     8.820000  0.1687000     0.4392000E-01  0.2378000 
1 1 1 14 15 6  o 6.887000  0.1296000     6.906000  0.1821000     6.868000  0.1843000     0.3804000E-01  0.2591000 
1 1 1 14 15 7  o 2.519000  0.2523000     2.754000  0.3115000     2.285000  0.3970000     0.4686000      0.5046000 
1 1 1 14 15 8  o 4.973000  0.1669000     5.074000  0.2194000     4.871000  0.2516000     0.2028000      0.3338000 
1 1 1 14 15 9  o 10.35000  0.1927000     10.25000  0.2857000     10.45000  0.2588000     -0.1959000     0.3855000 
1 1 1 14 15 10 o 12.77000  0.1666000     12.48000  0.2308000     13.06000  0.2402000     -0.5781000     0.3332000 
1 1 1 14 15 11 o 9.149000  0.2025000     8.692000  0.2418000     9.605000  0.3248000     -0.9130000     0.4049000 
1 1 1 14 15 12 o 14.32000  0.1795000     14.60000  0.2523000     14.04000  0.2554000     0.5593000      0.3590000 
1 1 1 14 15 13 o 2.560000  0.4582000     2.070000  0.6755000     3.050000  0.6192000     -0.9798000     0.9164000 
1 1 1 14 15 14 o 4.187000  0.3462000     4.573000  0.4382000     3.802000  0.5361000     0.7708000      0.6924000 
1 1 1 14 15 15 o 4.097000  0.6662000     3.550000  1.241000      4.644000  0.4855000     -1.093000      1.332000  
1 1 1 14 15 16 o 6.704000  0.2715000     6.924000  0.3791000     6.483000  0.3887000     0.4401000      0.5429000 
1 1 1 14 15 17 o 1.917000  0.5434000     1.933000  0.7615000     1.900000  0.7755000     0.3320000E-01  1.087000  
1 1 1 14 15 18 o 2.111000  0.5629000     2.340000  0.8076000     1.883000  0.7844000     0.4575000      1.126000  
1 1 1 14 15 19 o 4.175000  0.6224000     4.191000  0.5700000     4.159000  1.107000      0.3182000E-01  1.245000  
1 1 1 14 15 20 o 2.242000  0.6301000     1.927000  0.7475000     2.557000  1.015000      -0.6295000     1.260000  
1 1 1 14 15 21 o 2.693000  0.5910000     2.744000  0.6530000     2.642000  0.9853000     0.1020000      1.182000  
1 1 1 14 15 22 o 1.880000  0.5156000     2.210000  0.7705000     1.551000  0.6853000     0.6598000      1.031000  
1 1 1 14 15 23 o 1.385000  0.4490000     1.454000  0.6542000     1.315000  0.6152000     0.1391000      0.8980000 
1 1 1 14 15 24 o 1.290000  0.4298000     1.367000  0.6344000     1.213000  0.5801000     0.1543000      0.8597000 
1 1 1 14 15 25 o 1.290000  0.4459000     1.395000  0.6789000     1.185000  0.5783000     0.2103000      0.8918000 
1 1 1 14 16 0  o 6.637000  0.1564000     6.637000  0.1564000     6.637000  0.1564000     -0.000000      0.000000  
1 1 1 14 16 1  o 8.187000  0.1095000     8.171000  0.1552000     8.204000  0.1546000     -0.3328000E-01 0.2191000 
1 1 1 14 16 2  o 11.25000  0.1199000     11.22000  0.1683000     11.27000  0.1707000     -0.4910000E-01 0.2397000 
1 1 1 14 16 3  o 11.89000  0.1238000     11.84000  0.1738000     11.94000  0.1764000     -0.1011000     0.2477000 
1 1 1 14 16 4  o 5.473000  0.1259000     5.445000  0.1792000     5.501000  0.1768000     -0.5611000E-01 0.2517000 
1 1 1 14 16 5  o 8.982000  0.1219000     8.887000  0.1716000     9.077000  0.1731000     -0.1900000     0.2438000 
1 1 1 14 16 6  o 7.270000  0.1295000     7.063000  0.1835000     7.478000  0.1828000     -0.4149000     0.2591000 
1 1 1 14 16 7  o 3.135000  0.2636000     3.158000  0.4202000     3.112000  0.3183000     0.4646000E-01  0.5272000 
1 1 1 14 16 8  o 2.497000  0.2775000     2.735000  0.3466000     2.259000  0.4335000     0.4769000      0.5550000 
1 1 1 14 16 9  o 7.471000  0.3143000     7.236000  0.5828000     7.706000  0.2355000     -0.4700000     0.6286000 
1 1 1 14 16 10 o 2.328000  0.4095000     2.488000  0.5407000     2.168000  0.6153000     0.3196000      0.8191000 
1 1 1 14 16 11 o 7.437000  0.2305000     6.780000  0.3783000     8.094000  0.2633000     -1.314000      0.4609000 
1 1 1 14 16 12 o 9.230000  0.1837000     9.010000  0.2564000     9.451000  0.2630000     -0.4409000     0.3673000 
1 1 1 14 16 13 o 16.40000  0.2169000     16.41000  0.3027000     16.39000  0.3107000     0.2188000E-01  0.4338000 
1 1 1 14 16 14 f 4.854000  0.3001000     4.653000  0.4239000     5.054000  0.4248000     -0.4007000     0.6001000 
1 1 1 14 16 15 o 2.789000  0.6602000     3.386000  1.076000      2.192000  0.7652000     1.194000       1.320000  
1 1 1 14 16 16 o 6.336000  0.3649000     6.429000  0.3914000     6.243000  0.6160000     0.1865000      0.7298000 
1 1 1 14 16 17 o 2.009000  0.5410000     2.263000  0.7920000     1.754000  0.7371000     0.5091000      1.082000  
1 1 1 14 16 18 o 6.953000  0.2899000     7.565000  0.3697000     6.341000  0.4466000     1.224000       0.5797000 
1 1 1 14 16 19 o 2.732000  0.5237000     2.319000  0.7936000     3.146000  0.6837000     -0.8275000     1.047000  
1 1 1 14 16 20 f 3.041000  0.7956000     3.698000  1.350000      2.385000  0.8427000     1.313000       1.591000  
1 1 1 14 16 21 o 2.983000  0.5118000     3.595000  0.5116000     2.371000  0.8867000     1.224000       1.024000  
1 1 1 14 16 22 o 1.638000  0.4985000     1.078000  0.5227000     2.198000  0.8490000     -1.121000      0.9970000 
1 1 1 14 16 23 o 1.685000  0.5048000     1.549000  0.6401000     1.820000  0.7808000     -0.2712000     1.010000  
1 1 1 14 16 24 o 1.174000  0.3979000     1.159000  0.5369000     1.190000  0.5874000     -0.3136000E-01 0.7958000 
1 1 1 14 16 25 o 1.093000  0.3896000     1.144000  0.5736000     1.042000  0.5273000     0.1019000      0.7791000 
1 1 1 14 17 0  o 3.697000  0.2096000     3.697000  0.2096000     3.697000  0.2096000     -0.000000      0.000000  
1 1 1 14 17 1  o 10.51000  0.1172000     10.39000  0.1657000     10.62000  0.1658000     -0.2331000     0.2344000 
1 1 1 14 17 2  o 20.80000  0.1767000     20.93000  0.2512000     20.66000  0.2486000     0.2754000      0.3535000 
1 1 1 14 17 3  o 9.023000  0.1162000     9.001000  0.1641000     9.045000  0.1646000     -0.4398000E-01 0.2325000 
1 1 1 14 17 4  o 3.895000  0.1572000     4.086000  0.2139000     3.705000  0.2304000     0.3806000      0.3144000 
1 1 1 14 17 5  o 5.679000  0.1345000     5.830000  0.1870000     5.527000  0.1935000     0.3028000      0.2691000 
1 1 1 14 17 6  o 3.261000  0.2027000     3.535000  0.2610000     2.988000  0.3104000     0.5468000      0.4055000 
1 1 1 14 17 7  f 12.80000  0.1774000     12.78000  0.2249000     12.81000  0.2744000     -0.2460000E-01 0.3548000 
1 1 1 14 17 8  o 8.504000  0.1477000     8.419000  0.1960000     8.588000  0.2209000     -0.1688000     0.2953000 
1 1 1 14 17 9  o 13.04000  0.1671000     13.42000  0.2617000     12.66000  0.2077000     0.7611000      0.3341000 
1 1 1 14 17 10 o 12.60000  0.1655000     12.55000  0.2610000     12.65000  0.2035000     -0.1031000     0.3310000 
1 1 1 14 17 11 o 2.187000  0.4299000     1.670000  0.6186000     2.703000  0.5971000     -1.032000      0.8597000 
1 1 1 14 17 12 o 13.34000  0.1910000     13.13000  0.2840000     13.55000  0.2555000     -0.4275000     0.3820000 
1 1 1 14 17 13 o 9.562000  0.3272000     9.595000  0.2937000     9.529000  0.5847000     0.6541000E-01  0.6543000 
1 1 1 14 17 14 o 4.618000  0.4082000     4.698000  0.6565000     4.538000  0.4854000     0.1596000      0.8164000 
1 1 1 14 17 15 o 10.20000  0.2170000     10.30000  0.3089000     10.10000  0.3048000     0.2051000      0.4340000 
1 1 1 14 17 16 o 9.393000  0.2288000     9.382000  0.3215000     9.404000  0.3256000     -0.2149000E-01 0.4576000 
1 1 1 14 17 17 o 9.531000  0.2347000     9.811000  0.3216000     9.251000  0.3420000     0.5601000      0.4695000 
1 1 1 14 17 18 o 1.739000  0.5175000     1.664000  0.7177000     1.813000  0.7456000     -0.1494000     1.035000  
1 1 1 14 17 19 o 2.055000  0.5553000     1.665000  0.7783000     2.445000  0.7923000     -0.7802000     1.111000  
1 1 1 14 17 20 f 3.380000  0.7512000     3.605000  1.312000      3.154000  0.7330000     0.4508000      1.502000  
1 1 1 14 17 21 o 3.054000  0.4733000     3.175000  0.6615000     2.933000  0.6770000     0.2416000      0.9465000 
1 1 1 14 17 22 o 1.861000  0.5048000     1.824000  0.7059000     1.899000  0.7219000     -0.7522000E-01 1.010000  
1 1 1 14 17 23 o 2.770000  0.4658000     2.515000  0.6772000     3.025000  0.6397000     -0.5099000     0.9315000 
1 1 1 14 17 24 o 1.544000  0.4840000     1.212000  0.5577000     1.877000  0.7913000     -0.6642000     0.9681000 
1 1 1 14 17 25 o 1.643000  0.5124000     1.250000  0.6097000     2.035000  0.8238000     -0.7853000     1.025000  
1 1 1 14 18 0  o 8.998000  0.1621000     8.998000  0.1621000     8.998000  0.1621000     -0.000000      0.000000  
1 1 1 14 18 1  o 2.002000  0.2557000     1.917000  0.3782000     2.087000  0.3442000     -0.1697000     0.5114000 
1 1 1 14 18 2  o 12.33000  0.1278000     12.49000  0.1819000     12.16000  0.1795000     0.3329000      0.2556000 
1 1 1 14 18 3  o 6.406000  0.1217000     6.258000  0.1725000     6.554000  0.1718000     -0.2962000     0.2435000 
1 1 1 14 18 4  o 7.772000  0.1224000     7.763000  0.1738000     7.782000  0.1723000     -0.1860000E-01 0.2447000 
1 1 1 14 18 5  o 1.066000  0.3073000     1.301000  0.4755000     0.8319000 0.3893000     0.4691000      0.6146000 
1 1 1 14 18 6  o 6.565000  0.1508000     6.579000  0.2321000     6.551000  0.1928000     0.2810000E-01  0.3017000 
1 1 1 14 18 7  o 7.782000  0.1439000     8.071000  0.1884000     7.493000  0.2174000     0.5780000      0.2877000 
1 1 1 14 18 8  o 5.610000  0.2128000     5.858000  0.2420000     5.361000  0.3501000     0.4969000      0.4256000 
1 1 1 14 18 9  o 14.61000  0.1578000     14.72000  0.2247000     14.50000  0.2214000     0.2154000      0.3155000 
1 1 1 14 18 10 f 6.048000  0.1731000     6.129000  0.2413000     5.967000  0.2482000     0.1625000      0.3461000 
1 1 1 14 18 11 o 12.21000  0.1834000     11.94000  0.2716000     12.48000  0.2465000     -0.5400000     0.3668000 
1 1 1 14 18 12 o 16.68000  0.1905000     16.64000  0.2650000     16.73000  0.2736000     -0.8660000E-01 0.3809000 
1 1 1 14 18 13 f 7.069000  0.3074000     6.492000  0.3215000     7.646000  0.5240000     -1.154000      0.6148000 
1 1 1 14 18 14 o 8.737000  0.2323000     8.612000  0.3053000     8.862000  0.3503000     -0.2497000     0.4647000 
1 1 1 14 18 15 o 6.088000  0.2833000     6.079000  0.3909000     6.096000  0.4101000     -0.1700000E-01 0.5665000 
1 1 1 14 18 16 o 3.770000  0.4480000     3.487000  0.6600000     4.053000  0.6060000     -0.5660000     0.8960000 
1 1 1 14 18 17 o 6.746000  0.2912000     6.538000  0.4222000     6.955000  0.4013000     -0.4178000     0.5825000 
1 1 1 14 18 18 o 2.658000  0.5831000     3.106000  0.8210000     2.211000  0.8284000     0.8941000      1.166000  
1 1 1 14 18 19 o 3.106000  0.5293000     3.323000  0.7137000     2.889000  0.7818000     0.4340000      1.059000  
1 1 1 14 18 20 o 4.490000  0.6056000     3.730000  1.023000      5.251000  0.6490000     -1.520000      1.211000  
1 1 1 14 18 21 o 1.481000  0.4641000     1.524000  0.6642000     1.438000  0.6483000     0.8593000E-01  0.9282000 
1 1 1 14 18 22 o 2.038000  0.5045000     1.748000  0.6925000     2.327000  0.7339000     -0.5798000     1.009000  
1 1 1 14 18 23 o 1.413000  0.4502000     1.584000  0.6802000     1.241000  0.5901000     0.3438000      0.9004000 
1 1 1 14 18 24 o 1.311000  0.4246000     1.378000  0.6218000     1.244000  0.5782000     0.1338000      0.8491000 
1 1 1 14 18 25 o 1.667000  0.5045000     1.586000  0.7276000     1.747000  0.6991000     -0.1609000     1.009000  
1 1 1 14 19 0  o 3.778000  0.2234000     3.778000  0.2234000     3.778000  0.2234000     0.000000       0.000000  
1 1 1 14 19 1  o 10.07000  0.1202000     10.12000  0.1705000     10.02000  0.1695000     0.9611000E-01  0.2404000 
1 1 1 14 19 2  f 11.26000  0.1258000     11.20000  0.1776000     11.33000  0.1781000     -0.1352000     0.2515000 
1 1 1 14 19 3  o 8.228000  0.1224000     8.263000  0.1725000     8.192000  0.1738000     0.7091000E-01  0.2449000 
1 1 1 14 19 4  o 13.72000  0.1399000     13.82000  0.1985000     13.62000  0.1971000     0.1990000      0.2797000 
1 1 1 14 19 5  o 10.94000  0.1317000     10.78000  0.1854000     11.10000  0.1871000     -0.3176000     0.2634000 
1 1 1 14 19 6  o 8.966000  0.1724000     8.953000  0.2640000     8.979000  0.2218000     -0.2636000E-01 0.3448000 
1 1 1 14 19 7  o 8.213000  0.1480000     8.139000  0.1945000     8.287000  0.2232000     -0.1479000     0.2960000 
1 1 1 14 19 8  o 7.216000  0.1814000     7.278000  0.2963000     7.154000  0.2093000     0.1246000      0.3627000 
1 1 1 14 19 9  o 9.175000  0.1468000     9.201000  0.2073000     9.150000  0.2080000     0.5078000E-01  0.2936000 
1 1 1 14 19 10 o 9.976000  0.1508000     10.08000  0.2149000     9.868000  0.2116000     0.2170000      0.3016000 
1 1 1 14 19 11 o 10.98000  0.1721000     10.99000  0.2725000     10.96000  0.2102000     0.3526000E-01  0.3441000 
1 1 1 14 19 12 f 2.258000  0.4616000     1.796000  0.6693000     2.721000  0.6358000     -0.9251000     0.9232000 
1 1 1 14 19 13 o 5.059000  0.2966000     5.116000  0.3831000     5.002000  0.4529000     0.1131000      0.5932000 
1 1 1 14 19 14 o 6.867000  0.2957000     6.423000  0.4334000     7.312000  0.4024000     -0.8895000     0.5915000 
1 1 1 14 19 15 o 4.643000  0.3525000     4.368000  0.5281000     4.919000  0.4670000     -0.5506000     0.7050000 
1 1 1 14 19 16 o 3.649000  0.5780000     2.867000  0.9971000     4.431000  0.5848000     -1.564000      1.156000  
1 1 1 14 19 17 o 5.220000  0.3510000     5.025000  0.5034000     5.415000  0.4892000     -0.3898000     0.7019000 
1 1 1 14 19 18 o 3.651000  0.6354000     4.406000  0.6473000     2.896000  1.093000      1.509000       1.271000  
1 1 1 14 19 19 o 2.439000  0.5573000     2.604000  0.7807000     2.274000  0.7954000     0.3295000      1.115000  
1 1 1 14 19 20 o 4.213000  0.3799000     4.321000  0.5171000     4.104000  0.5567000     0.2178000      0.7598000 
1 1 1 14 19 21 o 5.630000  0.2896000     5.573000  0.4101000     5.688000  0.4090000     -0.1146000     0.5792000 
1 1 1 14 19 22 o 1.541000  0.4603000     1.523000  0.6334000     1.558000  0.6681000     -0.3490000E-01 0.9206000 
1 1 1 14 19 23 o 1.465000  0.4782000     1.529000  0.6669000     1.401000  0.6855000     0.1277000      0.9563000 
1 1 1 14 19 24 o 1.374000  0.4335000     1.119000  0.5389000     1.629000  0.6793000     -0.5096000     0.8671000 
1 1 1 14 19 25 o 1.433000  0.4489000     1.117000  0.5438000     1.748000  0.7143000     -0.6303000     0.8977000 
1 1 1 14 20 0  o 1.207000  0.5620000     1.207000  0.5620000     1.207000  0.5620000     0.000000       0.000000  
1 1 1 14 20 1  o 9.835000  0.1227000     9.606000  0.1731000     10.06000  0.1739000     -0.4582000     0.2453000 
1 1 1 14 20 2  o 6.324000  0.1284000     6.260000  0.1805000     6.388000  0.1826000     -0.1283000     0.2568000 
1 1 1 14 20 3  o 1.794000  0.3144000     1.584000  0.4717000     2.005000  0.4157000     -0.4209000     0.6287000 
1 1 1 14 20 4  o 6.056000  0.1375000     5.869000  0.1982000     6.243000  0.1906000     -0.3742000     0.2749000 
1 1 1 14 20 5  o 9.759000  0.1573000     9.886000  0.2245000     9.632000  0.2203000     0.2538000      0.3145000 
1 1 1 14 20 6  o 13.19000  0.1814000     13.05000  0.2297000     13.33000  0.2809000     -0.2797000     0.3629000 
1 1 1 14 20 7  o 12.04000  0.1863000     12.01000  0.2254000     12.06000  0.2967000     -0.4652000E-01 0.3726000 
1 1 1 14 20 8  o 15.87000  0.1619000     15.82000  0.2293000     15.91000  0.2287000     -0.8947000E-01 0.3238000 
1 1 1 14 20 9  o 9.030000  0.1466000     8.857000  0.2091000     9.204000  0.2055000     -0.3466000     0.2932000 
1 1 1 14 20 10 o 13.61000  0.1584000     13.75000  0.2256000     13.48000  0.2223000     0.2705000      0.3167000 
1 1 1 14 20 11 o 21.22000  0.2137000     21.63000  0.2855000     20.80000  0.3182000     0.8318000      0.4275000 
1 1 1 14 20 12 o 6.874000  0.2462000     7.081000  0.3497000     6.668000  0.3465000     0.4131000      0.4923000 
1 1 1 14 20 13 o 5.485000  0.2775000     5.100000  0.4092000     5.870000  0.3750000     -0.7696000     0.5550000 
1 1 1 14 20 14 o 6.206000  0.5076000     6.244000  0.9387000     6.168000  0.3866000     0.7641000E-01  1.015000  
1 1 1 14 20 15 o 7.326000  0.2511000     7.100000  0.3534000     7.553000  0.3569000     -0.4536000     0.5023000 
1 1 1 14 20 16 o 6.143000  0.3069000     6.441000  0.4044000     5.846000  0.4619000     0.5954000      0.6139000 
1 1 1 14 20 17 o 5.654000  0.3360000     5.260000  0.4920000     6.047000  0.4577000     -0.7870000     0.6720000 
1 1 1 14 20 18 o 1.950000  0.5992000     1.885000  0.7593000     2.014000  0.9271000     -0.1287000     1.198000  
1 1 1 14 20 19 o 1.575000  0.4978000     1.623000  0.7091000     1.526000  0.6988000     0.9694000E-01  0.9956000 
1 1 1 14 20 20 f 1.620000  0.4838000     1.402000  0.6332000     1.837000  0.7316000     -0.4350000     0.9675000 
1 1 1 14 20 21 o 1.790000  0.5048000     1.821000  0.7200000     1.759000  0.7077000     0.6194000E-01  1.010000  
1 1 1 14 20 22 o 1.406000  0.4459000     1.449000  0.6388000     1.364000  0.6223000     0.8454000E-01  0.8918000 
1 1 1 14 20 23 o 1.766000  0.5611000     1.623000  0.6829000     1.909000  0.8906000     -0.2866000     1.122000  
1 1 1 14 20 24 o 1.508000  0.4475000     1.843000  0.6928000     1.173000  0.5667000     0.6699000      0.8950000 
1 1 1 14 21 0  o 1.022000  0.5543000     1.022000  0.5543000     1.022000  0.5543000     0.000000       0.000000  
1 1 1 14 21 1  o 1.987000  0.2916000     1.531000  0.4735000     2.443000  0.3407000     -0.9115000     0.5833000 
1 1 1 14 21 2  o 12.77000  0.1359000     12.71000  0.1920000     12.83000  0.1924000     -0.1263000     0.2718000 
1 1 1 14 21 3  f 12.49000  0.1362000     12.69000  0.1932000     12.29000  0.1920000     0.4012000      0.2724000 
1 1 1 14 21 4  o 6.583000  0.1359000     6.633000  0.1932000     6.534000  0.1911000     0.9893000E-01  0.2717000 
1 1 1 14 21 5  o 5.499000  0.1864000     5.373000  0.2393000     5.624000  0.2858000     -0.2509000     0.3727000 
1 1 1 14 21 6  o 15.09000  0.1932000     14.85000  0.2167000     15.33000  0.3200000     -0.4822000     0.3864000 
1 1 1 14 21 7  o 8.337000  0.1587000     8.338000  0.2482000     8.336000  0.1979000     0.2187000E-02  0.3174000 
1 1 1 14 21 8  o 6.612000  0.1560000     6.704000  0.2174000     6.519000  0.2239000     0.1849000      0.3121000 
1 1 1 14 21 9  o 8.128000  0.1526000     8.184000  0.2166000     8.072000  0.2150000     0.1116000      0.3052000 
1 1 1 14 21 10 o 8.845000  0.1567000     8.982000  0.2196000     8.708000  0.2236000     0.2734000      0.3133000 
1 1 1 14 21 11 o 9.720000  0.1602000     9.645000  0.2261000     9.794000  0.2270000     -0.1494000     0.3204000 
1 1 1 14 21 12 f 4.732000  0.3266000     5.001000  0.4387000     4.463000  0.4841000     0.5388000      0.6533000 
1 1 1 14 21 13 o 5.973000  0.2592000     6.181000  0.3459000     5.764000  0.3862000     0.4169000      0.5185000 
1 1 1 14 21 14 o 1.843000  0.5459000     1.766000  0.8007000     1.921000  0.7421000     -0.1556000     1.092000  
1 1 1 14 21 15 o 8.822000  0.2360000     8.794000  0.3348000     8.849000  0.3329000     -0.5494000E-01 0.4721000 
1 1 1 14 21 16 o 3.648000  0.4795000     4.368000  0.5335000     2.927000  0.7968000     1.442000       0.9589000 
1 1 1 14 21 17 o 2.430000  0.5712000     2.706000  0.7945000     2.155000  0.8209000     0.5508000      1.142000  
1 1 1 14 21 18 o 4.231000  0.5830000     3.691000  0.6580000     4.771000  0.9625000     -1.080000      1.166000  
1 1 1 14 21 19 o 2.030000  0.5692000     1.978000  0.7906000     2.081000  0.8190000     -0.1032000     1.138000  
1 1 1 14 21 20 o 1.860000  0.4933000     1.360000  0.6239000     2.360000  0.7643000     -0.9992000     0.9866000 
1 1 1 14 21 21 o 1.550000  0.4713000     1.675000  0.6950000     1.425000  0.6367000     0.2500000      0.9426000 
1 1 1 14 21 22 o 2.394000  0.5205000     2.436000  0.7274000     2.352000  0.7448000     0.8418000E-01  1.041000  
1 1 1 14 21 23 o 1.667000  0.4939000     1.912000  0.7067000     1.422000  0.6902000     0.4896000      0.9878000 
1 1 1 14 21 24 o 1.687000  0.5034000     2.000000  0.7485000     1.373000  0.6735000     0.6265000      1.007000  
1 1 1 14 22 0  o 1.048000  0.5649000     1.048000  0.5649000     1.048000  0.5649000     0.000000       0.000000  
1 1 1 14 22 1  o 14.84000  0.1466000     14.73000  0.2068000     14.94000  0.2079000     -0.2042000     0.2933000 
1 1 1 14 22 2  o 10.72000  0.1302000     10.54000  0.1833000     10.90000  0.1851000     -0.3554000     0.2604000 
1 1 1 14 22 3  o 17.17000  0.1605000     17.32000  0.2278000     17.03000  0.2261000     0.2887000      0.3210000 
1 1 1 14 22 4  o 4.524000  0.2158000     4.360000  0.3430000     4.688000  0.2619000     -0.3271000     0.4316000 
1 1 1 14 22 5  o 4.025000  0.2186000     4.370000  0.2405000     3.680000  0.3650000     0.6902000      0.4371000 
1 1 1 14 22 6  o 13.58000  0.1928000     13.29000  0.2937000     13.87000  0.2498000     -0.5847000     0.3856000 
1 1 1 14 22 7  o 2.506000  0.3079000     2.507000  0.4230000     2.505000  0.4476000     0.2151000E-02  0.6158000 
1 1 1 14 22 8  o 11.52000  0.1482000     11.74000  0.2102000     11.30000  0.2090000     0.4373000      0.2964000 
1 1 1 14 22 9  o 3.048000  0.2864000     2.929000  0.4312000     3.168000  0.3770000     -0.2390000     0.5728000 
1 1 1 14 22 10 o 7.939000  0.1610000     7.869000  0.2263000     8.010000  0.2291000     -0.1411000     0.3220000 
1 1 1 14 22 11 o 18.23000  0.1847000     18.30000  0.2618000     18.16000  0.2606000     0.1428000      0.3694000 
1 1 1 14 22 12 o 9.666000  0.2036000     9.959000  0.2436000     9.372000  0.3262000     0.5865000      0.4072000 
1 1 1 14 22 13 o 5.388000  0.3153000     5.185000  0.4243000     5.590000  0.4666000     -0.4052000     0.6307000 
1 1 1 14 22 14 o 7.786000  0.2357000     7.848000  0.3263000     7.724000  0.3401000     0.1242000      0.4713000 
1 1 1 14 22 15 o 2.622000  0.4920000     1.736000  0.7228000     3.508000  0.6677000     -1.772000      0.9840000 
1 1 1 14 22 16 o 3.279000  0.5151000     3.529000  0.6648000     3.028000  0.7871000     0.5012000      1.030000  
1 1 1 14 22 17 o 3.825000  0.4714000     3.135000  0.7568000     4.514000  0.5623000     -1.379000      0.9428000 
1 1 1 14 22 18 o 2.899000  0.5553000     2.823000  0.7863000     2.974000  0.7842000     -0.1513000     1.111000  
1 1 1 14 22 19 o 2.161000  0.6249000     2.026000  0.9703000     2.297000  0.7878000     -0.2710000     1.250000  
1 1 1 14 22 20 o 1.355000  0.4433000     1.323000  0.6160000     1.387000  0.6377000     -0.6380000E-01 0.8866000 
1 1 1 14 22 21 o 1.442000  0.4557000     1.296000  0.6016000     1.589000  0.6846000     -0.2928000     0.9113000 
1 1 1 14 22 22 o 2.013000  0.5161000     2.195000  0.7290000     1.831000  0.7307000     0.3646000      1.032000  
1 1 1 14 22 23 o 1.191000  0.4024000     1.024000  0.5006000     1.358000  0.6301000     -0.3332000     0.8047000 
1 1 1 14 22 24 o 1.679000  0.4948000     1.310000  0.6226000     2.048000  0.7693000     -0.7385000     0.9897000 
1 1 1 14 23 0  o 8.869000  0.1828000     8.869000  0.1828000     8.869000  0.1828000     0.000000       0.000000  
1 1 1 14 23 1  o 4.484000  0.1595000     4.395000  0.2299000     4.573000  0.2212000     -0.1776000     0.3190000 
1 1 1 14 23 2  o 9.050000  0.1299000     8.921000  0.1844000     9.178000  0.1830000     -0.2563000     0.2597000 
1 1 1 14 23 3  o 12.34000  0.1797000     11.99000  0.2773000     12.70000  0.2286000     -0.7126000     0.3594000 
1 1 1 14 23 4  o 4.844000  0.2323000     4.786000  0.2310000     4.901000  0.4031000     -0.1148000     0.4646000 
1 1 1 14 23 5  o 4.017000  0.2521000     4.454000  0.3522000     3.579000  0.3609000     0.8746000      0.5043000 
1 1 1 14 23 6  o 26.92000  0.2274000     27.07000  0.3233000     26.77000  0.3199000     0.3067000      0.4548000 
1 1 1 14 23 7  o 12.99000  0.1499000     13.02000  0.2125000     12.96000  0.2116000     0.5917000E-01  0.2998000 
1 1 1 14 23 8  o 16.47000  0.1673000     16.21000  0.2353000     16.74000  0.2380000     -0.5266000     0.3347000 
1 1 1 14 23 9  o 11.35000  0.1535000     11.50000  0.2173000     11.20000  0.2168000     0.3063000      0.3070000 
1 1 1 14 23 10 o 2.776000  0.3383000     2.849000  0.4592000     2.702000  0.4969000     0.1469000      0.6766000 
1 1 1 14 23 11 o 12.48000  0.1827000     12.48000  0.2800000     12.47000  0.2347000     0.1627000E-01  0.3654000 
1 1 1 14 23 12 o 9.662000  0.1701000     9.718000  0.2401000     9.605000  0.2410000     0.1128000      0.3402000 
1 1 1 14 23 13 o 7.140000  0.4395000     6.925000  0.8118000     7.354000  0.3373000     -0.4291000     0.8790000 
1 1 1 14 23 14 o 5.484000  0.3054000     5.592000  0.4211000     5.375000  0.4423000     0.2169000      0.6107000 
1 1 1 14 23 15 o 6.123000  0.2907000     6.105000  0.4014000     6.142000  0.4205000     -0.3713000E-01 0.5813000 
1 1 1 14 23 16 o 3.551000  0.4949000     3.419000  0.6915000     3.683000  0.7081000     -0.2641000     0.9898000 
1 1 1 14 23 17 o 2.799000  0.5680000     2.198000  0.8326000     3.400000  0.7727000     -1.202000      1.136000  
1 1 1 14 23 18 o 4.752000  0.3650000     4.494000  0.5194000     5.011000  0.5129000     -0.5167000     0.7300000 
1 1 1 14 23 19 o 1.806000  0.5735000     2.166000  0.9365000     1.446000  0.6623000     0.7208000      1.147000  
1 1 1 14 23 20 o 1.908000  0.5228000     1.694000  0.7021000     2.122000  0.7750000     -0.4276000     1.046000  
1 1 1 14 23 21 o 1.718000  0.4756000     2.151000  0.7343000     1.286000  0.6047000     0.8642000      0.9512000 
1 1 1 14 23 22 o 1.203000  0.4027000     1.088000  0.5287000     1.317000  0.6075000     -0.2291000     0.8054000 
1 1 1 14 23 23 o 2.945000  0.4602000     2.447000  0.6913000     3.444000  0.6075000     -0.9972000     0.9203000 
1 1 1 14 23 24 o 1.372000  0.4938000     1.724000  0.8500000     1.021000  0.5030000     0.7036000      0.9877000 
1 1 1 14 24 0  f 12.97000  0.2304000     12.97000  0.2304000     12.97000  0.2304000     0.000000       0.000000  
1 1 1 14 24 1  o 7.136000  0.1483000     6.962000  0.2275000     7.309000  0.1904000     -0.3463000     0.2967000 
1 1 1 14 24 2  o 14.89000  0.2134000     15.08000  0.3048000     14.70000  0.2988000     0.3785000      0.4269000 
1 1 1 14 24 3  o 16.21000  0.2239000     16.21000  0.2239000     ?         ?             ?              ?         
1 1 1 14 24 4  o 8.407000  0.1776000     8.748000  0.2682000     8.066000  0.2329000     0.6824000      0.3552000 
1 1 1 14 24 5  o 18.31000  0.1864000     18.19000  0.2821000     18.43000  0.2436000     -0.2441000     0.3727000 
1 1 1 14 24 6  o 11.71000  0.1433000     11.76000  0.2023000     11.67000  0.2031000     0.8495000E-01  0.2867000 
1 1 1 14 24 7  o 17.12000  0.1695000     17.23000  0.2402000     17.01000  0.2393000     0.2165000      0.3391000 
1 1 1 14 24 8  o 4.444000  0.2086000     4.626000  0.2828000     4.263000  0.3067000     0.3632000      0.4172000 
1 1 1 14 24 9  o 7.631000  0.1627000     7.684000  0.2299000     7.577000  0.2303000     0.1073000      0.3254000 
1 1 1 14 24 10 o 6.149000  0.1839000     6.040000  0.2595000     6.259000  0.2607000     -0.2187000     0.3678000 
1 1 1 14 24 11 o 3.329000  0.4071000     3.054000  0.6397000     3.603000  0.5036000     -0.5488000     0.8141000 
1 1 1 14 24 12 o 6.188000  0.2070000     6.529000  0.2797000     5.847000  0.3052000     0.6818000      0.4140000 
1 1 1 14 24 13 o 12.42000  0.2013000     12.44000  0.3157000     12.40000  0.2499000     0.4563000E-01  0.4026000 
1 1 1 14 24 14 o 1.888000  0.5112000     2.300000  0.7719000     1.476000  0.6705000     0.8243000      1.022000  
1 1 1 14 24 15 o 2.346000  0.5615000     2.253000  0.7798000     2.439000  0.8080000     -0.1852000     1.123000  
1 1 1 14 24 16 o 4.143000  0.4199000     3.917000  0.6048000     4.368000  0.5827000     -0.4505000     0.8399000 
1 1 1 14 24 17 o 2.151000  0.6609000     1.920000  0.7857000     2.381000  1.063000      -0.4614000     1.322000  
1 1 1 14 24 18 o 1.890000  0.4898000     1.281000  0.6054000     2.500000  0.7703000     -1.219000      0.9797000 
1 1 1 14 24 19 o 1.428000  0.4587000     1.277000  0.6020000     1.580000  0.6922000     -0.3025000     0.9173000 
1 1 1 14 24 20 o 1.832000  0.5168000     1.882000  0.7314000     1.782000  0.7303000     0.1004000      1.034000  
1 1 1 14 24 21 o 2.562000  0.4891000     1.979000  0.7119000     3.146000  0.6709000     -1.168000      0.9783000 
1 1 1 14 24 22 o 2.110000  0.5311000     1.761000  0.7167000     2.459000  0.7841000     -0.6981000     1.062000  
1 1 1 14 24 23 o 1.187000  0.3988000     1.130000  0.5417000     1.244000  0.5855000     -0.1142000     0.7976000 
1 1 1 14 24 24 o 1.362000  0.4593000     1.395000  0.6801000     1.330000  0.6174000     0.6563000E-01  0.9185000 
1 1 1 14 25 0  o 1.602000  0.8477000     1.602000  0.8477000     1.602000  0.8477000     0.000000       0.000000  
1 1 1 14 25 1  o 18.96000  0.3436000     18.96000  0.3436000     ?         ?             ?              ?         
1 1 1 14 25 2  o 14.28000  0.2097000     14.50000  0.2964000     14.06000  0.2967000     0.4412000      0.4194000 
1 1 1 14 25 3  o 4.025000  0.2347000     3.852000  0.3861000     4.198000  0.2671000     -0.3459000     0.4695000 
1 1 1 14 25 4  o 14.82000  0.1543000     14.93000  0.2199000     14.71000  0.2166000     0.2211000      0.3087000 
1 1 1 14 25 5  o 9.120000  0.1404000     8.970000  0.2004000     9.269000  0.1967000     -0.2990000     0.2807000 
1 1 1 14 25 6  o 12.00000  0.1468000     12.00000  0.2066000     11.99000  0.2086000     0.1108000E-01  0.2936000 
1 1 1 14 25 7  o 13.17000  0.1533000     13.23000  0.2184000     13.11000  0.2150000     0.1192000      0.3065000 
1 1 1 14 25 8  o 5.068000  0.1936000     4.859000  0.2868000     5.277000  0.2600000     -0.4175000     0.3871000 
1 1 1 14 25 9  o 7.953000  0.1620000     7.945000  0.2277000     7.961000  0.2306000     -0.1630000E-01 0.3241000 
1 1 1 14 25 10 f 16.65000  0.1770000     16.37000  0.2486000     16.92000  0.2519000     -0.5501000     0.3539000 
1 1 1 14 25 11 f 5.441000  0.2576000     5.456000  0.2983000     5.427000  0.4200000     0.2930000E-01  0.5151000 
1 1 1 14 25 12 o 5.433000  0.2930000     5.446000  0.3130000     5.420000  0.4955000     0.2585000E-01  0.5860000 
1 1 1 14 25 13 o 9.565000  0.1837000     9.518000  0.2585000     9.611000  0.2611000     -0.9315000E-01 0.3674000 
1 1 1 14 25 14 o 3.632000  0.4071000     3.535000  0.6453000     3.728000  0.4966000     -0.1930000     0.8143000 
1 1 1 14 25 15 o 10.13000  0.2269000     10.22000  0.3117000     10.05000  0.3297000     0.1717000      0.4537000 
1 1 1 14 25 16 o 4.316000  0.4309000     4.670000  0.5174000     3.962000  0.6891000     0.7081000      0.8617000 
1 1 1 14 25 17 o 2.046000  0.5942000     2.182000  0.7863000     1.909000  0.8910000     0.2727000      1.188000  
1 1 1 14 25 18 o 1.981000  0.5026000     1.314000  0.6157000     2.648000  0.7946000     -1.334000      1.005000  
1 1 1 14 25 19 f 2.291000  0.5221000     2.634000  0.7425000     1.948000  0.7344000     0.6869000      1.044000  
1 1 1 14 25 20 o 3.502000  0.4443000     3.653000  0.5918000     3.350000  0.6629000     0.3036000      0.8886000 
1 1 1 14 25 21 o 3.127000  0.4715000     3.440000  0.5923000     2.813000  0.7337000     0.6262000      0.9429000 
1 1 1 14 25 22 f 2.269000  0.5132000     2.896000  0.6737000     1.642000  0.7745000     1.254000       1.026000  
1 1 1 14 25 23 o 1.735000  0.4926000     1.701000  0.6821000     1.769000  0.7109000     -0.6777000E-01 0.9852000 
1 1 1 14 25 24 o 1.176000  0.3967000     1.081000  0.5252000     1.271000  0.5947000     -0.1895000     0.7934000 
1 1 1 14 26 0  o 10.64000  0.2242000     10.64000  0.2242000     10.64000  0.2242000     0.000000       0.000000  
1 1 1 14 26 1  o 10.18000  0.1476000     10.34000  0.2245000     10.01000  0.1916000     0.3258000      0.2952000 
1 1 1 14 26 2  o 14.58000  0.1633000     14.47000  0.2462000     14.69000  0.2146000     -0.2181000     0.3266000 
1 1 1 14 26 3  o 21.19000  0.1886000     21.10000  0.2664000     21.27000  0.2672000     -0.1654000     0.3773000 
1 1 1 14 26 4  o 19.93000  0.1820000     19.78000  0.2561000     20.07000  0.2587000     -0.2875000     0.3641000 
1 1 1 14 26 5  o 15.01000  0.1567000     15.14000  0.2223000     14.88000  0.2207000     0.2576000      0.3133000 
1 1 1 14 26 6  o 20.19000  0.1864000     20.47000  0.2660000     19.92000  0.2613000     0.5484000      0.3729000 
1 1 1 14 26 7  o 7.669000  0.1536000     7.687000  0.2180000     7.650000  0.2165000     0.3660000E-01  0.3073000 
1 1 1 14 26 8  o 7.331000  0.1597000     7.286000  0.2265000     7.375000  0.2251000     -0.8937000E-01 0.3193000 
1 1 1 14 26 9  o 1.793000  0.4136000     1.853000  0.5767000     1.734000  0.5932000     0.1196000      0.8273000 
1 1 1 14 26 10 o 3.231000  0.3744000     3.291000  0.5988000     3.170000  0.4497000     0.1203000      0.7488000 
1 1 1 14 26 11 o 4.918000  0.2349000     4.660000  0.3384000     5.176000  0.3259000     -0.5155000     0.4698000 
1 1 1 14 26 12 o 6.238000  0.2900000     6.415000  0.4289000     6.062000  0.3903000     0.3534000      0.5799000 
1 1 1 14 26 13 o 6.376000  0.2217000     6.497000  0.3061000     6.255000  0.3207000     0.2421000      0.4434000 
1 1 1 14 26 14 f 3.464000  0.4006000     2.778000  0.6530000     4.150000  0.4644000     -1.372000      0.8013000 
1 1 1 14 26 15 o 6.868000  0.2756000     7.002000  0.3754000     6.734000  0.4037000     0.2684000      0.5513000 
1 1 1 14 26 16 o 2.946000  0.5684000     3.162000  0.7829000     2.731000  0.8242000     0.4306000      1.137000  
1 1 1 14 26 17 o 1.997000  0.5392000     2.329000  0.7928000     1.664000  0.7309000     0.6646000      1.078000  
1 1 1 14 26 18 o 2.618000  0.5738000     2.244000  0.8830000     2.992000  0.7331000     -0.7476000     1.148000  
1 1 1 14 26 19 o 2.206000  0.5280000     2.204000  0.7496000     2.209000  0.7439000     -0.4432000E-02 1.056000  
1 1 1 14 26 20 o 1.346000  0.4342000     1.027000  0.5054000     1.665000  0.7063000     -0.6380000     0.8685000 
1 1 1 14 26 21 o 1.661000  0.4874000     1.571000  0.6680000     1.750000  0.7100000     -0.1788000     0.9748000 
1 1 1 14 26 22 o 1.755000  0.5565000     1.636000  0.6734000     1.875000  0.8863000     -0.2391000     1.113000  
1 1 1 14 26 23 o 1.586000  0.4843000     1.530000  0.6583000     1.643000  0.7104000     -0.1134000     0.9685000 
1 1 1 14 27 0  o 1.150000  0.6091000     1.150000  0.6091000     1.150000  0.6091000     -0.000000      0.000000  
1 1 1 14 27 1  o 7.167000  0.1427000     7.198000  0.2022000     7.137000  0.2014000     0.6107000E-01  0.2854000 
1 1 1 14 27 2  o 14.19000  0.1508000     14.25000  0.2136000     14.13000  0.2129000     0.1118000      0.3016000 
1 1 1 14 27 3  o 19.65000  0.1804000     19.60000  0.2549000     19.70000  0.2555000     -0.9771000E-01 0.3609000 
1 1 1 14 27 4  o 18.13000  0.2269000     18.32000  0.2874000     17.93000  0.3512000     0.3919000      0.4538000 
1 1 1 14 27 5  o 3.560000  0.2392000     3.958000  0.3064000     3.161000  0.3674000     0.7968000      0.4784000 
1 1 1 14 27 6  o 1.919000  0.3689000     1.536000  0.5450000     2.302000  0.4973000     -0.7664000     0.7377000 
1 1 1 14 27 7  o 7.278000  0.1576000     7.647000  0.2199000     6.909000  0.2260000     0.7381000      0.3153000 
1 1 1 14 27 8  o 6.008000  0.1779000     5.890000  0.2550000     6.126000  0.2480000     -0.2360000     0.3557000 
1 1 1 14 27 9  o 10.95000  0.1588000     10.76000  0.2241000     11.13000  0.2251000     -0.3695000     0.3176000 
1 1 1 14 27 10 o 7.206000  0.2278000     7.689000  0.2783000     6.722000  0.3607000     0.9665000      0.4556000 
1 1 1 14 27 11 o 6.597000  0.2170000     6.480000  0.2836000     6.713000  0.3286000     -0.2321000     0.4341000 
1 1 1 14 27 12 o 9.172000  0.2026000     9.232000  0.3128000     9.112000  0.2576000     0.1204000      0.4052000 
1 1 1 14 27 13 o 2.782000  0.4455000     2.896000  0.5966000     2.667000  0.6617000     0.2285000      0.8910000 
1 1 1 14 27 14 o 14.83000  0.1904000     14.46000  0.2681000     15.20000  0.2705000     -0.7348000     0.3808000 
1 1 1 14 27 15 o 6.822000  0.2621000     6.914000  0.4065000     6.731000  0.3309000     0.1835000      0.5241000 
1 1 1 14 27 16 o 1.895000  0.5481000     1.529000  0.6987000     2.261000  0.8447000     -0.7316000     1.096000  
1 1 1 14 27 17 o 4.361000  0.3988000     4.601000  0.5288000     4.121000  0.5971000     0.4795000      0.7976000 
1 1 1 14 27 18 o 2.326000  0.5391000     1.736000  0.8273000     2.916000  0.6915000     -1.179000      1.078000  
1 1 1 14 27 19 o 1.511000  0.4713000     1.559000  0.6751000     1.463000  0.6580000     0.9656000E-01  0.9427000 
1 1 1 14 27 20 o 1.183000  0.4015000     1.195000  0.5699000     1.171000  0.5656000     0.2327000E-01  0.8029000 
1 1 1 14 27 21 o 2.257000  0.5205000     2.272000  0.7197000     2.242000  0.7523000     0.2922000E-01  1.041000  
1 1 1 14 27 22 o 1.459000  0.4652000     1.617000  0.6738000     1.300000  0.6416000     0.3172000      0.9304000 
1 1 1 14 27 23 o 1.205000  0.4106000     1.134000  0.5535000     1.277000  0.6067000     -0.1427000     0.8213000 
1 1 1 14 28 0  o 2.405000  0.4941000     2.405000  0.4941000     2.405000  0.4941000     0.000000       0.000000  
1 1 1 14 28 1  o 13.22000  0.1484000     13.20000  0.2099000     13.23000  0.2098000     -0.3060000E-01 0.2968000 
1 1 1 14 28 2  o 23.32000  0.2037000     22.96000  0.2850000     23.69000  0.2912000     -0.7367000     0.4074000 
1 1 1 14 28 3  o 16.10000  0.1623000     15.85000  0.2279000     16.35000  0.2312000     -0.4986000     0.3246000 
1 1 1 14 28 4  o 21.47000  0.1935000     21.23000  0.2714000     21.70000  0.2759000     -0.4680000     0.3870000 
1 1 1 14 28 5  o 4.065000  0.2153000     4.132000  0.3001000     3.998000  0.3088000     0.1340000      0.4306000 
1 1 1 14 28 6  f 5.954000  0.1717000     5.852000  0.2476000     6.055000  0.2380000     -0.2027000     0.3434000 
1 1 1 14 28 7  o 18.78000  0.1813000     18.54000  0.2540000     19.03000  0.2588000     -0.4935000     0.3626000 
1 1 1 14 28 8  o 14.05000  0.1634000     14.22000  0.2321000     13.89000  0.2301000     0.3315000      0.3268000 
1 1 1 14 28 9  o 9.110000  0.1839000     9.042000  0.2849000     9.178000  0.2327000     -0.1360000     0.3678000 
1 1 1 14 28 10 o 6.078000  0.2082000     6.318000  0.2719000     5.839000  0.3155000     0.4799000      0.4165000 
1 1 1 14 28 11 o 4.280000  0.3886000     4.243000  0.5868000     4.316000  0.5096000     -0.7359000E-01 0.7772000 
1 1 1 14 28 12 o 4.127000  0.2972000     4.285000  0.3988000     3.970000  0.4409000     0.3155000      0.5945000 
1 1 1 14 28 13 o 2.287000  0.4848000     2.355000  0.6676000     2.219000  0.7033000     0.1363000      0.9697000 
1 1 1 14 28 14 o 4.860000  0.2911000     5.104000  0.3835000     4.616000  0.4380000     0.4882000      0.5821000 
1 1 1 14 28 15 o 6.008000  0.2520000     6.368000  0.3422000     5.648000  0.3699000     0.7198000      0.5039000 
1 1 1 14 28 16 o 2.164000  0.6813000     1.704000  0.7432000     2.624000  1.142000      -0.9195000     1.363000  
1 1 1 14 28 17 o 1.621000  0.5024000     1.345000  0.6290000     1.896000  0.7837000     -0.5510000     1.005000  
1 1 1 14 28 18 o 1.648000  0.4904000     1.856000  0.7367000     1.440000  0.6475000     0.4153000      0.9809000 
1 1 1 14 28 19 o 1.594000  0.4714000     1.242000  0.5853000     1.946000  0.7391000     -0.7041000     0.9428000 
1 1 1 14 28 20 o 2.391000  0.5202000     2.581000  0.7224000     2.200000  0.7487000     0.3811000      1.040000  
1 1 1 14 28 21 o 1.719000  0.4906000     1.859000  0.7074000     1.580000  0.6801000     0.2788000      0.9813000 
1 1 1 14 28 22 o 1.461000  0.4526000     1.361000  0.6117000     1.561000  0.6674000     -0.1995000     0.9053000 
1 1 1 14 28 23 o 1.561000  0.5326000     1.787000  0.8715000     1.334000  0.6127000     0.4529000      1.065000  
1 1 1 14 29 0  o 0.5799000 0.4106000     0.5799000 0.4106000     0.5799000 0.4106000     -0.000000      0.000000  
1 1 1 14 29 1  o 15.02000  0.1571000     14.94000  0.2218000     15.10000  0.2225000     -0.1562000     0.3141000 
1 1 1 14 29 2  o 15.99000  0.1624000     16.24000  0.2312000     15.74000  0.2282000     0.4995000      0.3248000 
1 1 1 14 29 3  o 10.60000  0.1457000     10.63000  0.2057000     10.56000  0.2063000     0.6346000E-01  0.2914000 
1 1 1 14 29 4  o 10.17000  0.1465000     10.14000  0.2058000     10.20000  0.2085000     -0.5653000E-01 0.2930000 
1 1 1 14 29 5  o 13.63000  0.1555000     13.66000  0.2199000     13.61000  0.2199000     0.4901000E-01  0.3110000 
1 1 1 14 29 6  o 4.926000  0.1918000     4.764000  0.2738000     5.087000  0.2687000     -0.3239000     0.3836000 
1 1 1 14 29 7  o 24.41000  0.2159000     24.26000  0.3034000     24.55000  0.3072000     -0.2888000     0.4318000 
1 1 1 14 29 8  o 27.97000  0.2412000     28.04000  0.3415000     27.90000  0.3408000     0.1385000      0.4825000 
1 1 1 14 29 9  o 3.813000  0.3740000     3.628000  0.5734000     3.999000  0.4801000     -0.3709000     0.7479000 
1 1 1 14 29 10 o 8.373000  0.1923000     8.401000  0.2494000     8.345000  0.2926000     0.5671000E-01  0.3845000 
1 1 1 14 29 11 o 4.539000  0.3090000     4.256000  0.5001000     4.821000  0.3630000     -0.5647000     0.6180000 
1 1 1 14 29 12 o 6.885000  0.2237000     7.059000  0.3014000     6.711000  0.3305000     0.3479000      0.4473000 
1 1 1 14 29 13 o 11.49000  0.1853000     11.56000  0.2591000     11.42000  0.2650000     0.1406000      0.3706000 
1 1 1 14 29 14 o 1.836000  0.4793000     1.468000  0.6358000     2.203000  0.7174000     -0.7357000     0.9586000 
1 1 1 14 29 15 o 2.029000  0.5131000     2.206000  0.7332000     1.851000  0.7179000     0.3555000      1.026000  
1 1 1 14 29 16 o 7.092000  0.2914000     7.250000  0.4147000     6.934000  0.4095000     0.3162000      0.5828000 
1 1 1 14 29 17 o 4.607000  0.4369000     4.507000  0.6636000     4.707000  0.5686000     -0.2003000     0.8738000 
1 1 1 14 29 18 o 2.409000  0.5286000     2.469000  0.7353000     2.349000  0.7596000     0.1199000      1.057000  
1 1 1 14 29 19 o 2.688000  0.4622000     3.581000  0.5885000     1.794000  0.7129000     1.787000       0.9244000 
1 1 1 14 29 20 o 1.283000  0.4204000     1.327000  0.6035000     1.238000  0.5855000     0.8920000E-01  0.8408000 
1 1 1 14 29 21 o 1.309000  0.4343000     1.203000  0.5737000     1.416000  0.6521000     -0.2126000     0.8685000 
1 1 1 14 29 22 o 1.880000  0.5036000     1.728000  0.6970000     2.032000  0.7270000     -0.3045000     1.007000  
1 1 1 14 29 23 o 1.214000  0.4226000     1.386000  0.6713000     1.043000  0.5134000     0.3427000      0.8451000 
1 1 1 14 30 0  o 18.07000  0.2450000     18.07000  0.2450000     18.07000  0.2450000     -0.000000      0.000000  
1 1 1 14 30 1  o 13.79000  0.1530000     13.92000  0.2174000     13.67000  0.2155000     0.2426000      0.3061000 
1 1 1 14 30 2  o 40.86000  0.3282000     40.77000  0.4632000     40.95000  0.4650000     -0.1717000     0.6563000 
1 1 1 14 30 3  o 28.03000  0.2369000     28.01000  0.3349000     28.05000  0.3350000     -0.4243000E-01 0.4737000 
1 1 1 14 30 4  o 16.71000  0.1685000     16.74000  0.2379000     16.67000  0.2387000     0.6531000E-01  0.3370000 
1 1 1 14 30 5  o 16.71000  0.1695000     16.47000  0.2377000     16.96000  0.2417000     -0.4850000     0.3390000 
1 1 1 14 30 6  o 15.23000  0.1645000     15.04000  0.2311000     15.42000  0.2342000     -0.3836000     0.3290000 
1 1 1 14 30 7  o 21.90000  0.2016000     21.60000  0.2824000     22.20000  0.2876000     -0.5998000     0.4031000 
1 1 1 14 30 8  o 4.725000  0.2757000     4.849000  0.4464000     4.602000  0.3236000     0.2478000      0.5513000 
1 1 1 14 30 9  o 9.257000  0.1774000     9.431000  0.2385000     9.083000  0.2626000     0.3485000      0.3548000 
1 1 1 14 30 10 o 9.088000  0.2388000     8.632000  0.3635000     9.543000  0.3097000     -0.9116000     0.4776000 
1 1 1 14 30 11 o 12.58000  0.1768000     12.75000  0.2484000     12.40000  0.2515000     0.3535000      0.3535000 
1 1 1 14 30 12 o 3.719000  0.3914000     3.756000  0.5776000     3.682000  0.5283000     0.7391000E-01  0.7828000 
1 1 1 14 30 13 o 7.648000  0.2121000     7.713000  0.2916000     7.584000  0.3080000     0.1291000      0.4242000 
1 1 1 14 30 14 o 4.017000  0.3524000     4.362000  0.4404000     3.672000  0.5502000     0.6899000      0.7048000 
1 1 1 14 30 15 o 2.133000  0.5573000     2.508000  0.8660000     1.758000  0.7018000     0.7506000      1.115000  
1 1 1 14 30 16 o 5.616000  0.3082000     5.820000  0.4841000     5.411000  0.3817000     0.4089000      0.6165000 
1 1 1 14 30 17 o 4.778000  0.6835000     3.666000  1.300000      5.890000  0.4241000     -2.224000      1.367000  
1 1 1 14 30 18 o 2.955000  0.4831000     2.736000  0.7083000     3.175000  0.6572000     -0.4391000     0.9662000 
1 1 1 14 30 19 o 1.526000  0.4604000     1.219000  0.5761000     1.833000  0.7182000     -0.6140000     0.9207000 
1 1 1 14 30 20 o 1.612000  0.4651000     1.207000  0.5690000     2.017000  0.7359000     -0.8101000     0.9303000 
1 1 1 14 30 21 o 1.844000  0.5481000     2.031000  0.7514000     1.656000  0.7980000     0.3748000      1.096000  
1 1 1 14 30 22 o 1.599000  0.4806000     1.652000  0.6855000     1.547000  0.6737000     0.1050000      0.9611000 
1 1 1 14 30 23 o 1.339000  0.4354000     1.257000  0.5894000     1.421000  0.6409000     -0.1638000     0.8707000 
1 1 1 14 31 0  o 6.054000  0.2372000     6.054000  0.2372000     6.054000  0.2372000     0.000000       0.000000  
1 1 1 14 31 1  o 21.51000  0.1945000     21.55000  0.2757000     21.48000  0.2744000     0.6970000E-01  0.3890000 
1 1 1 14 31 2  o 6.996000  0.1572000     7.039000  0.2233000     6.954000  0.2214000     0.8476000E-01  0.3144000 
1 1 1 14 31 3  o 23.94000  0.2108000     24.12000  0.2997000     23.77000  0.2965000     0.3453000      0.4215000 
1 1 1 14 31 4  o 13.99000  0.1585000     14.03000  0.2238000     13.95000  0.2244000     0.7184000E-01  0.3170000 
1 1 1 14 31 5  o 6.273000  0.1746000     6.148000  0.2462000     6.397000  0.2475000     -0.2490000     0.3491000 
1 1 1 14 31 6  o 16.30000  0.1710000     16.38000  0.2423000     16.23000  0.2415000     0.1522000      0.3421000 
1 1 1 14 31 7  o 9.162000  0.1629000     9.133000  0.2299000     9.191000  0.2307000     -0.5778000E-01 0.3257000 
1 1 1 14 31 8  o 14.91000  0.2142000     15.03000  0.2745000     14.79000  0.3290000     0.2384000      0.4285000 
1 1 1 14 31 9  o 11.42000  0.2152000     11.54000  0.2415000     11.30000  0.3562000     0.2445000      0.4304000 
1 1 1 14 31 10 o 3.474000  0.4069000     2.487000  0.7216000     4.461000  0.3762000     -1.974000      0.8138000 
1 1 1 14 31 11 o 1.827000  0.4709000     1.893000  0.6643000     1.760000  0.6676000     0.1335000      0.9418000 
1 1 1 14 31 12 o 10.95000  0.1850000     10.81000  0.2593000     11.09000  0.2638000     -0.2801000     0.3699000 
1 1 1 14 31 13 o 9.771000  0.1959000     10.25000  0.2709000     9.290000  0.2829000     0.9618000      0.3917000 
1 1 1 14 31 14 o 4.431000  0.3195000     4.743000  0.4153000     4.119000  0.4857000     0.6239000      0.6390000 
1 1 1 14 31 15 o 2.798000  0.6022000     2.581000  0.8525000     3.015000  0.8508000     -0.4336000     1.204000  
1 1 1 14 31 16 o 1.583000  0.4849000     1.729000  0.7193000     1.438000  0.6504000     0.2916000      0.9698000 
1 1 1 14 31 17 o 1.635000  0.5218000     1.740000  0.8159000     1.530000  0.6507000     0.2102000      1.044000  
1 1 1 14 31 18 o 2.511000  0.5227000     2.489000  0.7258000     2.534000  0.7523000     -0.4494000E-01 1.045000  
1 1 1 14 31 19 o 1.305000  0.4232000     1.478000  0.6458000     1.132000  0.5470000     0.3466000      0.8463000 
1 1 1 14 31 20 o 1.169000  0.3904000     1.406000  0.6259000     0.9332000 0.4669000     0.4724000      0.7809000 
1 1 1 14 31 21 f 1.738000  0.5279000     1.114000  0.5395000     2.363000  0.9075000     -1.249000      1.056000  
1 1 1 14 31 22 o 1.764000  0.4747000     2.246000  0.7293000     1.282000  0.6079000     0.9635000      0.9495000 
1 1 1 14 32 0  o 0.8398000 0.5432000     0.8398000 0.5432000     0.8398000 0.5432000     -0.000000      0.000000  
1 1 1 14 32 1  o 4.712000  0.1967000     4.798000  0.2741000     4.627000  0.2822000     0.1709000      0.3934000 
1 1 1 14 32 2  o 12.55000  0.1533000     12.42000  0.2151000     12.68000  0.2184000     -0.2594000     0.3066000 
1 1 1 14 32 3  o 5.458000  0.1843000     5.395000  0.2603000     5.520000  0.2610000     -0.1249000     0.3686000 
1 1 1 14 32 4  o 14.85000  0.1632000     15.11000  0.2312000     14.60000  0.2303000     0.5071000      0.3264000 
1 1 1 14 32 5  o 16.25000  0.1701000     16.24000  0.2396000     16.27000  0.2415000     -0.3445000E-01 0.3402000 
1 1 1 14 32 6  f 11.29000  0.1592000     11.53000  0.2254000     11.04000  0.2249000     0.4938000      0.3184000 
1 1 1 14 32 7  o 12.27000  0.2134000     12.06000  0.3302000     12.48000  0.2703000     -0.4227000     0.4267000 
1 1 1 14 32 8  o 11.21000  0.1799000     11.24000  0.2353000     11.17000  0.2722000     0.6862000E-01  0.3598000 
1 1 1 14 32 9  o 6.351000  0.2773000     6.585000  0.4201000     6.117000  0.3621000     0.4673000      0.5546000 
1 1 1 14 32 10 o 4.233000  0.2882000     4.201000  0.4075000     4.266000  0.4076000     -0.6490000E-01 0.5764000 
1 1 1 14 32 11 o 5.270000  0.2565000     5.480000  0.3451000     5.060000  0.3797000     0.4204000      0.5131000 
1 1 1 14 32 12 o 9.573000  0.1934000     9.587000  0.2709000     9.558000  0.2761000     0.2896000E-01  0.3868000 
1 1 1 14 32 13 o 2.114000  0.5060000     2.044000  0.7070000     2.185000  0.7241000     -0.1408000     1.012000  
1 1 1 14 32 14 o 1.857000  0.4994000     2.078000  0.7201000     1.636000  0.6920000     0.4428000      0.9988000 
1 1 1 14 32 15 o 4.155000  0.4277000     3.981000  0.5367000     4.330000  0.6661000     -0.3489000     0.8554000 
1 1 1 14 32 16 o 2.942000  0.5731000     2.312000  0.7880000     3.572000  0.8323000     -1.259000      1.146000  
1 1 1 14 32 17 o 1.824000  0.4998000     1.626000  0.7107000     2.021000  0.7028000     -0.3954000     0.9995000 
1 1 1 14 32 18 o 3.856000  0.3940000     4.371000  0.4748000     3.340000  0.6290000     1.030000       0.7880000 
1 1 1 14 32 19 o 1.226000  0.4039000     1.371000  0.6138000     1.081000  0.5253000     0.2901000      0.8079000 
1 1 1 14 32 20 o 2.242000  0.5179000     1.992000  0.7129000     2.492000  0.7515000     -0.5001000     1.036000  
1 1 1 14 32 21 o 1.472000  0.4586000     1.558000  0.6719000     1.387000  0.6244000     0.1713000      0.9172000 
1 1 1 14 32 22 o 1.639000  0.5359000     1.696000  0.8290000     1.582000  0.6792000     0.1135000      1.072000  
1 1 1 14 33 0  o 16.22000  0.2380000     16.22000  0.2380000     16.22000  0.2380000     -0.000000      0.000000  
1 1 1 14 33 1  o 10.46000  0.1512000     10.43000  0.2143000     10.49000  0.2133000     -0.6905000E-01 0.3023000 
1 1 1 14 33 2  o 16.21000  0.1688000     16.18000  0.2378000     16.25000  0.2395000     -0.7059000E-01 0.3375000 
1 1 1 14 33 3  o 14.87000  0.1640000     15.00000  0.2323000     14.75000  0.2316000     0.2456000      0.3280000 
1 1 1 14 33 4  o 2.806000  0.3343000     3.170000  0.4124000     2.441000  0.5263000     0.7293000      0.6686000 
1 1 1 14 33 5  o 3.083000  0.3078000     2.958000  0.4467000     3.209000  0.4235000     -0.2506000     0.6156000 
1 1 1 14 33 6  o 7.908000  0.2102000     8.017000  0.3449000     7.798000  0.2404000     0.2184000      0.4204000 
1 1 1 14 33 7  o 9.780000  0.2428000     9.395000  0.2326000     10.16000  0.4263000     -0.7698000     0.4856000 
1 1 1 14 33 8  o 8.314000  0.2302000     8.610000  0.3377000     8.018000  0.3128000     0.5914000      0.4603000 
1 1 1 14 33 9  o 9.152000  0.1775000     8.893000  0.2536000     9.411000  0.2483000     -0.5177000     0.3549000 
1 1 1 14 33 10 o 10.90000  0.1778000     11.12000  0.2495000     10.69000  0.2535000     0.4314000      0.3556000 
1 1 1 14 33 11 o 3.234000  0.4080000     3.660000  0.5029000     2.808000  0.6427000     0.8519000      0.8160000 
1 1 1 14 33 12 o 4.838000  0.2889000     5.083000  0.3837000     4.594000  0.4321000     0.4895000      0.5779000 
1 1 1 14 33 13 o 7.540000  0.2211000     7.823000  0.3002000     7.257000  0.3246000     0.5667000      0.4421000 
1 1 1 14 33 14 o 2.240000  0.5395000     2.932000  0.8434000     1.548000  0.6729000     1.384000       1.079000  
1 1 1 14 33 15 o 3.099000  0.4615000     2.718000  0.7229000     3.480000  0.5739000     -0.7615000     0.9230000 
1 1 1 14 33 16 f 1.680000  0.5203000     1.870000  0.8047000     1.490000  0.6597000     0.3794000      1.041000  
1 1 1 14 33 17 o 1.343000  0.4319000     1.355000  0.6122000     1.331000  0.6094000     0.2341000E-01  0.8638000 
1 1 1 14 33 18 o 1.686000  0.4985000     1.545000  0.6905000     1.826000  0.7192000     -0.2808000     0.9970000 
1 1 1 14 33 19 o 1.530000  0.4367000     1.056000  0.5113000     2.004000  0.7080000     -0.9479000     0.8733000 
1 1 1 14 33 20 o 1.922000  0.5256000     2.075000  0.7400000     1.768000  0.7466000     0.3071000      1.051000  
1 1 1 14 33 21 o 1.519000  0.4553000     1.859000  0.7146000     1.180000  0.5645000     0.6791000      0.9107000 
1 1 1 14 33 22 o 1.134000  0.4043000     1.316000  0.6539000     0.9519000 0.4757000     0.3644000      0.8086000 
1 1 1 14 34 0  o 9.596000  0.2185000     9.596000  0.2185000     9.596000  0.2185000     -0.000000      0.000000  
1 1 1 14 34 1  o 7.597000  0.1601000     7.573000  0.2254000     7.621000  0.2274000     -0.4824000E-01 0.3202000 
1 1 1 14 34 2  o 21.45000  0.1978000     21.45000  0.2793000     21.45000  0.2801000     0.5569000E-02  0.3955000 
1 1 1 14 34 3  o 15.65000  0.1685000     15.23000  0.2355000     16.08000  0.2409000     -0.8472000     0.3369000 
1 1 1 14 34 4  o 15.77000  0.1697000     15.76000  0.2396000     15.77000  0.2404000     -0.1339000E-01 0.3394000 
1 1 1 14 34 5  o 7.046000  0.2156000     7.161000  0.3496000     6.931000  0.2525000     0.2295000      0.4312000 
1 1 1 14 34 6  o 8.886000  0.2512000     8.782000  0.2408000     8.990000  0.4409000     -0.2077000     0.5023000 
1 1 1 14 34 7  f 11.75000  0.2182000     11.60000  0.2624000     11.90000  0.3487000     -0.3029000     0.4364000 
1 1 1 14 34 8  o 10.69000  0.1869000     10.77000  0.2857000     10.60000  0.2410000     0.1667000      0.3738000 
1 1 1 14 34 9  o 7.752000  0.1915000     7.716000  0.2718000     7.787000  0.2698000     -0.7054000E-01 0.3830000 
1 1 1 14 34 10 o 6.297000  0.2207000     6.356000  0.3122000     6.238000  0.3119000     0.1186000      0.4413000 
1 1 1 14 34 11 o 4.799000  0.2854000     4.857000  0.3908000     4.741000  0.4161000     0.1153000      0.5708000 
1 1 1 14 34 12 o 11.52000  0.1881000     11.53000  0.2628000     11.52000  0.2691000     0.1160000E-01  0.3761000 
1 1 1 14 34 13 o 6.050000  0.2514000     5.977000  0.3462000     6.123000  0.3646000     -0.1463000     0.5027000 
1 1 1 14 34 14 o 5.628000  0.3373000     5.376000  0.4500000     5.879000  0.5025000     -0.5023000     0.6745000 
1 1 1 14 34 15 o 8.897000  0.2306000     9.092000  0.3092000     8.701000  0.3423000     0.3918000      0.4612000 
1 1 1 14 34 16 o 7.130000  0.2396000     7.284000  0.3416000     6.975000  0.3359000     0.3086000      0.4791000 
1 1 1 14 34 17 o 1.921000  0.4703000     2.358000  0.6829000     1.485000  0.6469000     0.8732000      0.9407000 
1 1 1 14 34 18 o 1.649000  0.4819000     1.873000  0.7462000     1.426000  0.6099000     0.4465000      0.9638000 
1 1 1 14 34 19 o 1.234000  0.4078000     1.068000  0.5193000     1.400000  0.6288000     -0.3325000     0.8155000 
1 1 1 14 34 20 o 1.553000  0.5338000     1.123000  0.5455000     1.982000  0.9176000     -0.8586000     1.068000  
1 1 1 14 34 21 o 1.835000  0.5212000     1.715000  0.6898000     1.955000  0.7814000     -0.2399000     1.042000  
1 1 1 14 34 22 o 1.557000  0.4744000     1.475000  0.6470000     1.639000  0.6940000     -0.1638000     0.9488000 
1 1 1 14 35 0  o 7.603000  0.2337000     7.603000  0.2337000     7.603000  0.2337000     -0.000000      0.000000  
1 1 1 14 35 1  o 7.979000  0.1626000     7.871000  0.2311000     8.087000  0.2288000     -0.2165000     0.3252000 
1 1 1 14 35 2  o 8.231000  0.1617000     8.141000  0.2278000     8.320000  0.2296000     -0.1789000     0.3235000 
1 1 1 14 35 3  o 4.598000  0.2227000     4.688000  0.3104000     4.509000  0.3195000     0.1782000      0.4454000 
1 1 1 14 35 4  o 6.317000  0.2282000     6.347000  0.3746000     6.286000  0.2605000     0.6069000E-01  0.4563000 
1 1 1 14 35 5  o 4.317000  0.3523000     4.033000  0.3648000     4.600000  0.6027000     -0.5667000     0.7045000 
1 1 1 14 35 6  o 3.966000  0.3649000     3.969000  0.4180000     3.963000  0.5982000     0.6515000E-02  0.7298000 
1 1 1 14 35 7  o 4.183000  0.2921000     4.426000  0.4358000     3.939000  0.3892000     0.4871000      0.5843000 
1 1 1 14 35 8  o 1.432000  0.4163000     1.143000  0.5320000     1.721000  0.6405000     -0.5781000     0.8326000 
1 1 1 14 35 9  o 5.729000  0.2271000     5.446000  0.3287000     6.013000  0.3134000     -0.5668000     0.4541000 
1 1 1 14 35 10 o 1.782000  0.4769000     1.757000  0.6716000     1.806000  0.6772000     -0.4978000E-01 0.9538000 
1 1 1 14 35 11 o 2.558000  0.4734000     2.857000  0.6377000     2.260000  0.6997000     0.5963000      0.9467000 
1 1 1 14 35 12 o 3.726000  0.3943000     4.272000  0.4746000     3.179000  0.6297000     1.093000       0.7885000 
1 1 1 14 35 13 o 3.298000  0.4843000     3.193000  0.7645000     3.402000  0.5948000     -0.2093000     0.9686000 
1 1 1 14 35 14 o 1.756000  0.5069000     1.637000  0.6954000     1.875000  0.7376000     -0.2379000     1.014000  
1 1 1 14 35 15 o 4.541000  0.4301000     4.884000  0.4768000     4.198000  0.7159000     0.6861000      0.8601000 
1 1 1 14 35 16 o 1.785000  0.4920000     1.686000  0.6767000     1.884000  0.7145000     -0.1980000     0.9841000 
1 1 1 14 35 17 o 1.662000  0.4496000     1.278000  0.5855000     2.046000  0.6824000     -0.7673000     0.8992000 
1 1 1 14 35 18 o 1.913000  0.4682000     2.211000  0.6791000     1.615000  0.6449000     0.5965000      0.9365000 
1 1 1 14 35 19 o 2.189000  0.4988000     2.564000  0.6932000     1.814000  0.7173000     0.7504000      0.9976000 
1 1 1 14 35 20 o 1.383000  0.4513000     1.472000  0.6405000     1.294000  0.6359000     0.1774000      0.9026000 
1 1 1 14 35 21 o 1.836000  0.5462000     1.895000  0.7985000     1.778000  0.7455000     0.1166000      1.092000  
1 1 1 14 36 0  o 13.47000  0.2301000     13.47000  0.2301000     13.47000  0.2301000     -0.000000      0.000000  
1 1 1 14 36 1  o 16.53000  0.1896000     16.54000  0.2883000     16.53000  0.2463000     0.1019000E-01  0.3792000 
1 1 1 14 36 2  o 8.170000  0.1824000     8.358000  0.2765000     7.981000  0.2381000     0.3766000      0.3649000 
1 1 1 14 36 3  o 6.600000  0.2632000     6.360000  0.3779000     6.841000  0.3666000     -0.4810000     0.5265000 
1 1 1 14 36 4  o 8.957000  0.2752000     8.957000  0.2752000     ?         ?             ?              ?         
1 1 1 14 36 5  o 2.817000  0.4724000     3.009000  0.6730000     2.625000  0.6631000     0.3834000      0.9448000 
1 1 1 14 36 6  o 2.487000  0.4551000     2.779000  0.6648000     2.194000  0.6217000     0.5857000      0.9102000 
1 1 1 14 36 7  o 13.87000  0.1750000     13.79000  0.2500000     13.96000  0.2450000     -0.1718000     0.3500000 
1 1 1 14 36 8  o 5.972000  0.2209000     6.470000  0.2921000     5.474000  0.3315000     0.9959000      0.4418000 
1 1 1 14 36 9  o 8.678000  0.1895000     8.509000  0.2709000     8.846000  0.2650000     -0.3369000     0.3789000 
1 1 1 14 36 10 o 10.00000  0.1880000     10.27000  0.2599000     9.729000  0.2716000     0.5405000      0.3759000 
1 1 1 14 36 11 o 12.50000  0.1898000     12.32000  0.2665000     12.67000  0.2705000     -0.3489000     0.3797000 
1 1 1 14 36 12 o 9.832000  0.1993000     9.483000  0.2833000     10.18000  0.2803000     -0.6976000     0.3985000 
1 1 1 14 36 13 o 2.637000  0.5715000     2.202000  0.8419000     3.072000  0.7731000     -0.8702000     1.143000  
1 1 1 14 36 14 o 5.064000  0.3180000     4.566000  0.4709000     5.563000  0.4275000     -0.9971000     0.6360000 
1 1 1 14 36 15 o 2.617000  0.5340000     2.613000  0.8131000     2.622000  0.6926000     -0.9419000E-02 1.068000  
1 1 1 14 36 16 o 2.937000  0.4564000     3.450000  0.5627000     2.424000  0.7188000     1.026000       0.9129000 
1 1 1 14 36 17 o 3.954000  0.3373000     4.093000  0.4541000     3.815000  0.4988000     0.2779000      0.6746000 
1 1 1 14 36 18 o 3.487000  0.3669000     3.009000  0.5816000     3.965000  0.4473000     -0.9563000     0.7337000 
1 1 1 14 36 19 o 1.716000  0.4533000     1.302000  0.6258000     2.129000  0.6558000     -0.8270000     0.9065000 
1 1 1 14 36 20 o 1.290000  0.4223000     1.203000  0.5694000     1.376000  0.6238000     -0.1732000     0.8446000 
1 1 1 14 36 21 o 1.394000  0.4744000     1.418000  0.7150000     1.370000  0.6237000     0.4804000E-01  0.9488000 
1 1 1 14 37 0  o 2.220000  1.064000      2.220000  1.064000      2.220000  1.064000      0.000000       0.000000  
1 1 1 14 37 1  o 6.296000  0.3936000     6.211000  0.5577000     6.380000  0.5555000     -0.1688000     0.7872000 
1 1 1 14 37 2  o 9.616000  0.3173000     9.616000  0.3173000     ?         ?             ?              ?         
1 1 1 14 37 3  o 4.536000  0.3330000     4.535000  0.4567000     4.537000  0.4848000     -0.2118000E-02 0.6660000 
1 1 1 14 37 4  o 11.80000  0.2005000     11.69000  0.3247000     11.92000  0.2352000     -0.2316000     0.4009000 
1 1 1 14 37 5  o 9.679000  0.1720000     9.730000  0.2447000     9.628000  0.2418000     0.1014000      0.3440000 
1 1 1 14 37 6  o 1.884000  0.4595000     1.976000  0.6483000     1.792000  0.6513000     0.1841000      0.9189000 
1 1 1 14 37 7  o 5.245000  0.2373000     5.359000  0.3298000     5.132000  0.3412000     0.2276000      0.4745000 
1 1 1 14 37 8  o 1.377000  0.4243000     1.259000  0.5665000     1.496000  0.6318000     -0.2364000     0.8486000 
1 1 1 14 37 9  o 3.270000  0.3908000     3.276000  0.5604000     3.264000  0.5448000     0.1257000E-01  0.7816000 
1 1 1 14 37 10 o 5.001000  0.2735000     5.188000  0.3779000     4.814000  0.3956000     0.3736000      0.5471000 
1 1 1 14 37 11 o 7.878000  0.2184000     8.002000  0.3044000     7.753000  0.3133000     0.2489000      0.4368000 
1 1 1 14 37 12 o 2.285000  0.5147000     2.195000  0.7257000     2.375000  0.7302000     -0.1804000     1.029000  
1 1 1 14 37 13 o 4.071000  0.4461000     4.204000  0.5206000     3.938000  0.7246000     0.2658000      0.8922000 
1 1 1 14 37 14 o 3.315000  0.5506000     3.959000  0.6256000     2.671000  0.9063000     1.289000       1.101000  
1 1 1 14 37 15 o 1.377000  0.4375000     1.208000  0.5663000     1.546000  0.6671000     -0.3373000     0.8751000 
1 1 1 14 37 16 o 4.506000  0.3220000     4.618000  0.4256000     4.393000  0.4832000     0.2259000      0.6439000 
1 1 1 14 37 17 o 4.054000  0.3376000     4.082000  0.4597000     4.027000  0.4945000     0.5542000E-01  0.6752000 
1 1 1 14 37 18 o 1.341000  0.4220000     1.359000  0.5986000     1.324000  0.5948000     0.3546000E-01  0.8439000 
1 1 1 14 37 19 o 1.481000  0.4750000     1.458000  0.6760000     1.504000  0.6674000     -0.4635000E-01 0.9499000 
1 1 1 14 37 20 o 1.050000  0.3630000     1.000000  0.4925000     1.100000  0.5336000     -0.1001000     0.7261000 
1 1 1 14 37 21 o 1.070000  0.3727000     0.9742000 0.4923000     1.166000  0.5596000     -0.1923000     0.7453000 
1 1 1 14 38 0  o 14.67000  0.2790000     14.67000  0.2790000     14.67000  0.2790000     -0.000000      0.000000  
1 1 1 14 38 1  o 10.12000  0.1921000     10.31000  0.2728000     9.928000  0.2706000     0.3825000      0.3843000 
1 1 1 14 38 2  o 14.01000  0.1840000     14.05000  0.2789000     13.97000  0.2400000     0.7594000E-01  0.3680000 
1 1 1 14 38 3  o 11.23000  0.1677000     11.17000  0.2374000     11.28000  0.2370000     -0.1155000     0.3354000 
1 1 1 14 38 4  o 26.61000  0.2361000     26.28000  0.3309000     26.93000  0.3370000     -0.6584000     0.4723000 
1 1 1 14 38 5  o 13.46000  0.1721000     13.65000  0.2431000     13.27000  0.2437000     0.3845000      0.3442000 
1 1 1 14 38 6  o 9.845000  0.1771000     9.901000  0.2488000     9.789000  0.2520000     0.1118000      0.3541000 
1 1 1 14 38 7  o 6.940000  0.2063000     6.385000  0.3046000     7.495000  0.2784000     -1.109000      0.4126000 
1 1 1 14 38 8  o 2.829000  0.4170000     3.031000  0.5566000     2.628000  0.6211000     0.4033000      0.8340000 
1 1 1 14 38 9  o 7.183000  0.2101000     7.041000  0.2962000     7.325000  0.2979000     -0.2846000     0.4201000 
1 1 1 14 38 10 o 8.722000  0.2002000     8.714000  0.2846000     8.729000  0.2815000     -0.1449000E-01 0.4004000 
1 1 1 14 38 11 o 10.94000  0.1939000     10.93000  0.2745000     10.95000  0.2739000     -0.1995000E-01 0.3878000 
1 1 1 14 38 12 o 3.496000  0.5140000     3.612000  0.7416000     3.380000  0.7119000     0.2325000      1.028000  
1 1 1 14 38 13 o 4.001000  0.3899000     3.760000  0.5585000     4.241000  0.5443000     -0.4811000     0.7798000 
1 1 1 14 38 14 o 2.273000  0.5582000     2.140000  0.8443000     2.406000  0.7305000     -0.2659000     1.116000  
1 1 1 14 38 15 o 1.416000  0.4485000     1.472000  0.6494000     1.359000  0.6187000     0.1135000      0.8969000 
1 1 1 14 38 16 o 2.192000  0.4961000     2.380000  0.7030000     2.004000  0.7003000     0.3760000      0.9923000 
1 1 1 14 38 17 o 1.170000  0.3882000     1.225000  0.5638000     1.116000  0.5336000     0.1092000      0.7763000 
1 1 1 14 38 18 o 2.232000  0.4684000     1.854000  0.6823000     2.610000  0.6419000     -0.7565000     0.9367000 
1 1 1 14 38 19 o 1.331000  0.4284000     1.414000  0.6156000     1.248000  0.5959000     0.1659000      0.8568000 
1 1 1 14 38 20 o 1.659000  0.5201000     1.582000  0.7114000     1.735000  0.7589000     -0.1533000     1.040000  
1 1 1 14 38 21 o 1.620000  0.5218000     1.876000  0.7905000     1.363000  0.6812000     0.5131000      1.044000  
1 1 1 14 39 0  o 7.200000  0.2618000     7.200000  0.2618000     7.200000  0.2618000     -0.000000      0.000000  
1 1 1 14 39 1  o 6.216000  0.2002000     6.416000  0.2779000     6.015000  0.2883000     0.4008000      0.4004000 
1 1 1 14 39 2  o 12.74000  0.1701000     12.97000  0.2383000     12.51000  0.2429000     0.4598000      0.3402000 
1 1 1 14 39 3  o 3.980000  0.2844000     4.027000  0.3842000     3.933000  0.4193000     0.9474000E-01  0.5687000 
1 1 1 14 39 4  o 10.86000  0.1713000     10.65000  0.2417000     11.07000  0.2429000     -0.4224000     0.3427000 
1 1 1 14 39 5  o 5.192000  0.2388000     5.467000  0.3225000     4.918000  0.3522000     0.5490000      0.4775000 
1 1 1 14 39 6  o 6.981000  0.2037000     6.754000  0.2916000     7.208000  0.2846000     -0.4538000     0.4074000 
1 1 1 14 39 7  o 11.74000  0.1785000     11.56000  0.2540000     11.92000  0.2508000     -0.3650000     0.3570000 
1 1 1 14 39 8  o 9.135000  0.1898000     9.057000  0.2714000     9.213000  0.2654000     -0.1568000     0.3796000 
1 1 1 14 39 9  o 3.500000  0.3739000     3.696000  0.5020000     3.304000  0.5541000     0.3921000      0.7477000 
1 1 1 14 39 10 o 3.010000  0.4425000     3.122000  0.5889000     2.898000  0.6605000     0.2243000      0.8849000 
1 1 1 14 39 11 o 6.084000  0.3325000     5.389000  0.5722000     6.778000  0.3388000     -1.389000      0.6650000 
1 1 1 14 39 12 o 3.659000  0.4910000     3.564000  0.5874000     3.754000  0.7870000     -0.1900000     0.9820000 
1 1 1 14 39 13 o 4.408000  0.4994000     5.299000  0.4565000     3.516000  0.8884000     1.783000       0.9988000 
1 1 1 14 39 14 o 1.214000  0.4050000     1.277000  0.5914000     1.151000  0.5534000     0.1258000      0.8099000 
1 1 1 14 39 15 o 2.839000  0.4620000     3.272000  0.5985000     2.406000  0.7041000     0.8660000      0.9240000 
1 1 1 14 39 16 o 3.070000  0.4371000     3.117000  0.6020000     3.024000  0.6338000     0.9325000E-01  0.8742000 
1 1 1 14 39 17 o 1.770000  0.4736000     1.986000  0.6904000     1.553000  0.6484000     0.4322000      0.9472000 
1 1 1 14 39 18 o 1.306000  0.4326000     1.486000  0.6866000     1.127000  0.5266000     0.3584000      0.8653000 
1 1 1 14 39 19 o 2.698000  0.4487000     2.310000  0.6825000     3.087000  0.5827000     -0.7776000     0.8974000 
1 1 1 14 39 20 o 2.016000  0.5057000     1.413000  0.7058000     2.620000  0.7243000     -1.207000      1.011000  
1 1 1 14 40 0  o 6.117000  0.2919000     6.117000  0.2919000     6.117000  0.2919000     0.000000       0.000000  
1 1 1 14 40 1  o 3.822000  0.2972000     4.040000  0.4048000     3.603000  0.4352000     0.4375000      0.5943000 
1 1 1 14 40 2  o 12.18000  0.1716000     12.13000  0.2415000     12.23000  0.2439000     -0.1026000     0.3432000 
1 1 1 14 40 3  o 4.475000  0.2605000     4.552000  0.3610000     4.398000  0.3756000     0.1537000      0.5210000 
1 1 1 14 40 4  o 5.011000  0.2400000     5.038000  0.3371000     4.983000  0.3418000     0.5561000E-01  0.4801000 
1 1 1 14 40 5  f 17.32000  0.1888000     17.47000  0.2672000     17.18000  0.2669000     0.2906000      0.3777000 
1 1 1 14 40 6  o 6.525000  0.2135000     6.335000  0.3029000     6.714000  0.3011000     -0.3781000     0.4271000 
1 1 1 14 40 7  o 8.044000  0.1948000     7.992000  0.2792000     8.096000  0.2716000     -0.1042000     0.3895000 
1 1 1 14 40 8  o 5.217000  0.2603000     5.153000  0.3723000     5.282000  0.3638000     -0.1292000     0.5206000 
1 1 1 14 40 9  o 7.569000  0.2109000     7.450000  0.2963000     7.688000  0.3003000     -0.2384000     0.4219000 
1 1 1 14 40 10 o 4.928000  0.2913000     5.247000  0.3878000     4.609000  0.4348000     0.6386000      0.5826000 
1 1 1 14 40 11 o 3.377000  0.5304000     4.027000  0.6994000     2.726000  0.7975000     1.301000       1.061000  
1 1 1 14 40 12 o 3.135000  0.4816000     3.677000  0.5795000     2.594000  0.7694000     1.082000       0.9632000 
1 1 1 14 40 13 o 4.278000  0.3927000     3.987000  0.6490000     4.569000  0.4423000     -0.5824000     0.7854000 
1 1 1 14 40 14 o 1.668000  0.4707000     1.995000  0.7149000     1.341000  0.6126000     0.6549000      0.9414000 
1 1 1 14 40 15 o 3.954000  0.3644000     4.335000  0.4695000     3.573000  0.5574000     0.7624000      0.7288000 
1 1 1 14 40 16 o 1.473000  0.4434000     1.704000  0.6712000     1.242000  0.5797000     0.4625000      0.8869000 
1 1 1 14 40 17 o 1.433000  0.4374000     1.479000  0.6269000     1.387000  0.6103000     0.9230000E-01  0.8749000 
1 1 1 14 40 18 o 1.424000  0.4680000     1.690000  0.7454000     1.159000  0.5662000     0.5308000      0.9360000 
1 1 1 14 40 19 o 1.398000  0.4354000     1.458000  0.6248000     1.338000  0.6066000     0.1195000      0.8709000 
1 1 1 14 40 20 o 1.743000  0.5300000     2.136000  0.8839000     1.350000  0.5852000     0.7862000      1.060000  
1 1 1 14 41 0  o 22.83000  0.3037000     22.83000  0.3037000     22.83000  0.3037000     -0.000000      0.000000  
1 1 1 14 41 1  o 14.10000  0.1760000     13.97000  0.2482000     14.22000  0.2497000     -0.2526000     0.3521000 
1 1 1 14 41 2  o 8.852000  0.1817000     8.787000  0.2543000     8.916000  0.2597000     -0.1281000     0.3635000 
1 1 1 14 41 3  o 7.752000  0.1938000     7.764000  0.2723000     7.740000  0.2757000     0.2337000E-01  0.3875000 
1 1 1 14 41 4  o 2.967000  0.3969000     3.367000  0.4883000     2.568000  0.6258000     0.7993000      0.7938000 
1 1 1 14 41 5  o 2.601000  0.4357000     2.279000  0.6559000     2.923000  0.5736000     -0.6445000     0.8713000 
1 1 1 14 41 6  o 5.772000  0.2350000     5.775000  0.3269000     5.769000  0.3376000     0.6166000E-02  0.4699000 
1 1 1 14 41 7  o 11.37000  0.1845000     11.10000  0.2634000     11.63000  0.2585000     -0.5264000     0.3691000 
1 1 1 14 41 8  o 2.610000  0.4604000     2.324000  0.6841000     2.897000  0.6163000     -0.5731000     0.9208000 
1 1 1 14 41 9  o 4.633000  0.3207000     4.364000  0.4340000     4.902000  0.4723000     -0.5383000     0.6414000 
1 1 1 14 41 10 o 7.885000  0.2658000     7.697000  0.4340000     8.073000  0.3070000     -0.3761000     0.5316000 
1 1 1 14 41 11 o 3.053000  0.4661000     2.433000  0.7183000     3.674000  0.5942000     -1.242000      0.9322000 
1 1 1 14 41 12 o 2.090000  0.5775000     1.949000  0.8256000     2.232000  0.8076000     -0.2828000     1.155000  
1 1 1 14 41 13 o 2.978000  0.4646000     2.950000  0.6584000     3.007000  0.6556000     -0.5688000E-01 0.9292000 
1 1 1 14 41 14 o 1.139000  0.3851000     1.223000  0.5720000     1.056000  0.5158000     0.1663000      0.7702000 
1 1 1 14 41 15 o 2.513000  0.4911000     2.078000  0.7278000     2.948000  0.6596000     -0.8700000     0.9822000 
1 1 1 14 41 16 o 1.327000  0.4228000     1.374000  0.6071000     1.280000  0.5886000     0.9405000E-01  0.8456000 
1 1 1 14 41 17 o 1.958000  0.4889000     1.869000  0.6725000     2.047000  0.7098000     -0.1779000     0.9778000 
1 1 1 14 41 18 o 1.207000  0.4053000     1.143000  0.5375000     1.270000  0.6068000     -0.1264000     0.8106000 
1 1 1 14 41 19 o 1.400000  0.4601000     0.9293000 0.4639000     1.870000  0.7948000     -0.9405000     0.9202000 
1 1 1 14 41 20 o 1.310000  0.4643000     1.103000  0.5605000     1.516000  0.7405000     -0.4129000     0.9286000 
1 1 1 14 42 0  f 9.949000  0.2557000     9.949000  0.2557000     9.949000  0.2557000     -0.000000      0.000000  
1 1 1 14 42 1  o 13.58000  0.1773000     13.73000  0.2500000     13.44000  0.2515000     0.2828000      0.3546000 
1 1 1 14 42 2  o 4.777000  0.2635000     4.446000  0.3890000     5.109000  0.3555000     -0.6636000     0.5270000 
1 1 1 14 42 3  o 9.381000  0.1817000     9.404000  0.2571000     9.357000  0.2569000     0.4746000E-01  0.3634000 
1 1 1 14 42 4  f 5.808000  0.2289000     5.652000  0.3281000     5.965000  0.3194000     -0.3133000     0.4579000 
1 1 1 14 42 5  o 14.07000  0.1817000     13.93000  0.2575000     14.21000  0.2563000     -0.2774000     0.3633000 
1 1 1 14 42 6  o 8.954000  0.1930000     9.203000  0.2678000     8.705000  0.2780000     0.4976000      0.3861000 
1 1 1 14 42 7  o 8.319000  0.2056000     8.626000  0.2852000     8.012000  0.2962000     0.6142000      0.4111000 
1 1 1 14 42 8  o 4.261000  0.3228000     4.330000  0.4473000     4.192000  0.4656000     0.1378000      0.6457000 
1 1 1 14 42 9  o 2.260000  0.5244000     2.080000  0.7723000     2.439000  0.7095000     -0.3589000     1.049000  
1 1 1 14 42 10 f 5.874000  0.3208000     6.014000  0.4069000     5.733000  0.4961000     0.2811000      0.6416000 
1 1 1 14 42 11 f 5.978000  0.3405000     5.807000  0.4307000     6.149000  0.5275000     -0.3423000     0.6810000 
1 1 1 14 42 12 o 2.117000  0.5432000     2.150000  0.8005000     2.084000  0.7344000     0.6595000E-01  1.086000  
1 1 1 14 42 13 o 2.531000  0.4852000     2.964000  0.6307000     2.098000  0.7376000     0.8658000      0.9705000 
1 1 1 14 42 14 o 2.568000  0.4815000     2.112000  0.7189000     3.023000  0.6407000     -0.9116000     0.9630000 
1 1 1 14 42 15 o 3.997000  0.3538000     3.878000  0.5154000     4.117000  0.4849000     -0.2386000     0.7076000 
1 1 1 14 42 16 o 1.905000  0.4947000     1.777000  0.6761000     2.034000  0.7222000     -0.2567000     0.9893000 
1 1 1 14 42 17 o 2.245000  0.5370000     2.954000  0.8507000     1.535000  0.6555000     1.419000       1.074000  
1 1 1 14 42 18 o 1.290000  0.4116000     1.208000  0.5576000     1.371000  0.6057000     -0.1627000     0.8233000 
1 1 1 14 42 19 f 1.250000  0.4137000     1.231000  0.5928000     1.269000  0.5772000     -0.3717000E-01 0.8274000 
1 1 1 14 43 0  o 5.131000  0.3512000     5.131000  0.3512000     5.131000  0.3512000     -0.000000      0.000000  
1 1 1 14 43 1  o 4.528000  0.2778000     4.684000  0.3834000     4.372000  0.4020000     0.3124000      0.5555000 
1 1 1 14 43 2  o 7.604000  0.1973000     7.396000  0.2813000     7.812000  0.2766000     -0.4160000     0.3945000 
1 1 1 14 43 3  o 9.926000  0.1817000     10.07000  0.2543000     9.786000  0.2595000     0.2797000      0.3633000 
1 1 1 14 43 4  o 3.637000  0.3461000     3.412000  0.5194000     3.863000  0.4575000     -0.4513000     0.6922000 
1 1 1 14 43 5  o 4.335000  0.2977000     4.413000  0.4154000     4.257000  0.4267000     0.1562000      0.5955000 
1 1 1 14 43 6  o 9.840000  0.1910000     9.765000  0.2716000     9.915000  0.2686000     -0.1502000     0.3820000 
1 1 1 14 43 7  o 6.159000  0.2412000     6.136000  0.3438000     6.182000  0.3384000     -0.4595000E-01 0.4824000 
1 1 1 14 43 8  o 5.713000  0.2633000     5.943000  0.3613000     5.483000  0.3830000     0.4603000      0.5266000 
1 1 1 14 43 9  o 6.112000  0.3340000     6.028000  0.5189000     6.196000  0.4206000     -0.1672000     0.6679000 
1 1 1 14 43 10 o 5.424000  0.3647000     5.605000  0.3877000     5.243000  0.6179000     0.3619000      0.7294000 
1 1 1 14 43 11 o 6.333000  0.3298000     5.938000  0.5632000     6.728000  0.3434000     -0.7900000     0.6597000 
1 1 1 14 43 12 o 1.441000  0.4404000     1.740000  0.6899000     1.142000  0.5476000     0.5971000      0.8809000 
1 1 1 14 43 13 o 2.029000  0.5056000     2.273000  0.7333000     1.785000  0.6963000     0.4886000      1.011000  
1 1 1 14 43 14 o 2.141000  0.5075000     2.147000  0.7156000     2.135000  0.7197000     0.1197000E-01  1.015000  
1 1 1 14 43 15 o 4.509000  0.3137000     4.619000  0.4338000     4.399000  0.4532000     0.2208000      0.6274000 
1 1 1 14 43 16 o 2.897000  0.4703000     3.271000  0.6146000     2.524000  0.7121000     0.7475000      0.9406000 
1 1 1 14 43 17 o 1.473000  0.4588000     1.383000  0.6107000     1.563000  0.6849000     -0.1801000     0.9177000 
1 1 1 14 43 18 o 1.504000  0.4793000     1.337000  0.5974000     1.670000  0.7498000     -0.3328000     0.9587000 
1 1 1 14 43 19 o 1.181000  0.3915000     1.147000  0.5441000     1.215000  0.5631000     -0.6813000E-01 0.7830000 
1 1 1 14 44 0  o 3.870000  0.4623000     3.870000  0.4623000     3.870000  0.4623000     -0.000000      0.000000  
1 1 1 14 44 1  o 5.694000  0.2395000     5.677000  0.3388000     5.711000  0.3387000     -0.3435000E-01 0.4790000 
1 1 1 14 44 2  f 5.669000  0.2353000     5.791000  0.3257000     5.548000  0.3395000     0.2434000      0.4705000 
1 1 1 14 44 3  o 8.247000  0.1973000     8.429000  0.2743000     8.065000  0.2835000     0.3645000      0.3945000 
1 1 1 14 44 4  o 8.099000  0.2013000     8.174000  0.2810000     8.023000  0.2882000     0.1506000      0.4025000 
1 1 1 14 44 5  o 1.827000  0.4737000     1.470000  0.6346000     2.184000  0.7034000     -0.7137000     0.9474000 
1 1 1 14 44 6  o 3.518000  0.3912000     3.857000  0.5013000     3.179000  0.6006000     0.6783000      0.7823000 
1 1 1 14 44 7  o 5.937000  0.2559000     5.793000  0.3633000     6.081000  0.3605000     -0.2883000     0.5118000 
1 1 1 14 44 8  o 2.572000  0.5730000     2.344000  0.8696000     2.799000  0.7465000     -0.4548000     1.146000  
1 1 1 14 44 9  o 7.584000  0.2637000     7.661000  0.3190000     7.507000  0.4201000     0.1540000      0.5275000 
1 1 1 14 44 10 o 4.996000  0.3990000     5.442000  0.5733000     4.550000  0.5551000     0.8923000      0.7980000 
1 1 1 14 44 11 f 8.547000  0.2165000     8.933000  0.2939000     8.161000  0.3179000     0.7719000      0.4329000 
1 1 1 14 44 12 o 3.237000  0.4263000     3.467000  0.5535000     3.006000  0.6486000     0.4608000      0.8526000 
1 1 1 14 44 13 o 1.279000  0.4199000     1.305000  0.6024000     1.253000  0.5851000     0.5248000E-01  0.8397000 
1 1 1 14 44 14 o 5.588000  0.2675000     5.729000  0.3743000     5.447000  0.3822000     0.2824000      0.5349000 
1 1 1 14 44 15 f 1.333000  0.4224000     1.540000  0.6525000     1.127000  0.5365000     0.4135000      0.8447000 
1 1 1 14 44 16 o 2.139000  0.5503000     2.377000  0.8515000     1.902000  0.6972000     0.4748000      1.101000  
1 1 1 14 44 17 o 1.800000  0.4666000     2.159000  0.6953000     1.441000  0.6224000     0.7183000      0.9332000 
1 1 1 14 44 18 o 1.698000  0.5162000     1.462000  0.6744000     1.934000  0.7817000     -0.4720000     1.032000  
1 1 1 14 45 0  o 7.686000  0.2910000     7.686000  0.2910000     7.686000  0.2910000     0.000000       0.000000  
1 1 1 14 45 1  o 6.576000  0.2227000     6.573000  0.3145000     6.579000  0.3155000     -0.6050000E-02 0.4455000 
1 1 1 14 45 2  o 2.260000  0.4422000     1.562000  0.6462000     2.958000  0.6039000     -1.396000      0.8844000 
1 1 1 14 45 3  o 5.306000  0.2618000     5.340000  0.3586000     5.272000  0.3815000     0.6717000E-01  0.5236000 
1 1 1 14 45 4  o 6.646000  0.2258000     6.699000  0.3163000     6.594000  0.3224000     0.1050000      0.4516000 
1 1 1 14 45 5  o 5.073000  0.2769000     5.261000  0.3789000     4.884000  0.4038000     0.3777000      0.5538000 
1 1 1 14 45 6  o 5.729000  0.2595000     5.922000  0.3547000     5.535000  0.3788000     0.3866000      0.5190000 
1 1 1 14 45 7  o 2.896000  0.5627000     3.138000  0.8176000     2.654000  0.7735000     0.4847000      1.125000  
1 1 1 14 45 8  o 3.235000  0.5627000     3.563000  0.5586000     2.907000  0.9769000     0.6555000      1.125000  
1 1 1 14 45 9  o 5.543000  0.3737000     5.652000  0.5626000     5.434000  0.4918000     0.2175000      0.7473000 
1 1 1 14 45 10 o 7.877000  0.2243000     7.597000  0.3185000     8.158000  0.3160000     -0.5614000     0.4487000 
1 1 1 14 45 11 o 2.068000  0.4741000     1.467000  0.6373000     2.668000  0.7020000     -1.201000      0.9481000 
1 1 1 14 45 12 o 7.095000  0.2495000     6.949000  0.3400000     7.240000  0.3652000     -0.2914000     0.4990000 
1 1 1 14 45 13 o 1.298000  0.4199000     1.433000  0.6327000     1.164000  0.5522000     0.2687000      0.8398000 
1 1 1 14 45 14 o 2.326000  0.4890000     2.507000  0.6897000     2.146000  0.6935000     0.3605000      0.9780000 
1 1 1 14 45 15 o 1.309000  0.4163000     1.510000  0.6427000     1.108000  0.5293000     0.4024000      0.8326000 
1 1 1 14 45 16 o 2.396000  0.5445000     2.421000  0.7285000     2.372000  0.8094000     0.4951000E-01  1.089000  
1 1 1 14 45 17 o 1.733000  0.4893000     1.887000  0.7075000     1.579000  0.6761000     0.3079000      0.9786000 
1 1 1 14 45 18 o 1.556000  0.4426000     1.109000  0.5432000     2.003000  0.6989000     -0.8941000     0.8852000 
1 1 1 14 46 0  o 7.582000  0.2979000     7.582000  0.2979000     7.582000  0.2979000     -0.000000      0.000000  
1 1 1 14 46 1  o 5.955000  0.2431000     6.133000  0.3341000     5.776000  0.3533000     0.3569000      0.4862000 
1 1 1 14 46 2  o 2.795000  0.4397000     2.270000  0.6840000     3.320000  0.5529000     -1.050000      0.8795000 
1 1 1 14 46 3  o 3.349000  0.3908000     3.127000  0.5892000     3.570000  0.5136000     -0.4431000     0.7816000 
1 1 1 14 46 4  o 7.479000  0.2153000     7.301000  0.3037000     7.657000  0.3053000     -0.3556000     0.4306000 
1 1 1 14 46 5  o 6.246000  0.2428000     6.343000  0.3417000     6.148000  0.3451000     0.1952000      0.4856000 
1 1 1 14 46 6  o 2.470000  0.5007000     1.614000  0.7274000     3.326000  0.6884000     -1.713000      1.001000  
1 1 1 14 46 7  o 1.784000  0.5549000     1.392000  0.6202000     2.176000  0.9204000     -0.7838000     1.110000  
1 1 1 14 46 8  o 4.772000  0.4440000     3.902000  0.7685000     5.642000  0.4450000     -1.740000      0.8880000 
1 1 1 14 46 9  f 3.292000  0.4382000     3.445000  0.5940000     3.140000  0.6445000     0.3058000      0.8765000 
1 1 1 14 46 10 f 1.996000  0.5082000     2.047000  0.7154000     1.945000  0.7220000     0.1016000      1.016000  
1 1 1 14 46 11 o 3.180000  0.4452000     2.749000  0.6853000     3.611000  0.5684000     -0.8618000     0.8904000 
1 1 1 14 46 12 o 5.653000  0.2707000     5.549000  0.3825000     5.757000  0.3830000     -0.2083000     0.5413000 
1 1 1 14 46 13 o 1.989000  0.5052000     2.023000  0.7125000     1.956000  0.7164000     0.6639000E-01  1.010000  
1 1 1 14 46 14 o 1.816000  0.4654000     1.389000  0.6094000     2.242000  0.7034000     -0.8536000     0.9307000 
1 1 1 14 46 15 o 2.214000  0.4954000     1.751000  0.7382000     2.677000  0.6608000     -0.9256000     0.9907000 
1 1 1 14 46 16 o 1.640000  0.4692000     1.924000  0.7044000     1.357000  0.6200000     0.5665000      0.9384000 
1 1 1 14 46 17 o 1.611000  0.5057000     1.539000  0.6914000     1.683000  0.7382000     -0.1441000     1.011000  
1 1 1 14 46 18 o 1.715000  0.5710000     1.675000  0.7968000     1.755000  0.8181000     -0.8043000E-01 1.142000  
1 1 1 14 47 0  o 8.170000  0.2914000     8.170000  0.2914000     8.170000  0.2914000     -0.000000      0.000000  
1 1 1 14 47 1  o 6.493000  0.2372000     6.931000  0.3195000     6.055000  0.3508000     0.8757000      0.4745000 
1 1 1 14 47 2  o 2.321000  0.4814000     2.668000  0.6604000     1.974000  0.7006000     0.6941000      0.9628000 
1 1 1 14 47 3  o 9.004000  0.2010000     8.931000  0.2827000     9.078000  0.2857000     -0.1473000     0.4020000 
1 1 1 14 47 4  o 4.812000  0.3182000     4.762000  0.4884000     4.861000  0.4080000     -0.9827000E-01 0.6363000 
1 1 1 14 47 5  o 3.615000  0.5352000     4.049000  0.7004000     3.182000  0.8094000     0.8666000      1.070000  
1 1 1 14 47 6  o 5.855000  0.4879000     6.377000  0.3921000     5.333000  0.8936000     1.044000       0.9758000 
1 1 1 14 47 7  o 1.507000  0.4873000     1.758000  0.7669000     1.255000  0.6013000     0.5037000      0.9746000 
1 1 1 14 47 8  o 2.195000  0.5054000     2.386000  0.7167000     2.003000  0.7128000     0.3826000      1.011000  
1 1 1 14 47 9  o 3.131000  0.4516000     2.807000  0.6772000     3.456000  0.5975000     -0.6491000     0.9031000 
1 1 1 14 47 10 o 4.261000  0.3315000     4.373000  0.4546000     4.149000  0.4825000     0.2240000      0.6629000 
1 1 1 14 47 11 o 6.815000  0.2403000     6.987000  0.3313000     6.644000  0.3482000     0.3431000      0.4806000 
1 1 1 14 47 12 o 4.077000  0.3473000     4.392000  0.4510000     3.761000  0.5282000     0.6316000      0.6945000 
1 1 1 14 47 13 o 1.596000  0.4532000     1.816000  0.6725000     1.375000  0.6077000     0.4417000      0.9064000 
1 1 1 14 47 14 o 1.178000  0.3930000     1.215000  0.5688000     1.140000  0.5425000     0.7537000E-01  0.7860000 
1 1 1 14 47 15 o 1.527000  0.4801000     1.310000  0.6083000     1.743000  0.7428000     -0.4332000     0.9601000 
1 1 1 14 47 16 o 1.010000  0.3509000     1.080000  0.5206000     0.9413000 0.4707000     0.1384000      0.7018000 
1 1 1 14 47 17 o 1.122000  0.3838000     1.341000  0.6207000     0.9034000 0.4517000     0.4372000      0.7676000 
1 1 1 14 48 0  o 1.048000  0.7015000     1.048000  0.7015000     1.048000  0.7015000     0.000000       0.000000  
1 1 1 14 48 1  o 7.848000  0.2341000     7.915000  0.3507000     7.781000  0.3101000     0.1340000      0.4682000 
1 1 1 14 48 2  o 2.488000  0.5727000     2.655000  0.8424000     2.322000  0.7761000     0.3332000      1.145000  
1 1 1 14 48 3  o 2.221000  0.5878000     2.021000  0.8162000     2.421000  0.8461000     -0.3995000     1.176000  
1 1 1 14 48 4  o 9.374000  0.3783000     9.374000  0.3783000     ?         ?             ?              ?         
1 1 1 14 48 5  o 7.279000  0.3011000     7.274000  0.3812000     7.283000  0.4662000     -0.8937000E-02 0.6022000 
1 1 1 14 48 6  o 1.531000  0.4762000     1.716000  0.7280000     1.346000  0.6142000     0.3698000      0.9525000 
1 1 1 14 48 7  o 4.117000  0.3582000     3.798000  0.5327000     4.436000  0.4790000     -0.6376000     0.7164000 
1 1 1 14 48 8  o 2.531000  0.5087000     2.623000  0.7192000     2.439000  0.7197000     0.1833000      1.017000  
1 1 1 14 48 9  o 1.825000  0.5006000     1.879000  0.7127000     1.771000  0.7032000     0.1082000      1.001000  
1 1 1 14 48 10 o 5.890000  0.2582000     6.160000  0.3538000     5.621000  0.3760000     0.5391000      0.5163000 
1 1 1 14 48 11 o 3.476000  0.4029000     3.560000  0.5588000     3.391000  0.5805000     0.1694000      0.8057000 
1 1 1 14 48 12 o 1.586000  0.4635000     1.666000  0.6656000     1.505000  0.6453000     0.1612000      0.9270000 
1 1 1 14 48 13 o 1.188000  0.3911000     1.391000  0.6142000     0.9853000 0.4842000     0.4057000      0.7821000 
1 1 1 14 48 14 o 2.473000  0.5390000     2.125000  0.8461000     2.820000  0.6679000     -0.6953000     1.078000  
1 1 1 14 48 15 o 1.400000  0.4360000     1.094000  0.5243000     1.706000  0.6968000     -0.6123000     0.8721000 
1 1 1 14 48 16 o 1.376000  0.4553000     1.268000  0.6085000     1.484000  0.6774000     -0.2156000     0.9106000 
1 1 1 14 48 17 o 1.181000  0.3989000     1.182000  0.5635000     1.181000  0.5648000     0.1109000E-02  0.7979000 
1 1 1 14 49 0  o 6.022000  0.5248000     6.022000  0.5248000     6.022000  0.5248000     0.000000       0.000000  
1 1 1 14 49 1  o 2.097000  0.6244000     1.407000  0.6612000     2.787000  1.059000      -1.380000      1.249000  
1 1 1 14 49 2  o 4.867000  0.5138000     4.577000  0.6492000     5.157000  0.7966000     -0.5801000     1.028000  
1 1 1 14 49 3  o 7.332000  0.3250000     8.155000  0.4256000     6.509000  0.4914000     1.646000       0.6501000 
1 1 1 14 49 4  o 5.288000  0.3132000     5.255000  0.4814000     5.322000  0.4008000     -0.6779000E-01 0.6264000 
1 1 1 14 49 5  o 4.936000  0.3168000     5.003000  0.4771000     4.870000  0.4169000     0.1330000      0.6336000 
1 1 1 14 49 6  o 3.996000  0.3503000     3.933000  0.4891000     4.059000  0.5018000     -0.1256000     0.7007000 
1 1 1 14 49 7  o 1.917000  0.5074000     1.856000  0.7096000     1.979000  0.7255000     -0.1223000     1.015000  
1 1 1 14 49 8  o 4.114000  0.3610000     4.428000  0.4661000     3.800000  0.5513000     0.6284000      0.7219000 
1 1 1 14 49 9  o 2.312000  0.4988000     2.734000  0.6966000     1.889000  0.7142000     0.8457000      0.9976000 
1 1 1 14 49 10 o 2.312000  0.4914000     2.007000  0.7108000     2.617000  0.6788000     -0.6094000     0.9828000 
1 1 1 14 49 11 o 2.320000  0.5032000     2.085000  0.7163000     2.555000  0.7070000     -0.4693000     1.006000  
1 1 1 14 49 12 o 2.794000  0.4632000     2.579000  0.6718000     3.009000  0.6380000     -0.4297000     0.9265000 
1 1 1 14 49 13 o 2.516000  0.4606000     1.868000  0.7028000     3.164000  0.5955000     -1.297000      0.9212000 
1 1 1 14 49 14 o 1.386000  0.4537000     1.356000  0.6219000     1.416000  0.6607000     -0.6044000E-01 0.9074000 
1 1 1 14 49 15 o 1.655000  0.5046000     1.200000  0.5622000     2.110000  0.8380000     -0.9095000     1.009000  
1 1 1 14 49 16 o 1.318000  0.4285000     1.512000  0.6673000     1.125000  0.5378000     0.3870000      0.8571000 
1 1 1 14 50 0  o 3.820000  0.6074000     3.820000  0.6074000     3.820000  0.6074000     -0.000000      0.000000  
1 1 1 14 50 1  o 6.487000  0.2609000     6.821000  0.3787000     6.152000  0.3589000     0.6691000      0.5217000 
1 1 1 14 50 2  o 7.008000  0.2340000     6.799000  0.3364000     7.217000  0.3252000     -0.4184000     0.4679000 
1 1 1 14 50 3  o 2.775000  0.4760000     2.928000  0.6523000     2.623000  0.6936000     0.3056000      0.9521000 
1 1 1 14 50 4  o 3.570000  0.3971000     3.224000  0.6100000     3.917000  0.5087000     -0.6934000     0.7943000 
1 1 1 14 50 5  o 4.921000  0.2947000     4.960000  0.4173000     4.883000  0.4161000     0.7709000E-01  0.5894000 
1 1 1 14 50 6  o 1.804000  0.4937000     1.946000  0.7153000     1.663000  0.6805000     0.2823000      0.9873000 
1 1 1 14 50 7  o 1.800000  0.4954000     1.669000  0.6834000     1.931000  0.7174000     -0.2619000     0.9908000 
1 1 1 14 50 8  f 3.979000  0.3607000     4.036000  0.5058000     3.921000  0.5144000     0.1151000      0.7214000 
1 1 1 14 50 9  o 3.851000  0.3663000     3.920000  0.5125000     3.782000  0.5236000     0.1385000      0.7327000 
1 1 1 14 50 10 o 1.693000  0.4807000     1.540000  0.6559000     1.846000  0.7029000     -0.3057000     0.9614000 
1 1 1 14 50 11 o 1.174000  0.3900000     1.356000  0.6077000     0.9908000 0.4891000     0.3656000      0.7801000 
1 1 1 14 50 12 o 1.896000  0.4906000     1.985000  0.6922000     1.807000  0.6955000     0.1776000      0.9813000 
1 1 1 14 50 13 o 1.404000  0.4612000     1.428000  0.6834000     1.381000  0.6194000     0.4705000E-01  0.9224000 
1 1 1 14 50 14 o 1.713000  0.4938000     1.787000  0.7004000     1.640000  0.6962000     0.1475000      0.9876000 
1 1 1 14 50 15 o 1.739000  0.4965000     1.449000  0.6766000     2.029000  0.7269000     -0.5792000     0.9930000 
1 1 1 14 50 16 o 1.047000  0.3639000     1.036000  0.5112000     1.058000  0.5179000     -0.2121000E-01 0.7277000 
1 1 1 14 51 0  o 7.345000  0.3187000     7.345000  0.3187000     7.345000  0.3187000     -0.000000      0.000000  
1 1 1 14 51 1  o 9.347000  0.2074000     9.678000  0.2863000     9.015000  0.3001000     0.6622000      0.4148000 
1 1 1 14 51 2  o 1.863000  0.5007000     1.811000  0.6966000     1.915000  0.7193000     -0.1039000     1.001000  
1 1 1 14 51 3  o 2.088000  0.5027000     2.339000  0.7145000     1.836000  0.7074000     0.5026000      1.005000  
1 1 1 14 51 4  o 1.566000  0.4718000     1.624000  0.6767000     1.508000  0.6577000     0.1156000      0.9437000 
1 1 1 14 51 5  o 4.445000  0.3332000     4.102000  0.4964000     4.788000  0.4447000     -0.6857000     0.6665000 
1 1 1 14 51 6  o 1.948000  0.4853000     1.483000  0.6458000     2.414000  0.7246000     -0.9307000     0.9706000 
1 1 1 14 51 7  o 3.198000  0.4357000     3.021000  0.6422000     3.374000  0.5890000     -0.3525000     0.8714000 
1 1 1 14 51 8  o 2.591000  0.4753000     3.055000  0.6260000     2.126000  0.7155000     0.9291000      0.9507000 
1 1 1 14 51 9  o 2.410000  0.4971000     2.201000  0.7198000     2.620000  0.6859000     -0.4193000     0.9942000 
1 1 1 14 51 10 o 1.979000  0.4976000     2.057000  0.7024000     1.901000  0.7050000     0.1563000      0.9952000 
1 1 1 14 51 11 f 1.495000  0.4530000     1.617000  0.6622000     1.372000  0.6182000     0.2450000      0.9059000 
1 1 1 14 51 12 o 2.184000  0.5428000     2.311000  0.8196000     2.056000  0.7120000     0.2548000      1.086000  
1 1 1 14 51 13 o 3.293000  0.4773000     3.978000  0.5039000     2.608000  0.8108000     1.370000       0.9547000 
1 1 1 14 51 14 f 1.462000  0.4818000     1.256000  0.5969000     1.668000  0.7564000     -0.4120000     0.9636000 
1 1 1 14 51 15 o 2.334000  0.5136000     2.257000  0.7387000     2.411000  0.7138000     -0.1544000     1.027000  
1 1 1 14 52 0  o 3.483000  0.5948000     3.483000  0.5948000     3.483000  0.5948000     0.000000       0.000000  
1 1 1 14 52 1  o 1.230000  0.4079000     1.345000  0.6130000     1.114000  0.5384000     0.2309000      0.8158000 
1 1 1 14 52 2  o 4.448000  0.3379000     3.930000  0.5206000     4.967000  0.4310000     -1.038000      0.6758000 
1 1 1 14 52 3  o 6.791000  0.2432000     6.897000  0.3355000     6.686000  0.3522000     0.2112000      0.4864000 
1 1 1 14 52 4  o 1.415000  0.4445000     1.439000  0.6323000     1.392000  0.6250000     0.4653000E-01  0.8891000 
1 1 1 14 52 5  o 5.383000  0.2843000     5.833000  0.3668000     4.932000  0.4345000     0.9008000      0.5686000 
1 1 1 14 52 6  o 2.197000  0.4963000     2.515000  0.6846000     1.879000  0.7188000     0.6361000      0.9927000 
1 1 1 14 52 7  o 1.740000  0.4677000     2.193000  0.7215000     1.288000  0.5954000     0.9046000      0.9354000 
1 1 1 14 52 8  o 2.932000  0.4634000     2.615000  0.7042000     3.249000  0.6026000     -0.6334000     0.9268000 
1 1 1 14 52 9  o 1.811000  0.4962000     1.927000  0.7144000     1.695000  0.6887000     0.2319000      0.9923000 
1 1 1 14 52 10 o 2.299000  0.5070000     2.323000  0.7332000     2.274000  0.7003000     0.4906000E-01  1.014000  
1 1 1 14 52 11 o 1.746000  0.4903000     1.896000  0.7172000     1.595000  0.6688000     0.3015000      0.9806000 
1 1 1 14 52 12 o 2.862000  0.5418000     3.222000  0.6912000     2.502000  0.8345000     0.7195000      1.084000  
1 1 1 14 52 13 o 1.412000  0.4657000     1.324000  0.6042000     1.500000  0.7088000     -0.1761000     0.9314000 
1 1 1 14 52 14 f 1.510000  0.4593000     1.332000  0.6202000     1.689000  0.6777000     -0.3575000     0.9187000 
1 1 1 14 53 0  o 7.358000  0.3302000     7.358000  0.3302000     7.358000  0.3302000     0.000000       0.000000  
1 1 1 14 53 1  o 6.018000  0.2620000     5.974000  0.3722000     6.062000  0.3689000     -0.8804000E-01 0.5241000 
1 1 1 14 53 2  o 1.878000  0.4554000     1.192000  0.5664000     2.564000  0.7132000     -1.373000      0.9107000 
1 1 1 14 53 3  o 3.938000  0.3658000     4.010000  0.4968000     3.866000  0.5372000     0.1442000      0.7317000 
1 1 1 14 53 4  o 4.682000  0.3053000     4.607000  0.4422000     4.757000  0.4212000     -0.1506000     0.6107000 
1 1 1 14 53 5  o 1.519000  0.4556000     1.788000  0.7016000     1.250000  0.5813000     0.5383000      0.9112000 
1 1 1 14 53 6  o 5.328000  0.2815000     5.346000  0.3980000     5.310000  0.3981000     0.3555000E-01  0.5629000 
1 1 1 14 53 7  o 2.387000  0.4662000     3.106000  0.6259000     1.669000  0.6910000     1.437000       0.9323000 
1 1 1 14 53 8  o 1.758000  0.4805000     2.090000  0.7252000     1.426000  0.6306000     0.6641000      0.9610000 
1 1 1 14 53 9  o 1.798000  0.4932000     1.643000  0.6845000     1.952000  0.7103000     -0.3096000     0.9864000 
1 1 1 14 53 10 o 1.194000  0.4001000     1.147000  0.5493000     1.241000  0.5820000     -0.9436000E-01 0.8002000 
1 1 1 14 53 11 o 1.696000  0.5269000     2.034000  0.8452000     1.359000  0.6292000     0.6754000      1.054000  
1 1 1 14 53 12 o 1.338000  0.4442000     1.092000  0.5285000     1.583000  0.7141000     -0.4907000     0.8884000 
1 1 1 14 53 13 o 2.221000  0.5417000     2.820000  0.8367000     1.622000  0.6883000     1.198000       1.083000  
1 1 1 14 53 14 o 1.442000  0.4384000     1.756000  0.6891000     1.129000  0.5423000     0.6268000      0.8768000 
1 1 1 14 54 0  o 5.318000  0.4016000     5.318000  0.4016000     5.318000  0.4016000     0.000000       0.000000  
1 1 1 14 54 1  o 4.313000  0.3352000     4.836000  0.4274000     3.790000  0.5166000     1.046000       0.6705000 
1 1 1 14 54 2  o 2.891000  0.4793000     2.930000  0.6770000     2.852000  0.6788000     0.7743000E-01  0.9587000 
1 1 1 14 54 3  o 1.524000  0.4599000     1.498000  0.6472000     1.551000  0.6537000     -0.5389000E-01 0.9199000 
1 1 1 14 54 4  o 2.152000  0.4781000     1.643000  0.6707000     2.661000  0.6816000     -1.018000      0.9563000 
1 1 1 14 54 5  f 6.370000  0.2511000     6.249000  0.3569000     6.490000  0.3534000     -0.2404000     0.5023000 
1 1 1 14 54 6  o 2.458000  0.4887000     2.018000  0.7191000     2.899000  0.6621000     -0.8813000     0.9775000 
1 1 1 14 54 7  o 4.474000  0.3385000     4.239000  0.4962000     4.708000  0.4604000     -0.4691000     0.6769000 
1 1 1 14 54 8  o 1.653000  0.4831000     1.663000  0.6843000     1.644000  0.6822000     0.1971000E-01  0.9663000 
1 1 1 14 54 9  o 2.502000  0.5054000     2.628000  0.7136000     2.375000  0.7159000     0.2532000      1.011000  
1 1 1 14 54 10 o 1.766000  0.5291000     2.163000  0.8578000     1.368000  0.6196000     0.7946000      1.058000  
1 1 1 14 54 11 o 1.323000  0.4577000     0.9426000 0.4691000     1.704000  0.7861000     -0.7617000     0.9154000 
1 1 1 14 54 12 o 1.432000  0.4679000     1.693000  0.7404000     1.170000  0.5724000     0.5229000      0.9359000 
1 1 1 14 54 13 o 1.353000  0.4294000     1.589000  0.6705000     1.117000  0.5365000     0.4722000      0.8588000 
1 1 1 14 55 0  o 5.879000  0.3837000     5.879000  0.3837000     5.879000  0.3837000     -0.000000      0.000000  
1 1 1 14 55 1  o 1.858000  0.4855000     2.134000  0.7106000     1.582000  0.6618000     0.5521000      0.9710000 
1 1 1 14 55 2  o 1.653000  0.4777000     1.813000  0.7029000     1.494000  0.6472000     0.3192000      0.9555000 
1 1 1 14 55 3  o 1.735000  0.4835000     1.492000  0.6497000     1.979000  0.7163000     -0.4871000     0.9670000 
1 1 1 14 55 4  o 3.206000  0.4374000     3.712000  0.5290000     2.700000  0.6968000     1.012000       0.8748000 
1 1 1 14 55 5  f 2.863000  0.4710000     3.096000  0.6237000     2.631000  0.7059000     0.4646000      0.9420000 
1 1 1 14 55 6  o 3.021000  0.4567000     2.745000  0.6826000     3.298000  0.6069000     -0.5534000     0.9133000 
1 1 1 14 55 7  o 2.741000  0.4764000     3.412000  0.6007000     2.069000  0.7395000     1.343000       0.9527000 
1 1 1 14 55 8  o 3.998000  0.3784000     3.570000  0.5824000     4.427000  0.4834000     -0.8566000     0.7569000 
1 1 1 14 55 9  o 3.102000  0.5258000     2.342000  0.9052000     3.862000  0.5350000     -1.521000      1.052000  
1 1 1 14 55 10 o 3.064000  0.5319000     3.815000  0.5440000     2.312000  0.9142000     1.503000       1.064000  
1 1 1 14 55 11 o 2.211000  0.5661000     2.363000  0.7970000     2.059000  0.8043000     0.3046000      1.132000  
1 1 1 14 55 12 o 1.525000  0.4633000     1.279000  0.6048000     1.771000  0.7019000     -0.4912000     0.9266000 
1 1 1 14 55 13 o 2.129000  0.6777000     1.972000  0.9038000     2.286000  1.010000      -0.3146000     1.355000  
1 1 1 14 56 0  o 0.7372000 0.5281000     0.7372000 0.5281000     0.7372000 0.5281000     -0.000000      0.000000  
1 1 1 14 56 1  o 4.040000  0.3648000     3.736000  0.5437000     4.344000  0.4865000     -0.6085000     0.7295000 
1 1 1 14 56 2  f 7.886000  0.2318000     7.753000  0.3276000     8.019000  0.3282000     -0.2659000     0.4637000 
1 1 1 14 56 3  o 1.383000  0.4394000     1.505000  0.6541000     1.261000  0.5870000     0.2441000      0.8788000 
1 1 1 14 56 4  o 6.178000  0.2614000     6.254000  0.3663000     6.102000  0.3729000     0.1525000      0.5227000 
1 1 1 14 56 5  o 3.803000  0.3999000     3.148000  0.6528000     4.459000  0.4621000     -1.312000      0.7999000 
1 1 1 14 56 6  o 1.215000  0.4057000     1.161000  0.5568000     1.269000  0.5902000     -0.1080000     0.8114000 
1 1 1 14 56 7  o 2.026000  0.5099000     1.719000  0.7048000     2.332000  0.7371000     -0.6136000     1.020000  
1 1 1 14 56 8  o 2.002000  0.5499000     2.645000  0.9053000     1.359000  0.6245000     1.286000       1.100000  
1 1 1 14 56 9  o 1.576000  0.4908000     1.765000  0.7116000     1.387000  0.6762000     0.3784000      0.9817000 
1 1 1 14 56 10 o 1.042000  0.3673000     0.9507000 0.4778000     1.134000  0.5579000     -0.1834000     0.7345000 
1 1 1 14 56 11 o 2.118000  0.4928000     1.627000  0.7051000     2.610000  0.6887000     -0.9834000     0.9857000 
1 1 1 14 56 12 o 1.708000  0.4901000     1.862000  0.7220000     1.554000  0.6630000     0.3077000      0.9802000 
1 1 1 14 57 0  o 1.186000  0.7467000     1.186000  0.7467000     1.186000  0.7467000     -0.000000      0.000000  
1 1 1 14 57 1  f 5.119000  0.3058000     5.249000  0.4208000     4.989000  0.4439000     0.2599000      0.6117000 
1 1 1 14 57 2  o 3.821000  0.3940000     4.070000  0.5143000     3.572000  0.5970000     0.4979000      0.7880000 
1 1 1 14 57 3  o 2.579000  0.4786000     2.039000  0.7254000     3.119000  0.6244000     -1.080000      0.9571000 
1 1 1 14 57 4  o 5.154000  0.3052000     5.787000  0.3846000     4.521000  0.4739000     1.266000       0.6103000 
1 1 1 14 57 5  o 5.139000  0.2994000     5.097000  0.4223000     5.181000  0.4244000     -0.8369000E-01 0.5988000 
1 1 1 14 57 6  o 1.221000  0.4066000     1.252000  0.5854000     1.190000  0.5644000     0.6272000E-01  0.8132000 
1 1 1 14 57 7  o 1.473000  0.4836000     1.750000  0.7827000     1.196000  0.5681000     0.5532000      0.9671000 
1 1 1 14 57 8  o 1.392000  0.4447000     1.725000  0.7055000     1.060000  0.5417000     0.6648000      0.8895000 
1 1 1 14 57 9  o 4.192000  0.4361000     4.042000  0.6326000     4.341000  0.6006000     -0.2993000     0.8723000 
1 1 1 14 57 10 o 1.619000  0.4801000     1.982000  0.7596000     1.256000  0.5873000     0.7254000      0.9601000 
1 1 1 14 57 11 o 2.720000  0.4905000     2.366000  0.7343000     3.074000  0.6504000     -0.7081000     0.9809000 
1 1 1 14 58 0  o 1.017000  0.6779000     1.017000  0.6779000     1.017000  0.6779000     0.000000       0.000000  
1 1 1 14 58 1  o 2.104000  0.5084000     1.697000  0.7034000     2.511000  0.7343000     -0.8147000     1.017000  
1 1 1 14 58 2  o 1.906000  0.5021000     1.535000  0.6623000     2.277000  0.7548000     -0.7419000     1.004000  
1 1 1 14 58 3  o 4.604000  0.3274000     4.518000  0.4649000     4.689000  0.4611000     -0.1712000     0.6548000 
1 1 1 14 58 4  o 2.324000  0.5218000     2.208000  0.7425000     2.441000  0.7334000     -0.2321000     1.044000  
1 1 1 14 58 5  o 2.441000  0.5448000     2.309000  0.8023000     2.573000  0.7373000     -0.2641000     1.090000  
1 1 1 14 58 6  o 1.916000  0.5693000     2.198000  0.8641000     1.635000  0.7414000     0.5634000      1.139000  
1 1 1 14 58 7  o 1.605000  0.7012000     1.605000  0.7012000     ?         ?             ?              ?         
1 1 1 14 58 8  o 2.545000  0.5974000     2.363000  0.8565000     2.726000  0.8332000     -0.3631000     1.195000  
1 1 1 14 58 9  o 1.690000  0.4995000     1.591000  0.7091000     1.789000  0.7038000     -0.1976000     0.9990000 
1 1 1 14 58 10 o 2.409000  0.5149000     2.446000  0.7303000     2.373000  0.7260000     0.7342000E-01  1.030000  
1 1 1 14 59 0  o 0.7402000 0.5308000     0.7402000 0.5308000     0.7402000 0.5308000     -0.000000      0.000000  
1 1 1 14 59 1  o 3.242000  0.4563000     2.797000  0.7169000     3.688000  0.5648000     -0.8906000     0.9127000 
1 1 1 14 59 2  o 6.203000  0.3051000     5.881000  0.4811000     6.525000  0.3754000     -0.6437000     0.6102000 
1 1 1 14 59 3  o 4.797000  0.3724000     4.466000  0.5975000     5.129000  0.4445000     -0.6636000     0.7447000 
1 1 1 14 59 4  o 3.865000  0.5839000     4.065000  0.8151000     3.666000  0.8362000     0.3983000      1.168000  
1 1 1 14 59 5  o 2.462000  0.7995000     2.462000  0.7995000     ?         ?             ?              ?         
1 1 1 14 59 6  o 1.260000  0.4303000     1.224000  0.5856000     1.295000  0.6306000     -0.7143000E-01 0.8606000 
1 1 1 14 59 7  o 1.968000  0.5118000     2.413000  0.7883000     1.523000  0.6529000     0.8900000      1.024000  
1 1 1 14 59 8  o 1.742000  0.4955000     1.940000  0.7316000     1.545000  0.6685000     0.3952000      0.9910000 
1 1 1 14 59 9  o 1.323000  0.4276000     1.535000  0.6672000     1.110000  0.5350000     0.4243000      0.8552000 
1 1 1 14 60 0  o 1.276000  0.8864000     1.276000  0.8864000     1.276000  0.8864000     0.000000       0.000000  
1 1 1 14 60 1  o 2.246000  0.6770000     2.671000  1.052000      1.820000  0.8529000     0.8513000      1.354000  
1 1 1 14 60 2  o 2.819000  0.9218000     2.819000  0.9218000     ?         ?             ?              ?         
1 1 1 14 60 3  o 4.226000  0.5903000     4.226000  0.5903000     ?         ?             ?              ?         
1 1 1 14 60 4  f 2.001000  0.5794000     2.194000  0.8437000     1.809000  0.7943000     0.3849000      1.159000  
1 1 1 14 60 5  o 2.297000  0.5361000     2.474000  0.7772000     2.120000  0.7387000     0.3544000      1.072000  
1 1 1 14 60 6  o 1.808000  0.5082000     2.063000  0.7719000     1.554000  0.6613000     0.5088000      1.016000  
1 1 1 14 60 7  o 1.256000  0.4165000     1.317000  0.6059000     1.195000  0.5718000     0.1220000      0.8331000 
1 1 1 14 60 8  o 1.475000  0.4645000     1.410000  0.6391000     1.540000  0.6741000     -0.1294000     0.9289000 
1 1 1 14 61 0  o 1.653000  0.9100000     1.653000  0.9100000     1.653000  0.9100000     -0.000000      0.000000  
1 1 1 14 61 1  o 1.298000  0.4350000     1.100000  0.5431000     1.497000  0.6795000     -0.3970000     0.8699000 
1 1 1 14 61 2  f 5.498000  0.3268000     5.648000  0.4876000     5.348000  0.4351000     0.2997000      0.6535000 
1 1 1 14 61 3  o 1.371000  0.4435000     1.282000  0.6071000     1.461000  0.6466000     -0.1797000     0.8869000 
1 1 1 14 61 4  o 4.421000  0.3508000     4.283000  0.5086000     4.559000  0.4832000     -0.2769000     0.7015000 
1 1 1 14 61 5  o 2.449000  0.5258000     2.447000  0.7443000     2.451000  0.7430000     -0.3373000E-02 1.052000  
1 1 1 14 61 6  o 1.211000  0.4056000     1.327000  0.6111000     1.096000  0.5335000     0.2305000      0.8112000 
1 1 1 14 61 7  f 3.856000  0.8376000     3.856000  0.8376000     ?         ?             ?              ?         
1 1 1 14 62 0  o 1.466000  0.8492000     1.466000  0.8492000     1.466000  0.8492000     0.000000       0.000000  
1 1 1 14 62 1  o 3.599000  0.4342000     3.933000  0.5567000     3.265000  0.6666000     0.6677000      0.8685000 
1 1 1 14 62 2  o 1.191000  0.4010000     1.055000  0.5180000     1.328000  0.6123000     -0.2725000     0.8020000 
1 1 1 14 62 3  o 3.683000  0.4178000     3.297000  0.6409000     4.068000  0.5362000     -0.7706000     0.8356000 
1 1 1 14 62 4  o 2.462000  0.4927000     1.888000  0.7232000     3.036000  0.6694000     -1.148000      0.9855000 
1 1 1 14 62 5  o 1.674000  0.4853000     1.381000  0.6273000     1.968000  0.7407000     -0.5868000     0.9706000 
1 1 1 14 63 0  o 0.6987000 0.5042000     0.6987000 0.5042000     0.6987000 0.5042000     0.000000       0.000000  
1 1 1 14 63 1  o 1.410000  0.4503000     1.363000  0.6226000     1.456000  0.6509000     -0.9251000E-01 0.9007000 
1 1 1 14 63 2  o 2.626000  0.5146000     3.057000  0.7059000     2.196000  0.7491000     0.8615000      1.029000  
1 1 1 15 0  1  o 12.31000  0.1673000     12.31000  0.1673000     12.31000  0.1673000     -0.000000      0.000000  
1 1 1 15 0  2  o 4.365000  0.9202000E-01 4.365000  0.9202000E-01 4.365000  0.9202000E-01 -0.000000      0.000000  
1 1 1 15 0  3  o 4.354000  0.1449000     4.354000  0.1449000     4.354000  0.1449000     0.000000       0.000000  
1 1 1 15 0  4  o 10.79000  0.1610000     10.79000  0.1610000     10.79000  0.1610000     0.000000       0.000000  
1 1 1 15 0  5  o 8.404000  0.1715000     8.404000  0.1715000     8.404000  0.1715000     0.000000       0.000000  
1 1 1 15 0  6  o 16.17000  0.2521000     16.17000  0.2521000     16.17000  0.2521000     -0.000000      0.000000  
1 1 1 15 0  7  o 3.461000  0.3572000     3.461000  0.3572000     3.461000  0.3572000     0.000000       0.000000  
1 1 1 15 0  8  o 9.464000  0.2181000     9.464000  0.2181000     9.464000  0.2181000     0.000000       0.000000  
1 1 1 15 0  9  o 3.174000  0.4858000     3.174000  0.4858000     3.174000  0.4858000     0.000000       0.000000  
1 1 1 15 0  10 o 5.523000  0.3288000     5.523000  0.3288000     5.523000  0.3288000     0.000000       0.000000  
1 1 1 15 0  11 o 1.096000  0.7197000     1.096000  0.7197000     1.096000  0.7197000     0.000000       0.000000  
1 1 1 15 0  12 o 10.53000  0.2703000     10.53000  0.2703000     10.53000  0.2703000     0.000000       0.000000  
1 1 1 15 0  13 o 2.057000  0.9358000     2.057000  0.9358000     2.057000  0.9358000     -0.000000      0.000000  
1 1 1 15 0  14 o 8.975000  0.3223000     8.975000  0.3223000     8.975000  0.3223000     -0.000000      0.000000  
1 1 1 15 0  15 f 10.89000  0.3731000     10.89000  0.3731000     10.89000  0.3731000     0.000000       0.000000  
1 1 1 15 0  16 o 6.686000  0.5412000     6.686000  0.5412000     6.686000  0.5412000     -0.000000      0.000000  
1 1 1 15 0  17 o 9.525000  0.3836000     9.525000  0.3836000     9.525000  0.3836000     0.000000       0.000000  
1 1 1 15 0  18 o 6.310000  0.5409000     6.310000  0.5409000     6.310000  0.5409000     0.000000       0.000000  
1 1 1 15 0  19 o 5.641000  0.5938000     5.641000  0.5938000     5.641000  0.5938000     0.000000       0.000000  
1 1 1 15 0  20 o 1.846000  1.021000      1.846000  1.021000      1.846000  1.021000      0.000000       0.000000  
1 1 1 15 0  21 o 2.409000  1.071000      2.409000  1.071000      2.409000  1.071000      0.000000       0.000000  
1 1 1 15 0  22 o 1.612000  0.8918000     1.612000  0.8918000     1.612000  0.8918000     0.000000       0.000000  
1 1 1 15 0  23 o 1.017000  0.6861000     1.017000  0.6861000     1.017000  0.6861000     0.000000       0.000000  
1 1 1 15 0  24 o 1.418000  0.8523000     1.418000  0.8523000     1.418000  0.8523000     -0.000000      0.000000  
1 1 1 15 0  25 o 0.6957000 0.5067000     0.6957000 0.5067000     0.6957000 0.5067000     0.000000       0.000000  
1 1 1 15 0  26 o 1.017000  0.7325000     1.017000  0.7325000     1.017000  0.7325000     0.000000       0.000000  
1 1 1 15 1  1  o 18.88000  0.2466000     18.90000  0.4284000     18.87000  0.2442000     0.2796000E-01  0.4931000 
1 1 1 15 1  2  o 7.920000  0.8843000E-01 7.985000  0.1114000     7.855000  0.1374000     0.1299000      0.1769000 
1 1 1 15 1  3  o 7.810000  0.1031000     7.716000  0.1325000     7.904000  0.1581000     -0.1877000     0.2063000 
1 1 1 15 1  4  o 3.039000  0.1753000     2.945000  0.2619000     3.133000  0.2332000     -0.1880000     0.3506000 
1 1 1 15 1  5  o 10.87000  0.1244000     10.80000  0.1767000     10.94000  0.1752000     -0.1424000     0.2489000 
1 1 1 15 1  6  o 10.64000  0.1541000     10.49000  0.2179000     10.80000  0.2180000     -0.3020000     0.3082000 
1 1 1 15 1  7  o 4.362000  0.2042000     4.427000  0.2762000     4.297000  0.3008000     0.1299000      0.4084000 
1 1 1 15 1  8  o 13.99000  0.1572000     14.04000  0.2217000     13.94000  0.2229000     0.9673000E-01  0.3144000 
1 1 1 15 1  9  o 9.154000  0.1643000     9.112000  0.2314000     9.196000  0.2332000     -0.8357000E-01 0.3285000 
1 1 1 15 1  10 o 4.869000  0.2552000     4.816000  0.3659000     4.922000  0.3559000     -0.1058000     0.5104000 
1 1 1 15 1  11 o 11.66000  0.2082000     11.85000  0.2937000     11.47000  0.2952000     0.3826000      0.4164000 
1 1 1 15 1  12 o 7.393000  0.2343000     7.212000  0.3171000     7.574000  0.3450000     -0.3618000     0.4686000 
1 1 1 15 1  13 o 10.51000  0.2046000     10.53000  0.2888000     10.49000  0.2899000     0.4421000E-01  0.4092000 
1 1 1 15 1  14 o 2.663000  0.5445000     2.992000  0.7522000     2.333000  0.7873000     0.6588000      1.089000  
1 1 1 15 1  15 o 5.238000  0.4289000     4.767000  0.6550000     5.708000  0.5537000     -0.9409000     0.8577000 
1 1 1 15 1  16 o 2.503000  0.6621000     2.784000  0.9622000     2.223000  0.9098000     0.5610000      1.324000  
1 1 1 15 1  17 o 8.533000  0.2910000     8.744000  0.4057000     8.323000  0.4172000     0.4215000      0.5820000 
1 1 1 15 1  18 o 3.974000  0.5788000     3.898000  0.8255000     4.051000  0.8114000     -0.1530000     1.158000  
1 1 1 15 1  19 f 2.454000  0.6767000     2.481000  0.9297000     2.427000  0.9835000     0.5424000E-01  1.353000  
1 1 1 15 1  20 o 3.811000  0.5532000     3.355000  0.8478000     4.267000  0.7109000     -0.9123000     1.106000  
1 1 1 15 1  21 o 1.848000  0.5599000     2.055000  0.8381000     1.641000  0.7428000     0.4139000      1.120000  
1 1 1 15 1  22 o 2.708000  0.5377000     2.903000  0.7491000     2.514000  0.7716000     0.3897000      1.075000  
1 1 1 15 1  23 o 1.967000  0.5288000     1.936000  0.7397000     1.999000  0.7558000     -0.6257000E-01 1.058000  
1 1 1 15 1  24 o 2.067000  0.5612000     2.051000  0.7856000     2.084000  0.8015000     -0.3269000E-01 1.122000  
1 1 1 15 1  25 o 1.368000  0.4406000     1.705000  0.7149000     1.032000  0.5153000     0.6723000      0.8813000 
1 1 1 15 1  26 o 1.234000  0.4434000     1.323000  0.6672000     1.145000  0.5842000     0.1785000      0.8868000 
1 1 1 15 2  0  o 8.123000  0.2061000     8.123000  0.2061000     8.123000  0.2061000     -0.000000      0.000000  
1 1 1 15 2  1  o 12.76000  0.1712000     12.94000  0.3091000     12.58000  0.1473000     0.3557000      0.3424000 
1 1 1 15 2  2  o 23.78000  0.2022000     23.80000  0.3055000     23.75000  0.2651000     0.4850000E-01  0.4045000 
1 1 1 15 2  3  o 12.03000  0.1154000     11.99000  0.1365000     12.08000  0.1860000     -0.8569000E-01 0.2307000 
1 1 1 15 2  4  o 9.668000  0.1144000     9.686000  0.1329000     9.649000  0.1862000     0.3614000E-01  0.2287000 
1 1 1 15 2  5  o 3.816000  0.1771000     3.724000  0.2629000     3.908000  0.2375000     -0.1844000     0.3543000 
1 1 1 15 2  6  o 4.559000  0.2759000     4.784000  0.3869000     4.333000  0.3934000     0.4509000      0.5518000 
1 1 1 15 2  7  o 9.718000  0.1408000     9.667000  0.1992000     9.769000  0.1990000     -0.1027000     0.2816000 
1 1 1 15 2  8  o 10.18000  0.1538000     10.45000  0.2168000     9.920000  0.2182000     0.5260000      0.3076000 
1 1 1 15 2  9  o 7.913000  0.1738000     7.929000  0.2418000     7.897000  0.2496000     0.3196000E-01  0.3475000 
1 1 1 15 2  10 o 8.631000  0.1840000     8.790000  0.2573000     8.471000  0.2632000     0.3197000      0.3681000 
1 1 1 15 2  11 f 7.001000  0.2487000     6.913000  0.3511000     7.089000  0.3523000     -0.1759000     0.4974000 
1 1 1 15 2  12 o 8.481000  0.2086000     8.674000  0.2900000     8.289000  0.3000000     0.3852000      0.4173000 
1 1 1 15 2  13 o 6.297000  0.2718000     6.588000  0.3677000     6.006000  0.4005000     0.5817000      0.5437000 
1 1 1 15 2  14 o 5.166000  0.3334000     5.292000  0.4514000     5.039000  0.4907000     0.2528000      0.6668000 
1 1 1 15 2  15 o 6.446000  0.3608000     6.451000  0.4994000     6.442000  0.5209000     0.8578000E-02  0.7216000 
1 1 1 15 2  16 o 11.31000  0.2740000     11.42000  0.3880000     11.20000  0.3869000     0.2165000      0.5480000 
1 1 1 15 2  17 o 1.876000  0.5795000     1.961000  0.8351000     1.790000  0.8036000     0.1707000      1.159000  
1 1 1 15 2  18 o 3.056000  0.6226000     3.811000  0.8429000     2.300000  0.9166000     1.511000       1.245000  
1 1 1 15 2  19 o 2.731000  0.6307000     3.297000  0.8935000     2.164000  0.8904000     1.132000       1.261000  
1 1 1 15 2  20 o 3.063000  0.5841000     2.243000  0.8689000     3.883000  0.7809000     -1.640000      1.168000  
1 1 1 15 2  21 o 2.393000  0.6024000     2.796000  0.8780000     1.989000  0.8250000     0.8065000      1.205000  
1 1 1 15 2  22 o 2.300000  0.5341000     1.820000  0.7387000     2.780000  0.7717000     -0.9594000     1.068000  
1 1 1 15 2  23 o 1.786000  0.5174000     1.618000  0.6996000     1.954000  0.7626000     -0.3362000     1.035000  
1 1 1 15 2  24 o 2.193000  0.5422000     1.694000  0.7329000     2.693000  0.7992000     -0.9984000     1.084000  
1 1 1 15 2  25 o 1.370000  0.4468000     1.169000  0.5686000     1.571000  0.6894000     -0.4024000     0.8936000 
1 1 1 15 2  26 o 0.9735000 0.3550000     0.9857000 0.5082000     0.9612000 0.4959000     0.2456000E-01  0.7100000 
1 1 1 15 3  0  o 22.04000  0.2433000     22.04000  0.2433000     22.04000  0.2433000     0.000000       0.000000  
1 1 1 15 3  1  o 15.87000  0.1571000     16.17000  0.2589000     15.57000  0.1779000     0.6016000      0.3141000 
1 1 1 15 3  2  o 5.044000  0.7521000E-01 4.959000  0.1019000     5.130000  0.1106000     -0.1709000     0.1504000 
1 1 1 15 3  3  o 10.23000  0.1203000     10.07000  0.1666000     10.38000  0.1737000     -0.3070000     0.2407000 
1 1 1 15 3  4  f 10.15000  0.1343000     9.947000  0.1456000     10.34000  0.2256000     -0.3980000     0.2685000 
1 1 1 15 3  5  o 7.660000  0.1347000     7.600000  0.1754000     7.721000  0.2045000     -0.1215000     0.2694000 
1 1 1 15 3  6  o 10.44000  0.1961000     10.54000  0.2749000     10.33000  0.2797000     0.2056000      0.3922000 
1 1 1 15 3  7  f 6.659000  0.1559000     6.524000  0.2240000     6.794000  0.2168000     -0.2707000     0.3118000 
1 1 1 15 3  8  o 2.055000  0.4220000     2.315000  0.5839000     1.794000  0.6096000     0.5205000      0.8441000 
1 1 1 15 3  9  o 7.462000  0.1783000     7.510000  0.2512000     7.415000  0.2530000     0.9536000E-01  0.3565000 
1 1 1 15 3  10 o 3.949000  0.3080000     3.922000  0.4462000     3.975000  0.4247000     -0.5227000E-01 0.6160000 
1 1 1 15 3  11 o 6.266000  0.2715000     6.709000  0.3644000     5.823000  0.4026000     0.8867000      0.5430000 
1 1 1 15 3  12 o 8.939000  0.2078000     8.994000  0.2895000     8.884000  0.2982000     0.1100000      0.4156000 
1 1 1 15 3  13 o 6.854000  0.2610000     7.082000  0.3489000     6.627000  0.3882000     0.4548000      0.5220000 
1 1 1 15 3  14 o 6.957000  0.2714000     6.778000  0.3896000     7.137000  0.3779000     -0.3591000     0.5428000 
1 1 1 15 3  15 o 13.39000  0.2532000     13.00000  0.3616000     13.77000  0.3545000     -0.7760000     0.5064000 
1 1 1 15 3  16 o 2.060000  0.5706000     1.337000  0.6597000     2.783000  0.9311000     -1.445000      1.141000  
1 1 1 15 3  17 o 2.871000  0.6551000     2.941000  0.9274000     2.800000  0.9257000     0.1407000      1.310000  
1 1 1 15 3  18 o 4.916000  0.4859000     4.593000  0.7283000     5.239000  0.6434000     -0.6466000     0.9719000 
1 1 1 15 3  19 o 4.255000  0.5566000     4.974000  0.6821000     3.536000  0.8797000     1.438000       1.113000  
1 1 1 15 3  20 o 2.304000  0.5478000     3.246000  0.8743000     1.363000  0.6602000     1.883000       1.096000  
1 1 1 15 3  21 o 1.562000  0.5104000     1.401000  0.6754000     1.722000  0.7654000     -0.3210000     1.021000  
1 1 1 15 3  22 o 2.508000  0.5522000     2.560000  0.7724000     2.455000  0.7895000     0.1056000      1.104000  
1 1 1 15 3  23 o 1.996000  0.5346000     1.726000  0.7270000     2.265000  0.7839000     -0.5385000     1.069000  
1 1 1 15 3  24 o 1.312000  0.4419000     1.147000  0.5632000     1.477000  0.6812000     -0.3304000     0.8838000 
1 1 1 15 3  25 o 1.897000  0.5265000     2.003000  0.7507000     1.791000  0.7385000     0.2120000      1.053000  
1 1 1 15 3  26 o 1.171000  0.4231000     1.148000  0.5867000     1.194000  0.6098000     -0.4554000E-01 0.8462000 
1 1 1 15 4  0  f 15.42000  0.1748000     15.42000  0.1748000     15.42000  0.1748000     -0.000000      0.000000  
1 1 1 15 4  1  f 18.18000  0.1496000     18.21000  0.2364000     18.16000  0.1834000     0.5112000E-01  0.2992000 
1 1 1 15 4  2  o 5.196000  0.7797000E-01 5.272000  0.1241000     5.119000  0.9442000E-01 0.1530000      0.1559000 
1 1 1 15 4  3  o 7.584000  0.9711000E-01 7.415000  0.1258000     7.754000  0.1480000     -0.3387000     0.1942000 
1 1 1 15 4  4  f 7.783000  0.1127000     7.889000  0.1554000     7.677000  0.1633000     0.2115000      0.2254000 
1 1 1 15 4  5  f 9.153000  0.1259000     9.308000  0.1456000     8.998000  0.2054000     0.3105000      0.2518000 
1 1 1 15 4  6  o 7.282000  0.1649000     7.364000  0.2372000     7.199000  0.2292000     0.1643000      0.3298000 
1 1 1 15 4  7  o 6.274000  0.1623000     6.204000  0.2346000     6.345000  0.2243000     -0.1407000     0.3246000 
1 1 1 15 4  8  o 3.424000  0.2849000     3.102000  0.4422000     3.747000  0.3594000     -0.6454000     0.5698000 
1 1 1 15 4  9  o 1.575000  0.4389000     1.571000  0.6241000     1.579000  0.6171000     -0.7324000E-02 0.8777000 
1 1 1 15 4  10 o 7.959000  0.1877000     7.883000  0.2680000     8.034000  0.2628000     -0.1510000     0.3754000 
1 1 1 15 4  11 o 4.988000  0.3237000     5.469000  0.4156000     4.507000  0.4963000     0.9626000      0.6473000 
1 1 1 15 4  12 o 8.907000  0.2088000     8.780000  0.2981000     9.033000  0.2924000     -0.2533000     0.4176000 
1 1 1 15 4  13 o 6.090000  0.2817000     5.885000  0.4086000     6.295000  0.3880000     -0.4104000     0.5635000 
1 1 1 15 4  14 o 2.205000  0.4773000     1.268000  0.6101000     3.141000  0.7341000     -1.873000      0.9546000 
1 1 1 15 4  15 o 6.528000  0.3176000     6.414000  0.4540000     6.641000  0.4442000     -0.2269000     0.6352000 
1 1 1 15 4  16 o 5.970000  0.4204000     6.160000  0.5826000     5.780000  0.6062000     0.3798000      0.8408000 
1 1 1 15 4  17 o 2.400000  0.6090000     1.846000  0.8172000     2.954000  0.9032000     -1.108000      1.218000  
1 1 1 15 4  18 o 6.969000  0.3596000     6.601000  0.5251000     7.338000  0.4913000     -0.7372000     0.7191000 
1 1 1 15 4  19 o 4.320000  0.5400000     4.487000  0.7197000     4.154000  0.8053000     0.3330000      1.080000  
1 1 1 15 4  20 o 2.003000  0.5458000     1.325000  0.6436000     2.682000  0.8817000     -1.357000      1.092000  
1 1 1 15 4  21 o 1.690000  0.5384000     1.690000  0.7645000     1.691000  0.7583000     -0.1213000E-02 1.077000  
1 1 1 15 4  22 o 1.370000  0.4410000     1.773000  0.7355000     0.9673000 0.4869000     0.8054000      0.8821000 
1 1 1 15 4  23 o 1.705000  0.5000000     1.483000  0.6676000     1.927000  0.7446000     -0.4433000     1.000000  
1 1 1 15 4  24 o 1.403000  0.4647000     1.390000  0.6506000     1.415000  0.6638000     -0.2489000E-01 0.9295000 
1 1 1 15 4  25 o 1.871000  0.4938000     1.282000  0.6088000     2.460000  0.7775000     -1.178000      0.9875000 
1 1 1 15 4  26 o 1.400000  0.4981000     1.375000  0.6932000     1.424000  0.7154000     -0.4878000E-01 0.9961000 
1 1 1 15 5  0  o 11.48000  0.1382000     11.48000  0.1382000     11.48000  0.1382000     0.000000       0.000000  
1 1 1 15 5  1  f 7.777000  0.7770000E-01 7.687000  0.1087000     7.867000  0.1110000     -0.1807000     0.1554000 
1 1 1 15 5  2  o 9.028000  0.9235000E-01 9.047000  0.1456000     9.008000  0.1136000     0.3823000E-01  0.1847000 
1 1 1 15 5  3  o 3.510000  0.1375000     3.548000  0.1483000     3.472000  0.2317000     0.7592000E-01  0.2751000 
1 1 1 15 5  4  o 4.455000  0.1924000     4.754000  0.1668000     4.156000  0.3468000     0.5983000      0.3848000 
1 1 1 15 5  5  o 8.990000  0.1155000     8.957000  0.1606000     9.023000  0.1660000     -0.6647000E-01 0.2310000 
1 1 1 15 5  6  o 3.565000  0.2575000     3.966000  0.3380000     3.165000  0.3887000     0.8015000      0.5151000 
1 1 1 15 5  7  o 13.45000  0.1618000     13.56000  0.2120000     13.34000  0.2446000     0.2168000      0.3237000 
1 1 1 15 5  8  o 1.354000  0.3938000     1.617000  0.6062000     1.092000  0.5028000     0.5259000      0.7876000 
1 1 1 15 5  9  o 6.298000  0.1988000     6.610000  0.2749000     5.987000  0.2872000     0.6227000      0.3975000 
1 1 1 15 5  10 o 8.940000  0.1798000     8.969000  0.2549000     8.912000  0.2536000     0.5633000E-01  0.3596000 
1 1 1 15 5  11 o 5.830000  0.3365000     6.025000  0.5209000     5.636000  0.4262000     0.3896000      0.6730000 
1 1 1 15 5  12 o 6.558000  0.2509000     7.256000  0.3271000     5.861000  0.3805000     1.396000       0.5018000 
1 1 1 15 5  13 o 8.506000  0.2265000     8.201000  0.3264000     8.811000  0.3140000     -0.6103000     0.4530000 
1 1 1 15 5  14 o 9.703000  0.2260000     9.782000  0.3183000     9.624000  0.3209000     0.1585000      0.4520000 
1 1 1 15 5  15 o 3.869000  0.4885000     3.775000  0.7230000     3.963000  0.6572000     -0.1876000     0.9771000 
1 1 1 15 5  16 o 3.930000  0.6104000     4.497000  0.7754000     3.362000  0.9429000     1.134000       1.221000  
1 1 1 15 5  17 o 1.964000  0.5861000     2.344000  0.9085000     1.584000  0.7408000     0.7599000      1.172000  
1 1 1 15 5  18 f 5.100000  0.4793000     5.583000  0.6110000     4.617000  0.7385000     0.9655000      0.9585000 
1 1 1 15 5  19 o 2.360000  0.6422000     2.387000  0.9088000     2.333000  0.9077000     0.5442000E-01  1.284000  
1 1 1 15 5  20 o 1.451000  0.4889000     1.409000  0.6748000     1.493000  0.7077000     -0.8413000E-01 0.9778000 
1 1 1 15 5  21 o 2.285000  0.6143000     2.245000  0.8665000     2.325000  0.8709000     -0.8039000E-01 1.229000  
1 1 1 15 5  22 f 1.360000  0.4472000     1.204000  0.5811000     1.516000  0.6800000     -0.3114000     0.8944000 
1 1 1 15 5  23 o 2.257000  0.5409000     1.906000  0.7570000     2.608000  0.7728000     -0.7023000     1.082000  
1 1 1 15 5  24 o 1.181000  0.4088000     1.132000  0.5594000     1.231000  0.5964000     -0.9916000E-01 0.8177000 
1 1 1 15 5  25 o 1.548000  0.4817000     1.451000  0.6584000     1.644000  0.7032000     -0.1923000     0.9633000 
1 1 1 15 6  0  o 22.50000  0.2508000     22.50000  0.2508000     22.50000  0.2508000     -0.000000      0.000000  
1 1 1 15 6  1  o 22.22000  0.1758000     22.25000  0.2486000     22.20000  0.2486000     0.5091000E-01  0.3516000 
1 1 1 15 6  2  o 4.969000  0.8112000E-01 4.978000  0.1159000     4.959000  0.1135000     0.1940000E-01  0.1622000 
1 1 1 15 6  3  o 8.376000  0.9863000E-01 8.339000  0.1557000     8.412000  0.1211000     -0.7292000E-01 0.1973000 
1 1 1 15 6  4  o 6.083000  0.1396000     6.111000  0.1492000     6.054000  0.2360000     0.5747000E-01  0.2792000 
1 1 1 15 6  5  o 2.079000  0.2525000     2.206000  0.3002000     1.953000  0.4061000     0.2534000      0.5050000 
1 1 1 15 6  6  o 9.488000  0.1234000     9.624000  0.1720000     9.351000  0.1771000     0.2736000      0.2469000 
1 1 1 15 6  7  o 1.166000  0.3453000     1.146000  0.4429000     1.186000  0.5300000     -0.3958000E-01 0.6907000 
1 1 1 15 6  8  o 4.878000  0.2082000     4.837000  0.2104000     4.918000  0.3592000     -0.8112000E-01 0.4163000 
1 1 1 15 6  9  o 4.679000  0.2714000     4.781000  0.3768000     4.578000  0.3906000     0.2027000      0.5427000 
1 1 1 15 6  10 o 1.228000  0.3973000     1.258000  0.5707000     1.199000  0.5528000     0.5909000E-01  0.7945000 
1 1 1 15 6  11 o 7.063000  0.3234000     6.722000  0.4646000     7.404000  0.4502000     -0.6823000     0.6469000 
1 1 1 15 6  12 o 11.14000  0.1931000     11.13000  0.2741000     11.15000  0.2720000     -0.1637000E-01 0.3862000 
1 1 1 15 6  13 o 12.11000  0.2010000     11.69000  0.2850000     12.52000  0.2835000     -0.8332000     0.4019000 
1 1 1 15 6  14 o 11.39000  0.2136000     11.00000  0.3064000     11.78000  0.2978000     -0.7786000     0.4273000 
1 1 1 15 6  15 o 8.899000  0.2529000     8.632000  0.3653000     9.166000  0.3497000     -0.5347000     0.5057000 
1 1 1 15 6  16 o 3.840000  0.6235000     3.603000  0.9295000     4.077000  0.8312000     -0.4733000     1.247000  
1 1 1 15 6  17 o 3.249000  0.5459000     4.544000  0.7049000     1.953000  0.8338000     2.592000       1.092000  
1 1 1 15 6  18 o 2.169000  0.5984000     2.845000  0.9602000     1.492000  0.7144000     1.353000       1.197000  
1 1 1 15 6  19 o 5.514000  0.4201000     5.342000  0.6137000     5.686000  0.5738000     -0.3446000     0.8402000 
1 1 1 15 6  20 o 3.901000  0.5258000     3.385000  0.8160000     4.417000  0.6634000     -1.032000      1.052000  
1 1 1 15 6  21 o 1.436000  0.4912000     1.516000  0.7333000     1.357000  0.6538000     0.1587000      0.9824000 
1 1 1 15 6  22 o 3.194000  0.4923000     3.765000  0.6138000     2.622000  0.7700000     1.143000       0.9847000 
1 1 1 15 6  23 o 1.819000  0.5206000     1.907000  0.7548000     1.732000  0.7173000     0.1744000      1.041000  
1 1 1 15 6  24 o 1.497000  0.4815000     1.398000  0.6529000     1.595000  0.7079000     -0.1967000     0.9630000 
1 1 1 15 6  25 o 1.227000  0.4155000     1.204000  0.5801000     1.251000  0.5950000     -0.4766000E-01 0.8310000 
1 1 1 15 7  0  o 3.258000  0.1357000     3.258000  0.1357000     3.258000  0.1357000     0.000000       0.000000  
1 1 1 15 7  1  o 3.587000  0.9204000E-01 3.737000  0.1253000     3.436000  0.1349000     0.3011000      0.1841000 
1 1 1 15 7  2  o 15.38000  0.1296000     15.33000  0.1830000     15.43000  0.1837000     -0.9957000E-01 0.2593000 
1 1 1 15 7  3  o 7.909000  0.9301000E-01 8.010000  0.1330000     7.809000  0.1301000     0.2006000      0.1860000 
1 1 1 15 7  4  o 4.484000  0.1185000     4.590000  0.1808000     4.379000  0.1532000     0.2109000      0.2370000 
1 1 1 15 7  5  o 3.930000  0.1698000     3.936000  0.2151000     3.923000  0.2627000     0.1257000E-01  0.3395000 
1 1 1 15 7  6  f 5.665000  0.1332000     5.630000  0.1817000     5.700000  0.1948000     -0.7022000E-01 0.2664000 
1 1 1 15 7  7  o 6.434000  0.1408000     6.409000  0.1938000     6.459000  0.2043000     -0.4945000E-01 0.2816000 
1 1 1 15 7  8  o 18.13000  0.1815000     18.25000  0.2170000     18.01000  0.2911000     0.2361000      0.3631000 
1 1 1 15 7  9  o 9.201000  0.1954000     9.290000  0.2056000     9.113000  0.3323000     0.1772000      0.3907000 
1 1 1 15 7  10 o 2.758000  0.4323000     2.643000  0.6329000     2.872000  0.5892000     -0.2285000     0.8647000 
1 1 1 15 7  11 o 8.746000  0.2319000     8.844000  0.3287000     8.647000  0.3271000     0.1967000      0.4637000 
1 1 1 15 7  12 o 6.981000  0.2354000     7.416000  0.3244000     6.545000  0.3411000     0.8704000      0.4707000 
1 1 1 15 7  13 o 1.799000  0.5212000     1.872000  0.7521000     1.726000  0.7218000     0.1465000      1.042000  
1 1 1 15 7  14 o 7.302000  0.2638000     7.270000  0.3739000     7.334000  0.3721000     -0.6403000E-01 0.5275000 
1 1 1 15 7  15 o 2.974000  0.5820000     2.777000  0.8396000     3.171000  0.8063000     -0.3941000     1.164000  
1 1 1 15 7  16 o 10.52000  0.3261000     10.41000  0.5011000     10.62000  0.4175000     -0.2083000     0.6522000 
1 1 1 15 7  17 o 6.052000  0.3791000     5.636000  0.5732000     6.469000  0.4962000     -0.8334000     0.7582000 
1 1 1 15 7  18 o 4.717000  0.5037000     5.198000  0.6349000     4.237000  0.7821000     0.9611000      1.007000  
1 1 1 15 7  19 o 2.938000  0.6574000     2.845000  0.9267000     3.031000  0.9328000     -0.1853000     1.315000  
1 1 1 15 7  20 o 1.901000  0.5539000     1.564000  0.7175000     2.238000  0.8442000     -0.6744000     1.108000  
1 1 1 15 7  21 o 2.001000  0.6033000     1.466000  0.7090000     2.536000  0.9763000     -1.070000      1.207000  
1 1 1 15 7  22 o 2.170000  0.5433000     2.177000  0.7705000     2.164000  0.7661000     0.1270000E-01  1.087000  
1 1 1 15 7  23 o 1.526000  0.4762000     1.447000  0.6590000     1.604000  0.6876000     -0.1567000     0.9524000 
1 1 1 15 7  24 o 1.543000  0.4781000     1.114000  0.5505000     1.972000  0.7817000     -0.8575000     0.9561000 
1 1 1 15 7  25 o 1.361000  0.4461000     1.298000  0.6150000     1.425000  0.6464000     -0.1273000     0.8923000 
1 1 1 15 8  0  o 26.27000  0.2927000     26.27000  0.2927000     26.27000  0.2927000     0.000000       0.000000  
1 1 1 15 8  1  o 5.351000  0.8457000E-01 5.256000  0.1186000     5.445000  0.1206000     -0.1892000     0.1691000 
1 1 1 15 8  2  o 10.21000  0.1003000     10.28000  0.1423000     10.14000  0.1414000     0.1345000      0.2007000 
1 1 1 15 8  3  o 22.50000  0.2234000     22.48000  0.3646000     22.53000  0.2583000     -0.5424000E-01 0.4468000 
1 1 1 15 8  4  o 13.46000  0.1313000     13.46000  0.2078000     13.47000  0.1606000     -0.1169000E-01 0.2626000 
1 1 1 15 8  5  o 6.456000  0.2203000     6.622000  0.4033000     6.289000  0.1773000     0.3323000      0.4406000 
1 1 1 15 8  6  f 12.07000  0.1333000     12.05000  0.1853000     12.09000  0.1917000     -0.3983000E-01 0.2666000 
1 1 1 15 8  7  o 6.906000  0.1395000     7.208000  0.1876000     6.603000  0.2066000     0.6053000      0.2790000 
1 1 1 15 8  8  o 6.013000  0.1588000     6.110000  0.2147000     5.917000  0.2340000     0.1936000      0.3176000 
1 1 1 15 8  9  o 10.72000  0.2046000     11.02000  0.2333000     10.42000  0.3362000     0.5986000      0.4093000 
1 1 1 15 8  10 o 1.795000  0.4363000     1.143000  0.4972000     2.447000  0.7170000     -1.304000      0.8725000 
1 1 1 15 8  11 o 2.656000  0.5375000     2.711000  0.7708000     2.601000  0.7492000     0.1100000      1.075000  
1 1 1 15 8  12 f 8.639000  0.2078000     8.874000  0.2909000     8.404000  0.2967000     0.4693000      0.4155000 
1 1 1 15 8  13 o 3.934000  0.4079000     3.798000  0.6009000     4.070000  0.5517000     -0.2719000     0.8158000 
1 1 1 15 8  14 o 5.140000  0.3937000     5.388000  0.5343000     4.891000  0.5783000     0.4972000      0.7874000 
1 1 1 15 8  15 f 6.935000  0.3056000     6.399000  0.4570000     7.471000  0.4059000     -1.072000      0.6112000 
1 1 1 15 8  16 o 4.946000  0.6162000     5.123000  0.8505000     4.769000  0.8918000     0.3541000      1.232000  
1 1 1 15 8  17 o 5.937000  0.3807000     5.872000  0.5389000     6.002000  0.5380000     -0.1293000     0.7615000 
1 1 1 15 8  18 o 5.558000  0.4291000     5.112000  0.6546000     6.004000  0.5549000     -0.8920000     0.8581000 
1 1 1 15 8  19 o 2.787000  0.6837000     2.486000  0.9533000     3.087000  0.9802000     -0.6011000     1.367000  
1 1 1 15 8  20 o 1.918000  0.5544000     1.596000  0.7231000     2.240000  0.8407000     -0.6445000     1.109000  
1 1 1 15 8  21 o 1.681000  0.5448000     1.596000  0.7518000     1.765000  0.7886000     -0.1694000     1.090000  
1 1 1 15 8  22 o 1.980000  0.5359000     2.079000  0.7680000     1.881000  0.7475000     0.1986000      1.072000  
1 1 1 15 8  23 f 1.900000  0.5227000     1.634000  0.6974000     2.166000  0.7788000     -0.5320000     1.045000  
1 1 1 15 8  24 o 1.303000  0.4371000     1.089000  0.5402000     1.516000  0.6872000     -0.4270000     0.8741000 
1 1 1 15 8  25 o 1.384000  0.4481000     1.200000  0.5764000     1.568000  0.6862000     -0.3675000     0.8961000 
1 1 1 15 9  0  o 5.648000  0.1234000     5.648000  0.1234000     5.648000  0.1234000     -0.000000      0.000000  
1 1 1 15 9  1  o 19.14000  0.1567000     18.96000  0.2195000     19.32000  0.2236000     -0.3524000     0.3134000 
1 1 1 15 9  2  o 8.076000  0.9346000E-01 8.052000  0.1321000     8.100000  0.1322000     -0.4820000E-01 0.1869000 
1 1 1 15 9  3  o 4.325000  0.1298000     4.320000  0.1661000     4.329000  0.1995000     -0.9450000E-02 0.2596000 
1 1 1 15 9  4  o 2.644000  0.1741000     2.325000  0.2579000     2.963000  0.2340000     -0.6375000     0.3482000 
1 1 1 15 9  5  o 8.868000  0.1590000     9.033000  0.2684000     8.704000  0.1706000     0.3295000      0.3180000 
1 1 1 15 9  6  o 4.858000  0.1510000     4.786000  0.2092000     4.929000  0.2179000     -0.1432000     0.3021000 
1 1 1 15 9  7  o 10.67000  0.1378000     10.74000  0.1900000     10.61000  0.1998000     0.1338000      0.2757000 
1 1 1 15 9  8  o 9.260000  0.1441000     9.102000  0.1987000     9.418000  0.2087000     -0.3161000     0.2881000 
1 1 1 15 9  9  o 4.461000  0.3928000     4.860000  0.2911000     4.062000  0.7298000     0.7981000      0.7857000 
1 1 1 15 9  10 o 5.856000  0.2268000     6.078000  0.2292000     5.633000  0.3915000     0.4452000      0.4536000 
1 1 1 15 9  11 o 10.56000  0.1884000     10.60000  0.2116000     10.52000  0.3117000     0.7875000E-01  0.3767000 
1 1 1 15 9  12 o 11.89000  0.1905000     11.79000  0.2694000     11.99000  0.2693000     -0.1948000     0.3809000 
1 1 1 15 9  13 o 8.660000  0.2275000     8.799000  0.3185000     8.521000  0.3248000     0.2780000      0.4549000 
1 1 1 15 9  14 o 6.453000  0.3400000     5.729000  0.5313000     7.177000  0.4244000     -1.449000      0.6800000 
1 1 1 15 9  15 o 6.329000  0.3202000     6.210000  0.4505000     6.448000  0.4551000     -0.2378000     0.6403000 
1 1 1 15 9  16 o 2.810000  0.6691000     3.198000  0.9748000     2.422000  0.9168000     0.7755000      1.338000  
1 1 1 15 9  17 o 5.530000  0.4132000     5.233000  0.6221000     5.826000  0.5440000     -0.5930000     0.8264000 
1 1 1 15 9  18 o 4.157000  0.5589000     4.245000  0.7815000     4.069000  0.7992000     0.1760000      1.118000  
1 1 1 15 9  19 o 5.039000  0.5052000     4.875000  0.7457000     5.203000  0.6817000     -0.3289000     1.010000  
1 1 1 15 9  20 o 2.106000  0.5741000     2.335000  0.8303000     1.877000  0.7931000     0.4580000      1.148000  
1 1 1 15 9  21 o 1.922000  0.5592000     1.433000  0.6784000     2.410000  0.8891000     -0.9765000     1.118000  
1 1 1 15 9  22 o 1.762000  0.4903000     1.233000  0.5896000     2.291000  0.7835000     -1.058000      0.9806000 
1 1 1 15 9  23 f 1.587000  0.4856000     1.685000  0.7069000     1.490000  0.6659000     0.1951000      0.9711000 
1 1 1 15 9  24 o 1.654000  0.5362000     1.751000  0.7953000     1.557000  0.7194000     0.1940000      1.072000  
1 1 1 15 9  25 o 1.311000  0.4335000     1.086000  0.5341000     1.536000  0.6831000     -0.4495000     0.8671000 
1 1 1 15 10 0  o 1.096000  0.4381000     1.096000  0.4381000     1.096000  0.4381000     0.000000       0.000000  
1 1 1 15 10 1  o 14.16000  0.1246000     14.16000  0.1757000     14.16000  0.1767000     0.2078000E-02  0.2491000 
1 1 1 15 10 2  o 4.049000  0.1354000     4.025000  0.2234000     4.073000  0.1530000     -0.4799000E-01 0.2708000 
1 1 1 15 10 3  o 16.69000  0.1540000     16.72000  0.2041000     16.65000  0.2307000     0.7478000E-01  0.3081000 
1 1 1 15 10 4  o 15.17000  0.1801000     14.95000  0.2190000     15.39000  0.2859000     -0.4392000     0.3601000 
1 1 1 15 10 5  o 8.717000  0.1107000     8.753000  0.1568000     8.680000  0.1563000     0.7360000E-01  0.2213000 
1 1 1 15 10 6  o 2.037000  0.2787000     1.817000  0.4664000     2.256000  0.3053000     -0.4389000     0.5575000 
1 1 1 15 10 7  f 4.007000  0.2055000     3.715000  0.3097000     4.299000  0.2702000     -0.5844000     0.4110000 
1 1 1 15 10 8  o 8.291000  0.1497000     8.343000  0.2054000     8.238000  0.2178000     0.1049000      0.2994000 
1 1 1 15 10 9  o 14.48000  0.2054000     14.22000  0.2241000     14.74000  0.3443000     -0.5198000     0.4108000 
1 1 1 15 10 10 o 19.62000  0.2050000     19.63000  0.2678000     19.60000  0.3106000     0.3640000E-01  0.4101000 
1 1 1 15 10 11 o 2.397000  0.3956000     2.327000  0.5468000     2.466000  0.5718000     -0.1386000     0.7912000 
1 1 1 15 10 12 o 6.998000  0.2376000     7.204000  0.2475000     6.792000  0.4056000     0.4122000      0.4752000 
1 1 1 15 10 13 o 13.72000  0.2185000     13.66000  0.2832000     13.79000  0.3328000     -0.1341000     0.4370000 
1 1 1 15 10 14 o 13.28000  0.2417000     13.45000  0.3431000     13.12000  0.3405000     0.3383000      0.4834000 
1 1 1 15 10 15 o 2.028000  0.5842000     1.946000  0.8099000     2.110000  0.8423000     -0.1635000     1.168000  
1 1 1 15 10 16 o 2.231000  0.5872000     3.133000  0.9759000     1.329000  0.6534000     1.803000       1.174000  
1 1 1 15 10 17 o 3.480000  0.5670000     2.327000  0.9032000     4.633000  0.6856000     -2.306000      1.134000  
1 1 1 15 10 18 o 4.633000  0.5457000     4.745000  0.6932000     4.521000  0.8431000     0.2247000      1.091000  
1 1 1 15 10 19 o 2.155000  0.6334000     2.335000  0.9309000     1.975000  0.8591000     0.3600000      1.267000  
1 1 1 15 10 20 o 4.552000  0.4320000     4.296000  0.6258000     4.809000  0.5957000     -0.5123000     0.8640000 
1 1 1 15 10 21 o 1.484000  0.4919000     1.402000  0.6648000     1.566000  0.7251000     -0.1638000     0.9838000 
1 1 1 15 10 22 o 1.644000  0.4947000     1.453000  0.6603000     1.835000  0.7368000     -0.3819000     0.9894000 
1 1 1 15 10 23 o 1.720000  0.4921000     2.064000  0.7535000     1.376000  0.6333000     0.6876000      0.9843000 
1 1 1 15 10 24 o 2.124000  0.6100000     2.125000  0.8763000     2.122000  0.8490000     0.3090000E-02  1.220000  
1 1 1 15 10 25 o 1.559000  0.4819000     1.407000  0.6463000     1.711000  0.7150000     -0.3041000     0.9638000 
1 1 1 15 11 0  o 4.614000  0.1440000     4.614000  0.1440000     4.614000  0.1440000     0.000000       0.000000  
1 1 1 15 11 1  o 12.69000  0.1271000     12.78000  0.1931000     12.59000  0.1652000     0.1989000      0.2541000 
1 1 1 15 11 2  o 18.09000  0.1955000     17.96000  0.2462000     18.22000  0.3037000     -0.2642000     0.3910000 
1 1 1 15 11 3  o 1.550000  0.3156000     1.571000  0.3682000     1.528000  0.5127000     0.4297000E-01  0.6312000 
1 1 1 15 11 4  o 6.328000  0.1218000     6.431000  0.1912000     6.224000  0.1511000     0.2071000      0.2437000 
1 1 1 15 11 5  o 8.230000  0.1250000     8.190000  0.1939000     8.270000  0.1579000     -0.7999000E-01 0.2501000 
1 1 1 15 11 6  o 10.49000  0.1325000     10.43000  0.2111000     10.55000  0.1601000     -0.1236000     0.2649000 
1 1 1 15 11 7  o 10.67000  0.1386000     10.62000  0.1909000     10.72000  0.2010000     -0.9736000E-01 0.2772000 
1 1 1 15 11 8  o 9.924000  0.1688000     9.841000  0.2608000     10.01000  0.2143000     -0.1657000     0.3376000 
1 1 1 15 11 9  o 5.895000  0.1810000     5.758000  0.2470000     6.033000  0.2646000     -0.2750000     0.3619000 
1 1 1 15 11 10 o 10.30000  0.1810000     10.36000  0.2481000     10.25000  0.2637000     0.1175000      0.3621000 
1 1 1 15 11 11 o 15.00000  0.1743000     14.87000  0.2446000     15.12000  0.2484000     -0.2520000     0.3487000 
1 1 1 15 11 12 o 15.95000  0.1827000     15.62000  0.2555000     16.28000  0.2611000     -0.6618000     0.3654000 
1 1 1 15 11 13 o 17.33000  0.2087000     17.15000  0.2423000     17.51000  0.3399000     -0.3577000     0.4174000 
1 1 1 15 11 14 o 8.424000  0.3799000     8.803000  0.3046000     8.044000  0.6962000     0.7594000      0.7599000 
1 1 1 15 11 15 o 6.394000  0.3368000     6.145000  0.4870000     6.642000  0.4654000     -0.4974000     0.6736000 
1 1 1 15 11 16 o 3.390000  0.6290000     3.542000  0.8271000     3.239000  0.9477000     0.3029000      1.258000  
1 1 1 15 11 17 o 8.915000  0.2921000     9.167000  0.4066000     8.663000  0.4194000     0.5036000      0.5841000 
1 1 1 15 11 18 o 2.388000  0.6504000     2.634000  0.9440000     2.141000  0.8950000     0.4928000      1.301000  
1 1 1 15 11 19 o 2.911000  0.6544000     3.578000  0.9451000     2.245000  0.9054000     1.333000       1.309000  
1 1 1 15 11 20 o 1.601000  0.5173000     1.529000  0.7069000     1.674000  0.7553000     -0.1448000     1.035000  
1 1 1 15 11 21 o 2.228000  0.6021000     2.196000  0.8256000     2.261000  0.8765000     -0.6545000E-01 1.204000  
1 1 1 15 11 22 o 1.271000  0.4259000     1.288000  0.6065000     1.254000  0.5980000     0.3388000E-01  0.8517000 
1 1 1 15 11 23 o 1.990000  0.5300000     1.803000  0.7270000     2.177000  0.7713000     -0.3748000     1.060000  
1 1 1 15 11 24 o 1.511000  0.4892000     1.417000  0.6680000     1.606000  0.7148000     -0.1891000     0.9784000 
1 1 1 15 11 25 o 1.712000  0.5030000     1.940000  0.7543000     1.484000  0.6656000     0.4554000      1.006000  
1 1 1 15 12 0  o 9.660000  0.2099000     9.660000  0.2099000     9.660000  0.2099000     -0.000000      0.000000  
1 1 1 15 12 1  o 11.39000  0.1816000     11.36000  0.1817000     11.41000  0.3144000     -0.5631000E-01 0.3631000 
1 1 1 15 12 2  o 6.543000  0.1381000     6.544000  0.1611000     6.542000  0.2244000     0.2893000E-02  0.2762000 
1 1 1 15 12 3  o 7.515000  0.1386000     7.466000  0.2126000     7.564000  0.1780000     -0.9775000E-01 0.2772000 
1 1 1 15 12 4  o 3.121000  0.1537000     3.077000  0.2202000     3.166000  0.2145000     -0.8864000E-01 0.3074000 
1 1 1 15 12 5  o 6.701000  0.1160000     6.984000  0.1618000     6.418000  0.1663000     0.5660000      0.2320000 
1 1 1 15 12 6  f 8.029000  0.1204000     7.962000  0.1715000     8.096000  0.1691000     -0.1337000     0.2408000 
1 1 1 15 12 7  o 8.119000  0.1379000     8.287000  0.2174000     7.951000  0.1696000     0.3353000      0.2758000 
1 1 1 15 12 8  o 7.204000  0.1704000     7.375000  0.2320000     7.033000  0.2497000     0.3420000      0.3409000 
1 1 1 15 12 9  o 2.912000  0.3164000     3.365000  0.3575000     2.459000  0.5221000     0.9056000      0.6328000 
1 1 1 15 12 10 o 1.713000  0.5326000     1.998000  0.8775000     1.428000  0.6039000     0.5700000      1.065000  
1 1 1 15 12 11 o 10.05000  0.1699000     10.10000  0.2370000     10.00000  0.2434000     0.9936000E-01  0.3397000 
1 1 1 15 12 12 o 12.16000  0.1750000     12.18000  0.2458000     12.15000  0.2491000     0.3544000E-01  0.3500000 
1 1 1 15 12 13 o 15.88000  0.1900000     15.97000  0.2666000     15.80000  0.2707000     0.1729000      0.3799000 
1 1 1 15 12 14 o 5.297000  0.4614000     5.898000  0.3557000     4.697000  0.8515000     1.201000       0.9228000 
1 1 1 15 12 15 o 10.12000  0.2404000     10.15000  0.2685000     10.10000  0.3988000     0.4632000E-01  0.4808000 
1 1 1 15 12 16 o 3.476000  0.5390000     3.133000  0.6524000     3.819000  0.8581000     -0.6865000     1.078000  
1 1 1 15 12 17 f 3.904000  0.5799000     3.330000  0.9057000     4.478000  0.7244000     -1.148000      1.160000  
1 1 1 15 12 18 o 4.985000  0.4730000     4.681000  0.7104000     5.289000  0.6247000     -0.6081000     0.9460000 
1 1 1 15 12 19 o 4.455000  0.6582000     4.984000  0.8892000     3.926000  0.9708000     1.058000       1.316000  
1 1 1 15 12 20 o 3.047000  0.6081000     2.997000  0.8623000     3.097000  0.8576000     -0.9920000E-01 1.216000  
1 1 1 15 12 21 o 4.880000  0.3493000     5.169000  0.4519000     4.591000  0.5327000     0.5784000      0.6985000 
1 1 1 15 12 22 o 1.471000  0.4644000     1.291000  0.6098000     1.651000  0.7007000     -0.3598000     0.9289000 
1 1 1 15 12 23 o 1.599000  0.4887000     1.626000  0.6957000     1.572000  0.6864000     0.5367000E-01  0.9773000 
1 1 1 15 12 24 o 1.520000  0.4899000     1.402000  0.6617000     1.638000  0.7227000     -0.2355000     0.9799000 
1 1 1 15 12 25 o 1.482000  0.4792000     1.330000  0.6248000     1.633000  0.7269000     -0.3027000     0.9585000 
1 1 1 15 13 0  o 11.62000  0.3204000     11.62000  0.3204000     11.62000  0.3204000     -0.000000      0.000000  
1 1 1 15 13 1  o 5.129000  0.1514000     5.123000  0.2135000     5.134000  0.2148000     -0.1048000E-01 0.3029000 
1 1 1 15 13 2  o 22.32000  0.2254000     22.20000  0.3670000     22.45000  0.2616000     -0.2478000     0.4507000 
1 1 1 15 13 3  o 9.381000  0.1109000     9.391000  0.1572000     9.371000  0.1566000     0.2006000E-01  0.2219000 
1 1 1 15 13 4  o 1.342000  0.2954000     1.444000  0.4214000     1.240000  0.4140000     0.2041000      0.5907000 
1 1 1 15 13 5  o 6.985000  0.1182000     7.052000  0.1676000     6.917000  0.1667000     0.1349000      0.2364000 
1 1 1 15 13 6  o 7.543000  0.1217000     7.685000  0.1721000     7.402000  0.1722000     0.2831000      0.2435000 
1 1 1 15 13 7  f 7.052000  0.1274000     7.165000  0.1843000     6.939000  0.1759000     0.2254000      0.2548000 
1 1 1 15 13 8  o 9.291000  0.2087000     9.369000  0.2629000     9.213000  0.3242000     0.1556000      0.4174000 
1 1 1 15 13 9  f 16.66000  0.1724000     16.50000  0.2406000     16.82000  0.2469000     -0.3222000     0.3448000 
1 1 1 15 13 10 o 14.30000  0.2180000     14.20000  0.3633000     14.40000  0.2411000     -0.2019000     0.4360000 
1 1 1 15 13 11 o 15.01000  0.1986000     15.17000  0.2498000     14.85000  0.3087000     0.3161000      0.3972000 
1 1 1 15 13 12 o 9.637000  0.1816000     9.670000  0.2494000     9.604000  0.2641000     0.6557000E-01  0.3633000 
1 1 1 15 13 13 o 14.28000  0.1857000     14.53000  0.2603000     14.02000  0.2650000     0.5149000      0.3715000 
1 1 1 15 13 14 o 11.19000  0.2607000     10.90000  0.2730000     11.49000  0.4443000     -0.5950000     0.5215000 
1 1 1 15 13 15 o 3.911000  0.3947000     3.818000  0.5170000     4.004000  0.5966000     -0.1858000     0.7895000 
1 1 1 15 13 16 o 4.622000  0.4983000     5.567000  0.3934000     3.677000  0.9157000     1.891000       0.9967000 
1 1 1 15 13 17 o 4.325000  0.5037000     4.343000  0.5040000     4.307000  0.8722000     0.3592000E-01  1.007000  
1 1 1 15 13 18 o 3.551000  0.6275000     3.505000  0.8823000     3.596000  0.8925000     -0.9130000E-01 1.255000  
1 1 1 15 13 19 o 3.205000  0.6738000     3.657000  0.9361000     2.753000  0.9695000     0.9038000      1.348000  
1 1 1 15 13 20 o 2.304000  0.5871000     2.803000  0.8672000     1.804000  0.7916000     0.9992000      1.174000  
1 1 1 15 13 21 o 1.658000  0.4944000     1.301000  0.6177000     2.016000  0.7721000     -0.7154000     0.9887000 
1 1 1 15 13 22 o 1.262000  0.4227000     1.194000  0.5750000     1.329000  0.6198000     -0.1355000     0.8454000 
1 1 1 15 13 23 o 1.599000  0.4653000     1.181000  0.5659000     2.016000  0.7388000     -0.8351000     0.9306000 
1 1 1 15 13 24 o 1.282000  0.4343000     1.184000  0.5827000     1.380000  0.6442000     -0.1960000     0.8687000 
1 1 1 15 13 25 o 1.258000  0.4291000     1.150000  0.5664000     1.366000  0.6449000     -0.2162000     0.8583000 
1 1 1 15 14 0  o 11.38000  0.1632000     11.38000  0.1632000     11.38000  0.1632000     0.000000       0.000000  
1 1 1 15 14 1  o 5.790000  0.1086000     5.768000  0.1536000     5.813000  0.1534000     -0.4437000E-01 0.2171000 
1 1 1 15 14 2  o 5.124000  0.1155000     5.051000  0.1633000     5.198000  0.1634000     -0.1477000     0.2310000 
1 1 1 15 14 3  o 17.78000  0.1552000     17.94000  0.2208000     17.61000  0.2182000     0.3339000      0.3104000 
1 1 1 15 14 4  o 6.049000  0.1173000     6.164000  0.1658000     5.935000  0.1658000     0.2290000      0.2345000 
1 1 1 15 14 5  o 10.77000  0.1227000     10.74000  0.1735000     10.80000  0.1735000     -0.6122000E-01 0.2454000 
1 1 1 15 14 6  o 5.735000  0.1337000     5.751000  0.1871000     5.719000  0.1911000     0.3213000E-01  0.2674000 
1 1 1 15 14 7  o 7.977000  0.1302000     7.918000  0.1819000     8.036000  0.1863000     -0.1182000     0.2604000 
1 1 1 15 14 8  o 3.340000  0.2665000     3.251000  0.4007000     3.428000  0.3513000     -0.1768000     0.5329000 
1 1 1 15 14 9  o 1.969000  0.3919000     1.236000  0.5301000     2.701000  0.5774000     -1.465000      0.7838000 
1 1 1 15 14 10 o 7.958000  0.1737000     8.221000  0.2392000     7.694000  0.2520000     0.5277000      0.3474000 
1 1 1 15 14 11 o 12.76000  0.1706000     13.00000  0.2393000     12.52000  0.2431000     0.4808000      0.3411000 
1 1 1 15 14 12 o 7.014000  0.2088000     6.924000  0.2862000     7.104000  0.3040000     -0.1795000     0.4176000 
1 1 1 15 14 13 o 10.54000  0.1961000     10.62000  0.2845000     10.46000  0.2701000     0.1587000      0.3923000 
1 1 1 15 14 14 f 19.03000  0.2086000     19.10000  0.2938000     18.96000  0.2962000     0.1431000      0.4172000 
1 1 1 15 14 15 o 10.70000  0.2299000     10.57000  0.3207000     10.83000  0.3294000     -0.2562000     0.4597000 
1 1 1 15 14 16 o 3.831000  0.4170000     3.962000  0.5477000     3.701000  0.6289000     0.2613000      0.8340000 
1 1 1 15 14 17 o 1.543000  0.4805000     1.434000  0.6528000     1.653000  0.7053000     -0.2190000     0.9610000 
1 1 1 15 14 18 o 3.310000  0.5915000     3.397000  0.6415000     3.223000  0.9941000     0.1744000      1.183000  
1 1 1 15 14 19 o 3.224000  0.6326000     3.625000  0.6588000     2.824000  1.080000      0.8006000      1.265000  
1 1 1 15 14 20 o 4.036000  0.5371000     3.270000  0.8513000     4.801000  0.6550000     -1.532000      1.074000  
1 1 1 15 14 21 o 4.001000  0.3981000     3.816000  0.5872000     4.187000  0.5376000     -0.3711000     0.7961000 
1 1 1 15 14 22 o 2.080000  0.5307000     1.950000  0.7453000     2.209000  0.7558000     -0.2589000     1.061000  
1 1 1 15 14 23 o 1.981000  0.5267000     1.974000  0.7444000     1.987000  0.7454000     -0.1308000E-01 1.053000  
1 1 1 15 14 24 o 1.334000  0.4417000     1.388000  0.6432000     1.281000  0.6057000     0.1066000      0.8835000 
1 1 1 15 14 25 o 1.320000  0.4433000     1.442000  0.6661000     1.199000  0.5852000     0.2432000      0.8867000 
1 1 1 15 15 0  o 5.842000  0.1572000     5.842000  0.1572000     5.842000  0.1572000     0.000000       0.000000  
1 1 1 15 15 1  o 4.426000  0.1237000     4.578000  0.1720000     4.274000  0.1779000     0.3038000      0.2475000 
1 1 1 15 15 2  o 9.137000  0.1110000     9.188000  0.1564000     9.086000  0.1574000     0.1016000      0.2220000 
1 1 1 15 15 3  o 10.91000  0.1194000     10.98000  0.1696000     10.83000  0.1680000     0.1452000      0.2388000 
1 1 1 15 15 4  o 11.15000  0.1229000     11.13000  0.1737000     11.16000  0.1738000     -0.2433000E-01 0.2457000 
1 1 1 15 15 5  o 9.442000  0.1217000     9.530000  0.1730000     9.355000  0.1713000     0.1754000      0.2434000 
1 1 1 15 15 6  o 19.75000  0.1752000     19.68000  0.2467000     19.82000  0.2488000     -0.1394000     0.3504000 
1 1 1 15 15 7  o 12.40000  0.1388000     12.44000  0.1965000     12.36000  0.1962000     0.8106000E-01  0.2776000 
1 1 1 15 15 8  o 16.03000  0.1685000     16.23000  0.2275000     15.84000  0.2487000     0.3944000      0.3370000 
1 1 1 15 15 9  o 13.16000  0.2020000     12.94000  0.3000000     13.38000  0.2705000     -0.4395000     0.4040000 
1 1 1 15 15 10 o 4.688000  0.2463000     4.712000  0.3244000     4.664000  0.3707000     0.4798000E-01  0.4926000 
1 1 1 15 15 11 o 7.822000  0.1847000     7.835000  0.2546000     7.809000  0.2677000     0.2588000E-01  0.3694000 
1 1 1 15 15 12 o 8.077000  0.1928000     7.955000  0.2648000     8.199000  0.2805000     -0.2439000     0.3857000 
1 1 1 15 15 13 o 6.991000  0.2312000     7.222000  0.2982000     6.760000  0.3534000     0.4615000      0.4624000 
1 1 1 15 15 14 o 5.627000  0.2725000     5.432000  0.3815000     5.822000  0.3891000     -0.3904000     0.5449000 
1 1 1 15 15 15 o 7.444000  0.4583000     8.013000  0.8281000     6.875000  0.3931000     1.138000       0.9167000 
1 1 1 15 15 16 o 6.843000  0.2670000     6.518000  0.3848000     7.168000  0.3703000     -0.6497000     0.5340000 
1 1 1 15 15 17 o 5.151000  0.3264000     5.081000  0.4732000     5.222000  0.4498000     -0.1411000     0.6528000 
1 1 1 15 15 18 o 4.749000  0.3688000     4.262000  0.5567000     5.236000  0.4837000     -0.9738000     0.7375000 
1 1 1 15 15 19 o 4.207000  0.4171000     3.706000  0.5728000     4.707000  0.6064000     -1.001000      0.8342000 
1 1 1 15 15 20 o 3.978000  0.5627000     3.941000  0.5737000     4.015000  0.9683000     -0.7467000E-01 1.125000  
1 1 1 15 15 21 o 1.514000  0.4550000     1.771000  0.6700000     1.258000  0.6159000     0.5125000      0.9101000 
1 1 1 15 15 22 o 2.202000  0.5446000     2.058000  0.6692000     2.346000  0.8594000     -0.2885000     1.089000  
1 1 1 15 15 23 o 1.439000  0.4580000     1.550000  0.6791000     1.327000  0.6147000     0.2236000      0.9160000 
1 1 1 15 15 24 f 1.462000  0.4603000     1.268000  0.5989000     1.656000  0.6992000     -0.3875000     0.9206000 
1 1 1 15 15 25 o 1.510000  0.4876000     1.326000  0.6450000     1.694000  0.7313000     -0.3684000     0.9751000 
1 1 1 15 16 0  o 14.17000  0.1881000     14.17000  0.1881000     14.17000  0.1881000     -0.000000      0.000000  
1 1 1 15 16 1  o 6.313000  0.1129000     6.324000  0.1602000     6.302000  0.1591000     0.2149000E-01  0.2257000 
1 1 1 15 16 2  o 16.09000  0.1457000     16.20000  0.2066000     15.98000  0.2055000     0.2168000      0.2914000 
1 1 1 15 16 3  o 16.42000  0.1486000     16.18000  0.2079000     16.66000  0.2125000     -0.4739000     0.2973000 
1 1 1 15 16 4  o 9.314000  0.1197000     9.201000  0.1701000     9.428000  0.1683000     -0.2279000     0.2393000 
1 1 1 15 16 5  o 9.642000  0.1232000     9.507000  0.1740000     9.777000  0.1746000     -0.2698000     0.2465000 
1 1 1 15 16 6  o 4.439000  0.1582000     4.298000  0.2226000     4.581000  0.2248000     -0.2831000     0.3164000 
1 1 1 15 16 7  o 6.841000  0.1684000     6.887000  0.2727000     6.796000  0.1976000     0.9100000E-01  0.3368000 
1 1 1 15 16 8  o 18.22000  0.1722000     18.41000  0.2450000     18.04000  0.2421000     0.3687000      0.3445000 
1 1 1 15 16 9  o 7.123000  0.3235000     6.863000  0.5968000     7.382000  0.2500000     -0.5188000     0.6471000 
1 1 1 15 16 10 o 9.707000  0.1665000     9.694000  0.2318000     9.720000  0.2392000     -0.2604000E-01 0.3331000 
1 1 1 15 16 11 o 16.64000  0.1840000     16.72000  0.2585000     16.55000  0.2621000     0.1688000      0.3681000 
1 1 1 15 16 12 o 6.731000  0.2164000     6.783000  0.2971000     6.680000  0.3148000     0.1030000      0.4328000 
1 1 1 15 16 13 o 5.349000  0.2886000     5.505000  0.3898000     5.192000  0.4256000     0.3128000      0.5771000 
1 1 1 15 16 14 o 6.422000  0.2609000     6.777000  0.3457000     6.068000  0.3909000     0.7097000      0.5218000 
1 1 1 15 16 15 o 11.17000  0.3079000     10.70000  0.5400000     11.64000  0.2958000     -0.9408000     0.6157000 
1 1 1 15 16 16 o 13.97000  0.2123000     13.87000  0.3010000     14.08000  0.2995000     -0.2146000     0.4246000 
1 1 1 15 16 17 o 4.565000  0.3768000     4.672000  0.5096000     4.459000  0.5552000     0.2138000      0.7536000 
1 1 1 15 16 18 o 1.857000  0.5231000     2.102000  0.7631000     1.612000  0.7158000     0.4902000      1.046000  
1 1 1 15 16 19 o 1.689000  0.5123000     1.539000  0.6827000     1.839000  0.7640000     -0.2997000     1.025000  
1 1 1 15 16 20 o 3.519000  0.5420000     3.160000  0.8682000     3.878000  0.6490000     -0.7181000     1.084000  
1 1 1 15 16 21 o 1.577000  0.4629000     1.364000  0.6043000     1.790000  0.7012000     -0.4262000     0.9257000 
1 1 1 15 16 22 o 2.691000  0.5127000     3.087000  0.5533000     2.295000  0.8632000     0.7918000      1.025000  
1 1 1 15 16 23 o 1.637000  0.4314000     2.208000  0.6779000     1.065000  0.5338000     1.143000       0.8628000 
1 1 1 15 16 24 o 1.275000  0.4149000     1.445000  0.6199000     1.105000  0.5518000     0.3403000      0.8299000 
1 1 1 15 16 25 f 1.255000  0.4340000     0.9747000 0.4970000     1.535000  0.7115000     -0.5602000     0.8679000 
1 1 1 15 17 0  o 0.7659000 0.4647000     0.7659000 0.4647000     0.7659000 0.4647000     0.000000       0.000000  
1 1 1 15 17 1  o 6.500000  0.1142000     6.436000  0.1621000     6.563000  0.1610000     -0.1278000     0.2285000 
1 1 1 15 17 2  o 4.809000  0.1315000     4.718000  0.1845000     4.900000  0.1875000     -0.1816000     0.2631000 
1 1 1 15 17 3  o 2.819000  0.1941000     2.885000  0.2652000     2.754000  0.2835000     0.1305000      0.3882000 
1 1 1 15 17 4  o 9.047000  0.1207000     9.097000  0.1704000     8.997000  0.1712000     0.9949000E-01  0.2415000 
1 1 1 15 17 5  o 8.974000  0.1253000     8.936000  0.1771000     9.012000  0.1772000     -0.7570000E-01 0.2505000 
1 1 1 15 17 6  o 7.801000  0.1310000     7.935000  0.1836000     7.668000  0.1870000     0.2668000      0.2620000 
1 1 1 15 17 7  o 7.224000  0.1950000     7.038000  0.2148000     7.409000  0.3256000     -0.3703000     0.3901000 
1 1 1 15 17 8  o 8.778000  0.1518000     8.766000  0.2000000     8.790000  0.2283000     -0.2398000E-01 0.3035000 
1 1 1 15 17 9  o 9.076000  0.1644000     9.173000  0.2568000     8.979000  0.2054000     0.1937000      0.3288000 
1 1 1 15 17 10 o 19.03000  0.2187000     19.01000  0.3674000     19.05000  0.2373000     -0.4730000E-01 0.4374000 
1 1 1 15 17 11 o 13.66000  0.1751000     13.99000  0.2458000     13.33000  0.2496000     0.6638000      0.3503000 
1 1 1 15 17 12 o 5.794000  0.2365000     5.712000  0.3204000     5.876000  0.3479000     -0.1640000     0.4729000 
1 1 1 15 17 13 o 8.201000  0.3637000     8.397000  0.3182000     8.005000  0.6540000     0.3920000      0.7274000 
1 1 1 15 17 14 o 10.38000  0.2093000     9.912000  0.2901000     10.85000  0.3017000     -0.9403000     0.4186000 
1 1 1 15 17 15 o 7.347000  0.3150000     7.711000  0.5119000     6.984000  0.3673000     0.7273000      0.6300000 
1 1 1 15 17 16 o 4.127000  0.4399000     4.991000  0.4703000     3.264000  0.7437000     1.727000       0.8799000 
1 1 1 15 17 17 o 5.333000  0.3381000     5.319000  0.4589000     5.346000  0.4967000     -0.2740000E-01 0.6763000 
1 1 1 15 17 18 o 2.620000  0.5668000     2.983000  0.7664000     2.256000  0.8353000     0.7268000      1.134000  
1 1 1 15 17 19 o 2.035000  0.5266000     1.599000  0.6931000     2.471000  0.7929000     -0.8722000     1.053000  
1 1 1 15 17 20 o 2.556000  0.7324000     3.143000  1.256000      1.970000  0.7533000     1.173000       1.465000  
1 1 1 15 17 21 o 1.244000  0.4077000     1.456000  0.6399000     1.032000  0.5054000     0.4237000      0.8155000 
1 1 1 15 17 22 o 1.984000  0.5082000     1.841000  0.7087000     2.127000  0.7286000     -0.2868000     1.016000  
1 1 1 15 17 23 o 1.317000  0.4275000     1.205000  0.5703000     1.429000  0.6370000     -0.2248000     0.8550000 
1 1 1 15 17 24 o 1.401000  0.4371000     1.416000  0.6097000     1.386000  0.6264000     0.3039000E-01  0.8741000 
1 1 1 15 17 25 o 1.469000  0.4988000     1.344000  0.6538000     1.595000  0.7535000     -0.2511000     0.9977000 
1 1 1 15 18 0  o 0.9338000 0.5140000     0.9338000 0.5140000     0.9338000 0.5140000     -0.000000      0.000000  
1 1 1 15 18 1  o 2.383000  0.2250000     2.098000  0.3488000     2.668000  0.2844000     -0.5703000     0.4501000 
1 1 1 15 18 2  o 15.01000  0.1417000     15.09000  0.2009000     14.92000  0.1998000     0.1695000      0.2833000 
1 1 1 15 18 3  o 10.65000  0.1236000     10.54000  0.1743000     10.76000  0.1751000     -0.2265000     0.2471000 
1 1 1 15 18 4  o 6.470000  0.1271000     6.515000  0.1806000     6.425000  0.1789000     0.9009000E-01  0.2543000 
1 1 1 15 18 5  o 8.741000  0.1276000     8.743000  0.1798000     8.739000  0.1810000     0.3901000E-02  0.2551000 
1 1 1 15 18 6  o 11.05000  0.1489000     11.02000  0.2292000     11.08000  0.1901000     -0.6093000E-01 0.2978000 
1 1 1 15 18 7  f 9.809000  0.1435000     9.852000  0.1918000     9.766000  0.2136000     0.8646000E-01  0.2871000 
1 1 1 15 18 8  o 4.997000  0.2308000     4.950000  0.2651000     5.043000  0.3779000     -0.9331000E-01 0.4616000 
1 1 1 15 18 9  o 7.335000  0.1546000     7.529000  0.2102000     7.141000  0.2268000     0.3870000      0.3092000 
1 1 1 15 18 10 o 24.41000  0.2268000     24.54000  0.3615000     24.27000  0.2740000     0.2719000      0.4536000 
1 1 1 15 18 11 o 4.242000  0.2778000     4.047000  0.3823000     4.437000  0.4031000     -0.3906000     0.5556000 
1 1 1 15 18 12 o 20.75000  0.2086000     20.73000  0.2929000     20.78000  0.2971000     -0.5072000E-01 0.4172000 
1 1 1 15 18 13 o 5.860000  0.4197000     6.873000  0.3472000     4.847000  0.7641000     2.026000       0.8393000 
1 1 1 15 18 14 o 1.649000  0.4981000     1.447000  0.6401000     1.851000  0.7632000     -0.4038000     0.9961000 
1 1 1 15 18 15 o 8.895000  0.2259000     8.784000  0.3189000     9.007000  0.3202000     -0.2231000     0.4519000 
1 1 1 15 18 16 o 4.460000  0.3870000     4.031000  0.5757000     4.889000  0.5172000     -0.8579000     0.7740000 
1 1 1 15 18 17 o 3.029000  0.5300000     3.226000  0.6963000     2.833000  0.7992000     0.3930000      1.060000  
1 1 1 15 18 18 o 2.815000  0.5413000     3.496000  0.7002000     2.134000  0.8256000     1.362000       1.083000  
1 1 1 15 18 19 o 2.042000  0.5271000     2.453000  0.7757000     1.632000  0.7140000     0.8211000      1.054000  
1 1 1 15 18 20 o 3.009000  0.6152000     3.440000  0.9850000     2.577000  0.7374000     0.8637000      1.230000  
1 1 1 15 18 21 o 2.913000  0.4780000     3.101000  0.6413000     2.726000  0.7090000     0.3755000      0.9560000 
1 1 1 15 18 22 o 1.490000  0.4560000     1.521000  0.6497000     1.459000  0.6400000     0.6165000E-01  0.9119000 
1 1 1 15 18 23 o 2.059000  0.5219000     1.990000  0.7210000     2.127000  0.7548000     -0.1368000     1.044000  
1 1 1 15 18 24 o 1.244000  0.4035000     1.527000  0.6514000     0.9619000 0.4764000     0.5648000      0.8070000 
1 1 1 15 19 0  o 13.19000  0.1874000     13.19000  0.1874000     13.19000  0.1874000     -0.000000      0.000000  
1 1 1 15 19 1  o 8.601000  0.1176000     8.515000  0.1657000     8.688000  0.1670000     -0.1731000     0.2352000 
1 1 1 15 19 2  o 10.55000  0.1242000     10.42000  0.1748000     10.67000  0.1764000     -0.2559000     0.2483000 
1 1 1 15 19 3  o 10.24000  0.1251000     10.24000  0.1766000     10.24000  0.1772000     0.1032000E-02  0.2502000 
1 1 1 15 19 4  o 12.01000  0.1332000     12.01000  0.1882000     12.00000  0.1887000     0.1814000E-01  0.2665000 
1 1 1 15 19 5  o 2.651000  0.2448000     2.580000  0.3507000     2.722000  0.3416000     -0.1415000     0.4895000 
1 1 1 15 19 6  o 10.13000  0.1856000     10.46000  0.2677000     9.797000  0.2571000     0.6660000      0.3712000 
1 1 1 15 19 7  o 2.183000  0.3422000     2.290000  0.4410000     2.075000  0.5233000     0.2154000      0.6844000 
1 1 1 15 19 8  o 5.267000  0.2071000     5.507000  0.3324000     5.028000  0.2472000     0.4785000      0.4143000 
1 1 1 15 19 9  f 3.650000  0.2370000     3.831000  0.3188000     3.470000  0.3507000     0.3614000      0.4740000 
1 1 1 15 19 10 o 2.306000  0.3774000     2.444000  0.5224000     2.169000  0.5449000     0.2757000      0.7549000 
1 1 1 15 19 11 o 5.081000  0.2299000     5.091000  0.3664000     5.071000  0.2778000     0.2060000E-01  0.4599000 
1 1 1 15 19 12 o 7.638000  0.2075000     7.152000  0.2998000     8.124000  0.2871000     -0.9729000     0.4151000 
1 1 1 15 19 13 o 1.563000  0.4470000     1.063000  0.5146000     2.062000  0.7310000     -0.9990000     0.8939000 
1 1 1 15 19 14 o 10.55000  0.2449000     10.53000  0.3519000     10.56000  0.3406000     -0.2837000E-01 0.4898000 
1 1 1 15 19 15 o 6.165000  0.2982000     6.823000  0.3708000     5.508000  0.4671000     1.315000       0.5963000 
1 1 1 15 19 16 o 5.597000  0.3174000     5.283000  0.4520000     5.912000  0.4458000     -0.6287000     0.6349000 
1 1 1 15 19 17 o 6.174000  0.3026000     6.077000  0.4161000     6.270000  0.4396000     -0.1928000     0.6052000 
1 1 1 15 19 18 o 2.752000  0.6605000     3.087000  0.7744000     2.416000  1.070000      0.6712000      1.321000  
1 1 1 15 19 19 o 3.764000  0.4503000     4.252000  0.5480000     3.276000  0.7147000     0.9757000      0.9006000 
1 1 1 15 19 20 o 1.541000  0.4756000     1.478000  0.6565000     1.605000  0.6884000     -0.1267000     0.9512000 
1 1 1 15 19 21 o 1.849000  0.4809000     2.266000  0.7160000     1.431000  0.6422000     0.8351000      0.9618000 
1 1 1 15 19 22 o 1.410000  0.4268000     0.9999000 0.4910000     1.821000  0.6984000     -0.8207000     0.8537000 
1 1 1 15 19 23 f 1.417000  0.4889000     1.224000  0.5759000     1.611000  0.7903000     -0.3865000     0.9779000 
1 1 1 15 19 24 o 1.263000  0.4070000     0.9223000 0.4601000     1.604000  0.6714000     -0.6816000     0.8139000 
1 1 1 15 20 0  o 14.95000  0.2028000     14.95000  0.2028000     14.95000  0.2028000     -0.000000      0.000000  
1 1 1 15 20 1  f 12.90000  0.1333000     13.08000  0.1902000     12.72000  0.1869000     0.3661000      0.2666000 
1 1 1 15 20 2  o 3.602000  0.1774000     3.490000  0.2559000     3.713000  0.2456000     -0.2222000     0.3547000 
1 1 1 15 20 3  o 2.730000  0.2326000     2.401000  0.3646000     3.059000  0.2889000     -0.6587000     0.4652000 
1 1 1 15 20 4  o 18.38000  0.1672000     18.32000  0.2356000     18.44000  0.2373000     -0.1239000     0.3344000 
1 1 1 15 20 5  o 18.18000  0.1831000     18.14000  0.2787000     18.23000  0.2376000     -0.9375000E-01 0.3663000 
1 1 1 15 20 6  o 7.397000  0.1464000     7.695000  0.1935000     7.099000  0.2197000     0.5962000      0.2927000 
1 1 1 15 20 7  o 8.465000  0.1832000     8.005000  0.2175000     8.926000  0.2948000     -0.9210000     0.3663000 
1 1 1 15 20 8  o 4.516000  0.1921000     4.437000  0.2627000     4.596000  0.2804000     -0.1587000     0.3842000 
1 1 1 15 20 9  o 20.80000  0.1916000     20.56000  0.2688000     21.03000  0.2730000     -0.4630000     0.3831000 
1 1 1 15 20 10 o 2.584000  0.3508000     2.625000  0.4705000     2.543000  0.5203000     0.8218000E-01  0.7015000 
1 1 1 15 20 11 o 10.74000  0.1748000     10.68000  0.2766000     10.80000  0.2137000     -0.1196000     0.3495000 
1 1 1 15 20 12 o 4.024000  0.3595000     4.175000  0.4798000     3.872000  0.5356000     0.3038000      0.7191000 
1 1 1 15 20 13 o 3.371000  0.4276000     2.646000  0.6795000     4.096000  0.5192000     -1.450000      0.8551000 
1 1 1 15 20 14 f 3.167000  0.6598000     2.950000  1.158000      3.385000  0.6323000     -0.4356000     1.320000  
1 1 1 15 20 15 o 6.883000  0.2652000     6.669000  0.3742000     7.098000  0.3760000     -0.4292000     0.5305000 
1 1 1 15 20 16 o 3.568000  0.4768000     3.595000  0.6416000     3.540000  0.7054000     0.5450000E-01  0.9536000 
1 1 1 15 20 17 o 2.993000  0.5305000     2.304000  0.7878000     3.683000  0.7108000     -1.378000      1.061000  
1 1 1 15 20 18 o 5.687000  0.4904000     6.125000  0.4130000     5.249000  0.8895000     0.8762000      0.9807000 
1 1 1 15 20 19 o 4.142000  0.4244000     4.068000  0.5609000     4.216000  0.6371000     -0.1474000     0.8488000 
1 1 1 15 20 20 o 2.916000  0.4714000     3.714000  0.5676000     2.117000  0.7527000     1.597000       0.9427000 
1 1 1 15 20 21 o 1.183000  0.3971000     1.115000  0.5358000     1.251000  0.5864000     -0.1359000     0.7943000 
1 1 1 15 20 22 o 1.269000  0.4064000     1.575000  0.6576000     0.9642000 0.4779000     0.6105000      0.8129000 
1 1 1 15 20 23 o 1.204000  0.4247000     0.9199000 0.4586000     1.488000  0.7150000     -0.5680000     0.8494000 
1 1 1 15 20 24 o 1.721000  0.4538000     2.277000  0.7187000     1.166000  0.5543000     1.111000       0.9077000 
1 1 1 15 21 0  o 1.694000  0.5344000     1.694000  0.5344000     1.694000  0.5344000     -0.000000      0.000000  
1 1 1 15 21 1  o 20.56000  0.1793000     20.73000  0.2554000     20.38000  0.2518000     0.3543000      0.3587000 
1 1 1 15 21 2  o 6.316000  0.1329000     6.390000  0.1863000     6.241000  0.1897000     0.1490000      0.2659000 
1 1 1 15 21 3  o 6.962000  0.1322000     6.994000  0.1852000     6.931000  0.1886000     0.6301000E-01  0.2644000 
1 1 1 15 21 4  f 4.726000  0.1578000     4.560000  0.2270000     4.891000  0.2192000     -0.3305000     0.3156000 
1 1 1 15 21 5  o 19.31000  0.2232000     19.22000  0.2830000     19.39000  0.3453000     -0.1716000     0.4464000 
1 1 1 15 21 6  o 28.39000  0.2562000     28.24000  0.3330000     28.55000  0.3895000     -0.3077000     0.5124000 
1 1 1 15 21 7  o 5.373000  0.2041000     5.225000  0.3336000     5.522000  0.2351000     -0.2967000     0.4081000 
1 1 1 15 21 8  o 16.16000  0.1657000     16.04000  0.2338000     16.28000  0.2349000     -0.2352000     0.3314000 
1 1 1 15 21 9  o 8.279000  0.1540000     8.226000  0.2171000     8.332000  0.2185000     -0.1059000     0.3080000 
1 1 1 15 21 10 o 20.11000  0.1914000     19.87000  0.2681000     20.36000  0.2733000     -0.4906000     0.3829000 
1 1 1 15 21 11 o 9.725000  0.1616000     9.877000  0.2294000     9.573000  0.2278000     0.3044000      0.3233000 
1 1 1 15 21 12 o 7.458000  0.2596000     7.128000  0.3840000     7.788000  0.3495000     -0.6596000     0.5192000 
1 1 1 15 21 13 o 3.316000  0.4340000     3.235000  0.5958000     3.397000  0.6311000     -0.1616000     0.8679000 
1 1 1 15 21 14 o 4.870000  0.4425000     4.357000  0.7756000     5.383000  0.4260000     -1.026000      0.8849000 
1 1 1 15 21 15 o 1.903000  0.5178000     1.550000  0.6778000     2.256000  0.7831000     -0.7058000     1.036000  
1 1 1 15 21 16 o 8.504000  0.2440000     8.439000  0.3374000     8.569000  0.3525000     -0.1302000     0.4880000 
1 1 1 15 21 17 o 6.253000  0.2952000     6.189000  0.4079000     6.318000  0.4269000     -0.1284000     0.5904000 
1 1 1 15 21 18 o 1.534000  0.4779000     1.827000  0.7383000     1.241000  0.6070000     0.5852000      0.9557000 
1 1 1 15 21 19 o 2.293000  0.5807000     2.193000  0.8018000     2.392000  0.8404000     -0.1995000     1.161000  
1 1 1 15 21 20 o 3.233000  0.4641000     3.051000  0.6890000     3.415000  0.6221000     -0.3639000     0.9283000 
1 1 1 15 21 21 o 1.589000  0.4751000     1.528000  0.6539000     1.650000  0.6893000     -0.1218000     0.9501000 
1 1 1 15 21 22 o 1.259000  0.4139000     1.271000  0.5894000     1.247000  0.5813000     0.2378000E-01  0.8279000 
1 1 1 15 21 23 o 1.965000  0.5257000     2.230000  0.7044000     1.700000  0.7806000     0.5303000      1.051000  
1 1 1 15 21 24 o 1.381000  0.4447000     1.277000  0.5903000     1.486000  0.6652000     -0.2098000     0.8894000 
1 1 1 15 22 0  o 13.06000  0.1952000     13.06000  0.1952000     13.06000  0.1952000     -0.000000      0.000000  
1 1 1 15 22 1  o 7.922000  0.1274000     8.050000  0.1804000     7.794000  0.1800000     0.2552000      0.2548000 
1 1 1 15 22 2  o 15.20000  0.1489000     15.13000  0.2101000     15.28000  0.2111000     -0.1530000     0.2979000 
1 1 1 15 22 3  o 2.212000  0.2933000     2.379000  0.3851000     2.045000  0.4426000     0.3336000      0.5866000 
1 1 1 15 22 4  o 15.82000  0.2012000     15.82000  0.3120000     15.82000  0.2540000     -0.2734000E-02 0.4023000 
1 1 1 15 22 5  o 8.259000  0.1588000     8.475000  0.1909000     8.042000  0.2539000     0.4331000      0.3177000 
1 1 1 15 22 6  o 5.779000  0.2098000     5.827000  0.3178000     5.732000  0.2740000     0.9461000E-01  0.4196000 
1 1 1 15 22 7  o 2.464000  0.3234000     2.767000  0.3999000     2.160000  0.5084000     0.6066000      0.6468000 
1 1 1 15 22 8  o 10.71000  0.1480000     10.78000  0.2081000     10.65000  0.2105000     0.1289000      0.2960000 
1 1 1 15 22 9  o 2.107000  0.3727000     1.792000  0.5561000     2.422000  0.4962000     -0.6295000     0.7453000 
1 1 1 15 22 10 o 12.66000  0.1588000     13.07000  0.2251000     12.26000  0.2241000     0.8074000      0.3177000 
1 1 1 15 22 11 o 18.94000  0.1893000     19.11000  0.2692000     18.77000  0.2663000     0.3382000      0.3787000 
1 1 1 15 22 12 o 10.10000  0.2004000     10.34000  0.2675000     9.854000  0.2984000     0.4876000      0.4008000 
1 1 1 15 22 13 o 5.968000  0.2871000     5.944000  0.3586000     5.992000  0.4485000     -0.4814000E-01 0.5742000 
1 1 1 15 22 14 o 6.943000  0.2567000     6.813000  0.3601000     7.072000  0.3658000     -0.2596000     0.5133000 
1 1 1 15 22 15 o 1.821000  0.5258000     1.759000  0.7303000     1.883000  0.7566000     -0.1245000     1.052000  
1 1 1 15 22 16 o 3.104000  0.5456000     3.211000  0.7524000     2.997000  0.7904000     0.2139000      1.091000  
1 1 1 15 22 17 o 2.238000  0.5464000     2.642000  0.7839000     1.834000  0.7615000     0.8079000      1.093000  
1 1 1 15 22 18 o 4.601000  0.3694000     4.590000  0.5080000     4.612000  0.5364000     -0.2200000E-01 0.7388000 
1 1 1 15 22 19 o 2.348000  0.6699000     2.312000  1.055000      2.383000  0.8261000     -0.7129000E-01 1.340000  
1 1 1 15 22 20 o 2.899000  0.4858000     2.316000  0.7405000     3.482000  0.6290000     -1.166000      0.9716000 
1 1 1 15 22 21 o 1.737000  0.4844000     1.329000  0.6096000     2.144000  0.7529000     -0.8143000     0.9688000 
1 1 1 15 22 22 o 1.452000  0.4432000     1.207000  0.5636000     1.697000  0.6840000     -0.4899000     0.8863000 
1 1 1 15 22 23 o 1.148000  0.3873000     1.002000  0.4918000     1.294000  0.5983000     -0.2917000     0.7745000 
1 1 1 15 22 24 o 1.791000  0.5097000     1.843000  0.7365000     1.738000  0.7049000     0.1050000      1.019000  
1 1 1 15 23 0  o 16.43000  0.2208000     16.43000  0.2208000     16.43000  0.2208000     0.000000       0.000000  
1 1 1 15 23 1  o 4.284000  0.1661000     4.257000  0.2366000     4.311000  0.2331000     -0.5456000E-01 0.3321000 
1 1 1 15 23 2  o 18.72000  0.1704000     18.53000  0.2395000     18.90000  0.2425000     -0.3619000     0.3408000 
1 1 1 15 23 3  o 14.07000  0.1887000     13.95000  0.2916000     14.19000  0.2395000     -0.2440000     0.3773000 
1 1 1 15 23 4  f 11.47000  0.1690000     11.16000  0.1931000     11.77000  0.2774000     -0.6061000     0.3380000 
1 1 1 15 23 5  o 10.87000  0.1636000     10.77000  0.2241000     10.97000  0.2384000     -0.1921000     0.3272000 
1 1 1 15 23 6  o 6.162000  0.1750000     6.238000  0.2719000     6.086000  0.2203000     0.1521000      0.3500000 
1 1 1 15 23 7  o 13.60000  0.1531000     13.70000  0.2161000     13.50000  0.2171000     0.1970000      0.3063000 
1 1 1 15 23 8  o 8.109000  0.1521000     8.070000  0.2134000     8.147000  0.2166000     -0.7733000E-01 0.3041000 
1 1 1 15 23 9  o 9.783000  0.1545000     9.645000  0.2173000     9.922000  0.2196000     -0.2766000     0.3089000 
1 1 1 15 23 10 o 10.25000  0.1599000     10.33000  0.2272000     10.16000  0.2252000     0.1709000      0.3199000 
1 1 1 15 23 11 o 1.983000  0.4836000     2.041000  0.7352000     1.924000  0.6283000     0.1174000      0.9671000 
1 1 1 15 23 12 o 3.637000  0.3079000     3.834000  0.4120000     3.441000  0.4578000     0.3928000      0.6159000 
1 1 1 15 23 13 o 5.034000  0.5634000     5.272000  1.003000      4.797000  0.5132000     0.4753000      1.127000  
1 1 1 15 23 14 o 8.244000  0.2346000     7.933000  0.3306000     8.556000  0.3330000     -0.6234000     0.4692000 
1 1 1 15 23 15 o 2.715000  0.5107000     1.983000  0.7577000     3.447000  0.6851000     -1.464000      1.021000  
1 1 1 15 23 16 o 4.130000  0.4566000     4.597000  0.5435000     3.662000  0.7339000     0.9351000      0.9132000 
1 1 1 15 23 17 o 1.883000  0.4994000     1.080000  0.5378000     2.686000  0.8416000     -1.606000      0.9988000 
1 1 1 15 23 18 o 1.724000  0.5145000     1.657000  0.7038000     1.792000  0.7507000     -0.1353000     1.029000  
1 1 1 15 23 19 o 2.168000  0.6550000     2.411000  1.071000      1.925000  0.7550000     0.4866000      1.310000  
1 1 1 15 23 20 o 1.762000  0.5011000     1.759000  0.7055000     1.766000  0.7119000     -0.7347000E-02 1.002000  
1 1 1 15 23 21 o 1.391000  0.4424000     1.178000  0.5638000     1.604000  0.6818000     -0.4261000     0.8847000 
1 1 1 15 23 22 o 1.686000  0.4715000     2.012000  0.7135000     1.359000  0.6164000     0.6527000      0.9429000 
1 1 1 15 23 23 o 1.198000  0.3980000     1.008000  0.4942000     1.388000  0.6241000     -0.3800000     0.7960000 
1 1 1 15 23 24 o 1.433000  0.4723000     1.329000  0.6763000     1.536000  0.6593000     -0.2063000     0.9445000 
1 1 1 15 24 0  f 30.56000  0.4086000     30.56000  0.4086000     30.56000  0.4086000     0.000000       0.000000  
1 1 1 15 24 1  o 16.76000  0.1729000     16.55000  0.2597000     16.97000  0.2283000     -0.4201000     0.3458000 
1 1 1 15 24 2  o 11.88000  0.1956000     11.76000  0.2776000     12.00000  0.2758000     -0.2406000     0.3913000 
1 1 1 15 24 3  o 3.378000  0.2938000     3.378000  0.2938000     ?         ?             ?              ?         
1 1 1 15 24 4  o 21.22000  0.2435000     21.18000  0.3744000     21.26000  0.3113000     -0.8106000E-01 0.4869000 
1 1 1 15 24 5  o 12.09000  0.1570000     11.95000  0.2401000     12.23000  0.2025000     -0.2854000     0.3141000 
1 1 1 15 24 6  o 1.197000  0.3542000     1.254000  0.5113000     1.139000  0.4904000     0.1152000      0.7085000 
1 1 1 15 24 7  o 22.01000  0.1974000     22.18000  0.2799000     21.85000  0.2783000     0.3282000      0.3947000 
1 1 1 15 24 8  o 10.69000  0.1510000     11.00000  0.2150000     10.38000  0.2121000     0.6138000      0.3020000 
1 1 1 15 24 9  o 23.44000  0.2110000     23.50000  0.2989000     23.38000  0.2978000     0.1240000      0.4219000 
1 1 1 15 24 10 o 9.268000  0.1763000     9.169000  0.2315000     9.366000  0.2660000     -0.1963000     0.3527000 
1 1 1 15 24 11 o 3.897000  0.3748000     3.875000  0.5201000     3.918000  0.5398000     -0.4314000E-01 0.7496000 
1 1 1 15 24 12 o 8.058000  0.1869000     8.196000  0.2568000     7.920000  0.2717000     0.2760000      0.3739000 
1 1 1 15 24 13 o 4.576000  0.5989000     4.221000  1.145000      4.930000  0.3503000     -0.7092000     1.198000  
1 1 1 15 24 14 o 1.898000  0.5226000     2.008000  0.7413000     1.787000  0.7369000     0.2208000      1.045000  
1 1 1 15 24 15 o 5.324000  0.3280000     5.039000  0.4627000     5.609000  0.4649000     -0.5704000     0.6559000 
1 1 1 15 24 16 o 6.280000  0.2944000     6.239000  0.4034000     6.320000  0.4290000     -0.8152000E-01 0.5889000 
1 1 1 15 24 17 o 2.611000  0.6074000     3.196000  0.7475000     2.026000  0.9576000     1.170000       1.215000  
1 1 1 15 24 18 o 3.354000  0.4664000     3.390000  0.6408000     3.318000  0.6778000     0.7122000E-01  0.9327000 
1 1 1 15 24 19 o 1.871000  0.5406000     2.100000  0.8245000     1.642000  0.6994000     0.4583000      1.081000  
1 1 1 15 24 20 o 1.508000  0.4614000     1.213000  0.5759000     1.803000  0.7210000     -0.5899000     0.9228000 
1 1 1 15 24 21 o 2.223000  0.4976000     2.761000  0.7065000     1.686000  0.7008000     1.075000       0.9951000 
1 1 1 15 24 22 o 1.540000  0.4738000     1.214000  0.5755000     1.866000  0.7528000     -0.6519000     0.9476000 
1 1 1 15 24 23 o 2.262000  0.5161000     2.154000  0.7274000     2.370000  0.7324000     -0.2162000     1.032000  
1 1 1 15 24 24 o 1.598000  0.5440000     1.527000  0.7554000     1.669000  0.7830000     -0.1422000     1.088000  
1 1 1 15 25 0  o 1.236000  0.7638000     1.236000  0.7638000     1.236000  0.7638000     0.000000       0.000000  
1 1 1 15 25 1  o 13.80000  0.2869000     13.80000  0.2869000     ?         ?             ?              ?         
1 1 1 15 25 2  o 7.050000  0.1978000     7.531000  0.2679000     6.568000  0.2910000     0.9634000      0.3956000 
1 1 1 15 25 3  o 17.17000  0.2117000     17.18000  0.3260000     17.15000  0.2702000     0.2818000E-01  0.4234000 
1 1 1 15 25 4  o 1.568000  0.3779000     1.353000  0.5486000     1.782000  0.5200000     -0.4291000     0.7559000 
1 1 1 15 25 5  o 4.675000  0.2032000     4.663000  0.2514000     4.687000  0.3193000     -0.2432000E-01 0.4064000 
1 1 1 15 25 6  o 4.326000  0.1964000     4.207000  0.2831000     4.445000  0.2722000     -0.2374000     0.3927000 
1 1 1 15 25 7  o 7.437000  0.1569000     7.186000  0.2262000     7.689000  0.2176000     -0.5030000     0.3139000 
1 1 1 15 25 8  o 7.860000  0.1591000     7.893000  0.2261000     7.827000  0.2240000     0.6637000E-01  0.3183000 
1 1 1 15 25 9  o 11.27000  0.1565000     11.32000  0.2217000     11.23000  0.2209000     0.8677000E-01  0.3130000 
1 1 1 15 25 10 o 10.75000  0.1628000     10.85000  0.2295000     10.65000  0.2309000     0.2012000      0.3256000 
1 1 1 15 25 11 o 10.17000  0.2024000     9.957000  0.2386000     10.38000  0.3269000     -0.4190000     0.4047000 
1 1 1 15 25 12 o 6.367000  0.2687000     6.358000  0.2874000     6.377000  0.4541000     -0.1988000E-01 0.5375000 
1 1 1 15 25 13 o 5.328000  0.2470000     5.127000  0.3558000     5.529000  0.3426000     -0.4017000     0.4939000 
1 1 1 15 25 14 o 2.481000  0.5077000     2.833000  0.7474000     2.130000  0.6872000     0.7031000      1.015000  
1 1 1 15 25 15 o 2.749000  0.5578000     2.482000  0.7889000     3.017000  0.7888000     -0.5350000     1.116000  
1 1 1 15 25 16 o 1.874000  0.5362000     1.634000  0.7050000     2.115000  0.8081000     -0.4816000     1.072000  
1 1 1 15 25 17 o 3.522000  0.6383000     3.316000  0.6955000     3.729000  1.070000      -0.4124000     1.277000  
1 1 1 15 25 18 o 2.682000  0.5098000     1.964000  0.7345000     3.400000  0.7070000     -1.436000      1.020000  
1 1 1 15 25 19 o 1.545000  0.4766000     1.629000  0.6909000     1.460000  0.6568000     0.1696000      0.9532000 
1 1 1 15 25 20 o 3.057000  0.4778000     3.052000  0.6667000     3.061000  0.6846000     -0.8867000E-02 0.9556000 
1 1 1 15 25 21 o 1.793000  0.4745000     2.276000  0.7296000     1.310000  0.6070000     0.9660000      0.9491000 
1 1 1 15 25 22 o 1.687000  0.5354000     1.690000  0.7032000     1.684000  0.8076000     0.6480000E-02  1.071000  
1 1 1 15 25 23 o 1.275000  0.4149000     1.070000  0.5192000     1.480000  0.6473000     -0.4098000     0.8298000 
1 1 1 15 26 0  o 22.70000  0.3219000     22.70000  0.3219000     22.70000  0.3219000     -0.000000      0.000000  
1 1 1 15 26 1  o 4.273000  0.1943000     4.253000  0.2911000     4.293000  0.2575000     -0.3955000E-01 0.3886000 
1 1 1 15 26 2  o 11.27000  0.1513000     10.88000  0.2273000     11.66000  0.1998000     -0.7831000     0.3026000 
1 1 1 15 26 3  o 15.15000  0.1547000     15.06000  0.2181000     15.23000  0.2196000     -0.1706000     0.3095000 
1 1 1 15 26 4  o 6.267000  0.1707000     6.190000  0.2194000     6.344000  0.2617000     -0.1539000     0.3415000 
1 1 1 15 26 5  o 5.338000  0.1708000     5.285000  0.2427000     5.390000  0.2405000     -0.1052000     0.3417000 
1 1 1 15 26 6  o 12.48000  0.1500000     12.57000  0.2131000     12.39000  0.2112000     0.1864000      0.3000000 
1 1 1 15 26 7  o 10.98000  0.1508000     11.13000  0.2143000     10.82000  0.2122000     0.3140000      0.3016000 
1 1 1 15 26 8  o 8.931000  0.1572000     8.826000  0.2230000     9.035000  0.2215000     -0.2085000     0.3143000 
1 1 1 15 26 9  o 9.891000  0.1599000     10.18000  0.2227000     9.600000  0.2294000     0.5831000      0.3197000 
1 1 1 15 26 10 o 2.128000  0.4855000     2.201000  0.7360000     2.055000  0.6333000     0.1458000      0.9710000 
1 1 1 15 26 11 o 4.433000  0.2616000     4.321000  0.3706000     4.546000  0.3694000     -0.2257000     0.5232000 
1 1 1 15 26 12 o 2.013000  0.5245000     2.013000  0.7370000     2.012000  0.7466000     0.5825000E-03  1.049000  
1 1 1 15 26 13 o 4.164000  0.3549000     4.399000  0.5236000     3.930000  0.4791000     0.4693000      0.7097000 
1 1 1 15 26 14 o 5.959000  0.2723000     6.136000  0.4171000     5.782000  0.3501000     0.3536000      0.5446000 
1 1 1 15 26 15 o 2.248000  0.5595000     2.494000  0.7812000     2.001000  0.8011000     0.4934000      1.119000  
1 1 1 15 26 16 o 1.705000  0.5158000     1.824000  0.7546000     1.586000  0.7035000     0.2378000      1.032000  
1 1 1 15 26 17 o 2.728000  0.5249000     3.504000  0.7170000     1.952000  0.7668000     1.551000       1.050000  
1 1 1 15 26 18 o 3.160000  0.5609000     3.005000  0.8658000     3.316000  0.7134000     -0.3114000     1.122000  
1 1 1 15 26 19 o 1.405000  0.4373000     1.023000  0.5055000     1.786000  0.7137000     -0.7630000     0.8746000 
1 1 1 15 26 20 o 1.310000  0.4292000     1.344000  0.6126000     1.276000  0.6013000     0.6755000E-01  0.8584000 
1 1 1 15 26 21 o 1.556000  0.4676000     1.617000  0.6725000     1.495000  0.6498000     0.1218000      0.9351000 
1 1 1 15 26 22 o 1.387000  0.4567000     1.438000  0.6381000     1.335000  0.6536000     0.1037000      0.9134000 
1 1 1 15 26 23 o 1.183000  0.3997000     1.219000  0.5717000     1.147000  0.5588000     0.7187000E-01  0.7994000 
1 1 1 15 27 0  o 23.51000  0.2874000     23.51000  0.2874000     23.51000  0.2874000     0.000000       0.000000  
1 1 1 15 27 1  o 15.06000  0.1542000     15.22000  0.2189000     14.91000  0.2173000     0.3143000      0.3085000 
1 1 1 15 27 2  o 9.495000  0.1395000     9.650000  0.1973000     9.341000  0.1972000     0.3094000      0.2790000 
1 1 1 15 27 3  o 8.414000  0.1420000     8.206000  0.2013000     8.621000  0.2004000     -0.4149000     0.2841000 
1 1 1 15 27 4  o 14.27000  0.1543000     14.22000  0.2174000     14.31000  0.2190000     -0.9178000E-01 0.3086000 
1 1 1 15 27 5  o 11.11000  0.1472000     11.19000  0.2073000     11.02000  0.2091000     0.1667000      0.2945000 
1 1 1 15 27 6  o 16.70000  0.1685000     16.77000  0.2385000     16.63000  0.2381000     0.1412000      0.3370000 
1 1 1 15 27 7  o 3.853000  0.2315000     3.774000  0.3315000     3.932000  0.3233000     -0.1574000     0.4630000 
1 1 1 15 27 8  o 7.430000  0.1655000     7.295000  0.2329000     7.565000  0.2352000     -0.2699000     0.3310000 
1 1 1 15 27 9  o 11.12000  0.1614000     11.22000  0.2271000     11.02000  0.2294000     0.1973000      0.3228000 
1 1 1 15 27 10 o 7.602000  0.2244000     7.514000  0.2824000     7.691000  0.3487000     -0.1768000     0.4487000 
1 1 1 15 27 11 o 8.778000  0.1933000     8.907000  0.2586000     8.650000  0.2873000     0.2563000      0.3866000 
1 1 1 15 27 12 o 11.81000  0.1978000     11.64000  0.3056000     11.97000  0.2512000     -0.3324000     0.3956000 
1 1 1 15 27 13 o 5.909000  0.2403000     6.036000  0.3279000     5.781000  0.3513000     0.2554000      0.4806000 
1 1 1 15 27 14 o 3.862000  0.3631000     3.508000  0.5526000     4.217000  0.4713000     -0.7098000     0.7263000 
1 1 1 15 27 15 o 5.254000  0.3089000     5.583000  0.4631000     4.925000  0.4091000     0.6577000      0.6179000 
1 1 1 15 27 16 o 5.180000  0.3779000     5.141000  0.5192000     5.219000  0.5492000     -0.7791000E-01 0.7558000 
1 1 1 15 27 17 o 5.473000  0.3148000     5.341000  0.4507000     5.606000  0.4397000     -0.2652000     0.6297000 
1 1 1 15 27 18 o 4.605000  0.6708000     5.083000  1.233000      4.126000  0.5300000     0.9575000      1.342000  
1 1 1 15 27 19 o 2.534000  0.5243000     2.335000  0.7609000     2.734000  0.7215000     -0.3985000     1.049000  
1 1 1 15 27 20 o 2.671000  0.5069000     2.702000  0.7092000     2.639000  0.7246000     0.6325000E-01  1.014000  
1 1 1 15 27 21 o 2.767000  0.4623000     3.321000  0.5846000     2.213000  0.7163000     1.108000       0.9246000 
1 1 1 15 27 22 o 1.244000  0.4138000     1.304000  0.5976000     1.184000  0.5726000     0.1199000      0.8276000 
1 1 1 15 27 23 o 1.768000  0.4995000     1.364000  0.6329000     2.172000  0.7729000     -0.8086000     0.9990000 
1 1 1 15 28 0  o 10.08000  0.1992000     10.08000  0.1992000     10.08000  0.1992000     -0.000000      0.000000  
1 1 1 15 28 1  o 17.74000  0.1697000     17.90000  0.2413000     17.58000  0.2387000     0.3163000      0.3394000 
1 1 1 15 28 2  o 9.900000  0.1407000     9.750000  0.1993000     10.05000  0.1988000     -0.2996000     0.2815000 
1 1 1 15 28 3  o 2.473000  0.3126000     2.821000  0.3714000     2.124000  0.5030000     0.6965000      0.6253000 
1 1 1 15 28 4  o 14.05000  0.1543000     13.95000  0.2171000     14.16000  0.2193000     -0.2047000     0.3086000 
1 1 1 15 28 5  f 23.57000  0.2078000     23.56000  0.2941000     23.58000  0.2936000     -0.2180000E-01 0.4156000 
1 1 1 15 28 6  o 5.911000  0.1741000     6.230000  0.2379000     5.593000  0.2542000     0.6366000      0.3482000 
1 1 1 15 28 7  o 4.998000  0.1963000     5.065000  0.2727000     4.931000  0.2824000     0.1336000      0.3926000 
1 1 1 15 28 8  o 4.890000  0.2136000     4.905000  0.3034000     4.876000  0.3008000     0.2851000E-01  0.4272000 
1 1 1 15 28 9  o 10.62000  0.2009000     10.07000  0.3300000     11.16000  0.2292000     -1.086000      0.4018000 
1 1 1 15 28 10 o 5.229000  0.2384000     5.255000  0.3169000     5.204000  0.3562000     0.5115000E-01  0.4768000 
1 1 1 15 28 11 o 5.375000  0.3226000     5.808000  0.3397000     4.941000  0.5486000     0.8675000      0.6453000 
1 1 1 15 28 12 o 6.152000  0.2459000     5.883000  0.3384000     6.421000  0.3569000     -0.5388000     0.4918000 
1 1 1 15 28 13 o 4.750000  0.2864000     4.569000  0.4063000     4.931000  0.4037000     -0.3619000     0.5728000 
1 1 1 15 28 14 o 2.089000  0.4282000     1.168000  0.5546000     3.010000  0.6526000     -1.843000      0.8564000 
1 1 1 15 28 15 o 3.115000  0.4819000     3.866000  0.6462000     2.365000  0.7151000     1.500000       0.9638000 
1 1 1 15 28 16 o 6.040000  0.5337000     5.965000  0.4448000     6.115000  0.9703000     -0.1495000     1.067000  
1 1 1 15 28 17 o 2.537000  0.5674000     2.348000  0.7724000     2.727000  0.8315000     -0.3791000     1.135000  
1 1 1 15 28 18 o 2.535000  0.4838000     1.649000  0.7426000     3.422000  0.6204000     -1.773000      0.9676000 
1 1 1 15 28 19 o 3.960000  0.3761000     4.014000  0.5145000     3.907000  0.5488000     0.1072000      0.7523000 
1 1 1 15 28 20 o 1.820000  0.4997000     1.845000  0.7123000     1.795000  0.7009000     0.4975000E-01  0.9994000 
1 1 1 15 28 21 o 1.762000  0.4889000     2.014000  0.7176000     1.510000  0.6640000     0.5044000      0.9777000 
1 1 1 15 28 22 o 1.288000  0.4193000     1.409000  0.6260000     1.168000  0.5582000     0.2411000      0.8387000 
1 1 1 15 28 23 o 1.316000  0.4674000     1.500000  0.7561000     1.132000  0.5495000     0.3672000      0.9347000 
1 1 1 15 29 0  f 12.86000  0.2102000     12.86000  0.2102000     12.86000  0.2102000     -0.000000      0.000000  
1 1 1 15 29 1  o 8.644000  0.1432000     8.680000  0.2026000     8.607000  0.2024000     0.7317000E-01  0.2864000 
1 1 1 15 29 2  o 9.620000  0.1435000     9.445000  0.2028000     9.796000  0.2030000     -0.3508000     0.2869000 
1 1 1 15 29 3  o 13.21000  0.1510000     13.01000  0.2128000     13.41000  0.2145000     -0.3992000     0.3021000 
1 1 1 15 29 4  o 18.82000  0.1782000     18.65000  0.2508000     19.00000  0.2533000     -0.3508000     0.3565000 
1 1 1 15 29 5  o 15.30000  0.1618000     15.43000  0.2293000     15.18000  0.2284000     0.2565000      0.3236000 
1 1 1 15 29 6  o 4.394000  0.2127000     4.602000  0.2865000     4.187000  0.3145000     0.4152000      0.4255000 
1 1 1 15 29 7  o 7.823000  0.1619000     7.700000  0.2295000     7.946000  0.2284000     -0.2468000     0.3238000 
1 1 1 15 29 8  o 5.213000  0.2039000     5.095000  0.2962000     5.331000  0.2804000     -0.2363000     0.4078000 
1 1 1 15 29 9  o 5.675000  0.2600000     5.782000  0.3191000     5.567000  0.4106000     0.2153000      0.5200000 
1 1 1 15 29 10 o 7.218000  0.2058000     7.601000  0.2643000     6.834000  0.3156000     0.7671000      0.4116000 
1 1 1 15 29 11 o 12.69000  0.1967000     12.15000  0.3033000     13.24000  0.2505000     -1.096000      0.3934000 
1 1 1 15 29 12 o 10.25000  0.1958000     10.26000  0.2871000     10.24000  0.2663000     0.2325000E-01  0.3916000 
1 1 1 15 29 13 o 3.721000  0.3510000     3.492000  0.5049000     3.950000  0.4879000     -0.4576000     0.7021000 
1 1 1 15 29 14 o 6.255000  0.2726000     6.118000  0.4230000     6.392000  0.3440000     -0.2737000     0.5452000 
1 1 1 15 29 15 o 6.903000  0.2332000     6.867000  0.3262000     6.940000  0.3334000     -0.7262000E-01 0.4664000 
1 1 1 15 29 16 o 3.938000  0.4286000     3.724000  0.6908000     4.152000  0.5075000     -0.4285000     0.8572000 
1 1 1 15 29 17 o 3.246000  0.5335000     3.419000  0.7129000     3.074000  0.7939000     0.3453000      1.067000  
1 1 1 15 29 18 o 3.941000  0.4169000     4.398000  0.5600000     3.483000  0.6177000     0.9156000      0.8337000 
1 1 1 15 29 19 o 2.157000  0.5184000     2.500000  0.7432000     1.815000  0.7229000     0.6848000      1.037000  
1 1 1 15 29 20 o 1.613000  0.4712000     1.553000  0.6490000     1.672000  0.6833000     -0.1183000     0.9424000 
1 1 1 15 29 21 o 1.514000  0.4727000     1.647000  0.6955000     1.380000  0.6404000     0.2671000      0.9454000 
1 1 1 15 29 22 o 2.367000  0.5027000     1.894000  0.7223000     2.840000  0.6994000     -0.9462000     1.005000  
1 1 1 15 29 23 o 1.821000  0.5364000     1.342000  0.6751000     2.300000  0.8338000     -0.9582000     1.073000  
1 1 1 15 30 0  o 3.053000  0.3837000     3.053000  0.3837000     3.053000  0.3837000     -0.000000      0.000000  
1 1 1 15 30 1  o 5.422000  0.1711000     5.590000  0.2380000     5.254000  0.2459000     0.3359000      0.3422000 
1 1 1 15 30 2  o 7.025000  0.1551000     6.893000  0.2214000     7.158000  0.2174000     -0.2649000     0.3102000 
1 1 1 15 30 3  o 11.25000  0.1473000     11.26000  0.2090000     11.25000  0.2076000     0.7204000E-02  0.2946000 
1 1 1 15 30 4  o 12.19000  0.1508000     12.14000  0.2124000     12.23000  0.2142000     -0.8965000E-01 0.3017000 
1 1 1 15 30 5  o 21.39000  0.1953000     21.44000  0.2763000     21.34000  0.2761000     0.1052000      0.3906000 
1 1 1 15 30 6  f 3.895000  0.2347000     3.988000  0.3148000     3.801000  0.3483000     0.1861000      0.4695000 
1 1 1 15 30 7  o 20.93000  0.1963000     20.93000  0.2776000     20.93000  0.2776000     -0.3389000E-02 0.3926000 
1 1 1 15 30 8  o 9.215000  0.2037000     9.023000  0.3350000     9.407000  0.2317000     -0.3840000     0.4074000 
1 1 1 15 30 9  o 5.415000  0.2283000     5.692000  0.2951000     5.138000  0.3484000     0.5535000      0.4566000 
1 1 1 15 30 10 o 4.829000  0.3012000     5.133000  0.3774000     4.526000  0.4696000     0.6076000      0.6025000 
1 1 1 15 30 11 o 6.876000  0.2165000     6.822000  0.3037000     6.930000  0.3086000     -0.1077000     0.4329000 
1 1 1 15 30 12 o 5.389000  0.2843000     5.074000  0.4480000     5.704000  0.3500000     -0.6302000     0.5685000 
1 1 1 15 30 13 o 8.882000  0.1957000     8.820000  0.2731000     8.943000  0.2804000     -0.1224000     0.3914000 
1 1 1 15 30 14 o 7.071000  0.2562000     6.652000  0.4026000     7.491000  0.3171000     -0.8390000     0.5125000 
1 1 1 15 30 15 o 2.571000  0.5457000     2.417000  0.8485000     2.725000  0.6866000     -0.3076000     1.091000  
1 1 1 15 30 16 o 1.933000  0.5312000     2.053000  0.7961000     1.812000  0.7036000     0.2413000      1.062000  
1 1 1 15 30 17 o 2.187000  0.6636000     2.583000  1.104000      1.791000  0.7375000     0.7913000      1.327000  
1 1 1 15 30 18 o 2.906000  0.4784000     3.462000  0.5942000     2.349000  0.7499000     1.112000       0.9568000 
1 1 1 15 30 19 o 1.261000  0.4170000     1.139000  0.5469000     1.383000  0.6297000     -0.2440000     0.8341000 
1 1 1 15 30 20 o 1.534000  0.4527000     1.192000  0.5590000     1.877000  0.7121000     -0.6851000     0.9053000 
1 1 1 15 30 21 o 2.537000  0.5961000     2.956000  0.7215000     2.118000  0.9490000     0.8382000      1.192000  
1 1 1 15 30 22 o 1.353000  0.4353000     1.460000  0.6456000     1.245000  0.5841000     0.2151000      0.8707000 
1 1 1 15 31 0  o 8.607000  0.2107000     8.607000  0.2107000     8.607000  0.2107000     -0.000000      0.000000  
1 1 1 15 31 1  o 21.50000  0.1938000     21.29000  0.2725000     21.70000  0.2757000     -0.4126000     0.3876000 
1 1 1 15 31 2  o 24.10000  0.2105000     24.21000  0.2985000     24.00000  0.2968000     0.2091000      0.4210000 
1 1 1 15 31 3  o 13.81000  0.1561000     13.45000  0.2195000     14.17000  0.2219000     -0.7189000     0.3121000 
1 1 1 15 31 4  o 8.794000  0.1524000     8.604000  0.2155000     8.985000  0.2154000     -0.3812000     0.3047000 
1 1 1 15 31 5  o 14.51000  0.1616000     14.75000  0.2287000     14.27000  0.2284000     0.4811000      0.3232000 
1 1 1 15 31 6  o 8.506000  0.1615000     8.549000  0.2280000     8.462000  0.2289000     0.8698000E-01  0.3231000 
1 1 1 15 31 7  o 6.417000  0.2032000     6.467000  0.3156000     6.367000  0.2560000     0.1005000      0.4064000 
1 1 1 15 31 8  o 1.922000  0.4750000     1.565000  0.6212000     2.279000  0.7188000     -0.7134000     0.9500000 
1 1 1 15 31 9  o 12.81000  0.2180000     12.72000  0.2425000     12.90000  0.3625000     -0.1805000     0.4361000 
1 1 1 15 31 10 o 10.05000  0.1986000     9.658000  0.3095000     10.45000  0.2491000     -0.7904000     0.3973000 
1 1 1 15 31 11 o 9.027000  0.1904000     9.312000  0.2654000     8.743000  0.2731000     0.5684000      0.3808000 
1 1 1 15 31 12 o 3.539000  0.3657000     3.731000  0.4621000     3.348000  0.5669000     0.3837000      0.7313000 
1 1 1 15 31 13 o 6.999000  0.2255000     7.017000  0.3121000     6.982000  0.3255000     0.3559000E-01  0.4510000 
1 1 1 15 31 14 o 4.401000  0.3233000     4.597000  0.4322000     4.205000  0.4808000     0.3928000      0.6465000 
1 1 1 15 31 15 f 10.53000  0.2804000     10.48000  0.4029000     10.57000  0.3900000     -0.8630000E-01 0.5607000 
1 1 1 15 31 16 o 4.844000  0.3159000     4.875000  0.4482000     4.814000  0.4454000     0.6047000E-01  0.6319000 
1 1 1 15 31 17 o 2.007000  0.5872000     2.198000  0.9204000     1.815000  0.7293000     0.3830000      1.174000  
1 1 1 15 31 18 o 3.029000  0.4735000     2.978000  0.6578000     3.081000  0.6814000     -0.1030000     0.9471000 
1 1 1 15 31 19 o 1.660000  0.4780000     1.652000  0.6720000     1.669000  0.6799000     -0.1649000E-01 0.9559000 
1 1 1 15 31 20 o 1.368000  0.4354000     1.181000  0.5622000     1.554000  0.6650000     -0.3729000     0.8708000 
1 1 1 15 31 21 o 1.865000  0.5172000     2.125000  0.7199000     1.604000  0.7426000     0.5215000      1.034000  
1 1 1 15 31 22 o 1.148000  0.3925000     1.070000  0.5213000     1.226000  0.5870000     -0.1560000     0.7851000 
1 1 1 15 32 0  o 8.825000  0.2116000     8.825000  0.2116000     8.825000  0.2116000     -0.000000      0.000000  
1 1 1 15 32 1  o 12.93000  0.1527000     12.62000  0.2150000     13.24000  0.2169000     -0.6179000     0.3054000 
1 1 1 15 32 2  o 8.014000  0.1540000     7.815000  0.2177000     8.213000  0.2179000     -0.3980000     0.3080000 
1 1 1 15 32 3  o 16.28000  0.1678000     16.30000  0.2371000     16.27000  0.2376000     0.2728000E-01  0.3357000 
1 1 1 15 32 4  o 6.579000  0.1708000     6.559000  0.2395000     6.599000  0.2434000     -0.3966000E-01 0.3415000 
1 1 1 15 32 5  o 13.31000  0.1597000     13.05000  0.2241000     13.57000  0.2276000     -0.5285000     0.3194000 
1 1 1 15 32 6  o 13.08000  0.1623000     13.25000  0.2296000     12.90000  0.2295000     0.3462000      0.3246000 
1 1 1 15 32 7  o 5.987000  0.2566000     6.043000  0.3876000     5.931000  0.3364000     0.1123000      0.5132000 
1 1 1 15 32 8  o 7.823000  0.1948000     7.760000  0.2551000     7.885000  0.2945000     -0.1257000     0.3896000 
1 1 1 15 32 9  o 2.934000  0.4894000     2.569000  0.7727000     3.298000  0.6008000     -0.7291000     0.9788000 
1 1 1 15 32 10 o 4.359000  0.2847000     3.850000  0.4396000     4.867000  0.3617000     -1.017000      0.5693000 
1 1 1 15 32 11 o 6.912000  0.2174000     6.726000  0.3104000     7.097000  0.3044000     -0.3711000     0.4347000 
1 1 1 15 32 12 o 2.426000  0.4302000     1.553000  0.6385000     3.299000  0.5766000     -1.746000      0.8604000 
1 1 1 15 32 13 o 1.682000  0.4837000     1.738000  0.6898000     1.625000  0.6784000     0.1129000      0.9675000 
1 1 1 15 32 14 o 6.354000  0.2486000     6.647000  0.3431000     6.061000  0.3599000     0.5860000      0.4972000 
1 1 1 15 32 15 o 3.811000  0.4683000     4.116000  0.4854000     3.505000  0.8010000     0.6114000      0.9366000 
1 1 1 15 32 16 o 4.262000  0.4832000     5.048000  0.4336000     3.476000  0.8636000     1.571000       0.9663000 
1 1 1 15 32 17 o 4.216000  0.3697000     4.097000  0.6089000     4.335000  0.4196000     -0.2376000     0.7395000 
1 1 1 15 32 18 o 2.187000  0.4748000     2.855000  0.6862000     1.519000  0.6564000     1.336000       0.9496000 
1 1 1 15 32 19 o 1.308000  0.4226000     1.261000  0.5810000     1.354000  0.6139000     -0.9314000E-01 0.8452000 
1 1 1 15 32 20 o 1.823000  0.4901000     2.100000  0.7159000     1.546000  0.6696000     0.5545000      0.9802000 
1 1 1 15 32 21 o 2.205000  0.5152000     1.920000  0.7315000     2.490000  0.7257000     -0.5702000     1.030000  
1 1 1 15 32 22 o 1.643000  0.5071000     1.506000  0.6976000     1.779000  0.7362000     -0.2735000     1.014000  
1 1 1 15 33 0  o 7.203000  0.2287000     7.203000  0.2287000     7.203000  0.2287000     0.000000       0.000000  
1 1 1 15 33 1  o 13.01000  0.1552000     12.77000  0.2189000     13.26000  0.2202000     -0.4830000     0.3104000 
1 1 1 15 33 2  o 5.345000  0.1877000     5.112000  0.2678000     5.578000  0.2630000     -0.4665000     0.3753000 
1 1 1 15 33 3  o 5.990000  0.1783000     5.934000  0.2542000     6.045000  0.2500000     -0.1118000     0.3566000 
1 1 1 15 33 4  f 13.87000  0.1613000     13.98000  0.2282000     13.76000  0.2281000     0.2147000      0.3227000 
1 1 1 15 33 5  o 1.111000  0.3561000     1.114000  0.5020000     1.107000  0.5051000     0.6705000E-02  0.7122000 
1 1 1 15 33 6  o 4.554000  0.2910000     4.487000  0.4764000     4.621000  0.3343000     -0.1347000     0.5820000 
1 1 1 15 33 7  o 14.66000  0.2054000     14.73000  0.2422000     14.59000  0.3318000     0.1405000      0.4108000 
1 1 1 15 33 8  o 6.105000  0.2454000     5.714000  0.3414000     6.497000  0.3527000     -0.7835000     0.4909000 
1 1 1 15 33 9  o 9.551000  0.1769000     9.769000  0.2506000     9.333000  0.2497000     0.4365000      0.3537000 
1 1 1 15 33 10 o 11.32000  0.1831000     11.61000  0.2551000     11.04000  0.2626000     0.5706000      0.3661000 
1 1 1 15 33 11 o 5.696000  0.2475000     5.351000  0.3677000     6.041000  0.3314000     -0.6895000     0.4950000 
1 1 1 15 33 12 o 8.317000  0.2060000     7.781000  0.2935000     8.852000  0.2891000     -1.071000      0.4119000 
1 1 1 15 33 13 o 2.162000  0.5070000     1.952000  0.7153000     2.371000  0.7186000     -0.4187000     1.014000  
1 1 1 15 33 14 o 2.547000  0.5630000     2.533000  0.8526000     2.561000  0.7356000     -0.2789000E-01 1.126000  
1 1 1 15 33 15 o 2.403000  0.5135000     2.374000  0.7022000     2.431000  0.7493000     -0.5681000E-01 1.027000  
1 1 1 15 33 16 o 2.928000  0.5818000     2.685000  0.8542000     3.171000  0.7901000     -0.4867000     1.164000  
1 1 1 15 33 17 o 1.413000  0.4355000     1.590000  0.6581000     1.236000  0.5705000     0.3547000      0.8709000 
1 1 1 15 33 18 o 3.005000  0.4562000     2.909000  0.6435000     3.101000  0.6467000     -0.1913000     0.9123000 
1 1 1 15 33 19 o 2.149000  0.5026000     2.172000  0.7118000     2.125000  0.7098000     0.4611000E-01  1.005000  
1 1 1 15 33 20 o 2.145000  0.4922000     2.824000  0.7210000     1.465000  0.6702000     1.359000       0.9844000 
1 1 1 15 33 21 o 2.629000  0.4820000     3.311000  0.6302000     1.948000  0.7294000     1.362000       0.9640000 
1 1 1 15 33 22 o 1.466000  0.4941000     1.509000  0.7544000     1.422000  0.6384000     0.8649000E-01  0.9883000 
1 1 1 15 34 0  o 4.983000  0.2833000     4.983000  0.2833000     4.983000  0.2833000     -0.000000      0.000000  
1 1 1 15 34 1  o 6.915000  0.1673000     7.038000  0.2346000     6.791000  0.2385000     0.2468000      0.3345000 
1 1 1 15 34 2  o 8.993000  0.1579000     9.048000  0.2212000     8.938000  0.2255000     0.1096000      0.3159000 
1 1 1 15 34 3  o 10.81000  0.1563000     10.52000  0.2211000     11.09000  0.2210000     -0.5741000     0.3126000 
1 1 1 15 34 4  o 4.371000  0.2332000     4.622000  0.3056000     4.119000  0.3522000     0.5030000      0.4663000 
1 1 1 15 34 5  o 6.360000  0.2322000     6.546000  0.3756000     6.174000  0.2733000     0.3726000      0.4645000 
1 1 1 15 34 6  o 2.784000  0.5060000     3.215000  0.5554000     2.354000  0.8459000     0.8610000      1.012000  
1 1 1 15 34 7  o 9.831000  0.2269000     9.792000  0.2698000     9.870000  0.3649000     -0.7798000E-01 0.4538000 
1 1 1 15 34 8  o 1.988000  0.4679000     2.361000  0.6942000     1.614000  0.6277000     0.7468000      0.9359000 
1 1 1 15 34 9  o 9.912000  0.1799000     9.785000  0.2568000     10.04000  0.2519000     -0.2528000     0.3597000 
1 1 1 15 34 10 o 1.731000  0.4684000     1.910000  0.6852000     1.552000  0.6389000     0.3581000      0.9368000 
1 1 1 15 34 11 o 4.361000  0.3181000     3.971000  0.4812000     4.752000  0.4162000     -0.7803000     0.6362000 
1 1 1 15 34 12 o 8.964000  0.2039000     8.741000  0.2897000     9.188000  0.2871000     -0.4472000     0.4079000 
1 1 1 15 34 13 o 2.874000  0.4636000     3.219000  0.5806000     2.528000  0.7231000     0.6910000      0.9273000 
1 1 1 15 34 14 o 4.495000  0.3768000     4.538000  0.4641000     4.452000  0.5938000     0.8599000E-01  0.7536000 
1 1 1 15 34 15 o 2.315000  0.4688000     3.060000  0.6331000     1.570000  0.6916000     1.490000       0.9376000 
1 1 1 15 34 16 o 4.506000  0.3508000     4.534000  0.5350000     4.478000  0.4539000     0.5542000E-01  0.7016000 
1 1 1 15 34 17 o 1.695000  0.4747000     1.615000  0.6546000     1.776000  0.6877000     -0.1604000     0.9494000 
1 1 1 15 34 18 f 1.457000  0.4511000     1.741000  0.7226000     1.173000  0.5401000     0.5687000      0.9021000 
1 1 1 15 34 19 o 1.902000  0.4628000     2.422000  0.6830000     1.382000  0.6246000     1.040000       0.9255000 
1 1 1 15 34 20 o 1.553000  0.5145000     1.418000  0.6321000     1.687000  0.8119000     -0.2690000     1.029000  
1 1 1 15 34 21 o 1.380000  0.4357000     0.9653000 0.4794000     1.795000  0.7276000     -0.8292000     0.8713000 
1 1 1 15 35 0  o 14.73000  0.2339000     14.73000  0.2339000     14.73000  0.2339000     -0.000000      0.000000  
1 1 1 15 35 1  o 18.87000  0.1844000     18.66000  0.2592000     19.07000  0.2622000     -0.4035000     0.3687000 
1 1 1 15 35 2  o 13.17000  0.1608000     13.27000  0.2271000     13.06000  0.2277000     0.2048000      0.3216000 
1 1 1 15 35 3  o 9.220000  0.1633000     9.212000  0.2314000     9.227000  0.2306000     -0.1528000E-01 0.3267000 
1 1 1 15 35 4  o 13.31000  0.2151000     13.44000  0.3356000     13.19000  0.2690000     0.2552000      0.4302000 
1 1 1 15 35 5  o 6.266000  0.2759000     6.126000  0.2699000     6.406000  0.4814000     -0.2800000     0.5519000 
1 1 1 15 35 6  o 3.818000  0.3918000     3.905000  0.4303000     3.731000  0.6549000     0.1736000      0.7836000 
1 1 1 15 35 7  o 9.953000  0.1906000     9.941000  0.2932000     9.965000  0.2438000     -0.2437000E-01 0.3813000 
1 1 1 15 35 8  o 9.191000  0.1773000     9.254000  0.2503000     9.129000  0.2510000     0.1250000      0.3545000 
1 1 1 15 35 9  o 11.29000  0.1812000     11.07000  0.2572000     11.50000  0.2554000     -0.4350000     0.3624000 
1 1 1 15 35 10 o 6.615000  0.2253000     6.812000  0.3112000     6.418000  0.3258000     0.3932000      0.4506000 
1 1 1 15 35 11 o 9.369000  0.1960000     9.626000  0.2745000     9.112000  0.2797000     0.5141000      0.3919000 
1 1 1 15 35 12 o 6.872000  0.2333000     6.963000  0.3270000     6.780000  0.3328000     0.1832000      0.4666000 
1 1 1 15 35 13 o 3.916000  0.4495000     3.089000  0.7906000     4.744000  0.4281000     -1.655000      0.8990000 
1 1 1 15 35 14 o 4.520000  0.3437000     4.944000  0.4243000     4.096000  0.5408000     0.8479000      0.6874000 
1 1 1 15 35 15 o 2.053000  0.5306000     2.538000  0.7676000     1.569000  0.7329000     0.9686000      1.061000  
1 1 1 15 35 16 o 1.398000  0.4395000     1.524000  0.6487000     1.271000  0.5931000     0.2532000      0.8790000 
1 1 1 15 35 17 o 1.896000  0.4284000     1.175000  0.5520000     2.617000  0.6553000     -1.442000      0.8568000 
1 1 1 15 35 18 o 2.211000  0.5136000     2.327000  0.7903000     2.094000  0.6560000     0.2321000      1.027000  
1 1 1 15 35 19 o 1.184000  0.3952000     1.195000  0.5611000     1.173000  0.5568000     0.2269000E-01  0.7905000 
1 1 1 15 35 20 o 1.746000  0.4916000     1.368000  0.6150000     2.123000  0.7672000     -0.7548000     0.9833000 
1 1 1 15 35 21 f 1.140000  0.3959000     1.160000  0.5697000     1.120000  0.5499000     0.3957000E-01  0.7918000 
1 1 1 15 36 0  o 5.190000  0.2949000     5.190000  0.2949000     5.190000  0.2949000     0.000000       0.000000  
1 1 1 15 36 1  o 11.75000  0.1748000     12.04000  0.2665000     11.46000  0.2264000     0.5792000      0.3497000 
1 1 1 15 36 2  o 19.42000  0.2086000     19.59000  0.3202000     19.25000  0.2673000     0.3397000      0.4171000 
1 1 1 15 36 3  o 13.30000  0.2366000     13.52000  0.3363000     13.08000  0.3328000     0.4402000      0.4731000 
1 1 1 15 36 4  o 8.041000  0.2517000     8.041000  0.2517000     ?         ?             ?              ?         
1 1 1 15 36 5  o 1.609000  0.4540000     2.093000  0.7328000     1.126000  0.5364000     0.9671000      0.9081000 
1 1 1 15 36 6  o 3.831000  0.3231000     3.889000  0.4873000     3.773000  0.4243000     0.1157000      0.6461000 
1 1 1 15 36 7  o 3.623000  0.3149000     3.413000  0.4624000     3.834000  0.4276000     -0.4214000     0.6298000 
1 1 1 15 36 8  o 11.83000  0.1765000     11.88000  0.2486000     11.78000  0.2506000     0.1020000      0.3530000 
1 1 1 15 36 9  o 10.80000  0.1809000     10.72000  0.2552000     10.89000  0.2564000     -0.1705000     0.3617000 
1 1 1 15 36 10 o 7.083000  0.2149000     6.721000  0.3124000     7.446000  0.2953000     -0.7250000     0.4299000 
1 1 1 15 36 11 f 2.905000  0.4727000     2.928000  0.6623000     2.883000  0.6747000     0.4565000E-01  0.9455000 
1 1 1 15 36 12 o 1.600000  0.4558000     1.203000  0.5681000     1.998000  0.7130000     -0.7954000     0.9117000 
1 1 1 15 36 13 o 6.769000  0.3281000     6.910000  0.4622000     6.627000  0.4658000     0.2835000      0.6562000 
1 1 1 15 36 14 o 2.572000  0.5019000     1.990000  0.7235000     3.155000  0.6958000     -1.165000      1.004000  
1 1 1 15 36 15 o 2.091000  0.5285000     2.519000  0.8045000     1.663000  0.6855000     0.8560000      1.057000  
1 1 1 15 36 16 o 1.605000  0.4507000     1.192000  0.5569000     2.017000  0.7088000     -0.8246000     0.9014000 
1 1 1 15 36 17 o 2.949000  0.4211000     2.058000  0.6914000     3.840000  0.4809000     -1.782000      0.8422000 
1 1 1 15 36 18 o 2.039000  0.3903000     1.062000  0.5101000     3.016000  0.5909000     -1.955000      0.7806000 
1 1 1 15 36 19 o 1.828000  0.5149000     2.005000  0.7992000     1.650000  0.6496000     0.3549000      1.030000  
1 1 1 15 36 20 o 1.340000  0.4359000     1.096000  0.5278000     1.583000  0.6939000     -0.4871000     0.8718000 
1 1 1 15 36 21 o 1.595000  0.5311000     1.724000  0.8377000     1.466000  0.6530000     0.2577000      1.062000  
1 1 1 15 37 0  o 3.012000  1.022000      3.012000  1.022000      3.012000  1.022000      0.000000       0.000000  
1 1 1 15 37 1  o 13.56000  0.3007000     13.68000  0.3341000     13.44000  0.5002000     0.2372000      0.6015000 
1 1 1 15 37 2  o 10.55000  0.3192000     10.55000  0.3192000     ?         ?             ?              ?         
1 1 1 15 37 3  o 3.746000  0.4096000     3.379000  0.6081000     4.113000  0.5488000     -0.7339000     0.8192000 
1 1 1 15 37 4  f 11.85000  0.2045000     11.64000  0.3314000     12.05000  0.2397000     -0.4085000     0.4090000 
1 1 1 15 37 5  o 11.35000  0.1715000     11.63000  0.2424000     11.07000  0.2426000     0.5598000      0.3429000 
1 1 1 15 37 6  o 5.129000  0.2387000     5.457000  0.3238000     4.801000  0.3507000     0.6559000      0.4774000 
1 1 1 15 37 7  o 11.22000  0.1759000     10.94000  0.2496000     11.49000  0.2478000     -0.5501000     0.3517000 
1 1 1 15 37 8  o 7.717000  0.1969000     7.585000  0.2828000     7.850000  0.2740000     -0.2654000     0.3938000 
1 1 1 15 37 9  f 6.558000  0.2190000     6.629000  0.3048000     6.487000  0.3145000     0.1413000      0.4380000 
1 1 1 15 37 10 o 6.471000  0.2327000     6.583000  0.3256000     6.359000  0.3326000     0.2239000      0.4654000 
1 1 1 15 37 11 o 4.597000  0.3180000     3.995000  0.5038000     5.198000  0.3881000     -1.203000      0.6360000 
1 1 1 15 37 12 o 4.719000  0.3368000     4.853000  0.5165000     4.586000  0.4325000     0.2669000      0.6736000 
1 1 1 15 37 13 o 1.518000  0.4693000     1.429000  0.6321000     1.607000  0.6940000     -0.1776000     0.9387000 
1 1 1 15 37 14 o 2.877000  0.5724000     2.856000  0.7235000     2.897000  0.8872000     -0.4147000E-01 1.145000  
1 1 1 15 37 15 o 3.926000  0.3724000     3.781000  0.5336000     4.072000  0.5197000     -0.2911000     0.7448000 
1 1 1 15 37 16 o 2.294000  0.4928000     2.304000  0.6819000     2.284000  0.7115000     0.2077000E-01  0.9855000 
1 1 1 15 37 17 o 1.345000  0.4187000     1.061000  0.5104000     1.630000  0.6639000     -0.5688000     0.8374000 
1 1 1 15 37 18 o 3.179000  0.4040000     3.473000  0.5158000     2.885000  0.6221000     0.5889000      0.8081000 
1 1 1 15 37 19 o 2.489000  0.5897000     2.496000  0.8522000     2.483000  0.8154000     0.1286000E-01  1.179000  
1 1 1 15 37 20 o 1.259000  0.4147000     1.248000  0.5803000     1.270000  0.5927000     -0.2191000E-01 0.8295000 
1 1 1 15 37 21 o 0.9148000 0.3343000     0.9170000 0.4736000     0.9126000 0.4719000     0.4355000E-02  0.6686000 
1 1 1 15 38 0  o 10.82000  0.2701000     10.82000  0.2701000     10.82000  0.2701000     0.000000       0.000000  
1 1 1 15 38 1  o 2.049000  0.4720000     1.857000  0.6609000     2.242000  0.6741000     -0.3855000     0.9440000 
1 1 1 15 38 2  o 9.247000  0.1849000     9.461000  0.2768000     9.034000  0.2453000     0.4268000      0.3698000 
1 1 1 15 38 3  o 4.852000  0.2354000     5.151000  0.3174000     4.554000  0.3476000     0.5971000      0.4707000 
1 1 1 15 38 4  f 4.684000  0.2523000     4.515000  0.3664000     4.853000  0.3470000     -0.3377000     0.5046000 
1 1 1 15 38 5  o 3.051000  0.3663000     3.045000  0.5179000     3.057000  0.5182000     -0.1174000E-01 0.7326000 
1 1 1 15 38 6  o 16.62000  0.2005000     16.49000  0.2622000     16.75000  0.3035000     -0.2620000     0.4011000 
1 1 1 15 38 7  o 14.44000  0.1799000     14.48000  0.2554000     14.39000  0.2536000     0.9184000E-01  0.3599000 
1 1 1 15 38 8  o 2.095000  0.4689000     1.825000  0.6618000     2.366000  0.6645000     -0.5412000     0.9378000 
1 1 1 15 38 9  o 5.472000  0.2521000     5.816000  0.3354000     5.127000  0.3765000     0.6883000      0.5043000 
1 1 1 15 38 10 o 4.088000  0.3335000     3.795000  0.5012000     4.381000  0.4400000     -0.5858000     0.6669000 
1 1 1 15 38 11 o 1.479000  0.4381000     1.873000  0.7016000     1.084000  0.5247000     0.7894000      0.8761000 
1 1 1 15 38 12 o 3.746000  0.5044000     3.542000  0.7756000     3.951000  0.6452000     -0.4092000     1.009000  
1 1 1 15 38 13 o 2.199000  0.4890000     2.733000  0.6773000     1.666000  0.7055000     1.067000       0.9779000 
1 1 1 15 38 14 o 1.475000  0.4531000     1.163000  0.5727000     1.788000  0.7024000     -0.6251000     0.9062000 
1 1 1 15 38 15 o 1.515000  0.4570000     1.538000  0.6463000     1.492000  0.6463000     0.4633000E-01  0.9140000 
1 1 1 15 38 16 o 2.374000  0.4899000     2.455000  0.6723000     2.293000  0.7128000     0.1618000      0.9799000 
1 1 1 15 38 17 o 1.262000  0.4017000     1.603000  0.6611000     0.9212000 0.4564000     0.6814000      0.8033000 
1 1 1 15 38 18 o 1.390000  0.4160000     1.696000  0.6514000     1.084000  0.5175000     0.6122000      0.8319000 
1 1 1 15 38 19 o 1.044000  0.3623000     0.9406000 0.4609000     1.148000  0.5591000     -0.2076000     0.7246000 
1 1 1 15 38 20 o 1.839000  0.5126000     1.885000  0.7232000     1.793000  0.7266000     0.9175000E-01  1.025000  
1 1 1 15 39 0  o 1.197000  0.6968000     1.197000  0.6968000     1.197000  0.6968000     0.000000       0.000000  
1 1 1 15 39 1  o 8.091000  0.1800000     8.268000  0.2548000     7.915000  0.2543000     0.3526000      0.3599000 
1 1 1 15 39 2  o 9.043000  0.1755000     8.882000  0.2484000     9.203000  0.2480000     -0.3210000     0.3510000 
1 1 1 15 39 3  o 8.350000  0.1803000     8.625000  0.2492000     8.075000  0.2606000     0.5498000      0.3605000 
1 1 1 15 39 4  o 13.73000  0.1746000     13.77000  0.2472000     13.68000  0.2467000     0.9159000E-01  0.3493000 
1 1 1 15 39 5  o 8.937000  0.1848000     9.033000  0.2586000     8.840000  0.2640000     0.1932000      0.3696000 
1 1 1 15 39 6  o 13.12000  0.1784000     13.17000  0.2522000     13.08000  0.2525000     0.9140000E-01  0.3569000 
1 1 1 15 39 7  o 4.602000  0.2764000     4.551000  0.3945000     4.652000  0.3872000     -0.1002000     0.5527000 
1 1 1 15 39 8  o 6.870000  0.2160000     6.800000  0.3075000     6.940000  0.3034000     -0.1399000     0.4320000 
1 1 1 15 39 9  o 2.328000  0.4734000     2.673000  0.6470000     1.983000  0.6911000     0.6897000      0.9467000 
1 1 1 15 39 10 o 6.847000  0.2282000     6.877000  0.3198000     6.818000  0.3257000     0.5921000E-01  0.4565000 
1 1 1 15 39 11 o 4.624000  0.3340000     4.606000  0.5101000     4.642000  0.4313000     -0.3610000E-01 0.6680000 
1 1 1 15 39 12 o 2.683000  0.4852000     3.295000  0.5917000     2.070000  0.7691000     1.225000       0.9704000 
1 1 1 15 39 13 o 1.687000  0.5218000     1.405000  0.6366000     1.969000  0.8269000     -0.5636000     1.044000  
1 1 1 15 39 14 o 1.676000  0.4860000     1.812000  0.7079000     1.540000  0.6661000     0.2722000      0.9720000 
1 1 1 15 39 15 o 3.568000  0.4123000     4.317000  0.4478000     2.819000  0.6923000     1.498000       0.8245000 
1 1 1 15 39 16 o 2.607000  0.4728000     2.606000  0.6579000     2.607000  0.6792000     -0.8836000E-03 0.9455000 
1 1 1 15 39 17 o 3.282000  0.3966000     3.174000  0.5706000     3.390000  0.5509000     -0.2156000     0.7932000 
1 1 1 15 39 18 o 1.460000  0.4651000     1.574000  0.7115000     1.345000  0.5992000     0.2298000      0.9301000 
1 1 1 15 39 19 o 1.120000  0.3736000     1.030000  0.4968000     1.210000  0.5582000     -0.1800000     0.7473000 
1 1 1 15 39 20 o 1.663000  0.5223000     1.537000  0.7619000     1.789000  0.7146000     -0.2513000     1.045000  
1 1 1 15 40 0  o 5.844000  0.3059000     5.844000  0.3059000     5.844000  0.3059000     0.000000       0.000000  
1 1 1 15 40 1  f 3.244000  0.3610000     3.793000  0.4189000     2.696000  0.5880000     1.096000       0.7219000 
1 1 1 15 40 2  o 13.49000  0.1741000     13.68000  0.2467000     13.31000  0.2458000     0.3716000      0.3483000 
1 1 1 15 40 3  o 2.602000  0.4158000     3.058000  0.5164000     2.146000  0.6519000     0.9118000      0.8317000 
1 1 1 15 40 4  o 8.436000  0.1871000     8.375000  0.2640000     8.496000  0.2653000     -0.1212000     0.3743000 
1 1 1 15 40 5  o 11.20000  0.1769000     11.34000  0.2487000     11.05000  0.2516000     0.2934000      0.3538000 
1 1 1 15 40 6  o 2.773000  0.4401000     2.812000  0.6081000     2.735000  0.6364000     0.7740000E-01  0.8802000 
1 1 1 15 40 7  o 6.610000  0.2198000     6.363000  0.3191000     6.858000  0.3023000     -0.4951000     0.4396000 
1 1 1 15 40 8  o 7.686000  0.2065000     7.498000  0.2958000     7.875000  0.2881000     -0.3775000     0.4130000 
1 1 1 15 40 9  o 2.635000  0.4721000     2.599000  0.6705000     2.670000  0.6648000     -0.7018000E-01 0.9442000 
1 1 1 15 40 10 o 6.310000  0.2435000     6.465000  0.3419000     6.155000  0.3467000     0.3104000      0.4869000 
1 1 1 15 40 11 o 2.738000  0.5611000     2.782000  0.7528000     2.695000  0.8322000     0.8669000E-01  1.122000  
1 1 1 15 40 12 o 2.646000  0.5282000     2.431000  0.7123000     2.860000  0.7800000     -0.4294000     1.056000  
1 1 1 15 40 13 o 5.072000  0.3307000     5.106000  0.5126000     5.039000  0.4180000     0.6698000E-01  0.6614000 
1 1 1 15 40 14 o 2.870000  0.4657000     3.361000  0.5810000     2.378000  0.7280000     0.9834000      0.9314000 
1 1 1 15 40 15 o 1.475000  0.4338000     1.033000  0.5052000     1.917000  0.7053000     -0.8838000     0.8675000 
1 1 1 15 40 16 o 3.076000  0.4384000     3.002000  0.6131000     3.151000  0.6267000     -0.1491000     0.8767000 
1 1 1 15 40 17 o 1.854000  0.4877000     1.859000  0.6879000     1.848000  0.6915000     0.1117000E-01  0.9754000 
1 1 1 15 40 18 o 1.630000  0.4879000     1.653000  0.6772000     1.608000  0.7025000     0.4575000E-01  0.9758000 
1 1 1 15 40 19 o 0.9474000 0.3310000     0.8890000 0.4432000     1.006000  0.4916000     -0.1168000     0.6619000 
1 1 1 15 40 20 o 1.418000  0.7044000     ?         ?             1.418000  0.7044000     ?              ?         
1 1 1 15 41 0  o 8.853000  0.2586000     8.853000  0.2586000     8.853000  0.2586000     0.000000       0.000000  
1 1 1 15 41 1  o 14.24000  0.1780000     14.44000  0.2522000     14.04000  0.2513000     0.4057000      0.3560000 
1 1 1 15 41 2  o 5.461000  0.2313000     5.392000  0.3297000     5.530000  0.3246000     -0.1386000     0.4627000 
1 1 1 15 41 3  o 9.901000  0.1783000     9.881000  0.2486000     9.921000  0.2556000     -0.3964000E-01 0.3566000 
1 1 1 15 41 4  o 7.935000  0.1933000     7.788000  0.2740000     8.081000  0.2729000     -0.2932000     0.3867000 
1 1 1 15 41 5  o 7.426000  0.2016000     7.779000  0.2742000     7.074000  0.2955000     0.7043000      0.4032000 
1 1 1 15 41 6  o 9.836000  0.1871000     9.600000  0.2639000     10.07000  0.2653000     -0.4720000     0.3742000 
1 1 1 15 41 7  o 6.032000  0.2370000     6.031000  0.3329000     6.034000  0.3373000     -0.2865000E-02 0.4739000 
1 1 1 15 41 8  f 5.926000  0.2429000     6.061000  0.3374000     5.791000  0.3494000     0.2699000      0.4857000 
1 1 1 15 41 9  o 5.557000  0.2582000     5.230000  0.3778000     5.884000  0.3519000     -0.6531000     0.5163000 
1 1 1 15 41 10 o 7.818000  0.2699000     7.897000  0.4386000     7.739000  0.3147000     0.1578000      0.5398000 
1 1 1 15 41 11 o 2.959000  0.4713000     2.566000  0.7043000     3.352000  0.6266000     -0.7857000     0.9427000 
1 1 1 15 41 12 o 3.746000  0.5103000     4.551000  0.6438000     2.942000  0.7918000     1.608000       1.021000  
1 1 1 15 41 13 o 4.969000  0.2985000     4.899000  0.4210000     5.039000  0.4234000     -0.1391000     0.5971000 
1 1 1 15 41 14 o 1.566000  0.4467000     2.044000  0.7223000     1.088000  0.5259000     0.9556000      0.8935000 
1 1 1 15 41 15 o 1.554000  0.4624000     1.598000  0.6627000     1.511000  0.6451000     0.8752000E-01  0.9248000 
1 1 1 15 41 16 o 1.352000  0.4278000     1.417000  0.6181000     1.286000  0.5915000     0.1312000      0.8555000 
1 1 1 15 41 17 o 2.249000  0.4603000     2.800000  0.6252000     1.698000  0.6757000     1.102000       0.9206000 
1 1 1 15 41 18 o 1.964000  0.4424000     2.634000  0.6525000     1.293000  0.5976000     1.340000       0.8848000 
1 1 1 15 41 19 o 1.390000  0.4591000     1.244000  0.5770000     1.537000  0.7141000     -0.2937000     0.9181000 
1 1 1 15 42 0  o 2.658000  0.6926000     2.658000  0.6926000     2.658000  0.6926000     -0.000000      0.000000  
1 1 1 15 42 1  f 11.15000  0.1748000     10.97000  0.2478000     11.33000  0.2465000     -0.3588000     0.3496000 
1 1 1 15 42 2  o 15.08000  0.1806000     15.05000  0.2561000     15.11000  0.2547000     -0.5319000E-01 0.3612000 
1 1 1 15 42 3  o 8.173000  0.1904000     8.119000  0.2690000     8.227000  0.2697000     -0.1080000     0.3809000 
1 1 1 15 42 4  o 2.273000  0.4598000     2.123000  0.6640000     2.423000  0.6361000     -0.2996000     0.9195000 
1 1 1 15 42 5  o 6.680000  0.2199000     6.174000  0.3271000     7.185000  0.2941000     -1.011000      0.4399000 
1 1 1 15 42 6  o 2.743000  0.4521000     2.556000  0.6738000     2.931000  0.6030000     -0.3755000     0.9042000 
1 1 1 15 42 7  o 6.218000  0.2350000     6.121000  0.3290000     6.316000  0.3356000     -0.1947000     0.4699000 
1 1 1 15 42 8  o 2.578000  0.4704000     2.014000  0.7124000     3.143000  0.6143000     -1.128000      0.9407000 
1 1 1 15 42 9  o 14.34000  0.2122000     13.92000  0.3239000     14.77000  0.2742000     -0.8453000     0.4244000 
1 1 1 15 42 10 o 3.732000  0.4404000     3.747000  0.5219000     3.718000  0.7096000     0.2868000E-01  0.8808000 
1 1 1 15 42 11 o 1.406000  0.4654000     1.403000  0.6371000     1.409000  0.6785000     -0.5851000E-02 0.9307000 
1 1 1 15 42 12 o 6.511000  0.2726000     6.762000  0.4144000     6.260000  0.3544000     0.5020000      0.5453000 
1 1 1 15 42 13 o 1.718000  0.4715000     1.314000  0.5994000     2.121000  0.7279000     -0.8064000     0.9430000 
1 1 1 15 42 14 o 1.871000  0.4979000     1.898000  0.7103000     1.844000  0.6980000     0.5395000E-01  0.9958000 
1 1 1 15 42 15 o 2.050000  0.4999000     2.040000  0.7031000     2.059000  0.7108000     -0.1813000E-01 0.9998000 
1 1 1 15 42 16 f 1.896000  0.4827000     1.645000  0.6582000     2.147000  0.7063000     -0.5018000     0.9655000 
1 1 1 15 42 17 o 1.155000  0.3967000     1.163000  0.5760000     1.147000  0.5457000     0.1616000E-01  0.7934000 
1 1 1 15 42 18 f 1.795000  0.4788000     1.908000  0.6834000     1.682000  0.6709000     0.2261000      0.9577000 
1 1 1 15 42 19 o 1.223000  0.4082000     1.392000  0.6372000     1.054000  0.5105000     0.3382000      0.8165000 
1 1 1 15 43 0  o 9.346000  0.2578000     9.346000  0.2578000     9.346000  0.2578000     -0.000000      0.000000  
1 1 1 15 43 1  o 4.761000  0.2606000     4.899000  0.3634000     4.623000  0.3735000     0.2762000      0.5211000 
1 1 1 15 43 2  o 10.56000  0.1808000     10.84000  0.2532000     10.27000  0.2581000     0.5679000      0.3615000 
1 1 1 15 43 3  o 5.175000  0.2492000     5.225000  0.3511000     5.125000  0.3539000     0.1002000      0.4985000 
1 1 1 15 43 4  o 7.380000  0.2072000     7.640000  0.2888000     7.120000  0.2971000     0.5201000      0.4143000 
1 1 1 15 43 5  o 4.973000  0.2703000     4.715000  0.3945000     5.231000  0.3698000     -0.5165000     0.5407000 
1 1 1 15 43 6  o 8.671000  0.1998000     8.449000  0.2824000     8.893000  0.2826000     -0.4434000     0.3995000 
1 1 1 15 43 7  o 6.297000  0.2412000     5.957000  0.3486000     6.638000  0.3335000     -0.6809000     0.4824000 
1 1 1 15 43 8  o 4.079000  0.3497000     3.835000  0.5248000     4.323000  0.4621000     -0.4876000     0.6993000 
1 1 1 15 43 9  o 2.278000  0.5569000     2.009000  0.7518000     2.548000  0.8217000     -0.5387000     1.114000  
1 1 1 15 43 10 o 1.487000  0.4589000     1.604000  0.6623000     1.370000  0.6352000     0.2335000      0.9177000 
1 1 1 15 43 11 o 2.436000  0.5490000     2.180000  0.8470000     2.691000  0.6987000     -0.5110000     1.098000  
1 1 1 15 43 12 o 1.863000  0.4973000     2.043000  0.7152000     1.683000  0.6910000     0.3599000      0.9945000 
1 1 1 15 43 13 o 6.293000  0.2645000     6.607000  0.3806000     5.978000  0.3674000     0.6293000      0.5290000 
1 1 1 15 43 14 o 3.838000  0.3585000     3.844000  0.5129000     3.832000  0.5010000     0.1207000E-01  0.7169000 
1 1 1 15 43 15 o 1.480000  0.4495000     1.385000  0.6152000     1.576000  0.6555000     -0.1905000     0.8990000 
1 1 1 15 43 16 o 2.409000  0.4826000     2.155000  0.6963000     2.663000  0.6684000     -0.5087000     0.9652000 
1 1 1 15 43 17 o 2.005000  0.5240000     1.996000  0.6867000     2.015000  0.7916000     -0.1947000E-01 1.048000  
1 1 1 15 43 18 o 1.331000  0.4327000     1.421000  0.6179000     1.240000  0.6058000     0.1813000      0.8653000 
1 1 1 15 44 0  o 4.409000  0.4251000     4.409000  0.4251000     4.409000  0.4251000     -0.000000      0.000000  
1 1 1 15 44 1  o 5.547000  0.2473000     5.328000  0.3668000     5.765000  0.3318000     -0.4371000     0.4946000 
1 1 1 15 44 2  o 2.670000  0.4452000     3.073000  0.5588000     2.268000  0.6932000     0.8048000      0.8904000 
1 1 1 15 44 3  o 5.114000  0.2664000     5.389000  0.3503000     4.839000  0.4015000     0.5504000      0.5328000 
1 1 1 15 44 4  o 5.171000  0.2612000     5.074000  0.3627000     5.268000  0.3760000     -0.1944000     0.5224000 
1 1 1 15 44 5  o 8.315000  0.2055000     8.167000  0.2913000     8.463000  0.2899000     -0.2954000     0.4110000 
1 1 1 15 44 6  o 3.829000  0.3528000     3.758000  0.5011000     3.900000  0.4967000     -0.1411000     0.7055000 
1 1 1 15 44 7  o 4.603000  0.3077000     4.408000  0.4562000     4.797000  0.4132000     -0.3891000     0.6155000 
1 1 1 15 44 8  o 2.431000  0.5664000     2.884000  0.8462000     1.978000  0.7530000     0.9058000      1.133000  
1 1 1 15 44 9  o 1.473000  0.4590000     1.604000  0.6648000     1.342000  0.6330000     0.2624000      0.9180000 
1 1 1 15 44 10 f 5.912000  0.3429000     5.748000  0.5276000     6.076000  0.4380000     -0.3281000     0.6857000 
1 1 1 15 44 11 o 1.505000  0.4575000     1.738000  0.6949000     1.272000  0.5951000     0.4659000      0.9149000 
1 1 1 15 44 12 o 4.417000  0.3254000     4.135000  0.4853000     4.698000  0.4336000     -0.5634000     0.6507000 
1 1 1 15 44 13 o 2.006000  0.4776000     1.513000  0.6471000     2.499000  0.7025000     -0.9858000     0.9551000 
1 1 1 15 44 14 f 1.749000  0.4752000     1.595000  0.6598000     1.902000  0.6842000     -0.3075000     0.9505000 
1 1 1 15 44 15 o 3.929000  0.3447000     3.709000  0.5210000     4.150000  0.4514000     -0.4407000     0.6894000 
1 1 1 15 44 16 o 2.802000  0.5310000     3.706000  0.7947000     1.899000  0.7046000     1.806000       1.062000  
1 1 1 15 44 17 o 1.433000  0.4307000     1.140000  0.5436000     1.726000  0.6681000     -0.5855000     0.8613000 
1 1 1 15 44 18 o 1.707000  0.5182000     1.514000  0.6877000     1.901000  0.7753000     -0.3867000     1.036000  
1 1 1 15 45 0  o 7.439000  0.2963000     7.439000  0.2963000     7.439000  0.2963000     -0.000000      0.000000  
1 1 1 15 45 1  o 6.410000  0.2255000     6.230000  0.3253000     6.590000  0.3125000     -0.3598000     0.4510000 
1 1 1 15 45 2  o 3.705000  0.3549000     4.242000  0.4256000     3.169000  0.5680000     1.074000       0.7098000 
1 1 1 15 45 3  o 2.638000  0.4579000     2.729000  0.6348000     2.548000  0.6600000     0.1808000      0.9157000 
1 1 1 15 45 4  o 7.213000  0.2179000     6.899000  0.3136000     7.527000  0.3025000     -0.6280000     0.4358000 
1 1 1 15 45 5  o 4.888000  0.2887000     4.806000  0.4093000     4.970000  0.4073000     -0.1635000     0.5774000 
1 1 1 15 45 6  o 1.773000  0.4819000     2.011000  0.7089000     1.536000  0.6531000     0.4752000      0.9638000 
1 1 1 15 45 7  o 1.795000  0.5370000     2.026000  0.8265000     1.565000  0.6858000     0.4608000      1.074000  
1 1 1 15 45 8  o 4.202000  0.4033000     4.245000  0.4846000     4.159000  0.6449000     0.8648000E-01  0.8067000 
1 1 1 15 45 9  o 3.356000  0.5231000     3.102000  0.8179000     3.610000  0.6524000     -0.5083000     1.046000  
1 1 1 15 45 10 o 2.038000  0.5088000     2.243000  0.7256000     1.832000  0.7136000     0.4109000      1.018000  
1 1 1 15 45 11 o 5.427000  0.2790000     5.569000  0.3777000     5.285000  0.4109000     0.2838000      0.5581000 
1 1 1 15 45 12 o 1.970000  0.4913000     1.721000  0.6860000     2.218000  0.7034000     -0.4970000     0.9825000 
1 1 1 15 45 13 o 4.414000  0.3222000     4.244000  0.4682000     4.583000  0.4428000     -0.3392000     0.6444000 
1 1 1 15 45 14 o 2.368000  0.4867000     2.641000  0.6778000     2.095000  0.6987000     0.5459000      0.9734000 
1 1 1 15 45 15 o 1.724000  0.4720000     1.418000  0.6226000     2.030000  0.7096000     -0.6126000     0.9440000 
1 1 1 15 45 16 f 1.618000  0.4876000     1.394000  0.6308000     1.842000  0.7436000     -0.4471000     0.9751000 
1 1 1 15 45 17 o 1.323000  0.4255000     1.273000  0.5784000     1.373000  0.6242000     -0.9972000E-01 0.8510000 
1 1 1 15 45 18 o 1.550000  0.4864000     1.984000  0.8083000     1.117000  0.5411000     0.8671000      0.9727000 
1 1 1 15 46 0  o 8.334000  0.2899000     8.334000  0.2899000     8.334000  0.2899000     -0.000000      0.000000  
1 1 1 15 46 1  o 5.612000  0.2559000     6.171000  0.3392000     5.052000  0.3833000     1.118000       0.5118000 
1 1 1 15 46 2  o 3.913000  0.3332000     3.876000  0.4711000     3.951000  0.4713000     -0.7419000E-01 0.6664000 
1 1 1 15 46 3  o 9.918000  0.1931000     9.933000  0.2705000     9.903000  0.2755000     0.2942000E-01  0.3861000 
1 1 1 15 46 4  o 3.899000  0.3455000     4.025000  0.4642000     3.774000  0.5119000     0.2509000      0.6911000 
1 1 1 15 46 5  o 7.193000  0.2409000     7.577000  0.3535000     6.810000  0.3274000     0.7672000      0.4818000 
1 1 1 15 46 6  o 5.951000  0.3307000     5.823000  0.5219000     6.080000  0.4062000     -0.2570000     0.6614000 
1 1 1 15 46 7  o 3.172000  0.4968000     2.705000  0.6816000     3.640000  0.7229000     -0.9354000     0.9936000 
1 1 1 15 46 8  o 5.220000  0.3794000     4.967000  0.6056000     5.472000  0.4573000     -0.5057000     0.7588000 
1 1 1 15 46 9  o 4.988000  0.3278000     5.257000  0.4829000     4.719000  0.4434000     0.5375000      0.6556000 
1 1 1 15 46 10 o 2.179000  0.5137000     2.138000  0.7223000     2.221000  0.7307000     -0.8258000E-01 1.027000  
1 1 1 15 46 11 o 5.595000  0.2694000     5.351000  0.3948000     5.838000  0.3667000     -0.4869000     0.5388000 
1 1 1 15 46 12 o 1.584000  0.4646000     1.360000  0.6088000     1.809000  0.7019000     -0.4488000     0.9292000 
1 1 1 15 46 13 o 1.333000  0.4173000     1.088000  0.5233000     1.578000  0.6503000     -0.4901000     0.8347000 
1 1 1 15 46 14 o 2.639000  0.4738000     2.475000  0.6960000     2.802000  0.6431000     -0.3272000     0.9477000 
1 1 1 15 46 15 o 3.505000  0.4912000     3.167000  0.8439000     3.843000  0.5028000     -0.6762000     0.9823000 
1 1 1 15 46 16 o 1.822000  0.4683000     2.158000  0.6857000     1.486000  0.6378000     0.6723000      0.9365000 
1 1 1 15 46 17 o 2.422000  0.5498000     2.671000  0.7347000     2.173000  0.8181000     0.4984000      1.100000  
1 1 1 15 47 0  o 4.983000  0.4061000     4.983000  0.4061000     4.983000  0.4061000     0.000000       0.000000  
1 1 1 15 47 1  o 7.775000  0.2145000     7.747000  0.3070000     7.804000  0.2997000     -0.5713000E-01 0.4290000 
1 1 1 15 47 2  o 6.811000  0.2249000     6.809000  0.3139000     6.813000  0.3221000     -0.4059000E-02 0.4498000 
1 1 1 15 47 3  o 2.758000  0.4593000     2.973000  0.6247000     2.543000  0.6734000     0.4301000      0.9185000 
1 1 1 15 47 4  o 3.169000  0.5038000     3.887000  0.7285000     2.451000  0.6960000     1.436000       1.008000  
1 1 1 15 47 5  o 2.633000  0.5592000     2.398000  0.7510000     2.868000  0.8286000     -0.4700000     1.118000  
1 1 1 15 47 6  o 2.116000  0.6015000     1.524000  0.6629000     2.709000  1.004000      -1.185000      1.203000  
1 1 1 15 47 7  f 1.854000  0.5367000     2.191000  0.8295000     1.517000  0.6811000     0.6740000      1.073000  
1 1 1 15 47 8  o 2.656000  0.4985000     2.826000  0.7004000     2.486000  0.7096000     0.3403000      0.9971000 
1 1 1 15 47 9  o 1.765000  0.4936000     1.943000  0.7214000     1.587000  0.6741000     0.3565000      0.9873000 
1 1 1 15 47 10 o 1.720000  0.4440000     1.081000  0.5220000     2.359000  0.7183000     -1.278000      0.8879000 
1 1 1 15 47 11 o 3.506000  0.3950000     3.813000  0.5096000     3.199000  0.6037000     0.6147000      0.7900000 
1 1 1 15 47 12 o 1.446000  0.4483000     1.338000  0.6059000     1.554000  0.6610000     -0.2163000     0.8967000 
1 1 1 15 47 13 o 2.963000  0.4296000     2.775000  0.6328000     3.151000  0.5810000     -0.3757000     0.8591000 
1 1 1 15 47 14 o 1.335000  0.4162000     1.628000  0.6593000     1.042000  0.5081000     0.5860000      0.8324000 
1 1 1 15 47 15 o 1.671000  0.4615000     2.166000  0.7230000     1.176000  0.5737000     0.9901000      0.9230000 
1 1 1 15 47 16 o 1.122000  0.3815000     1.065000  0.5160000     1.178000  0.5621000     -0.1129000     0.7631000 
1 1 1 15 47 17 o 1.410000  0.4434000     1.276000  0.5991000     1.543000  0.6539000     -0.2666000     0.8868000 
1 1 1 15 48 0  o 1.986000  0.9270000     1.986000  0.9270000     1.986000  0.9270000     0.000000       0.000000  
1 1 1 15 48 1  o 3.194000  0.4771000     2.452000  0.7738000     3.936000  0.5583000     -1.484000      0.9542000 
1 1 1 15 48 2  o 1.384000  0.4490000     1.176000  0.5777000     1.591000  0.6876000     -0.4146000     0.8981000 
1 1 1 15 48 3  o 2.929000  0.5879000     3.215000  0.8213000     2.643000  0.8413000     0.5721000      1.176000  
1 1 1 15 48 4  o 1.895000  0.7411000     1.895000  0.7411000     ?         ?             ?              ?         
1 1 1 15 48 5  o 7.012000  0.2980000     6.895000  0.3841000     7.129000  0.4557000     -0.2339000     0.5960000 
1 1 1 15 48 6  o 6.845000  0.2593000     6.374000  0.4076000     7.316000  0.3206000     -0.9417000     0.5186000 
1 1 1 15 48 7  o 1.440000  0.4471000     1.565000  0.6615000     1.315000  0.6017000     0.2493000      0.8942000 
1 1 1 15 48 8  o 4.133000  0.3603000     4.250000  0.4926000     4.017000  0.5259000     0.2332000      0.7205000 
1 1 1 15 48 9  o 4.868000  0.2996000     4.343000  0.4614000     5.393000  0.3822000     -1.050000      0.5991000 
1 1 1 15 48 10 o 1.992000  0.4760000     2.431000  0.6960000     1.554000  0.6496000     0.8769000      0.9520000 
1 1 1 15 48 11 o 1.731000  0.4789000     1.616000  0.6616000     1.846000  0.6925000     -0.2299000     0.9577000 
1 1 1 15 48 12 o 1.575000  0.4361000     1.081000  0.5209000     2.069000  0.6997000     -0.9884000     0.8723000 
1 1 1 15 48 13 o 1.406000  0.4375000     1.224000  0.5719000     1.589000  0.6622000     -0.3649000     0.8750000 
1 1 1 15 48 14 o 1.466000  0.4715000     1.621000  0.7293000     1.312000  0.5979000     0.3083000      0.9430000 
1 1 1 15 48 15 o 1.723000  0.4730000     2.000000  0.7045000     1.446000  0.6314000     0.5537000      0.9460000 
1 1 1 15 48 16 o 1.794000  0.5375000     1.722000  0.7518000     1.867000  0.7685000     -0.1444000     1.075000  
1 1 1 15 49 0  o 1.246000  0.8194000     1.246000  0.8194000     1.246000  0.8194000     -0.000000      0.000000  
1 1 1 15 49 1  o 5.848000  0.4410000     6.001000  0.4819000     5.696000  0.7386000     0.3049000      0.8820000 
1 1 1 15 49 2  o 4.228000  0.5681000     4.478000  0.6393000     3.978000  0.9393000     0.4994000      1.136000  
1 1 1 15 49 3  o 3.032000  0.5765000     3.342000  0.7857000     2.722000  0.8438000     0.6197000      1.153000  
1 1 1 15 49 4  o 3.607000  0.4172000     4.045000  0.5851000     3.170000  0.5948000     0.8748000      0.8343000 
1 1 1 15 49 5  o 3.052000  0.4676000     2.254000  0.7892000     3.850000  0.5017000     -1.596000      0.9352000 
1 1 1 15 49 6  o 2.952000  0.4559000     3.580000  0.5716000     2.324000  0.7104000     1.256000       0.9118000 
1 1 1 15 49 7  o 6.610000  0.2492000     6.543000  0.3534000     6.678000  0.3514000     -0.1354000     0.4984000 
1 1 1 15 49 8  o 1.780000  0.4905000     1.673000  0.6827000     1.887000  0.7045000     -0.2136000     0.9811000 
1 1 1 15 49 9  o 2.380000  0.4499000     3.207000  0.6081000     1.552000  0.6631000     1.655000       0.8997000 
1 1 1 15 49 10 o 1.531000  0.4543000     1.699000  0.6738000     1.363000  0.6095000     0.3360000      0.9086000 
1 1 1 15 49 11 o 1.508000  0.4560000     1.581000  0.6568000     1.435000  0.6327000     0.1454000      0.9120000 
1 1 1 15 49 12 o 2.782000  0.4490000     2.148000  0.7014000     3.415000  0.5608000     -1.267000      0.8980000 
1 1 1 15 49 13 o 1.285000  0.4167000     1.190000  0.5602000     1.380000  0.6170000     -0.1904000     0.8333000 
1 1 1 15 49 14 o 1.604000  0.4844000     1.583000  0.6592000     1.626000  0.7099000     -0.4222000E-01 0.9688000 
1 1 1 15 49 15 o 1.532000  0.4905000     1.340000  0.6005000     1.723000  0.7758000     -0.3827000     0.9811000 
1 1 1 15 49 16 o 1.710000  0.4919000     1.869000  0.7338000     1.551000  0.6554000     0.3187000      0.9839000 
1 1 1 15 50 0  o 8.184000  0.3403000     8.184000  0.3403000     8.184000  0.3403000     -0.000000      0.000000  
1 1 1 15 50 1  o 6.897000  0.2481000     6.260000  0.3889000     7.534000  0.3081000     -1.274000      0.4962000 
1 1 1 15 50 2  o 1.879000  0.4902000     1.707000  0.6825000     2.050000  0.7039000     -0.3436000     0.9804000 
1 1 1 15 50 3  o 6.018000  0.2544000     6.158000  0.3569000     5.877000  0.3627000     0.2813000      0.5089000 
1 1 1 15 50 4  o 8.392000  0.2166000     8.651000  0.3028000     8.133000  0.3098000     0.5180000      0.4332000 
1 1 1 15 50 5  o 4.941000  0.2984000     5.039000  0.4150000     4.843000  0.4289000     0.1959000      0.5968000 
1 1 1 15 50 6  o 5.237000  0.2918000     5.112000  0.4196000     5.362000  0.4055000     -0.2496000     0.5835000 
1 1 1 15 50 7  o 3.496000  0.4183000     3.316000  0.6225000     3.676000  0.5589000     -0.3595000     0.8365000 
1 1 1 15 50 8  o 3.160000  0.4376000     3.985000  0.5036000     2.336000  0.7157000     1.648000       0.8751000 
1 1 1 15 50 9  o 4.494000  0.3211000     5.010000  0.4215000     3.978000  0.4845000     1.032000       0.6422000 
1 1 1 15 50 10 o 2.847000  0.4572000     2.198000  0.7128000     3.496000  0.5727000     -1.298000      0.9143000 
1 1 1 15 50 11 o 2.809000  0.4667000     2.940000  0.6239000     2.679000  0.6943000     0.2612000      0.9334000 
1 1 1 15 50 12 o 2.573000  0.4702000     2.035000  0.7115000     3.112000  0.6149000     -1.078000      0.9404000 
1 1 1 15 50 13 o 3.559000  0.5098000     3.330000  0.8336000     3.788000  0.5871000     -0.4577000     1.020000  
1 1 1 15 50 14 o 1.810000  0.4750000     2.202000  0.7036000     1.417000  0.6382000     0.7855000      0.9500000 
1 1 1 15 50 15 o 1.588000  0.5015000     1.702000  0.7427000     1.473000  0.6740000     0.2291000      1.003000  
1 1 1 15 51 0  o 10.34000  0.2847000     10.34000  0.2847000     10.34000  0.2847000     0.000000       0.000000  
1 1 1 15 51 1  o 2.129000  0.5024000     1.889000  0.7011000     2.369000  0.7197000     -0.4804000     1.005000  
1 1 1 15 51 2  o 6.775000  0.2401000     6.678000  0.3396000     6.872000  0.3395000     -0.1940000     0.4802000 
1 1 1 15 51 3  f 2.408000  0.4965000     2.418000  0.6915000     2.397000  0.7126000     0.2082000E-01  0.9930000 
1 1 1 15 51 4  o 2.325000  0.5067000     2.491000  0.7092000     2.158000  0.7239000     0.3331000      1.013000  
1 1 1 15 51 5  o 5.492000  0.2760000     5.392000  0.3955000     5.592000  0.3850000     -0.2004000     0.5519000 
1 1 1 15 51 6  o 4.593000  0.3165000     4.853000  0.4292000     4.333000  0.4654000     0.5195000      0.6330000 
1 1 1 15 51 7  o 2.490000  0.5007000     2.475000  0.7088000     2.504000  0.7074000     -0.2853000E-01 1.001000  
1 1 1 15 51 8  o 2.200000  0.4839000     2.754000  0.6995000     1.647000  0.6689000     1.107000       0.9678000 
1 1 1 15 51 9  o 2.851000  0.4759000     3.217000  0.6296000     2.485000  0.7139000     0.7320000      0.9518000 
1 1 1 15 51 10 o 1.564000  0.4620000     1.682000  0.6744000     1.445000  0.6317000     0.2363000      0.9240000 
1 1 1 15 51 11 f 1.902000  0.4885000     1.600000  0.6729000     2.205000  0.7085000     -0.6050000     0.9771000 
1 1 1 15 51 12 o 2.267000  0.4833000     3.189000  0.7456000     1.346000  0.6151000     1.842000       0.9666000 
1 1 1 15 51 13 o 1.439000  0.4335000     1.787000  0.6798000     1.090000  0.5383000     0.6975000      0.8671000 
1 1 1 15 51 14 o 1.503000  0.4724000     1.656000  0.6831000     1.351000  0.6527000     0.3055000      0.9448000 
1 1 1 15 51 15 o 1.776000  0.5179000     1.816000  0.7419000     1.735000  0.7228000     0.8067000E-01  1.036000  
1 1 1 15 52 0  o 1.112000  0.7111000     1.112000  0.7111000     1.112000  0.7111000     0.000000       0.000000  
1 1 1 15 52 1  o 3.200000  0.4357000     3.662000  0.5476000     2.739000  0.6779000     0.9236000      0.8715000 
1 1 1 15 52 2  o 4.909000  0.3032000     5.152000  0.4137000     4.667000  0.4433000     0.4849000      0.6064000 
1 1 1 15 52 3  o 5.644000  0.2698000     5.722000  0.3737000     5.565000  0.3893000     0.1577000      0.5397000 
1 1 1 15 52 4  f 5.720000  0.2606000     5.896000  0.3568000     5.544000  0.3798000     0.3527000      0.5212000 
1 1 1 15 52 5  o 9.153000  0.2094000     8.886000  0.3015000     9.421000  0.2907000     -0.5349000     0.4189000 
1 1 1 15 52 6  o 2.312000  0.4979000     2.648000  0.6872000     1.977000  0.7205000     0.6707000      0.9957000 
1 1 1 15 52 7  o 2.454000  0.4976000     2.535000  0.6868000     2.372000  0.7203000     0.1633000      0.9953000 
1 1 1 15 52 8  o 4.431000  0.3204000     4.602000  0.4404000     4.259000  0.4653000     0.3422000      0.6407000 
1 1 1 15 52 9  o 2.160000  0.5146000     2.105000  0.7366000     2.214000  0.7189000     -0.1087000     1.029000  
1 1 1 15 52 10 o 2.185000  0.5119000     2.253000  0.7253000     2.117000  0.7225000     0.1358000      1.024000  
1 1 1 15 52 11 o 1.490000  0.4538000     1.629000  0.6734000     1.351000  0.6086000     0.2785000      0.9077000 
1 1 1 15 52 12 o 1.267000  0.4220000     0.9325000 0.4671000     1.601000  0.7029000     -0.6688000     0.8440000 
1 1 1 15 52 13 o 2.779000  0.5735000     2.228000  0.7330000     3.330000  0.8822000     -1.102000      1.147000  
1 1 1 15 52 14 o 1.347000  0.4375000     1.475000  0.6630000     1.220000  0.5710000     0.2555000      0.8750000 
1 1 1 15 53 0  o 1.915000  0.8935000     1.915000  0.8935000     1.915000  0.8935000     0.000000       0.000000  
1 1 1 15 53 1  o 2.167000  0.5056000     2.368000  0.7148000     1.967000  0.7153000     0.4012000      1.011000  
1 1 1 15 53 2  o 7.804000  0.2232000     7.988000  0.3093000     7.620000  0.3218000     0.3690000      0.4464000 
1 1 1 15 53 3  o 2.894000  0.4371000     2.198000  0.6989000     3.590000  0.5250000     -1.392000      0.8741000 
1 1 1 15 53 4  o 1.577000  0.4639000     1.471000  0.6338000     1.684000  0.6775000     -0.2132000     0.9278000 
1 1 1 15 53 5  o 1.592000  0.4691000     1.590000  0.6610000     1.594000  0.6658000     -0.4079000E-02 0.9382000 
1 1 1 15 53 6  o 3.013000  0.4535000     3.127000  0.6145000     2.899000  0.6670000     0.2284000      0.9069000 
1 1 1 15 53 7  o 4.183000  0.3445000     3.906000  0.5196000     4.461000  0.4526000     -0.5550000     0.6891000 
1 1 1 15 53 8  o 3.464000  0.4185000     2.834000  0.6848000     4.094000  0.4812000     -1.259000      0.8369000 
1 1 1 15 53 9  o 3.821000  0.3841000     3.274000  0.6195000     4.369000  0.4542000     -1.095000      0.7682000 
1 1 1 15 53 10 o 2.904000  0.4665000     2.837000  0.6720000     2.970000  0.6471000     -0.1328000     0.9330000 
1 1 1 15 53 11 o 2.343000  0.5371000     1.822000  0.8038000     2.864000  0.7126000     -1.042000      1.074000  
1 1 1 15 53 12 o 3.722000  0.4187000     3.930000  0.5079000     3.514000  0.6658000     0.4161000      0.8374000 
1 1 1 15 53 13 o 1.388000  0.4581000     1.183000  0.5792000     1.593000  0.7098000     -0.4100000     0.9161000 
1 1 1 15 54 0  o 2.876000  0.7580000     2.876000  0.7580000     2.876000  0.7580000     -0.000000      0.000000  
1 1 1 15 54 1  f 6.415000  0.2475000     6.564000  0.3448000     6.267000  0.3551000     0.2976000      0.4950000 
1 1 1 15 54 2  o 4.990000  0.2914000     4.929000  0.4076000     5.051000  0.4164000     -0.1222000     0.5827000 
1 1 1 15 54 3  o 5.193000  0.2807000     5.290000  0.3916000     5.097000  0.4023000     0.1939000      0.5614000 
1 1 1 15 54 4  o 2.384000  0.4603000     1.656000  0.6715000     3.113000  0.6298000     -1.457000      0.9206000 
1 1 1 15 54 5  o 1.509000  0.4533000     1.300000  0.5957000     1.718000  0.6835000     -0.4181000     0.9066000 
1 1 1 15 54 6  o 3.092000  0.4568000     3.380000  0.5847000     2.804000  0.7020000     0.5755000      0.9136000 
1 1 1 15 54 7  o 2.174000  0.5020000     2.399000  0.7032000     1.948000  0.7166000     0.4509000      1.004000  
1 1 1 15 54 8  o 1.168000  0.3924000     1.049000  0.5134000     1.288000  0.5935000     -0.2388000     0.7848000 
1 1 1 15 54 9  o 2.969000  0.4651000     3.497000  0.6043000     2.440000  0.7073000     1.056000       0.9303000 
1 1 1 15 54 10 o 3.332000  0.5209000     2.931000  0.8921000     3.733000  0.5379000     -0.8015000     1.042000  
1 1 1 15 54 11 o 4.144000  0.4082000     3.759000  0.5226000     4.528000  0.6272000     -0.7688000     0.8163000 
1 1 1 15 54 12 o 1.534000  0.4851000     1.816000  0.7593000     1.253000  0.6041000     0.5634000      0.9703000 
1 1 1 15 54 13 o 1.352000  0.4330000     1.359000  0.6145000     1.346000  0.6102000     0.1358000E-01  0.8660000 
1 1 1 15 55 0  o 1.164000  0.7277000     1.164000  0.7277000     1.164000  0.7277000     -0.000000      0.000000  
1 1 1 15 55 1  o 4.039000  0.3515000     4.067000  0.4882000     4.012000  0.5058000     0.5586000E-01  0.7030000 
1 1 1 15 55 2  o 2.464000  0.4471000     1.577000  0.6705000     3.351000  0.5916000     -1.774000      0.8941000 
1 1 1 15 55 3  o 3.534000  0.3952000     3.501000  0.5687000     3.567000  0.5490000     -0.6683000E-01 0.7905000 
1 1 1 15 55 4  o 4.258000  0.3392000     4.500000  0.4492000     4.017000  0.5085000     0.4836000      0.6785000 
1 1 1 15 55 5  o 1.187000  0.3950000     1.074000  0.5194000     1.301000  0.5952000     -0.2275000     0.7900000 
1 1 1 15 55 6  o 4.492000  0.3389000     5.241000  0.4041000     3.744000  0.5441000     1.498000       0.6777000 
1 1 1 15 55 7  o 2.889000  0.4755000     3.055000  0.6515000     2.723000  0.6927000     0.3316000      0.9510000 
1 1 1 15 55 8  o 1.794000  0.4539000     2.416000  0.7166000     1.173000  0.5573000     1.243000       0.9078000 
1 1 1 15 55 9  o 1.417000  0.4528000     1.224000  0.6046000     1.610000  0.6742000     -0.3852000     0.9056000 
1 1 1 15 55 10 o 1.869000  0.5495000     1.918000  0.7200000     1.820000  0.8302000     0.9759000E-01  1.099000  
1 1 1 15 55 11 o 1.839000  0.5069000     2.225000  0.7643000     1.453000  0.6659000     0.7719000      1.014000  
1 1 1 15 55 12 o 1.628000  0.4793000     1.510000  0.6722000     1.745000  0.6835000     -0.2350000     0.9587000 
1 1 1 15 56 0  o 6.204000  0.3695000     6.204000  0.3695000     6.204000  0.3695000     -0.000000      0.000000  
1 1 1 15 56 1  o 6.007000  0.2665000     5.671000  0.3831000     6.342000  0.3707000     -0.6713000     0.5331000 
1 1 1 15 56 2  o 5.379000  0.2919000     5.088000  0.4255000     5.671000  0.3996000     -0.5836000     0.5837000 
1 1 1 15 56 3  o 9.446000  0.2154000     9.255000  0.3070000     9.637000  0.3022000     -0.3813000     0.4308000 
1 1 1 15 56 4  o 4.243000  0.3428000     4.124000  0.5016000     4.363000  0.4672000     -0.2395000     0.6855000 
1 1 1 15 56 5  o 1.723000  0.4891000     1.630000  0.6742000     1.816000  0.7088000     -0.1860000     0.9782000 
1 1 1 15 56 6  o 1.959000  0.5074000     1.856000  0.7051000     2.063000  0.7298000     -0.2070000     1.015000  
1 1 1 15 56 7  o 2.160000  0.5037000     2.564000  0.7167000     1.757000  0.7079000     0.8066000      1.007000  
1 1 1 15 56 8  o 1.841000  0.4779000     1.268000  0.6223000     2.414000  0.7254000     -1.146000      0.9557000 
1 1 1 15 56 9  o 1.880000  0.5570000     1.665000  0.6852000     2.094000  0.8784000     -0.4287000     1.114000  
1 1 1 15 56 10 f 1.413000  0.4602000     1.280000  0.6027000     1.545000  0.6956000     -0.2656000     0.9204000 
1 1 1 15 56 11 o 1.455000  0.4584000     1.356000  0.6312000     1.554000  0.6649000     -0.1981000     0.9168000 
1 1 1 15 57 0  o 1.217000  0.7549000     1.217000  0.7549000     1.217000  0.7549000     0.000000       0.000000  
1 1 1 15 57 1  o 1.835000  0.4878000     2.186000  0.7267000     1.483000  0.6509000     0.7023000      0.9756000 
1 1 1 15 57 2  o 4.074000  0.3692000     3.652000  0.5683000     4.496000  0.4715000     -0.8445000     0.7384000 
1 1 1 15 57 3  o 3.013000  0.4469000     3.999000  0.5154000     2.027000  0.7303000     1.973000       0.8938000 
1 1 1 15 57 4  o 1.867000  0.5073000     1.802000  0.7044000     1.932000  0.7302000     -0.1296000     1.015000  
1 1 1 15 57 5  o 1.730000  0.4909000     1.693000  0.6899000     1.768000  0.6984000     -0.7455000E-01 0.9817000 
1 1 1 15 57 6  o 1.852000  0.5175000     2.043000  0.7749000     1.660000  0.6860000     0.3826000      1.035000  
1 1 1 15 57 7  o 2.443000  0.5900000     2.328000  0.8702000     2.557000  0.7971000     -0.2290000     1.180000  
1 1 1 15 57 8  o 1.969000  0.5422000     2.258000  0.7428000     1.680000  0.7900000     0.5776000      1.084000  
1 1 1 15 57 9  o 1.382000  0.4537000     1.427000  0.6516000     1.337000  0.6317000     0.8989000E-01  0.9075000 
1 1 1 15 57 10 o 1.679000  0.4989000     1.820000  0.7493000     1.538000  0.6589000     0.2821000      0.9978000 
1 1 1 15 58 0  o 2.917000  0.7738000     2.917000  0.7738000     2.917000  0.7738000     0.000000       0.000000  
1 1 1 15 58 1  o 6.844000  0.2532000     6.400000  0.3720000     7.288000  0.3435000     -0.8875000     0.5064000 
1 1 1 15 58 2  o 3.732000  0.4032000     3.320000  0.6380000     4.145000  0.4933000     -0.8258000     0.8064000 
1 1 1 15 58 3  o 1.195000  0.3981000     1.437000  0.6391000     0.9530000 0.4748000     0.4836000      0.7962000 
1 1 1 15 58 4  o 1.621000  0.4817000     1.502000  0.6601000     1.740000  0.7016000     -0.2373000     0.9634000 
1 1 1 15 58 5  o 1.723000  0.5067000     1.859000  0.7608000     1.587000  0.6694000     0.2716000      1.013000  
1 1 1 15 58 6  o 1.948000  0.4968000     2.629000  0.7787000     1.266000  0.6173000     1.363000       0.9937000 
1 1 1 15 58 7  o 1.974000  0.5963000     1.973000  0.7644000     1.974000  0.9154000     -0.1305000E-02 1.193000  
1 1 1 15 58 8  o 1.727000  0.5319000     1.796000  0.7766000     1.658000  0.7269000     0.1375000      1.064000  
1 1 1 15 58 9  o 1.281000  0.4240000     1.216000  0.5877000     1.347000  0.6114000     -0.1304000     0.8481000 
1 1 1 15 59 0  o 1.455000  0.8305000     1.455000  0.8305000     1.455000  0.8305000     0.000000       0.000000  
1 1 1 15 59 1  f 3.740000  0.4035000     3.300000  0.6338000     4.180000  0.4995000     -0.8801000     0.8070000 
1 1 1 15 59 2  o 2.709000  0.5452000     2.879000  0.8037000     2.538000  0.7368000     0.3406000      1.090000  
1 1 1 15 59 3  o 2.879000  0.5614000     2.630000  0.9063000     3.128000  0.6629000     -0.4983000     1.123000  
1 1 1 15 59 4  o 1.389000  0.4723000     1.443000  0.6905000     1.334000  0.6446000     0.1089000      0.9446000 
1 1 1 15 59 5  o 3.131000  0.7261000     3.131000  0.7261000     ?         ?             ?              ?         
1 1 1 15 59 6  o 1.727000  0.4981000     2.124000  0.7607000     1.330000  0.6433000     0.7941000      0.9962000 
1 1 1 15 59 7  o 1.400000  0.4556000     1.418000  0.6605000     1.381000  0.6276000     0.3683000E-01  0.9111000 
1 1 1 15 59 8  o 1.938000  0.5162000     1.998000  0.7384000     1.877000  0.7214000     0.1209000      1.032000  
1 1 1 15 60 0  o 1.069000  0.7637000     1.069000  0.7637000     1.069000  0.7637000     -0.000000      0.000000  
1 1 1 15 60 1  o 1.870000  0.6182000     1.793000  0.8531000     1.946000  0.8950000     -0.1525000     1.236000  
1 1 1 15 60 2  o 1.397000  0.6696000     1.397000  0.6696000     ?         ?             ?              ?         
1 1 1 15 60 3  o 2.742000  0.6670000     2.658000  0.8058000     2.826000  1.063000      -0.1674000     1.334000  
1 1 1 15 60 4  o 1.919000  0.5696000     1.633000  0.7391000     2.206000  0.8669000     -0.5736000     1.139000  
1 1 1 15 60 5  o 1.365000  0.4444000     1.598000  0.7027000     1.131000  0.5442000     0.4675000      0.8888000 
1 1 1 15 60 6  o 2.276000  0.4717000     1.467000  0.6647000     3.084000  0.6695000     -1.617000      0.9434000 
1 1 1 15 60 7  o 1.333000  0.4288000     1.164000  0.5547000     1.501000  0.6542000     -0.3363000     0.8577000 
1 1 1 15 61 0  o 1.402000  0.8469000     1.402000  0.8469000     1.402000  0.8469000     -0.000000      0.000000  
1 1 1 15 61 1  o 2.227000  0.5538000     2.569000  0.8086000     1.884000  0.7569000     0.6853000      1.108000  
1 1 1 15 61 2  o 1.311000  0.4330000     1.312000  0.6187000     1.310000  0.6061000     0.2316000E-02  0.8661000 
1 1 1 15 61 3  o 1.586000  0.4729000     1.234000  0.5935000     1.938000  0.7364000     -0.7040000     0.9458000 
1 1 1 15 61 4  o 2.131000  0.5164000     2.387000  0.7339000     1.874000  0.7269000     0.5133000      1.033000  
1 1 1 15 61 5  o 4.193000  0.3713000     4.555000  0.4806000     3.831000  0.5660000     0.7246000      0.7425000 
1 1 1 15 62 0  o 2.843000  0.7984000     2.843000  0.7984000     2.843000  0.7984000     -0.000000      0.000000  
1 1 1 15 62 1  o 1.507000  0.4611000     1.291000  0.5993000     1.724000  0.7010000     -0.4330000     0.9223000 
1 1 1 15 62 2  o 1.767000  0.4982000     1.916000  0.7225000     1.617000  0.6861000     0.2995000      0.9963000 
1 1 1 15 62 3  o 2.248000  0.5128000     1.894000  0.7243000     2.603000  0.7261000     -0.7090000     1.026000  
1 1 1 16 0  1  o 11.56000  0.1951000     11.56000  0.1951000     11.56000  0.1951000     -0.000000      0.000000  
1 1 1 16 0  2  o 6.409000  0.9971000E-01 6.409000  0.9971000E-01 6.409000  0.9971000E-01 0.000000       0.000000  
1 1 1 16 0  3  o 12.02000  0.1580000     12.02000  0.1580000     12.02000  0.1580000     0.000000       0.000000  
1 1 1 16 0  4  o 12.35000  0.1704000     12.35000  0.1704000     12.35000  0.1704000     0.000000       0.000000  
1 1 1 16 0  5  o 4.583000  0.2244000     4.583000  0.2244000     4.583000  0.2244000     0.000000       0.000000  
1 1 1 16 0  6  o 0.8778000 0.5678000     0.8778000 0.5678000     0.8778000 0.5678000     -0.000000      0.000000  
1 1 1 16 0  7  o 2.288000  0.6076000     2.288000  0.6076000     2.288000  0.6076000     0.000000       0.000000  
1 1 1 16 0  8  o 10.30000  0.2149000     10.30000  0.2149000     10.30000  0.2149000     -0.000000      0.000000  
1 1 1 16 0  9  o 5.605000  0.3062000     5.605000  0.3062000     5.605000  0.3062000     0.000000       0.000000  
1 1 1 16 0  10 o 5.964000  0.3134000     5.964000  0.3134000     5.964000  0.3134000     0.000000       0.000000  
1 1 1 16 0  11 o 8.633000  0.3184000     8.633000  0.3184000     8.633000  0.3184000     0.000000       0.000000  
1 1 1 16 0  12 o 16.70000  0.2756000     16.70000  0.2756000     16.70000  0.2756000     0.000000       0.000000  
1 1 1 16 0  13 o 1.899000  0.9321000     1.899000  0.9321000     1.899000  0.9321000     0.000000       0.000000  
1 1 1 16 0  14 o 6.148000  0.4262000     6.148000  0.4262000     6.148000  0.4262000     0.000000       0.000000  
1 1 1 16 0  15 o 8.450000  0.3734000     8.450000  0.3734000     8.450000  0.3734000     0.000000       0.000000  
1 1 1 16 0  16 o 2.079000  1.057000      2.079000  1.057000      2.079000  1.057000      0.000000       0.000000  
1 1 1 16 0  17 o 5.989000  0.5273000     5.989000  0.5273000     5.989000  0.5273000     0.000000       0.000000  
1 1 1 16 0  18 o 2.347000  1.138000      2.347000  1.138000      2.347000  1.138000      0.000000       0.000000  
1 1 1 16 0  19 o 6.518000  0.4872000     6.518000  0.4872000     6.518000  0.4872000     -0.000000      0.000000  
1 1 1 16 0  20 f 0.9261000 0.6585000     0.9261000 0.6585000     0.9261000 0.6585000     0.000000       0.000000  
1 1 1 16 0  21 o 1.458000  0.8959000     1.458000  0.8959000     1.458000  0.8959000     0.000000       0.000000  
1 1 1 16 0  22 o 1.052000  0.7069000     1.052000  0.7069000     1.052000  0.7069000     -0.000000      0.000000  
1 1 1 16 0  23 o 0.6909000 0.5030000     0.6909000 0.5030000     0.6909000 0.5030000     0.000000       0.000000  
1 1 1 16 0  24 o 1.247000  0.8004000     1.247000  0.8004000     1.247000  0.8004000     0.000000       0.000000  
1 1 1 16 0  25 o 1.112000  0.7257000     1.112000  0.7257000     1.112000  0.7257000     0.000000       0.000000  
1 1 1 16 1  1  o 12.78000  0.1790000     13.04000  0.3142000     12.51000  0.1715000     0.5306000      0.3580000 
1 1 1 16 1  2  o 21.46000  0.1704000     21.56000  0.2419000     21.35000  0.2401000     0.2137000      0.3408000 
1 1 1 16 1  3  o 4.291000  0.1113000     4.498000  0.1140000     4.084000  0.1913000     0.4145000      0.2226000 
1 1 1 16 1  4  o 14.13000  0.1307000     14.08000  0.1850000     14.19000  0.1847000     -0.1117000     0.2614000 
1 1 1 16 1  5  o 1.182000  0.3290000     0.9979000 0.4421000     1.366000  0.4875000     -0.3679000     0.6581000 
1 1 1 16 1  6  o 3.360000  0.2743000     3.613000  0.3678000     3.106000  0.4071000     0.5073000      0.5486000 
1 1 1 16 1  7  o 4.513000  0.2077000     4.698000  0.2783000     4.329000  0.3083000     0.3686000      0.4154000 
1 1 1 16 1  8  o 16.07000  0.1655000     16.14000  0.2338000     16.01000  0.2343000     0.1330000      0.3310000 
1 1 1 16 1  9  o 7.241000  0.1836000     7.121000  0.2554000     7.361000  0.2638000     -0.2402000     0.3671000 
1 1 1 16 1  10 o 7.830000  0.1924000     8.146000  0.2608000     7.514000  0.2830000     0.6327000      0.3848000 
1 1 1 16 1  11 o 8.471000  0.2287000     8.161000  0.3278000     8.780000  0.3191000     -0.6185000     0.4574000 
1 1 1 16 1  12 o 8.499000  0.2080000     8.575000  0.2905000     8.423000  0.2979000     0.1521000      0.4161000 
1 1 1 16 1  13 o 21.04000  0.2165000     20.96000  0.3052000     21.12000  0.3072000     -0.1626000     0.4330000 
1 1 1 16 1  14 o 6.940000  0.2709000     7.061000  0.3787000     6.819000  0.3875000     0.2420000      0.5418000 
1 1 1 16 1  15 o 2.271000  0.6006000     2.013000  0.8215000     2.529000  0.8765000     -0.5160000     1.201000  
1 1 1 16 1  16 f 2.488000  0.6130000     2.833000  0.8818000     2.142000  0.8518000     0.6912000      1.226000  
1 1 1 16 1  17 o 2.195000  0.6160000     1.956000  0.8420000     2.434000  0.8994000     -0.4778000     1.232000  
1 1 1 16 1  18 o 5.794000  0.3982000     5.674000  0.5886000     5.913000  0.5363000     -0.2391000     0.7963000 
1 1 1 16 1  19 o 4.316000  0.5076000     4.508000  0.6820000     4.123000  0.7521000     0.3844000      1.015000  
1 1 1 16 1  20 o 1.904000  0.5580000     2.260000  0.8548000     1.548000  0.7176000     0.7123000      1.116000  
1 1 1 16 1  21 o 1.535000  0.4995000     1.576000  0.7192000     1.495000  0.6934000     0.8074000E-01  0.9990000 
1 1 1 16 1  22 o 3.461000  0.4638000     4.205000  0.5438000     2.717000  0.7515000     1.488000       0.9276000 
1 1 1 16 1  23 o 2.087000  0.5383000     2.256000  0.7705000     1.918000  0.7519000     0.3372000      1.077000  
1 1 1 16 1  24 o 1.277000  0.4296000     0.9651000 0.4867000     1.590000  0.7081000     -0.6245000     0.8592000 
1 1 1 16 1  25 o 1.190000  0.4060000     1.231000  0.5869000     1.150000  0.5611000     0.8058000E-01  0.8119000 
1 1 1 16 2  0  o 9.519000  0.2303000     9.519000  0.2303000     9.519000  0.2303000     -0.000000      0.000000  
1 1 1 16 2  1  o 5.601000  0.1246000     5.835000  0.2186000     5.368000  0.1195000     0.4673000      0.2492000 
1 1 1 16 2  2  o 5.882000  0.7853000E-01 5.960000  0.1142000     5.804000  0.1078000     0.1565000      0.1571000 
1 1 1 16 2  3  o 11.28000  0.1124000     11.13000  0.1316000     11.43000  0.1822000     -0.3063000     0.2248000 
1 1 1 16 2  4  o 6.248000  0.1289000     6.348000  0.1267000     6.148000  0.2245000     0.1997000      0.2578000 
1 1 1 16 2  5  f 7.147000  0.1253000     7.192000  0.1798000     7.102000  0.1747000     0.9008000E-01  0.2507000 
1 1 1 16 2  6  o 5.396000  0.1921000     5.322000  0.2758000     5.471000  0.2675000     -0.1492000     0.3842000 
1 1 1 16 2  7  o 4.614000  0.2036000     4.487000  0.2927000     4.740000  0.2830000     -0.2535000     0.4072000 
1 1 1 16 2  8  o 10.04000  0.1533000     9.856000  0.2174000     10.22000  0.2161000     -0.3601000     0.3066000 
1 1 1 16 2  9  o 12.78000  0.1641000     12.91000  0.2322000     12.65000  0.2320000     0.2529000      0.3283000 
1 1 1 16 2  10 f 7.119000  0.2010000     6.957000  0.2849000     7.281000  0.2835000     -0.3241000     0.4019000 
1 1 1 16 2  11 o 5.177000  0.3077000     5.042000  0.4418000     5.313000  0.4282000     -0.2709000     0.6153000 
1 1 1 16 2  12 o 17.17000  0.1944000     16.86000  0.2731000     17.47000  0.2768000     -0.6030000     0.3889000 
1 1 1 16 2  13 o 3.790000  0.4269000     4.181000  0.5232000     3.399000  0.6747000     0.7819000      0.8538000 
1 1 1 16 2  14 o 6.576000  0.2908000     7.208000  0.3731000     5.943000  0.4463000     1.265000       0.5817000 
1 1 1 16 2  15 o 1.815000  0.5511000     1.930000  0.8035000     1.701000  0.7546000     0.2295000      1.102000  
1 1 1 16 2  16 o 3.749000  0.5924000     3.669000  0.7936000     3.829000  0.8797000     -0.1601000     1.185000  
1 1 1 16 2  17 o 5.350000  0.4475000     4.652000  0.6970000     6.047000  0.5615000     -1.395000      0.8951000 
1 1 1 16 2  18 o 3.665000  0.6184000     3.773000  0.8494000     3.557000  0.8989000     0.2155000      1.237000  
1 1 1 16 2  19 o 4.305000  0.5145000     4.929000  0.6087000     3.682000  0.8298000     1.247000       1.029000  
1 1 1 16 2  20 o 3.554000  0.5597000     3.372000  0.8098000     3.736000  0.7728000     -0.3633000     1.119000  
1 1 1 16 2  21 o 1.500000  0.4908000     1.364000  0.6489000     1.637000  0.7366000     -0.2726000     0.9817000 
1 1 1 16 2  22 o 2.399000  0.5546000     2.420000  0.7800000     2.379000  0.7886000     0.4083000E-01  1.109000  
1 1 1 16 2  23 o 1.450000  0.4656000     1.406000  0.6451000     1.494000  0.6716000     -0.8860000E-01 0.9313000 
1 1 1 16 2  24 o 1.528000  0.4889000     1.554000  0.6962000     1.503000  0.6865000     0.5090000E-01  0.9777000 
1 1 1 16 2  25 o 1.465000  0.4670000     1.383000  0.6367000     1.547000  0.6833000     -0.1638000     0.9340000 
1 1 1 16 3  0  o 12.78000  0.1727000     12.78000  0.1727000     12.78000  0.1727000     -0.000000      0.000000  
1 1 1 16 3  1  o 10.42000  0.1103000     10.38000  0.1783000     10.46000  0.1300000     -0.7856000E-01 0.2207000 
1 1 1 16 3  2  o 2.846000  0.9860000E-01 3.011000  0.1281000     2.682000  0.1499000     0.3292000      0.1972000 
1 1 1 16 3  3  o 12.70000  0.1143000     12.73000  0.1594000     12.67000  0.1638000     0.6242000E-01  0.2285000 
1 1 1 16 3  4  o 5.769000  0.1322000     5.792000  0.1356000     5.746000  0.2271000     0.4652000E-01  0.2645000 
1 1 1 16 3  5  o 5.979000  0.1485000     5.673000  0.1972000     6.286000  0.2220000     -0.6128000     0.2970000 
1 1 1 16 3  6  o 7.495000  0.2113000     7.223000  0.3019000     7.768000  0.2958000     -0.5458000     0.4227000 
1 1 1 16 3  7  o 3.577000  0.2555000     3.251000  0.3946000     3.903000  0.3247000     -0.6525000     0.5110000 
1 1 1 16 3  8  o 10.71000  0.1531000     10.78000  0.2168000     10.64000  0.2161000     0.1347000      0.3061000 
1 1 1 16 3  9  o 3.882000  0.2854000     3.854000  0.4133000     3.910000  0.3937000     -0.5605000E-01 0.5708000 
1 1 1 16 3  10 o 9.032000  0.1796000     9.114000  0.2507000     8.951000  0.2573000     0.1627000      0.3592000 
1 1 1 16 3  11 o 7.184000  0.2489000     7.249000  0.3484000     7.118000  0.3555000     0.1304000      0.4978000 
1 1 1 16 3  12 o 14.38000  0.1898000     14.60000  0.2668000     14.16000  0.2700000     0.4417000      0.3796000 
1 1 1 16 3  13 o 9.271000  0.2205000     9.619000  0.3022000     8.922000  0.3212000     0.6974000      0.4410000 
1 1 1 16 3  14 o 3.616000  0.4914000     4.179000  0.5905000     3.054000  0.7856000     1.125000       0.9828000 
1 1 1 16 3  15 o 3.276000  0.5773000     2.551000  0.8822000     4.002000  0.7449000     -1.451000      1.155000  
1 1 1 16 3  16 o 5.712000  0.4478000     5.732000  0.6481000     5.692000  0.6182000     0.4086000E-01  0.8957000 
1 1 1 16 3  17 o 7.913000  0.3173000     8.180000  0.4438000     7.645000  0.4535000     0.5351000      0.6345000 
1 1 1 16 3  18 o 6.348000  0.3891000     7.209000  0.4831000     5.487000  0.6101000     1.722000       0.7782000 
1 1 1 16 3  19 o 3.739000  0.5728000     3.813000  0.7968000     3.664000  0.8231000     0.1488000      1.146000  
1 1 1 16 3  20 o 2.020000  0.5840000     2.181000  0.8562000     1.858000  0.7943000     0.3226000      1.168000  
1 1 1 16 3  21 o 2.468000  0.5731000     3.254000  0.8411000     1.682000  0.7788000     1.572000       1.146000  
1 1 1 16 3  22 o 1.647000  0.5001000     1.580000  0.6941000     1.715000  0.7200000     -0.1343000     1.000000  
1 1 1 16 3  23 o 1.664000  0.4870000     1.240000  0.5929000     2.088000  0.7727000     -0.8482000     0.9739000 
1 1 1 16 3  24 o 1.381000  0.4569000     1.447000  0.6647000     1.316000  0.6271000     0.1313000      0.9138000 
1 1 1 16 3  25 o 1.246000  0.4199000     1.153000  0.5593000     1.338000  0.6264000     -0.1852000     0.8398000 
1 1 1 16 4  0  o 24.22000  0.2671000     24.22000  0.2671000     24.22000  0.2671000     -0.000000      0.000000  
1 1 1 16 4  1  o 12.86000  0.1109000     12.98000  0.1760000     12.73000  0.1350000     0.2511000      0.2218000 
1 1 1 16 4  2  o 10.30000  0.1038000     10.21000  0.1541000     10.38000  0.1392000     -0.1690000     0.2077000 
1 1 1 16 4  3  o 11.81000  0.1106000     11.88000  0.1542000     11.75000  0.1585000     0.1247000      0.2211000 
1 1 1 16 4  4  o 3.648000  0.1398000     3.984000  0.1766000     3.312000  0.2167000     0.6715000      0.2796000 
1 1 1 16 4  5  o 6.528000  0.1352000     6.686000  0.1473000     6.370000  0.2267000     0.3159000      0.2704000 
1 1 1 16 4  6  o 9.501000  0.1797000     9.484000  0.2805000     9.518000  0.2246000     -0.3393000E-01 0.3594000 
1 1 1 16 4  7  o 13.85000  0.1514000     13.87000  0.2143000     13.83000  0.2140000     0.4226000E-01  0.3029000 
1 1 1 16 4  8  o 4.635000  0.2242000     4.790000  0.3114000     4.480000  0.3226000     0.3104000      0.4484000 
1 1 1 16 4  9  o 2.677000  0.4020000     2.188000  0.6438000     3.167000  0.4817000     -0.9788000     0.8041000 
1 1 1 16 4  10 o 11.97000  0.1722000     12.00000  0.2457000     11.94000  0.2414000     0.6434000E-01  0.3444000 
1 1 1 16 4  11 o 11.08000  0.2136000     11.15000  0.3003000     11.01000  0.3038000     0.1431000      0.4272000 
1 1 1 16 4  12 o 17.19000  0.1959000     17.43000  0.2788000     16.95000  0.2753000     0.4780000      0.3918000 
1 1 1 16 4  13 o 8.324000  0.2295000     8.442000  0.3268000     8.207000  0.3225000     0.2345000      0.4591000 
1 1 1 16 4  14 o 11.60000  0.2159000     11.90000  0.3009000     11.30000  0.3096000     0.6023000      0.4317000 
1 1 1 16 4  15 o 7.897000  0.2825000     8.030000  0.3925000     7.763000  0.4064000     0.2676000      0.5650000 
1 1 1 16 4  16 o 3.167000  0.6654000     3.771000  0.9239000     2.563000  0.9578000     1.208000       1.331000  
1 1 1 16 4  17 o 2.890000  0.6527000     2.385000  0.9215000     3.394000  0.9245000     -1.009000      1.305000  
1 1 1 16 4  18 o 5.193000  0.4686000     5.682000  0.5842000     4.703000  0.7329000     0.9795000      0.9373000 
1 1 1 16 4  19 o 2.434000  0.6307000     2.596000  0.8932000     2.273000  0.8907000     0.3224000      1.261000  
1 1 1 16 4  20 o 1.586000  0.5178000     1.666000  0.7575000     1.507000  0.7061000     0.1591000      1.036000  
1 1 1 16 4  21 o 2.898000  0.5691000     2.273000  0.8528000     3.524000  0.7537000     -1.251000      1.138000  
1 1 1 16 4  22 o 1.834000  0.5061000     1.343000  0.6295000     2.325000  0.7928000     -0.9822000     1.012000  
1 1 1 16 4  23 o 1.466000  0.4690000     1.569000  0.6901000     1.362000  0.6353000     0.2074000      0.9380000 
1 1 1 16 4  24 o 1.538000  0.4854000     1.280000  0.6082000     1.796000  0.7567000     -0.5165000     0.9708000 
1 1 1 16 4  25 o 1.392000  0.4551000     1.554000  0.6829000     1.229000  0.6019000     0.3246000      0.9103000 
1 1 1 16 5  0  o 8.385000  0.1129000     8.385000  0.1129000     8.385000  0.1129000     0.000000       0.000000  
1 1 1 16 5  1  o 12.96000  0.1086000     12.90000  0.1529000     13.03000  0.1542000     -0.1249000     0.2172000 
1 1 1 16 5  2  o 13.00000  0.1168000     13.13000  0.1853000     12.86000  0.1421000     0.2794000      0.2335000 
1 1 1 16 5  3  f 13.88000  0.1242000     13.93000  0.1735000     13.84000  0.1777000     0.8571000E-01  0.2483000 
1 1 1 16 5  4  o 2.922000  0.2575000     3.279000  0.2049000     2.564000  0.4725000     0.7153000      0.5151000 
1 1 1 16 5  5  o 9.385000  0.1175000     9.198000  0.1634000     9.572000  0.1689000     -0.3739000     0.2350000 
1 1 1 16 5  6  o 2.133000  0.3996000     2.039000  0.5831000     2.227000  0.5466000     -0.1879000     0.7992000 
1 1 1 16 5  7  o 6.763000  0.1617000     7.001000  0.1727000     6.525000  0.2735000     0.4761000      0.3235000 
1 1 1 16 5  8  o 12.44000  0.1545000     12.49000  0.2196000     12.40000  0.2173000     0.9315000E-01  0.3089000 
1 1 1 16 5  9  o 9.274000  0.1816000     9.672000  0.2386000     8.876000  0.2739000     0.7960000      0.3633000 
1 1 1 16 5  10 o 6.810000  0.2066000     6.509000  0.3019000     7.112000  0.2822000     -0.6025000     0.4133000 
1 1 1 16 5  11 o 8.789000  0.2350000     9.496000  0.3225000     8.082000  0.3418000     1.414000       0.4700000 
1 1 1 16 5  12 o 18.04000  0.1997000     17.92000  0.2823000     18.16000  0.2824000     -0.2378000     0.3993000 
1 1 1 16 5  13 o 9.220000  0.2221000     9.210000  0.3154000     9.230000  0.3127000     -0.2081000E-01 0.4441000 
1 1 1 16 5  14 o 9.353000  0.2372000     9.333000  0.3378000     9.372000  0.3331000     -0.3949000E-01 0.4744000 
1 1 1 16 5  15 o 2.252000  0.5972000     1.977000  0.8281000     2.527000  0.8606000     -0.5506000     1.194000  
1 1 1 16 5  16 o 3.650000  0.6466000     3.845000  0.9093000     3.454000  0.9196000     0.3910000      1.293000  
1 1 1 16 5  17 o 4.580000  0.5124000     5.166000  0.6214000     3.993000  0.8149000     1.173000       1.025000  
1 1 1 16 5  18 o 2.312000  0.6331000     2.652000  0.9414000     1.972000  0.8468000     0.6799000      1.266000  
1 1 1 16 5  19 o 1.497000  0.4998000     1.424000  0.6824000     1.570000  0.7303000     -0.1457000     0.9996000 
1 1 1 16 5  20 o 2.166000  0.5876000     1.804000  0.7857000     2.527000  0.8740000     -0.7232000     1.175000  
1 1 1 16 5  21 o 1.522000  0.5046000     1.623000  0.7543000     1.421000  0.6705000     0.2017000      1.009000  
1 1 1 16 5  22 o 1.351000  0.4445000     1.183000  0.5736000     1.518000  0.6793000     -0.3357000     0.8891000 
1 1 1 16 5  23 o 2.310000  0.5464000     2.068000  0.7711000     2.552000  0.7742000     -0.4836000     1.093000  
1 1 1 16 5  24 o 1.557000  0.4911000     1.749000  0.7451000     1.365000  0.6399000     0.3844000      0.9822000 
1 1 1 16 5  25 o 1.162000  0.3978000     0.9744000 0.4882000     1.350000  0.6281000     -0.3754000     0.7955000 
1 1 1 16 6  0  o 0.4706000 0.3041000     0.4706000 0.3041000     0.4706000 0.3041000     0.000000       0.000000  
1 1 1 16 6  1  o 7.290000  0.7940000E-01 7.290000  0.1115000     7.291000  0.1130000     -0.1274000E-02 0.1588000 
1 1 1 16 6  2  o 5.145000  0.9231000E-01 5.134000  0.1172000     5.156000  0.1427000     -0.2198000E-01 0.1846000 
1 1 1 16 6  3  f 6.000000  0.1148000     5.913000  0.1506000     6.087000  0.1734000     -0.1741000     0.2296000 
1 1 1 16 6  4  o 10.72000  0.1425000     10.77000  0.1590000     10.66000  0.2366000     0.1068000      0.2850000 
1 1 1 16 6  5  o 4.432000  0.1403000     4.474000  0.1884000     4.390000  0.2079000     0.8450000E-01  0.2806000 
1 1 1 16 6  6  o 8.171000  0.1468000     8.150000  0.2328000     8.193000  0.1790000     -0.4362000E-01 0.2936000 
1 1 1 16 6  7  o 8.862000  0.1468000     8.565000  0.1661000     9.160000  0.2421000     -0.5948000     0.2936000 
1 1 1 16 6  8  o 4.670000  0.2247000     5.027000  0.2147000     4.312000  0.3948000     0.7150000      0.4494000 
1 1 1 16 6  9  o 3.107000  0.4122000     2.186000  0.6927000     4.029000  0.4469000     -1.843000      0.8244000 
1 1 1 16 6  10 f 12.84000  0.1721000     12.79000  0.2448000     12.88000  0.2421000     -0.8986000E-01 0.3443000 
1 1 1 16 6  11 o 8.853000  0.2929000     8.436000  0.4221000     9.270000  0.4061000     -0.8341000     0.5857000 
1 1 1 16 6  12 o 4.122000  0.3772000     3.441000  0.6108000     4.802000  0.4428000     -1.361000      0.7544000 
1 1 1 16 6  13 o 11.00000  0.2068000     10.71000  0.2938000     11.30000  0.2912000     -0.5820000     0.4137000 
1 1 1 16 6  14 o 3.278000  0.5324000     3.687000  0.6776000     2.869000  0.8215000     0.8172000      1.065000  
1 1 1 16 6  15 o 9.154000  0.2596000     9.093000  0.3716000     9.216000  0.3625000     -0.1238000     0.5191000 
1 1 1 16 6  16 o 2.323000  0.6383000     2.878000  0.9807000     1.769000  0.8173000     1.109000       1.277000  
1 1 1 16 6  17 o 2.597000  0.6616000     2.569000  0.9434000     2.625000  0.9278000     -0.5543000E-01 1.323000  
1 1 1 16 6  18 o 3.400000  0.6174000     2.830000  0.9460000     3.969000  0.7936000     -1.139000      1.235000  
1 1 1 16 6  19 f 2.677000  0.6300000     2.266000  0.8806000     3.087000  0.9012000     -0.8207000     1.260000  
1 1 1 16 6  20 o 2.035000  0.5777000     1.951000  0.8085000     2.120000  0.8255000     -0.1685000     1.155000  
1 1 1 16 6  21 o 1.976000  0.5671000     2.296000  0.8584000     1.657000  0.7413000     0.6391000      1.134000  
1 1 1 16 6  22 o 2.314000  0.5271000     1.839000  0.7416000     2.789000  0.7493000     -0.9497000     1.054000  
1 1 1 16 6  23 o 1.187000  0.4016000     0.9715000 0.4862000     1.402000  0.6393000     -0.4303000     0.8032000 
1 1 1 16 6  24 o 1.268000  0.4298000     1.037000  0.5185000     1.500000  0.6856000     -0.4637000     0.8596000 
1 1 1 16 6  25 o 1.248000  0.4192000     1.361000  0.6312000     1.135000  0.5519000     0.2252000      0.8385000 
1 1 1 16 7  0  o 15.64000  0.1827000     15.64000  0.1827000     15.64000  0.1827000     0.000000       0.000000  
1 1 1 16 7  1  o 8.704000  0.9457000E-01 8.775000  0.1421000     8.634000  0.1249000     0.1408000      0.1891000 
1 1 1 16 7  2  o 12.65000  0.1123000     12.72000  0.1592000     12.58000  0.1584000     0.1352000      0.2246000 
1 1 1 16 7  3  o 10.22000  0.1080000     10.16000  0.1708000     10.28000  0.1324000     -0.1181000     0.2161000 
1 1 1 16 7  4  o 8.335000  0.1235000     8.300000  0.1733000     8.369000  0.1761000     -0.6860000E-01 0.2471000 
1 1 1 16 7  5  o 2.049000  0.3009000     2.061000  0.3759000     2.037000  0.4700000     0.2400000E-01  0.6019000 
1 1 1 16 7  6  o 7.100000  0.1299000     7.238000  0.1799000     6.962000  0.1874000     0.2758000      0.2598000 
1 1 1 16 7  7  o 5.788000  0.1503000     5.756000  0.2089000     5.820000  0.2161000     -0.6495000E-01 0.3006000 
1 1 1 16 7  8  o 3.827000  0.2534000     3.824000  0.2622000     3.830000  0.4338000     -0.6337000E-02 0.5069000 
1 1 1 16 7  9  o 6.682000  0.2210000     6.685000  0.2218000     6.678000  0.3824000     0.6618000E-02  0.4420000 
1 1 1 16 7  10 o 11.06000  0.1731000     11.10000  0.2451000     11.01000  0.2445000     0.8493000E-01  0.3462000 
1 1 1 16 7  11 o 1.426000  0.4693000     1.523000  0.7037000     1.330000  0.6210000     0.1929000      0.9386000 
1 1 1 16 7  12 o 16.58000  0.1937000     16.55000  0.2751000     16.60000  0.2729000     -0.5191000E-01 0.3875000 
1 1 1 16 7  13 o 7.172000  0.2544000     7.227000  0.3579000     7.117000  0.3616000     0.1101000      0.5088000 
1 1 1 16 7  14 o 8.056000  0.2773000     8.460000  0.3615000     7.653000  0.4207000     0.8072000      0.5547000 
1 1 1 16 7  15 o 1.752000  0.5437000     1.689000  0.7473000     1.815000  0.7898000     -0.1253000     1.087000  
1 1 1 16 7  16 o 4.119000  0.6611000     4.202000  0.9725000     4.036000  0.8960000     0.1660000      1.322000  
1 1 1 16 7  17 o 8.487000  0.3014000     8.171000  0.4345000     8.802000  0.4180000     -0.6316000     0.6029000 
1 1 1 16 7  18 o 3.535000  0.6243000     3.453000  0.8878000     3.617000  0.8780000     -0.1640000     1.249000  
1 1 1 16 7  19 o 4.712000  0.5380000     4.892000  0.7248000     4.531000  0.7952000     0.3611000      1.076000  
1 1 1 16 7  20 o 2.276000  0.5919000     2.107000  0.8258000     2.445000  0.8480000     -0.3372000     1.184000  
1 1 1 16 7  21 o 1.824000  0.5709000     1.917000  0.8441000     1.732000  0.7688000     0.1850000      1.142000  
1 1 1 16 7  22 f 1.980000  0.5284000     1.661000  0.7090000     2.299000  0.7838000     -0.6377000     1.057000  
1 1 1 16 7  23 o 2.528000  0.5375000     2.382000  0.7688000     2.674000  0.7515000     -0.2916000     1.075000  
1 1 1 16 7  24 o 1.252000  0.4266000     1.227000  0.5944000     1.277000  0.6122000     -0.5086000E-01 0.8533000 
1 1 1 16 7  25 o 1.382000  0.4455000     1.606000  0.6920000     1.158000  0.5613000     0.4479000      0.8910000 
1 1 1 16 8  0  o 5.892000  0.1186000     5.892000  0.1186000     5.892000  0.1186000     -0.000000      0.000000  
1 1 1 16 8  1  o 5.812000  0.8486000E-01 5.849000  0.1185000     5.776000  0.1215000     0.7276000E-01  0.1697000 
1 1 1 16 8  2  o 11.12000  0.1049000     11.21000  0.1493000     11.04000  0.1474000     0.1698000      0.2098000 
1 1 1 16 8  3  o 2.839000  0.1708000     2.650000  0.2885000     3.029000  0.1828000     -0.3786000     0.3415000 
1 1 1 16 8  4  o 8.229000  0.1103000     8.130000  0.1747000     8.329000  0.1347000     -0.1991000     0.2206000 
1 1 1 16 8  5  o 2.340000  0.4393000     2.430000  0.7594000     2.251000  0.4417000     0.1786000      0.8785000 
1 1 1 16 8  6  o 7.876000  0.1304000     7.778000  0.1790000     7.974000  0.1896000     -0.1962000     0.2608000 
1 1 1 16 8  7  o 4.929000  0.1634000     5.021000  0.2228000     4.838000  0.2391000     0.1828000      0.3268000 
1 1 1 16 8  8  o 6.749000  0.2131000     6.518000  0.3085000     6.980000  0.2939000     -0.4620000     0.4261000 
1 1 1 16 8  9  o 11.03000  0.2611000     10.81000  0.2325000     11.25000  0.4675000     -0.4438000     0.5222000 
1 1 1 16 8  10 o 5.520000  0.2381000     5.667000  0.2407000     5.374000  0.4108000     0.2928000      0.4761000 
1 1 1 16 8  11 o 12.84000  0.2139000     12.66000  0.3015000     13.01000  0.3035000     -0.3432000     0.4278000 
1 1 1 16 8  12 o 13.17000  0.1907000     13.21000  0.2709000     13.14000  0.2684000     0.7084000E-01  0.3813000 
1 1 1 16 8  13 o 13.13000  0.1995000     13.40000  0.2831000     12.86000  0.2811000     0.5365000      0.3990000 
1 1 1 16 8  14 o 7.005000  0.3162000     7.147000  0.4452000     6.864000  0.4492000     0.2828000      0.6324000 
1 1 1 16 8  15 o 13.12000  0.2230000     13.20000  0.3169000     13.05000  0.3137000     0.1530000      0.4459000 
1 1 1 16 8  16 o 6.653000  0.4916000     6.613000  0.6849000     6.693000  0.7054000     -0.7995000E-01 0.9832000 
1 1 1 16 8  17 o 7.903000  0.3091000     8.289000  0.4206000     7.517000  0.4532000     0.7719000      0.6183000 
1 1 1 16 8  18 o 2.286000  0.6182000     1.821000  0.8121000     2.752000  0.9322000     -0.9311000     1.236000  
1 1 1 16 8  19 o 2.034000  0.6091000     1.614000  0.7595000     2.454000  0.9524000     -0.8398000     1.218000  
1 1 1 16 8  20 o 1.903000  0.5621000     1.981000  0.8106000     1.825000  0.7790000     0.1553000      1.124000  
1 1 1 16 8  21 o 2.039000  0.6077000     2.221000  0.8811000     1.856000  0.8372000     0.3640000      1.215000  
1 1 1 16 8  22 o 1.838000  0.5060000     1.411000  0.6420000     2.265000  0.7825000     -0.8535000     1.012000  
1 1 1 16 8  23 o 1.609000  0.4797000     1.915000  0.7404000     1.304000  0.6102000     0.6109000      0.9595000 
1 1 1 16 8  24 o 1.542000  0.5072000     1.745000  0.7808000     1.338000  0.6475000     0.4072000      1.014000  
1 1 1 16 8  25 o 1.178000  0.4010000     1.158000  0.5597000     1.198000  0.5743000     -0.4012000E-01 0.8019000 
1 1 1 16 9  0  o 5.735000  0.1263000     5.735000  0.1263000     5.735000  0.1263000     0.000000       0.000000  
1 1 1 16 9  1  o 3.267000  0.1140000     3.229000  0.1591000     3.306000  0.1633000     -0.7712000E-01 0.2280000 
1 1 1 16 9  2  o 9.833000  0.1009000     9.746000  0.1422000     9.921000  0.1430000     -0.1746000     0.2017000 
1 1 1 16 9  3  o 11.14000  0.1370000     11.31000  0.1786000     10.96000  0.2077000     0.3470000      0.2739000 
1 1 1 16 9  4  o 5.868000  0.1133000     5.734000  0.1532000     6.001000  0.1670000     -0.2671000     0.2266000 
1 1 1 16 9  5  o 17.84000  0.2567000     17.66000  0.4724000     18.03000  0.2013000     -0.3642000     0.5135000 
1 1 1 16 9  6  o 14.78000  0.1473000     14.84000  0.2064000     14.73000  0.2101000     0.1102000      0.2946000 
1 1 1 16 9  7  o 6.718000  0.1474000     6.779000  0.1993000     6.658000  0.2172000     0.1212000      0.2948000 
1 1 1 16 9  8  f 6.603000  0.1565000     6.471000  0.2157000     6.736000  0.2269000     -0.2649000     0.3131000 
1 1 1 16 9  9  o 14.33000  0.2084000     14.54000  0.2301000     14.12000  0.3476000     0.4155000      0.4169000 
1 1 1 16 9  10 f 8.571000  0.1579000     8.472000  0.2097000     8.669000  0.2363000     -0.1978000     0.3159000 
1 1 1 16 9  11 o 13.70000  0.2000000     13.83000  0.2598000     13.58000  0.3041000     0.2495000      0.4000000 
1 1 1 16 9  12 f 16.89000  0.2015000     16.83000  0.2357000     16.95000  0.3269000     -0.1205000     0.4030000 
1 1 1 16 9  13 o 8.516000  0.2279000     8.658000  0.3208000     8.373000  0.3238000     0.2852000      0.4558000 
1 1 1 16 9  14 o 7.179000  0.3176000     7.658000  0.4418000     6.699000  0.4564000     0.9586000      0.6352000 
1 1 1 16 9  15 o 2.621000  0.5568000     1.823000  0.7872000     3.420000  0.7875000     -1.598000      1.114000  
1 1 1 16 9  16 o 3.203000  0.6935000     2.746000  1.052000      3.661000  0.9035000     -0.9144000     1.387000  
1 1 1 16 9  17 o 4.746000  0.4945000     5.255000  0.6330000     4.236000  0.7599000     1.020000       0.9890000 
1 1 1 16 9  18 o 2.484000  0.6415000     2.892000  0.9406000     2.077000  0.8727000     0.8150000      1.283000  
1 1 1 16 9  19 o 1.828000  0.5819000     1.872000  0.8368000     1.783000  0.8087000     0.8873000E-01  1.164000  
1 1 1 16 9  20 o 2.355000  0.5984000     2.416000  0.8485000     2.293000  0.8441000     0.1231000      1.197000  
1 1 1 16 9  21 o 2.262000  0.6093000     1.945000  0.8422000     2.578000  0.8807000     -0.6327000     1.219000  
1 1 1 16 9  22 o 1.352000  0.4429000     1.421000  0.6483000     1.282000  0.6037000     0.1392000      0.8859000 
1 1 1 16 9  23 o 1.447000  0.4587000     1.268000  0.5981000     1.626000  0.6957000     -0.3579000     0.9175000 
1 1 1 16 9  24 o 1.395000  0.4721000     1.328000  0.6436000     1.463000  0.6908000     -0.1353000     0.9442000 
1 1 1 16 9  25 f 1.786000  0.5070000     2.014000  0.7513000     1.557000  0.6810000     0.4572000      1.014000  
1 1 1 16 10 0  o 13.32000  0.1678000     13.32000  0.1678000     13.32000  0.1678000     0.000000       0.000000  
1 1 1 16 10 1  o 7.166000  0.9319000E-01 7.185000  0.1306000     7.146000  0.1330000     0.3863000E-01  0.1864000 
1 1 1 16 10 2  o 5.281000  0.1216000     5.001000  0.2008000     5.561000  0.1372000     -0.5604000     0.2432000 
1 1 1 16 10 3  o 3.238000  0.1411000     3.409000  0.1876000     3.066000  0.2109000     0.3430000      0.2823000 
1 1 1 16 10 4  o 4.821000  0.1568000     4.674000  0.1785000     4.968000  0.2578000     -0.2943000     0.3136000 
1 1 1 16 10 5  o 11.51000  0.1294000     11.53000  0.2057000     11.49000  0.1570000     0.3583000E-01  0.2588000 
1 1 1 16 10 6  o 11.19000  0.1420000     11.27000  0.2109000     11.10000  0.1902000     0.1677000      0.2840000 
1 1 1 16 10 7  o 6.737000  0.1449000     6.688000  0.1985000     6.786000  0.2113000     -0.9844000E-01 0.2899000 
1 1 1 16 10 8  o 8.497000  0.1483000     8.466000  0.2010000     8.528000  0.2183000     -0.6185000E-01 0.2967000 
1 1 1 16 10 9  o 4.119000  0.3156000     3.885000  0.3146000     4.354000  0.5472000     -0.4695000     0.6312000 
1 1 1 16 10 10 o 11.35000  0.1620000     11.14000  0.2244000     11.56000  0.2337000     -0.4200000     0.3240000 
1 1 1 16 10 11 o 2.788000  0.3752000     2.131000  0.6095000     3.445000  0.4375000     -1.314000      0.7503000 
1 1 1 16 10 12 o 2.981000  0.4420000     2.364000  0.5745000     3.599000  0.6719000     -1.235000      0.8840000 
1 1 1 16 10 13 o 3.866000  0.4591000     4.586000  0.3659000     3.146000  0.8422000     1.440000       0.9183000 
1 1 1 16 10 14 o 5.910000  0.4504000     4.978000  0.7589000     6.841000  0.4854000     -1.862000      0.9008000 
1 1 1 16 10 15 o 8.098000  0.2772000     8.039000  0.4012000     8.157000  0.3825000     -0.1179000     0.5543000 
1 1 1 16 10 16 o 7.593000  0.3656000     7.599000  0.5302000     7.586000  0.5036000     0.1263000E-01  0.7313000 
1 1 1 16 10 17 o 6.063000  0.3875000     5.891000  0.5604000     6.234000  0.5355000     -0.3430000     0.7751000 
1 1 1 16 10 18 o 3.650000  0.5939000     3.308000  0.8905000     3.992000  0.7861000     -0.6842000     1.188000  
1 1 1 16 10 19 o 3.272000  0.6343000     4.029000  0.8625000     2.515000  0.9302000     1.514000       1.269000  
1 1 1 16 10 20 o 2.259000  0.5974000     2.432000  0.8499000     2.086000  0.8398000     0.3454000      1.195000  
1 1 1 16 10 21 o 1.854000  0.5586000     1.718000  0.7534000     1.990000  0.8249000     -0.2715000     1.117000  
1 1 1 16 10 22 o 1.723000  0.5077000     1.738000  0.7256000     1.709000  0.7102000     0.2882000E-01  1.015000  
1 1 1 16 10 23 o 1.618000  0.4895000     1.512000  0.6708000     1.724000  0.7131000     -0.2124000     0.9790000 
1 1 1 16 10 24 o 1.454000  0.4730000     1.580000  0.7063000     1.329000  0.6292000     0.2501000      0.9459000 
1 1 1 16 10 25 o 2.174000  0.4894000     2.914000  0.7334000     1.433000  0.6482000     1.480000       0.9789000 
1 1 1 16 11 0  o 3.099000  0.1828000     3.099000  0.1828000     3.099000  0.1828000     0.000000       0.000000  
1 1 1 16 11 1  o 14.01000  0.1358000     14.12000  0.2065000     13.90000  0.1764000     0.2252000      0.2715000 
1 1 1 16 11 2  o 7.361000  0.1216000     7.420000  0.1561000     7.302000  0.1865000     0.1178000      0.2432000 
1 1 1 16 11 3  o 6.775000  0.1125000     6.751000  0.1465000     6.799000  0.1708000     -0.4750000E-01 0.2250000 
1 1 1 16 11 4  o 10.37000  0.1410000     10.35000  0.2319000     10.39000  0.1606000     -0.4785000E-01 0.2820000 
1 1 1 16 11 5  o 13.42000  0.1318000     13.33000  0.1863000     13.50000  0.1865000     -0.1652000     0.2636000 
1 1 1 16 11 6  o 9.410000  0.1289000     9.407000  0.2038000     9.412000  0.1578000     -0.4539000E-02 0.2578000 
1 1 1 16 11 7  o 8.438000  0.1390000     8.481000  0.1902000     8.395000  0.2027000     0.8657000E-01  0.2779000 
1 1 1 16 11 8  o 9.944000  0.1460000     9.821000  0.2040000     10.07000  0.2088000     -0.2463000     0.2919000 
1 1 1 16 11 9  o 2.769000  0.3262000     3.066000  0.3954000     2.473000  0.5188000     0.5933000      0.6523000 
1 1 1 16 11 10 o 8.357000  0.1879000     8.479000  0.2489000     8.235000  0.2815000     0.2442000      0.3757000 
1 1 1 16 11 11 o 6.864000  0.2021000     6.398000  0.3052000     7.330000  0.2651000     -0.9318000     0.4043000 
1 1 1 16 11 12 o 12.79000  0.1769000     13.00000  0.2476000     12.58000  0.2529000     0.4242000      0.3539000 
1 1 1 16 11 13 o 20.25000  0.2204000     19.90000  0.2574000     20.60000  0.3579000     -0.7005000     0.4408000 
1 1 1 16 11 14 o 14.91000  0.3305000     15.14000  0.3028000     14.69000  0.5875000     0.4587000      0.6609000 
1 1 1 16 11 15 o 9.893000  0.2734000     10.12000  0.3523000     9.664000  0.4181000     0.4578000      0.5467000 
1 1 1 16 11 16 o 3.366000  0.6673000     3.790000  0.9252000     2.943000  0.9617000     0.8469000      1.335000  
1 1 1 16 11 17 o 2.458000  0.6453000     2.366000  0.9133000     2.550000  0.9118000     -0.1841000     1.291000  
1 1 1 16 11 18 o 2.481000  0.6079000     1.846000  0.8219000     3.116000  0.8959000     -1.270000      1.216000  
1 1 1 16 11 19 o 2.629000  0.6919000     2.081000  0.9411000     3.177000  1.015000      -1.096000      1.384000  
1 1 1 16 11 20 o 5.795000  0.3558000     5.694000  0.4982000     5.896000  0.5081000     -0.2012000     0.7116000 
1 1 1 16 11 21 o 2.190000  0.5895000     2.058000  0.8113000     2.321000  0.8554000     -0.2635000     1.179000  
1 1 1 16 11 22 o 1.747000  0.5047000     1.804000  0.7235000     1.690000  0.7038000     0.1144000      1.009000  
1 1 1 16 11 23 o 1.649000  0.4794000     1.297000  0.6082000     2.002000  0.7413000     -0.7050000     0.9589000 
1 1 1 16 11 24 o 1.235000  0.4238000     1.334000  0.6374000     1.137000  0.5586000     0.1970000      0.8475000 
1 1 1 16 11 25 o 1.560000  0.4778000     1.613000  0.6866000     1.506000  0.6647000     0.1063000      0.9556000 
1 1 1 16 12 0  o 6.006000  0.2021000     6.006000  0.2021000     6.006000  0.2021000     -0.000000      0.000000  
1 1 1 16 12 1  o 3.842000  0.1911000     3.684000  0.1929000     4.001000  0.3300000     -0.3177000     0.3822000 
1 1 1 16 12 2  o 13.33000  0.1559000     13.34000  0.1768000     13.31000  0.2568000     0.3138000E-01  0.3118000 
1 1 1 16 12 3  o 10.93000  0.1496000     10.89000  0.2289000     10.97000  0.1926000     -0.7956000E-01 0.2992000 
1 1 1 16 12 4  o 0.7586000 0.2462000     0.8086000 0.3634000     0.7086000 0.3323000     0.9994000E-01  0.4924000 
1 1 1 16 12 5  o 1.726000  0.2818000     1.562000  0.4115000     1.889000  0.3850000     -0.3263000     0.5636000 
1 1 1 16 12 6  o 4.527000  0.1433000     4.282000  0.2076000     4.773000  0.1977000     -0.4907000     0.2866000 
1 1 1 16 12 7  o 9.357000  0.1374000     9.116000  0.2161000     9.597000  0.1697000     -0.4817000     0.2747000 
1 1 1 16 12 8  f 16.70000  0.1907000     16.79000  0.2678000     16.62000  0.2715000     0.1712000      0.3814000 
1 1 1 16 12 9  o 12.19000  0.1569000     12.40000  0.2193000     11.98000  0.2245000     0.4214000      0.3138000 
1 1 1 16 12 10 o 11.24000  0.2056000     11.26000  0.3060000     11.21000  0.2748000     0.5345000E-01  0.4112000 
1 1 1 16 12 11 o 7.235000  0.1901000     7.108000  0.2700000     7.363000  0.2676000     -0.2544000     0.3801000 
1 1 1 16 12 12 f 12.38000  0.2076000     13.01000  0.3270000     11.75000  0.2561000     1.260000       0.4153000 
1 1 1 16 12 13 o 7.888000  0.2042000     8.043000  0.2796000     7.732000  0.2978000     0.3107000      0.4085000 
1 1 1 16 12 14 o 13.10000  0.2615000     12.89000  0.2714000     13.31000  0.4471000     -0.4224000     0.5230000 
1 1 1 16 12 15 o 10.79000  0.2385000     10.79000  0.2660000     10.79000  0.3960000     -0.8230000E-02 0.4770000 
1 1 1 16 12 16 o 7.570000  0.3050000     7.849000  0.3073000     7.291000  0.5270000     0.5581000      0.6101000 
1 1 1 16 12 17 o 2.225000  0.6083000     2.742000  0.9379000     1.709000  0.7751000     1.034000       1.217000  
1 1 1 16 12 18 o 4.571000  0.4850000     4.192000  0.7424000     4.950000  0.6243000     -0.7582000     0.9700000 
1 1 1 16 12 19 o 1.757000  0.5700000     2.081000  0.9019000     1.432000  0.6973000     0.6484000      1.140000  
1 1 1 16 12 20 o 1.958000  0.5659000     2.148000  0.8305000     1.769000  0.7689000     0.3798000      1.132000  
1 1 1 16 12 21 o 1.708000  0.5224000     1.332000  0.6246000     2.085000  0.8376000     -0.7531000     1.045000  
1 1 1 16 12 22 o 2.060000  0.5168000     1.669000  0.7059000     2.451000  0.7550000     -0.7813000     1.034000  
1 1 1 16 12 23 o 1.204000  0.4065000     1.123000  0.5470000     1.286000  0.6014000     -0.1630000     0.8129000 
1 1 1 16 12 24 o 1.457000  0.4757000     1.468000  0.6821000     1.447000  0.6631000     0.2099000E-01  0.9513000 
1 1 1 16 12 25 o 1.125000  0.3891000     1.179000  0.5718000     1.071000  0.5278000     0.1080000      0.7781000 
1 1 1 16 13 0  o 3.237000  0.3766000     3.237000  0.3766000     3.237000  0.3766000     0.000000       0.000000  
1 1 1 16 13 1  o 3.067000  0.2041000     3.059000  0.2853000     3.076000  0.2920000     -0.1739000E-01 0.4082000 
1 1 1 16 13 2  o 4.169000  0.1519000     4.171000  0.2479000     4.167000  0.1756000     0.3978000E-02  0.3038000 
1 1 1 16 13 3  o 1.005000  0.2788000     0.8458000 0.3721000     1.164000  0.4153000     -0.3178000     0.5576000 
1 1 1 16 13 4  o 7.194000  0.1112000     7.212000  0.1581000     7.176000  0.1566000     0.3660000E-01  0.2225000 
1 1 1 16 13 5  o 6.675000  0.1188000     6.868000  0.1689000     6.481000  0.1671000     0.3871000      0.2376000 
1 1 1 16 13 6  o 7.490000  0.1235000     7.755000  0.1734000     7.226000  0.1759000     0.5288000      0.2470000 
1 1 1 16 13 7  o 6.397000  0.1472000     6.510000  0.2335000     6.284000  0.1792000     0.2261000      0.2944000 
1 1 1 16 13 8  o 14.86000  0.2132000     14.81000  0.2533000     14.90000  0.3430000     -0.9131000E-01 0.4264000 
1 1 1 16 13 9  o 14.34000  0.1624000     14.35000  0.2276000     14.32000  0.2317000     0.2610000E-01  0.3248000 
1 1 1 16 13 10 o 10.57000  0.2809000     11.15000  0.5097000     9.976000  0.2365000     1.179000       0.5618000 
1 1 1 16 13 11 o 9.254000  0.1761000     9.451000  0.2460000     9.056000  0.2521000     0.3949000      0.3522000 
1 1 1 16 13 12 o 9.955000  0.1795000     9.967000  0.2513000     9.943000  0.2565000     0.2449000E-01  0.3591000 
1 1 1 16 13 13 o 4.020000  0.3350000     3.574000  0.5230000     4.467000  0.4188000     -0.8930000     0.6700000 
1 1 1 16 13 14 o 14.16000  0.2114000     14.48000  0.2793000     13.83000  0.3174000     0.6518000      0.4228000 
1 1 1 16 13 15 o 12.65000  0.2155000     12.76000  0.2857000     12.54000  0.3227000     0.2250000      0.4310000 
1 1 1 16 13 16 o 1.450000  0.4845000     1.281000  0.5958000     1.618000  0.7642000     -0.3373000     0.9690000 
1 1 1 16 13 17 o 6.151000  0.3813000     6.557000  0.3615000     5.746000  0.6715000     0.8101000      0.7626000 
1 1 1 16 13 18 o 3.884000  0.5419000     4.342000  0.5031000     3.427000  0.9599000     0.9158000      1.084000  
1 1 1 16 13 19 o 2.335000  0.6392000     1.910000  0.8543000     2.759000  0.9511000     -0.8486000     1.278000  
1 1 1 16 13 20 o 2.904000  0.5623000     2.382000  0.8342000     3.425000  0.7541000     -1.043000      1.125000  
1 1 1 16 13 21 o 1.969000  0.5279000     1.735000  0.7271000     2.203000  0.7655000     -0.4681000     1.056000  
1 1 1 16 13 22 o 1.495000  0.4650000     1.243000  0.5931000     1.748000  0.7164000     -0.5045000     0.9301000 
1 1 1 16 13 23 o 1.147000  0.3926000     1.243000  0.5901000     1.050000  0.5179000     0.1933000      0.7851000 
1 1 1 16 13 24 o 1.299000  0.4398000     1.453000  0.6763000     1.145000  0.5624000     0.3074000      0.8796000 
1 1 1 16 13 25 o 1.091000  0.3799000     1.177000  0.5686000     1.006000  0.5039000     0.1709000      0.7598000 
1 1 1 16 14 0  o 7.782000  0.1502000     7.782000  0.1502000     7.782000  0.1502000     0.000000       0.000000  
1 1 1 16 14 1  o 12.77000  0.1233000     12.60000  0.1731000     12.93000  0.1757000     -0.3310000     0.2467000 
1 1 1 16 14 2  f 8.726000  0.1087000     8.814000  0.1523000     8.639000  0.1551000     0.1757000      0.2174000 
1 1 1 16 14 3  o 0.9243000 0.2735000     1.078000  0.4178000     0.7709000 0.3532000     0.3068000      0.5471000 
1 1 1 16 14 4  o 2.755000  0.1927000     2.508000  0.2950000     3.001000  0.2480000     -0.4931000     0.3854000 
1 1 1 16 14 5  o 7.453000  0.1196000     7.374000  0.1702000     7.532000  0.1682000     -0.1579000     0.2392000 
1 1 1 16 14 6  o 14.53000  0.1437000     14.54000  0.2030000     14.52000  0.2034000     0.2227000E-01  0.2874000 
1 1 1 16 14 7  o 12.17000  0.1466000     12.36000  0.2186000     11.99000  0.1954000     0.3706000      0.2932000 
1 1 1 16 14 8  o 12.92000  0.1744000     12.79000  0.2487000     13.05000  0.2447000     -0.2651000     0.3489000 
1 1 1 16 14 9  o 7.357000  0.1683000     7.284000  0.2282000     7.430000  0.2473000     -0.1463000     0.3365000 
1 1 1 16 14 10 o 1.515000  0.4311000     1.264000  0.5973000     1.766000  0.6218000     -0.5025000     0.8622000 
1 1 1 16 14 11 o 12.62000  0.1730000     12.52000  0.2413000     12.71000  0.2481000     -0.1880000     0.3461000 
1 1 1 16 14 12 o 12.37000  0.1785000     12.33000  0.2472000     12.41000  0.2577000     -0.8172000E-01 0.3571000 
1 1 1 16 14 13 o 14.08000  0.1916000     13.98000  0.2689000     14.18000  0.2729000     -0.2016000     0.3831000 
1 1 1 16 14 14 o 9.189000  0.2090000     9.361000  0.2895000     9.016000  0.3016000     0.3453000      0.4181000 
1 1 1 16 14 15 o 6.581000  0.2896000     6.735000  0.3895000     6.427000  0.4287000     0.3076000      0.5792000 
1 1 1 16 14 16 o 1.148000  0.3921000     0.9831000 0.4908000     1.312000  0.6117000     -0.3292000     0.7843000 
1 1 1 16 14 17 o 1.841000  0.5386000     1.838000  0.7596000     1.845000  0.7638000     -0.7106000E-02 1.077000  
1 1 1 16 14 18 o 1.903000  0.5676000     1.586000  0.6771000     2.220000  0.9110000     -0.6340000     1.135000  
1 1 1 16 14 19 o 4.474000  0.5691000     4.276000  0.5658000     4.672000  0.9877000     -0.3960000     1.138000  
1 1 1 16 14 20 o 2.198000  0.5687000     2.405000  0.7153000     1.991000  0.8844000     0.4139000      1.137000  
1 1 1 16 14 21 o 1.541000  0.4790000     1.418000  0.6465000     1.663000  0.7069000     -0.2450000     0.9580000 
1 1 1 16 14 22 o 1.533000  0.4757000     1.571000  0.6834000     1.494000  0.6620000     0.7714000E-01  0.9515000 
1 1 1 16 14 23 o 1.415000  0.4481000     1.174000  0.5661000     1.657000  0.6949000     -0.4827000     0.8962000 
1 1 1 16 14 24 o 1.366000  0.4382000     1.105000  0.5380000     1.627000  0.6918000     -0.5217000     0.8763000 
1 1 1 16 14 25 o 1.792000  0.5385000     1.703000  0.7619000     1.881000  0.7613000     -0.1776000     1.077000  
1 1 1 16 15 0  o 1.513000  0.4677000     1.513000  0.4677000     1.513000  0.4677000     0.000000       0.000000  
1 1 1 16 15 1  f 5.397000  0.1252000     5.245000  0.1901000     5.550000  0.1631000     -0.3050000     0.2505000 
1 1 1 16 15 2  o 5.800000  0.1161000     5.805000  0.1645000     5.795000  0.1638000     0.1016000E-01  0.2321000 
1 1 1 16 15 3  o 11.40000  0.1215000     11.48000  0.1720000     11.33000  0.1717000     0.1455000      0.2430000 
1 1 1 16 15 4  o 9.433000  0.1176000     9.392000  0.1672000     9.475000  0.1655000     -0.8276000E-01 0.2352000 
1 1 1 16 15 5  o 15.38000  0.1463000     15.16000  0.2054000     15.60000  0.2084000     -0.4335000     0.2926000 
1 1 1 16 15 6  o 11.58000  0.1324000     11.27000  0.1853000     11.88000  0.1891000     -0.6050000     0.2647000 
1 1 1 16 15 7  f 4.721000  0.1786000     4.874000  0.2686000     4.567000  0.2355000     0.3070000      0.3573000 
1 1 1 16 15 8  o 5.001000  0.1872000     4.637000  0.3067000     5.365000  0.2147000     -0.7277000     0.3744000 
1 1 1 16 15 9  o 18.09000  0.2091000     18.19000  0.2925000     17.99000  0.2990000     0.1965000      0.4182000 
1 1 1 16 15 10 o 4.490000  0.2444000     4.325000  0.3444000     4.656000  0.3467000     -0.3312000     0.4887000 
1 1 1 16 15 11 o 3.414000  0.3348000     3.473000  0.4602000     3.355000  0.4865000     0.1184000      0.6697000 
1 1 1 16 15 12 o 2.650000  0.4453000     2.411000  0.6346000     2.890000  0.6250000     -0.4794000     0.8907000 
1 1 1 16 15 13 f 8.059000  0.2271000     7.943000  0.3122000     8.175000  0.3297000     -0.2329000     0.4541000 
1 1 1 16 15 14 o 3.085000  0.4653000     3.029000  0.6762000     3.141000  0.6393000     -0.1115000     0.9306000 
1 1 1 16 15 15 o 8.481000  0.4539000     8.575000  0.8283000     8.387000  0.3713000     0.1882000      0.9078000 
1 1 1 16 15 16 o 8.577000  0.2350000     8.824000  0.3270000     8.330000  0.3376000     0.4934000      0.4700000 
1 1 1 16 15 17 o 4.484000  0.3883000     4.719000  0.5023000     4.249000  0.5923000     0.4697000      0.7766000 
1 1 1 16 15 18 o 2.198000  0.5520000     2.342000  0.7770000     2.054000  0.7843000     0.2889000      1.104000  
1 1 1 16 15 19 o 6.312000  0.2919000     6.431000  0.3975000     6.193000  0.4275000     0.2375000      0.5837000 
1 1 1 16 15 20 o 3.490000  0.5325000     2.170000  0.7346000     4.810000  0.7711000     -2.640000      1.065000  
1 1 1 16 15 21 o 1.115000  0.3848000     1.098000  0.5227000     1.133000  0.5648000     -0.3455000E-01 0.7695000 
1 1 1 16 15 22 o 3.322000  0.4843000     3.257000  0.5284000     3.388000  0.8117000     -0.1304000     0.9686000 
1 1 1 16 15 23 o 2.161000  0.5582000     1.729000  0.7209000     2.593000  0.8525000     -0.8637000     1.116000  
1 1 1 16 15 24 o 1.386000  0.4469000     1.236000  0.5880000     1.536000  0.6731000     -0.2998000     0.8938000 
1 1 1 16 15 25 f 1.189000  0.4267000     1.297000  0.6503000     1.080000  0.5526000     0.2168000      0.8534000 
1 1 1 16 16 0  f 4.383000  0.1863000     4.383000  0.1863000     4.383000  0.1863000     -0.000000      0.000000  
1 1 1 16 16 1  o 13.07000  0.1282000     13.10000  0.1818000     13.04000  0.1808000     0.6921000E-01  0.2564000 
1 1 1 16 16 2  o 10.09000  0.1165000     9.875000  0.1633000     10.30000  0.1663000     -0.4219000     0.2331000 
1 1 1 16 16 3  o 2.830000  0.1956000     3.078000  0.2534000     2.582000  0.2982000     0.4956000      0.3913000 
1 1 1 16 16 4  o 3.125000  0.1843000     3.094000  0.2670000     3.155000  0.2542000     -0.6089000E-01 0.3687000 
1 1 1 16 16 5  o 8.611000  0.1225000     8.680000  0.1726000     8.542000  0.1738000     0.1382000      0.2449000 
1 1 1 16 16 6  o 13.19000  0.1406000     13.36000  0.1992000     13.01000  0.1984000     0.3518000      0.2812000 
1 1 1 16 16 7  o 16.44000  0.2068000     16.45000  0.3178000     16.44000  0.2646000     0.1567000E-01  0.4135000 
1 1 1 16 16 8  o 17.05000  0.1652000     16.92000  0.2325000     17.17000  0.2349000     -0.2456000     0.3305000 
1 1 1 16 16 9  o 12.98000  0.2723000     13.03000  0.4935000     12.92000  0.2304000     0.1095000      0.5447000 
1 1 1 16 16 10 o 8.270000  0.1750000     8.436000  0.2398000     8.105000  0.2551000     0.3309000      0.3501000 
1 1 1 16 16 11 o 2.562000  0.4169000     2.425000  0.5945000     2.699000  0.5846000     -0.2736000     0.8337000 
1 1 1 16 16 12 o 5.648000  0.2460000     5.445000  0.3515000     5.851000  0.3444000     -0.4059000     0.4921000 
1 1 1 16 16 13 o 7.324000  0.3152000     7.381000  0.3435000     7.268000  0.5287000     0.1137000      0.6305000 
1 1 1 16 16 14 o 4.232000  0.3668000     4.520000  0.4563000     3.945000  0.5746000     0.5753000      0.7337000 
1 1 1 16 16 15 f 4.788000  0.6863000     4.088000  1.296000      5.487000  0.4516000     -1.400000      1.373000  
1 1 1 16 16 16 o 1.838000  0.5153000     1.591000  0.6919000     2.086000  0.7637000     -0.4946000     1.031000  
1 1 1 16 16 17 o 3.661000  0.4726000     3.364000  0.6999000     3.957000  0.6354000     -0.5928000     0.9453000 
1 1 1 16 16 18 o 2.110000  0.5489000     1.928000  0.7561000     2.291000  0.7959000     -0.3636000     1.098000  
1 1 1 16 16 19 o 1.298000  0.4342000     1.306000  0.6148000     1.289000  0.6133000     0.1750000E-01  0.8684000 
1 1 1 16 16 20 o 3.369000  0.5502000     3.382000  0.8253000     3.356000  0.7280000     0.2637000E-01  1.100000  
1 1 1 16 16 21 o 1.888000  0.4928000     2.199000  0.7316000     1.578000  0.6604000     0.6212000      0.9856000 
1 1 1 16 16 22 o 1.434000  0.4600000     1.384000  0.6041000     1.485000  0.6938000     -0.1012000     0.9200000 
1 1 1 16 16 23 o 1.719000  0.5217000     1.632000  0.6533000     1.805000  0.8135000     -0.1732000     1.043000  
1 1 1 16 16 24 o 1.578000  0.4915000     1.261000  0.5711000     1.895000  0.8001000     -0.6340000     0.9830000 
1 1 1 16 17 0  o 26.57000  0.3061000     26.57000  0.3061000     26.57000  0.3061000     0.000000       0.000000  
1 1 1 16 17 1  f 7.000000  0.1143000     6.886000  0.1623000     7.114000  0.1609000     -0.2285000     0.2285000 
1 1 1 16 17 2  o 5.665000  0.1234000     5.655000  0.1732000     5.676000  0.1757000     -0.2117000E-01 0.2467000 
1 1 1 16 17 3  o 5.487000  0.1273000     5.325000  0.1826000     5.648000  0.1775000     -0.3229000     0.2546000 
1 1 1 16 17 4  f 12.76000  0.1327000     12.79000  0.1882000     12.74000  0.1872000     0.4740000E-01  0.2655000 
1 1 1 16 17 5  o 6.715000  0.1299000     6.525000  0.1865000     6.904000  0.1808000     -0.3786000     0.2597000 
1 1 1 16 17 6  o 5.562000  0.1460000     5.710000  0.2019000     5.413000  0.2110000     0.2971000      0.2920000 
1 1 1 16 17 7  o 2.408000  0.3418000     1.954000  0.5057000     2.862000  0.4600000     -0.9078000     0.6836000 
1 1 1 16 17 8  o 7.365000  0.1583000     7.506000  0.2054000     7.224000  0.2409000     0.2820000      0.3166000 
1 1 1 16 17 9  o 8.418000  0.1684000     8.728000  0.2619000     8.108000  0.2119000     0.6202000      0.3369000 
1 1 1 16 17 10 f 7.832000  0.1873000     7.697000  0.3074000     7.966000  0.2142000     -0.2689000     0.3747000 
1 1 1 16 17 11 o 1.502000  0.4363000     1.463000  0.6004000     1.540000  0.6330000     -0.7694000E-01 0.8725000 
1 1 1 16 17 12 o 8.814000  0.1912000     8.387000  0.2699000     9.240000  0.2708000     -0.8531000     0.3824000 
1 1 1 16 17 13 o 17.78000  0.2740000     17.79000  0.3195000     17.77000  0.4452000     0.2368000E-01  0.5480000 
1 1 1 16 17 14 o 12.18000  0.1991000     12.03000  0.2781000     12.32000  0.2849000     -0.2943000     0.3982000 
1 1 1 16 17 15 o 2.833000  0.6321000     3.356000  0.9606000     2.310000  0.8220000     1.046000       1.264000  
1 1 1 16 17 16 o 2.009000  0.5410000     1.816000  0.7415000     2.203000  0.7879000     -0.3869000     1.082000  
1 1 1 16 17 17 o 1.953000  0.5385000     2.158000  0.7834000     1.748000  0.7390000     0.4093000      1.077000  
1 1 1 16 17 18 o 6.224000  0.3142000     6.390000  0.4171000     6.057000  0.4700000     0.3328000      0.6284000 
1 1 1 16 17 19 o 2.579000  0.5507000     2.592000  0.7756000     2.566000  0.7819000     0.2640000E-01  1.101000  
1 1 1 16 17 20 o 1.821000  0.6079000     2.209000  1.029000      1.433000  0.6483000     0.7754000      1.216000  
1 1 1 16 17 21 o 2.479000  0.4989000     2.675000  0.6786000     2.282000  0.7315000     0.3925000      0.9978000 
1 1 1 16 17 22 o 1.961000  0.4870000     1.689000  0.6655000     2.234000  0.7112000     -0.5455000     0.9740000 
1 1 1 16 17 23 o 1.824000  0.4930000     1.515000  0.6579000     2.133000  0.7344000     -0.6179000     0.9860000 
1 1 1 16 17 24 o 1.273000  0.4113000     1.356000  0.5987000     1.190000  0.5642000     0.1656000      0.8226000 
1 1 1 16 18 0  o 14.34000  0.1942000     14.34000  0.1942000     14.34000  0.1942000     -0.000000      0.000000  
1 1 1 16 18 1  o 6.972000  0.1175000     7.034000  0.1658000     6.911000  0.1665000     0.1230000      0.2349000 
1 1 1 16 18 2  o 2.729000  0.2135000     3.198000  0.2467000     2.259000  0.3484000     0.9395000      0.4269000 
1 1 1 16 18 3  o 14.40000  0.1400000     14.27000  0.1972000     14.53000  0.1987000     -0.2561000     0.2800000 
1 1 1 16 18 4  o 11.00000  0.1393000     10.96000  0.2124000     11.05000  0.1803000     -0.8664000E-01 0.2786000 
1 1 1 16 18 5  o 9.613000  0.1404000     9.874000  0.2153000     9.353000  0.1802000     0.5204000      0.2808000 
1 1 1 16 18 6  o 4.717000  0.1992000     5.026000  0.3163000     4.407000  0.2423000     0.6195000      0.3984000 
1 1 1 16 18 7  o 24.49000  0.2103000     24.47000  0.2967000     24.51000  0.2982000     -0.3797000E-01 0.4206000 
1 1 1 16 18 8  o 15.83000  0.2105000     15.97000  0.2565000     15.68000  0.3338000     0.2863000      0.4209000 
1 1 1 16 18 9  o 15.04000  0.1605000     14.96000  0.2261000     15.11000  0.2278000     -0.1531000     0.3210000 
1 1 1 16 18 10 o 14.54000  0.1734000     14.83000  0.2762000     14.25000  0.2097000     0.5742000      0.3468000 
1 1 1 16 18 11 o 15.73000  0.1810000     15.87000  0.2551000     15.60000  0.2569000     0.2702000      0.3620000 
1 1 1 16 18 12 o 6.791000  0.2194000     6.512000  0.3040000     7.071000  0.3166000     -0.5590000     0.4389000 
1 1 1 16 18 13 o 1.933000  0.5961000     1.898000  0.8151000     1.968000  0.8699000     -0.7020000E-01 1.192000  
1 1 1 16 18 14 f 4.619000  0.3604000     4.566000  0.4458000     4.672000  0.5663000     -0.1064000     0.7207000 
1 1 1 16 18 15 o 1.497000  0.4751000     1.683000  0.7178000     1.310000  0.6226000     0.3727000      0.9502000 
1 1 1 16 18 16 o 1.944000  0.5466000     1.795000  0.7472000     2.093000  0.7980000     -0.2978000     1.093000  
1 1 1 16 18 17 o 1.882000  0.5420000     1.767000  0.7452000     1.998000  0.7873000     -0.2318000     1.084000  
1 1 1 16 18 18 o 1.910000  0.5926000     1.392000  0.6549000     2.428000  0.9878000     -1.036000      1.185000  
1 1 1 16 18 19 o 2.615000  0.5075000     1.862000  0.7418000     3.368000  0.6927000     -1.505000      1.015000  
1 1 1 16 18 20 o 1.796000  0.5504000     2.417000  0.9482000     1.175000  0.5591000     1.242000       1.101000  
1 1 1 16 18 21 o 1.723000  0.4757000     2.007000  0.7067000     1.438000  0.6368000     0.5694000      0.9513000 
1 1 1 16 18 22 o 2.018000  0.4697000     1.471000  0.6286000     2.564000  0.6980000     -1.093000      0.9393000 
1 1 1 16 18 23 o 1.940000  0.4669000     2.667000  0.7089000     1.213000  0.6078000     1.454000       0.9338000 
1 1 1 16 18 24 o 1.186000  0.3946000     1.363000  0.6144000     1.009000  0.4955000     0.3538000      0.7893000 
1 1 1 16 19 0  o 6.142000  0.1772000     6.142000  0.1772000     6.142000  0.1772000     -0.000000      0.000000  
1 1 1 16 19 1  o 3.020000  0.1884000     3.182000  0.2573000     2.858000  0.2752000     0.3242000      0.3767000 
1 1 1 16 19 2  o 3.799000  0.1646000     3.876000  0.2298000     3.723000  0.2357000     0.1533000      0.3292000 
1 1 1 16 19 3  o 10.01000  0.1245000     10.08000  0.1759000     9.945000  0.1762000     0.1337000      0.2490000 
1 1 1 16 19 4  o 9.223000  0.1263000     9.187000  0.1779000     9.258000  0.1794000     -0.7078000E-01 0.2527000 
1 1 1 16 19 5  o 11.92000  0.1363000     11.99000  0.1927000     11.84000  0.1929000     0.1536000      0.2726000 
1 1 1 16 19 6  o 11.73000  0.1725000     11.83000  0.2211000     11.63000  0.2648000     0.2005000      0.3449000 
1 1 1 16 19 7  o 12.21000  0.1547000     11.96000  0.2014000     12.47000  0.2348000     -0.5143000     0.3093000 
1 1 1 16 19 8  o 19.23000  0.2215000     19.34000  0.3634000     19.13000  0.2536000     0.2054000      0.4431000 
1 1 1 16 19 9  o 7.661000  0.1522000     7.508000  0.2135000     7.813000  0.2170000     -0.3052000     0.3044000 
1 1 1 16 19 10 o 8.503000  0.1561000     8.332000  0.2210000     8.673000  0.2206000     -0.3415000     0.3122000 
1 1 1 16 19 11 o 16.51000  0.1866000     16.28000  0.2942000     16.73000  0.2296000     -0.4440000     0.3732000 
1 1 1 16 19 12 o 2.638000  0.4597000     2.417000  0.6413000     2.858000  0.6589000     -0.4409000     0.9195000 
1 1 1 16 19 13 o 7.108000  0.2391000     7.096000  0.3323000     7.121000  0.3439000     -0.2553000E-01 0.4782000 
1 1 1 16 19 14 o 7.313000  0.2680000     7.209000  0.3591000     7.417000  0.3978000     -0.2079000     0.5359000 
1 1 1 16 19 15 o 2.854000  0.5151000     3.321000  0.6573000     2.388000  0.7932000     0.9327000      1.030000  
1 1 1 16 19 16 o 3.450000  0.4991000     3.577000  0.6652000     3.323000  0.7442000     0.2540000      0.9982000 
1 1 1 16 19 17 o 2.012000  0.5489000     2.009000  0.7692000     2.015000  0.7834000     -0.6191000E-02 1.098000  
1 1 1 16 19 18 o 2.125000  0.6408000     2.053000  0.7871000     2.197000  1.011000      -0.1436000     1.282000  
1 1 1 16 19 19 o 1.401000  0.4569000     1.398000  0.6424000     1.405000  0.6500000     -0.6996000E-02 0.9139000 
1 1 1 16 19 20 o 1.428000  0.4673000     1.475000  0.6933000     1.382000  0.6269000     0.9331000E-01  0.9347000 
1 1 1 16 19 21 o 3.376000  0.4240000     3.673000  0.5362000     3.079000  0.6570000     0.5939000      0.8480000 
1 1 1 16 19 22 o 3.019000  0.4444000     3.826000  0.4907000     2.212000  0.7412000     1.614000       0.8889000 
1 1 1 16 19 23 o 1.516000  0.5008000     1.516000  0.6625000     1.516000  0.7513000     0.3074000E-03  1.002000  
1 1 1 16 19 24 o 1.171000  0.3928000     1.123000  0.5383000     1.220000  0.5722000     -0.9677000E-01 0.7856000 
1 1 1 16 20 0  o 9.933000  0.1753000     9.933000  0.1753000     9.933000  0.1753000     -0.000000      0.000000  
1 1 1 16 20 1  o 14.48000  0.1418000     14.60000  0.2016000     14.35000  0.1996000     0.2507000      0.2837000 
1 1 1 16 20 2  o 21.98000  0.1880000     22.00000  0.2659000     21.96000  0.2660000     0.3694000E-01  0.3761000 
1 1 1 16 20 3  o 15.43000  0.1486000     15.47000  0.2100000     15.38000  0.2102000     0.9543000E-01  0.2971000 
1 1 1 16 20 4  f 4.642000  0.1567000     4.738000  0.2223000     4.546000  0.2208000     0.1921000      0.3133000 
1 1 1 16 20 5  o 3.894000  0.2271000     3.799000  0.3748000     3.989000  0.2566000     -0.1899000     0.4542000 
1 1 1 16 20 6  o 5.649000  0.1629000     5.813000  0.2141000     5.486000  0.2455000     0.3268000      0.3258000 
1 1 1 16 20 7  o 12.87000  0.1922000     12.63000  0.2326000     13.11000  0.3060000     -0.4747000     0.3843000 
1 1 1 16 20 8  o 15.87000  0.1627000     16.09000  0.2314000     15.65000  0.2287000     0.4346000      0.3254000 
1 1 1 16 20 9  o 20.34000  0.1894000     20.27000  0.2675000     20.41000  0.2682000     -0.1398000     0.3788000 
1 1 1 16 20 10 o 9.474000  0.1552000     9.589000  0.2192000     9.360000  0.2197000     0.2291000      0.3104000 
1 1 1 16 20 11 o 1.841000  0.3935000     2.748000  0.6445000     0.9340000 0.4515000     1.814000       0.7869000 
1 1 1 16 20 12 o 9.051000  0.2206000     9.048000  0.3101000     9.055000  0.3139000     -0.7532000E-02 0.4413000 
1 1 1 16 20 13 o 3.749000  0.3940000     3.534000  0.5859000     3.964000  0.5269000     -0.4305000     0.7880000 
1 1 1 16 20 14 o 9.453000  0.3944000     9.327000  0.7213000     9.578000  0.3196000     -0.2513000     0.7889000 
1 1 1 16 20 15 f 4.883000  0.3468000     4.825000  0.4750000     4.941000  0.5055000     -0.1154000     0.6937000 
1 1 1 16 20 16 o 4.531000  0.3919000     3.610000  0.6235000     5.453000  0.4749000     -1.843000      0.7837000 
1 1 1 16 20 17 o 6.873000  0.2773000     6.539000  0.4012000     7.208000  0.3830000     -0.6684000     0.5546000 
1 1 1 16 20 18 o 5.603000  0.4463000     5.722000  0.4341000     5.483000  0.7799000     0.2386000      0.8925000 
1 1 1 16 20 19 o 4.028000  0.3944000     3.919000  0.5647000     4.137000  0.5508000     -0.2175000     0.7888000 
1 1 1 16 20 20 o 4.231000  0.3673000     3.984000  0.5553000     4.478000  0.4808000     -0.4947000     0.7345000 
1 1 1 16 20 21 o 2.467000  0.5037000     2.736000  0.6801000     2.199000  0.7431000     0.5364000      1.007000  
1 1 1 16 20 22 o 1.540000  0.4617000     1.415000  0.6204000     1.665000  0.6840000     -0.2499000     0.9235000 
1 1 1 16 20 23 o 1.467000  0.4854000     1.202000  0.5606000     1.732000  0.7925000     -0.5305000     0.9707000 
1 1 1 16 20 24 o 1.085000  0.3695000     1.116000  0.5359000     1.054000  0.5089000     0.6213000E-01  0.7390000 
1 1 1 16 21 0  o 21.34000  0.2608000     21.34000  0.2608000     21.34000  0.2608000     0.000000       0.000000  
1 1 1 16 21 1  o 21.49000  0.1854000     21.33000  0.2608000     21.65000  0.2637000     -0.3200000     0.3709000 
1 1 1 16 21 2  o 9.834000  0.1269000     9.711000  0.1791000     9.956000  0.1797000     -0.2445000     0.2537000 
1 1 1 16 21 3  o 15.86000  0.1526000     15.92000  0.2161000     15.80000  0.2155000     0.1228000      0.3051000 
1 1 1 16 21 4  o 4.986000  0.1566000     4.936000  0.2277000     5.037000  0.2151000     -0.1007000     0.3132000 
1 1 1 16 21 5  o 6.427000  0.1744000     6.549000  0.2214000     6.305000  0.2694000     0.2442000      0.3487000 
1 1 1 16 21 6  o 10.01000  0.1485000     10.31000  0.1943000     9.705000  0.2245000     0.6054000      0.2969000 
1 1 1 16 21 7  o 13.00000  0.1820000     13.15000  0.2979000     12.85000  0.2092000     0.2983000      0.3640000 
1 1 1 16 21 8  o 10.70000  0.1561000     11.06000  0.2305000     10.33000  0.2106000     0.7297000      0.3122000 
1 1 1 16 21 9  o 4.184000  0.2196000     4.323000  0.2948000     4.044000  0.3256000     0.2786000      0.4392000 
1 1 1 16 21 10 o 4.937000  0.2044000     4.659000  0.2951000     5.216000  0.2828000     -0.5578000     0.4087000 
1 1 1 16 21 11 o 1.845000  0.4195000     2.103000  0.5801000     1.586000  0.6062000     0.5174000      0.8391000 
1 1 1 16 21 12 o 2.579000  0.5231000     2.870000  0.7370000     2.287000  0.7425000     0.5825000      1.046000  
1 1 1 16 21 13 f 2.369000  0.5182000     2.602000  0.7115000     2.136000  0.7535000     0.4666000      1.036000  
1 1 1 16 21 14 o 6.975000  0.3380000     6.826000  0.5645000     7.124000  0.3719000     -0.2979000     0.6760000 
1 1 1 16 21 15 f 5.428000  0.3227000     5.166000  0.4627000     5.690000  0.4499000     -0.5243000     0.6453000 
1 1 1 16 21 16 o 1.617000  0.4829000     1.129000  0.5561000     2.106000  0.7896000     -0.9768000     0.9658000 
1 1 1 16 21 17 o 3.707000  0.4542000     3.640000  0.6338000     3.775000  0.6507000     -0.1346000     0.9084000 
1 1 1 16 21 18 o 2.441000  0.5061000     3.113000  0.6909000     1.770000  0.7396000     1.343000       1.012000  
1 1 1 16 21 19 o 1.738000  0.5235000     1.762000  0.7446000     1.714000  0.7361000     0.4734000E-01  1.047000  
1 1 1 16 21 20 o 1.679000  0.4900000     1.755000  0.7065000     1.602000  0.6790000     0.1525000      0.9799000 
1 1 1 16 21 21 o 1.800000  0.4966000     1.923000  0.7080000     1.677000  0.6966000     0.2454000      0.9932000 
1 1 1 16 21 22 o 1.840000  0.4577000     2.396000  0.6952000     1.283000  0.5955000     1.113000       0.9154000 
1 1 1 16 21 23 o 1.307000  0.4162000     1.601000  0.6651000     1.012000  0.5005000     0.5889000      0.8323000 
1 1 1 16 21 24 o 1.860000  0.5103000     1.815000  0.6995000     1.905000  0.7431000     -0.9031000E-01 1.021000  
1 1 1 16 22 0  o 5.639000  0.1990000     5.639000  0.1990000     5.639000  0.1990000     -0.000000      0.000000  
1 1 1 16 22 1  o 12.21000  0.1350000     12.37000  0.1918000     12.05000  0.1901000     0.3144000      0.2700000 
1 1 1 16 22 2  o 2.960000  0.2278000     3.358000  0.2785000     2.562000  0.3605000     0.7958000      0.4555000 
1 1 1 16 22 3  o 8.920000  0.1310000     8.878000  0.1839000     8.962000  0.1865000     -0.8370000E-01 0.2619000 
1 1 1 16 22 4  o 15.86000  0.2017000     15.62000  0.3119000     16.10000  0.2560000     -0.4821000     0.4035000 
1 1 1 16 22 5  o 14.56000  0.1642000     14.54000  0.2124000     14.57000  0.2505000     -0.2131000E-01 0.3284000 
1 1 1 16 22 6  o 10.60000  0.1859000     11.00000  0.2836000     10.20000  0.2405000     0.7996000      0.3718000 
1 1 1 16 22 7  o 8.688000  0.1455000     8.785000  0.2065000     8.591000  0.2049000     0.1939000      0.2909000 
1 1 1 16 22 8  o 9.915000  0.1473000     9.926000  0.2067000     9.904000  0.2098000     0.2144000E-01  0.2946000 
1 1 1 16 22 9  o 10.86000  0.1538000     10.90000  0.2189000     10.82000  0.2162000     0.8304000E-01  0.3077000 
1 1 1 16 22 10 o 12.67000  0.1597000     12.62000  0.2246000     12.72000  0.2271000     -0.1021000     0.3194000 
1 1 1 16 22 11 o 11.72000  0.1645000     11.79000  0.2327000     11.65000  0.2326000     0.1457000      0.3290000 
1 1 1 16 22 12 o 4.192000  0.3162000     4.014000  0.4963000     4.370000  0.3919000     -0.3556000     0.6324000 
1 1 1 16 22 13 o 3.999000  0.4128000     4.364000  0.4667000     3.633000  0.6811000     0.7307000      0.8257000 
1 1 1 16 22 14 o 3.240000  0.4856000     3.133000  0.6665000     3.348000  0.7065000     -0.2156000     0.9713000 
1 1 1 16 22 15 o 9.942000  0.2257000     9.726000  0.3134000     10.16000  0.3248000     -0.4319000     0.4514000 
1 1 1 16 22 16 o 2.583000  0.5578000     2.305000  0.7836000     2.862000  0.7939000     -0.5567000     1.116000  
1 1 1 16 22 17 o 7.735000  0.2799000     7.780000  0.3846000     7.691000  0.4068000     0.8906000E-01  0.5598000 
1 1 1 16 22 18 o 2.236000  0.5465000     2.309000  0.7664000     2.163000  0.7792000     0.1458000      1.093000  
1 1 1 16 22 19 o 1.750000  0.5343000     1.654000  0.7500000     1.846000  0.7613000     -0.1921000     1.069000  
1 1 1 16 22 20 o 1.746000  0.4915000     1.529000  0.6619000     1.963000  0.7268000     -0.4341000     0.9830000 
1 1 1 16 22 21 o 1.731000  0.4921000     1.551000  0.6653000     1.911000  0.7252000     -0.3605000     0.9841000 
1 1 1 16 22 22 o 1.982000  0.5004000     2.099000  0.7059000     1.866000  0.7094000     0.2324000      1.001000  
1 1 1 16 22 23 o 1.273000  0.4097000     1.523000  0.6482000     1.022000  0.5012000     0.5013000      0.8193000 
1 1 1 16 22 24 o 1.484000  0.4662000     1.236000  0.5961000     1.732000  0.7171000     -0.4956000     0.9325000 
1 1 1 16 23 0  o 25.94000  0.3067000     25.94000  0.3067000     25.94000  0.3067000     -0.000000      0.000000  
1 1 1 16 23 1  o 15.21000  0.1501000     15.04000  0.2109000     15.39000  0.2135000     -0.3516000     0.3001000 
1 1 1 16 23 2  o 7.452000  0.1346000     7.390000  0.1917000     7.513000  0.1890000     -0.1233000     0.2692000 
1 1 1 16 23 3  o 2.588000  0.3397000     2.742000  0.5054000     2.434000  0.4540000     0.3079000      0.6794000 
1 1 1 16 23 4  o 8.895000  0.1621000     8.972000  0.1903000     8.818000  0.2624000     0.1537000      0.3241000 
1 1 1 16 23 5  o 9.661000  0.1818000     9.526000  0.2181000     9.796000  0.2908000     -0.2700000     0.3635000 
1 1 1 16 23 6  o 11.59000  0.1593000     11.38000  0.2440000     11.80000  0.2049000     -0.4225000     0.3186000 
1 1 1 16 23 7  o 12.49000  0.1500000     12.44000  0.2127000     12.55000  0.2116000     -0.1046000     0.3001000 
1 1 1 16 23 8  o 10.21000  0.1492000     10.27000  0.2095000     10.16000  0.2125000     0.1089000      0.2984000 
1 1 1 16 23 9  o 11.81000  0.1554000     11.74000  0.2211000     11.88000  0.2184000     -0.1454000     0.3108000 
1 1 1 16 23 10 o 10.42000  0.1614000     10.21000  0.2274000     10.63000  0.2291000     -0.4223000     0.3228000 
1 1 1 16 23 11 o 4.026000  0.3216000     4.003000  0.5255000     4.049000  0.3710000     -0.4554000E-01 0.6433000 
1 1 1 16 23 12 o 2.160000  0.4487000     2.187000  0.6223000     2.133000  0.6466000     0.5420000E-01  0.8974000 
1 1 1 16 23 13 o 3.538000  0.4697000     3.344000  0.6786000     3.732000  0.6496000     -0.3878000     0.9394000 
1 1 1 16 23 14 o 7.057000  0.2618000     7.025000  0.3678000     7.089000  0.3727000     -0.6418000E-01 0.5237000 
1 1 1 16 23 15 o 3.920000  0.4368000     3.682000  0.6436000     4.158000  0.5907000     -0.4757000     0.8736000 
1 1 1 16 23 16 o 1.915000  0.5409000     1.674000  0.7185000     2.156000  0.8087000     -0.4820000     1.082000  
1 1 1 16 23 17 o 2.185000  0.6232000     2.164000  0.8094000     2.206000  0.9480000     -0.4245000E-01 1.246000  
1 1 1 16 23 18 o 2.260000  0.5387000     2.390000  0.7425000     2.130000  0.7807000     0.2600000      1.077000  
1 1 1 16 23 19 o 2.550000  0.7036000     3.261000  1.199000      1.838000  0.7357000     1.423000       1.407000  
1 1 1 16 23 20 o 1.608000  0.4799000     1.498000  0.6533000     1.717000  0.7031000     -0.2192000     0.9597000 
1 1 1 16 23 21 o 1.389000  0.4422000     1.293000  0.5958000     1.485000  0.6537000     -0.1916000     0.8844000 
1 1 1 16 23 22 o 1.532000  0.4671000     1.174000  0.5610000     1.889000  0.7471000     -0.7149000     0.9343000 
1 1 1 16 23 23 o 1.606000  0.4575000     1.872000  0.6829000     1.340000  0.6090000     0.5326000      0.9150000 
1 1 1 16 24 0  o 6.132000  0.2389000     6.132000  0.2389000     6.132000  0.2389000     0.000000       0.000000  
1 1 1 16 24 1  o 7.527000  0.1490000     7.379000  0.2248000     7.676000  0.1955000     -0.2975000     0.2979000 
1 1 1 16 24 2  o 18.48000  0.2933000     18.31000  0.4759000     18.65000  0.3429000     -0.3433000     0.5866000 
1 1 1 16 24 3  o 5.573000  0.2616000     5.392000  0.2214000     5.754000  0.4741000     -0.3629000     0.5232000 
1 1 1 16 24 4  o 2.797000  0.3114000     2.599000  0.4474000     2.994000  0.4333000     -0.3944000     0.6229000 
1 1 1 16 24 5  o 7.631000  0.1596000     7.384000  0.2456000     7.878000  0.2038000     -0.4942000     0.3191000 
1 1 1 16 24 6  o 10.38000  0.1426000     10.55000  0.2008000     10.21000  0.2026000     0.3312000      0.2853000 
1 1 1 16 24 7  o 3.166000  0.2685000     3.456000  0.3463000     2.877000  0.4103000     0.5787000      0.5369000 
1 1 1 16 24 8  o 9.446000  0.1508000     9.472000  0.2145000     9.421000  0.2119000     0.5122000E-01  0.3015000 
1 1 1 16 24 9  o 13.12000  0.1591000     12.85000  0.2249000     13.40000  0.2251000     -0.5505000     0.3182000 
1 1 1 16 24 10 o 12.87000  0.1635000     12.75000  0.2312000     12.99000  0.2311000     -0.2412000     0.3269000 
1 1 1 16 24 11 o 7.689000  0.2476000     7.514000  0.3617000     7.864000  0.3381000     -0.3494000     0.4951000 
1 1 1 16 24 12 o 6.999000  0.1962000     6.880000  0.2781000     7.119000  0.2768000     -0.2395000     0.3924000 
1 1 1 16 24 13 o 7.338000  0.4222000     7.420000  0.7962000     7.257000  0.2815000     0.1631000      0.8445000 
1 1 1 16 24 14 o 5.870000  0.2991000     5.631000  0.4333000     6.109000  0.4123000     -0.4781000     0.5981000 
1 1 1 16 24 15 o 2.676000  0.5651000     2.597000  0.7859000     2.754000  0.8121000     -0.1565000     1.130000  
1 1 1 16 24 16 o 5.722000  0.3079000     5.652000  0.4423000     5.792000  0.4284000     -0.1401000     0.6158000 
1 1 1 16 24 17 o 2.297000  0.6675000     2.252000  0.8089000     2.343000  1.062000      -0.9107000E-01 1.335000  
1 1 1 16 24 18 f 2.566000  0.5332000     2.678000  0.7334000     2.454000  0.7743000     0.2247000      1.066000  
1 1 1 16 24 19 o 1.848000  0.5434000     2.092000  0.8437000     1.604000  0.6849000     0.4888000      1.087000  
1 1 1 16 24 20 o 1.501000  0.4637000     1.343000  0.6118000     1.658000  0.6970000     -0.3147000     0.9274000 
1 1 1 16 24 21 o 2.400000  0.5078000     2.032000  0.7199000     2.768000  0.7163000     -0.7354000     1.016000  
1 1 1 16 24 22 o 1.814000  0.5145000     1.757000  0.7048000     1.870000  0.7498000     -0.1129000     1.029000  
1 1 1 16 24 23 o 1.053000  0.3630000     0.9214000 0.4592000     1.184000  0.5624000     -0.2625000     0.7261000 
1 1 1 16 25 0  o 11.17000  0.2828000     11.17000  0.2828000     11.17000  0.2828000     -0.000000      0.000000  
1 1 1 16 25 1  o 14.85000  0.2981000     14.85000  0.2981000     ?         ?             ?              ?         
1 1 1 16 25 2  o 22.84000  0.2568000     22.87000  0.3256000     22.80000  0.3972000     0.6895000E-01  0.5136000 
1 1 1 16 25 3  o 12.68000  0.2055000     12.98000  0.2876000     12.39000  0.2936000     0.5987000      0.4110000 
1 1 1 16 25 4  o 18.36000  0.1867000     18.33000  0.2823000     18.39000  0.2445000     -0.5857000E-01 0.3735000 
1 1 1 16 25 5  o 21.63000  0.1930000     21.59000  0.2722000     21.67000  0.2737000     -0.7699000E-01 0.3861000 
1 1 1 16 25 6  o 11.93000  0.1473000     11.98000  0.2068000     11.88000  0.2097000     0.9930000E-01  0.2945000 
1 1 1 16 25 7  o 17.94000  0.1746000     17.82000  0.2463000     18.07000  0.2475000     -0.2473000     0.3492000 
1 1 1 16 25 8  o 16.88000  0.1713000     16.72000  0.2421000     17.04000  0.2424000     -0.3262000     0.3426000 
1 1 1 16 25 9  o 8.610000  0.1621000     8.409000  0.2281000     8.812000  0.2305000     -0.4035000     0.3243000 
1 1 1 16 25 10 o 4.412000  0.2446000     4.155000  0.3567000     4.668000  0.3347000     -0.5122000     0.4892000 
1 1 1 16 25 11 o 7.176000  0.1977000     7.154000  0.2583000     7.199000  0.2993000     -0.4475000E-01 0.3954000 
1 1 1 16 25 12 o 10.78000  0.2263000     10.59000  0.2472000     10.97000  0.3791000     -0.3788000     0.4525000 
1 1 1 16 25 13 o 13.75000  0.1840000     13.93000  0.2587000     13.57000  0.2616000     0.3643000      0.3679000 
1 1 1 16 25 14 o 2.837000  0.4639000     1.940000  0.7760000     3.734000  0.5086000     -1.794000      0.9278000 
1 1 1 16 25 15 o 1.683000  0.4962000     2.048000  0.7682000     1.318000  0.6283000     0.7302000      0.9924000 
1 1 1 16 25 16 o 2.039000  0.5407000     2.133000  0.7617000     1.944000  0.7677000     0.1894000      1.081000  
1 1 1 16 25 17 o 4.278000  0.4199000     4.360000  0.5387000     4.197000  0.6442000     0.1625000      0.8398000 
1 1 1 16 25 18 o 1.721000  0.5052000     1.642000  0.6886000     1.801000  0.7393000     -0.1586000     1.010000  
1 1 1 16 25 19 o 1.497000  0.4623000     1.286000  0.5986000     1.709000  0.7046000     -0.4227000     0.9245000 
1 1 1 16 25 20 o 1.951000  0.4981000     2.285000  0.7205000     1.616000  0.6880000     0.6690000      0.9962000 
1 1 1 16 25 21 o 1.418000  0.4385000     1.639000  0.6680000     1.198000  0.5682000     0.4410000      0.8769000 
1 1 1 16 25 22 o 1.633000  0.5173000     1.717000  0.7034000     1.550000  0.7588000     0.1672000      1.035000  
1 1 1 16 25 23 o 2.143000  0.4853000     1.634000  0.6804000     2.653000  0.6922000     -1.019000      0.9706000 
1 1 1 16 26 0  o 16.01000  0.2582000     16.01000  0.2582000     16.01000  0.2582000     -0.000000      0.000000  
1 1 1 16 26 1  o 16.28000  0.1721000     16.30000  0.2606000     16.25000  0.2249000     0.4268000E-01  0.3442000 
1 1 1 16 26 2  o 13.31000  0.1587000     13.09000  0.2389000     13.53000  0.2089000     -0.4450000     0.3174000 
1 1 1 16 26 3  o 5.216000  0.1685000     5.314000  0.2340000     5.118000  0.2424000     0.1960000      0.3369000 
1 1 1 16 26 4  o 9.023000  0.1423000     9.043000  0.1992000     9.003000  0.2033000     0.3946000E-01  0.2846000 
1 1 1 16 26 5  o 10.58000  0.1452000     10.70000  0.2046000     10.47000  0.2061000     0.2305000      0.2904000 
1 1 1 16 26 6  o 20.32000  0.1869000     20.13000  0.2623000     20.51000  0.2662000     -0.3721000     0.3737000 
1 1 1 16 26 7  o 9.608000  0.1490000     9.720000  0.2124000     9.497000  0.2091000     0.2236000      0.2980000 
1 1 1 16 26 8  o 9.723000  0.1724000     9.639000  0.2667000     9.806000  0.2186000     -0.1669000     0.3449000 
1 1 1 16 26 9  o 2.995000  0.3213000     2.800000  0.4740000     3.191000  0.4338000     -0.3906000     0.6425000 
1 1 1 16 26 10 o 5.995000  0.2461000     5.943000  0.3955000     6.046000  0.2932000     -0.1028000     0.4923000 
1 1 1 16 26 11 o 1.722000  0.4614000     1.775000  0.6537000     1.668000  0.6514000     0.1064000      0.9228000 
1 1 1 16 26 12 o 1.526000  0.4696000     1.252000  0.5952000     1.800000  0.7264000     -0.5488000     0.9391000 
1 1 1 16 26 13 o 5.528000  0.2512000     5.733000  0.3453000     5.322000  0.3650000     0.4102000      0.5025000 
1 1 1 16 26 14 o 4.014000  0.3700000     4.355000  0.5335000     3.673000  0.5129000     0.6816000      0.7401000 
1 1 1 16 26 15 o 2.134000  0.5389000     1.765000  0.7266000     2.504000  0.7960000     -0.7388000     1.078000  
1 1 1 16 26 16 o 1.692000  0.5065000     1.790000  0.7291000     1.593000  0.7032000     0.1965000      1.013000  
1 1 1 16 26 17 o 1.824000  0.5099000     2.135000  0.7689000     1.512000  0.6699000     0.6231000      1.020000  
1 1 1 16 26 18 o 2.847000  0.5575000     3.395000  0.7842000     2.300000  0.7927000     1.095000       1.115000  
1 1 1 16 26 19 o 1.791000  0.4761000     2.299000  0.7387000     1.283000  0.6007000     1.016000       0.9521000 
1 1 1 16 26 20 o 1.350000  0.4345000     1.164000  0.5511000     1.536000  0.6719000     -0.3712000     0.8690000 
1 1 1 16 26 21 o 1.709000  0.4780000     1.380000  0.6135000     2.038000  0.7332000     -0.6581000     0.9560000 
1 1 1 16 26 22 o 1.402000  0.4539000     1.492000  0.6402000     1.313000  0.6435000     0.1790000      0.9077000 
1 1 1 16 26 23 o 1.096000  0.3770000     1.153000  0.5517000     1.040000  0.5140000     0.1136000      0.7540000 
1 1 1 16 27 0  o 8.273000  0.1999000     8.273000  0.1999000     8.273000  0.1999000     0.000000       0.000000  
1 1 1 16 27 1  o 17.71000  0.1683000     17.64000  0.2375000     17.78000  0.2384000     -0.1350000     0.3365000 
1 1 1 16 27 2  o 2.960000  0.2699000     3.435000  0.3179000     2.485000  0.4362000     0.9504000      0.5398000 
1 1 1 16 27 3  o 29.39000  0.2445000     29.78000  0.3494000     29.00000  0.3422000     0.7714000      0.4891000 
1 1 1 16 27 4  o 8.086000  0.1471000     7.985000  0.2060000     8.187000  0.2099000     -0.2015000     0.2941000 
1 1 1 16 27 5  o 11.71000  0.1470000     11.68000  0.2064000     11.73000  0.2093000     -0.4718000E-01 0.2939000 
1 1 1 16 27 6  o 2.475000  0.3376000     2.789000  0.4175000     2.162000  0.5307000     0.6274000      0.6752000 
1 1 1 16 27 7  o 10.59000  0.1517000     10.58000  0.2155000     10.61000  0.2135000     -0.3103000E-01 0.3034000 
1 1 1 16 27 8  o 13.77000  0.1607000     13.86000  0.2275000     13.68000  0.2271000     0.1790000      0.3215000 
1 1 1 16 27 9  o 2.806000  0.3546000     2.453000  0.5493000     3.158000  0.4486000     -0.7054000     0.7092000 
1 1 1 16 27 10 o 2.888000  0.5103000     3.560000  0.4505000     2.216000  0.9158000     1.344000       1.021000  
1 1 1 16 27 11 o 5.494000  0.2460000     5.406000  0.3233000     5.582000  0.3709000     -0.1758000     0.4920000 
1 1 1 16 27 12 f 6.503000  0.2535000     6.128000  0.4036000     6.879000  0.3068000     -0.7512000     0.5070000 
1 1 1 16 27 13 o 5.030000  0.2675000     4.783000  0.3871000     5.277000  0.3693000     -0.4946000     0.5350000 
1 1 1 16 27 14 o 3.955000  0.3556000     3.331000  0.5568000     4.579000  0.4425000     -1.248000      0.7113000 
1 1 1 16 27 15 o 3.346000  0.4711000     2.701000  0.8131000     3.992000  0.4762000     -1.291000      0.9423000 
1 1 1 16 27 16 o 3.130000  0.6356000     2.523000  0.8010000     3.737000  0.9870000     -1.213000      1.271000  
1 1 1 16 27 17 o 1.937000  0.5304000     2.005000  0.7617000     1.869000  0.7382000     0.1355000      1.061000  
1 1 1 16 27 18 o 1.873000  0.5890000     1.941000  0.9282000     1.806000  0.7253000     0.1346000      1.178000  
1 1 1 16 27 19 o 1.526000  0.4703000     1.539000  0.6697000     1.513000  0.6606000     0.2579000E-01  0.9407000 
1 1 1 16 27 20 o 1.282000  0.4189000     1.194000  0.5616000     1.370000  0.6217000     -0.1763000     0.8378000 
1 1 1 16 27 21 o 1.954000  0.4941000     2.328000  0.7259000     1.580000  0.6705000     0.7479000      0.9882000 
1 1 1 16 27 22 o 1.207000  0.4032000     1.103000  0.5324000     1.311000  0.6058000     -0.2079000     0.8065000 
1 1 1 16 27 23 o 1.315000  0.4354000     1.243000  0.5900000     1.386000  0.6406000     -0.1431000     0.8709000 
1 1 1 16 28 0  o 15.83000  0.2262000     15.83000  0.2262000     15.83000  0.2262000     -0.000000      0.000000  
1 1 1 16 28 1  o 12.10000  0.1448000     11.93000  0.2045000     12.26000  0.2051000     -0.3341000     0.2897000 
1 1 1 16 28 2  o 21.81000  0.1942000     21.98000  0.2763000     21.64000  0.2730000     0.3433000      0.3884000 
1 1 1 16 28 3  o 14.70000  0.1565000     14.55000  0.2202000     14.85000  0.2223000     -0.2981000     0.3129000 
1 1 1 16 28 4  o 13.80000  0.1537000     13.49000  0.2148000     14.11000  0.2198000     -0.6253000     0.3073000 
1 1 1 16 28 5  o 1.887000  0.3872000     2.075000  0.5339000     1.698000  0.5610000     0.3769000      0.7744000 
1 1 1 16 28 6  o 15.24000  0.1736000     15.53000  0.2622000     14.94000  0.2276000     0.5890000      0.3472000 
1 1 1 16 28 7  f 6.874000  0.1692000     6.896000  0.2394000     6.852000  0.2391000     0.4341000E-01  0.3383000 
1 1 1 16 28 8  o 7.342000  0.1704000     7.171000  0.2422000     7.513000  0.2398000     -0.3413000     0.3408000 
1 1 1 16 28 9  o 8.077000  0.2134000     8.341000  0.3438000     7.814000  0.2530000     0.5260000      0.4268000 
1 1 1 16 28 10 o 11.61000  0.1701000     11.72000  0.2396000     11.49000  0.2414000     0.2257000      0.3401000 
1 1 1 16 28 11 o 5.881000  0.2974000     5.944000  0.3221000     5.819000  0.5001000     0.1256000      0.5948000 
1 1 1 16 28 12 o 7.967000  0.1985000     8.216000  0.2712000     7.717000  0.2900000     0.4988000      0.3971000 
1 1 1 16 28 13 o 12.87000  0.1842000     12.93000  0.2588000     12.81000  0.2622000     0.1179000      0.3684000 
1 1 1 16 28 14 o 4.665000  0.2975000     4.662000  0.4197000     4.668000  0.4217000     -0.5881000E-02 0.5949000 
1 1 1 16 28 15 o 5.441000  0.3019000     5.660000  0.4639000     5.221000  0.3866000     0.4390000      0.6039000 
1 1 1 16 28 16 o 3.384000  0.5836000     4.130000  0.5735000     2.639000  1.017000      1.490000       1.167000  
1 1 1 16 28 17 o 2.258000  0.5291000     1.823000  0.7348000     2.693000  0.7614000     -0.8697000     1.058000  
1 1 1 16 28 18 o 2.551000  0.5574000     2.326000  0.8548000     2.776000  0.7157000     -0.4501000     1.115000  
1 1 1 16 28 19 o 3.018000  0.4646000     2.470000  0.7323000     3.566000  0.5720000     -1.095000      0.9292000 
1 1 1 16 28 20 o 1.670000  0.4638000     1.194000  0.5612000     2.147000  0.7385000     -0.9529000     0.9276000 
1 1 1 16 28 21 o 1.442000  0.4549000     1.574000  0.6681000     1.309000  0.6176000     0.2649000      0.9098000 
1 1 1 16 28 22 o 1.946000  0.5077000     2.067000  0.7163000     1.826000  0.7197000     0.2413000      1.015000  
1 1 1 16 29 0  o 32.37000  0.3758000     32.37000  0.3758000     32.37000  0.3758000     -0.000000      0.000000  
1 1 1 16 29 1  o 9.704000  0.1440000     9.681000  0.2036000     9.727000  0.2037000     -0.4569000E-01 0.2880000 
1 1 1 16 29 2  o 8.514000  0.1460000     8.574000  0.2032000     8.454000  0.2098000     0.1194000      0.2921000 
1 1 1 16 29 3  o 8.197000  0.1492000     8.351000  0.2095000     8.044000  0.2124000     0.3069000      0.2983000 
1 1 1 16 29 4  o 7.628000  0.1522000     7.692000  0.2158000     7.565000  0.2148000     0.1266000      0.3045000 
1 1 1 16 29 5  o 4.881000  0.1924000     4.713000  0.2802000     5.049000  0.2637000     -0.3359000     0.3847000 
1 1 1 16 29 6  o 9.424000  0.1527000     9.266000  0.2167000     9.583000  0.2153000     -0.3167000     0.3054000 
1 1 1 16 29 7  f 15.17000  0.1657000     15.03000  0.2331000     15.31000  0.2357000     -0.2813000     0.3315000 
1 1 1 16 29 8  o 3.048000  0.3335000     2.687000  0.5216000     3.408000  0.4157000     -0.7213000     0.6669000 
1 1 1 16 29 9  o 10.33000  0.2302000     10.17000  0.3358000     10.49000  0.3151000     -0.3210000     0.4605000 
1 1 1 16 29 10 o 7.107000  0.2062000     7.336000  0.2652000     6.877000  0.3159000     0.4588000      0.4125000 
1 1 1 16 29 11 o 2.943000  0.4705000     3.193000  0.6737000     2.693000  0.6570000     0.4996000      0.9410000 
1 1 1 16 29 12 o 4.269000  0.3063000     4.185000  0.4487000     4.353000  0.4170000     -0.1686000     0.6125000 
1 1 1 16 29 13 o 10.27000  0.1892000     10.25000  0.2642000     10.29000  0.2709000     -0.4789000E-01 0.3784000 
1 1 1 16 29 14 o 3.849000  0.3737000     4.435000  0.4281000     3.263000  0.6128000     1.173000       0.7475000 
1 1 1 16 29 15 o 1.559000  0.4648000     1.360000  0.6095000     1.758000  0.7020000     -0.3976000     0.9296000 
1 1 1 16 29 16 o 3.618000  0.5182000     3.003000  0.8174000     4.233000  0.6371000     -1.230000      1.036000  
1 1 1 16 29 17 o 2.270000  0.5382000     2.623000  0.7555000     1.917000  0.7668000     0.7060000      1.076000  
1 1 1 16 29 18 o 2.016000  0.5137000     2.050000  0.7216000     1.983000  0.7315000     0.6688000E-01  1.027000  
1 1 1 16 29 19 o 3.053000  0.4795000     3.020000  0.6941000     3.086000  0.6617000     -0.6593000E-01 0.9590000 
1 1 1 16 29 20 o 1.081000  0.3690000     1.139000  0.5399000     1.024000  0.5030000     0.1147000      0.7379000 
1 1 1 16 29 21 f 1.391000  0.4775000     1.113000  0.5411000     1.669000  0.7869000     -0.5563000     0.9550000 
1 1 1 16 29 22 o 2.436000  0.4939000     2.073000  0.7188000     2.798000  0.6775000     -0.7245000     0.9878000 
1 1 1 16 30 0  o 11.83000  0.2090000     11.83000  0.2090000     11.83000  0.2090000     -0.000000      0.000000  
1 1 1 16 30 1  o 10.53000  0.1457000     10.68000  0.2069000     10.38000  0.2053000     0.3001000      0.2915000 
1 1 1 16 30 2  o 10.71000  0.1459000     10.60000  0.2067000     10.81000  0.2058000     -0.2136000     0.2917000 
1 1 1 16 30 3  o 15.31000  0.1604000     15.54000  0.2286000     15.07000  0.2252000     0.4621000      0.3209000 
1 1 1 16 30 4  f 14.14000  0.1570000     14.22000  0.2230000     14.06000  0.2211000     0.1541000      0.3140000 
1 1 1 16 30 5  o 11.06000  0.1511000     10.71000  0.2132000     11.41000  0.2142000     -0.7055000     0.3022000 
1 1 1 16 30 6  o 6.235000  0.1759000     6.217000  0.2501000     6.254000  0.2475000     -0.3725000E-01 0.3519000 
1 1 1 16 30 7  o 2.945000  0.3262000     2.991000  0.4463000     2.898000  0.4759000     0.9267000E-01  0.6524000 
1 1 1 16 30 8  o 8.526000  0.2096000     8.515000  0.3409000     8.536000  0.2439000     -0.2094000E-01 0.4191000 
1 1 1 16 30 9  o 2.397000  0.4341000     2.688000  0.5651000     2.105000  0.6590000     0.5826000      0.8682000 
1 1 1 16 30 10 o 1.835000  0.4729000     2.249000  0.6698000     1.421000  0.6677000     0.8284000      0.9457000 
1 1 1 16 30 11 o 4.298000  0.2949000     4.435000  0.3926000     4.160000  0.4402000     0.2742000      0.5898000 
1 1 1 16 30 12 o 1.836000  0.4751000     2.096000  0.6872000     1.576000  0.6563000     0.5194000      0.9502000 
1 1 1 16 30 13 o 3.795000  0.3656000     3.238000  0.5729000     4.351000  0.4544000     -1.114000      0.7312000 
1 1 1 16 30 14 o 2.074000  0.4597000     2.708000  0.6595000     1.440000  0.6405000     1.267000       0.9193000 
1 1 1 16 30 15 o 3.354000  0.4844000     3.226000  0.7855000     3.482000  0.5670000     -0.2558000     0.9688000 
1 1 1 16 30 16 o 2.217000  0.5230000     1.951000  0.7939000     2.483000  0.6812000     -0.5320000     1.046000  
1 1 1 16 30 17 o 3.154000  0.6212000     2.579000  1.092000      3.730000  0.5933000     -1.151000      1.242000  
1 1 1 16 30 18 o 2.262000  0.5028000     1.788000  0.7021000     2.737000  0.7198000     -0.9489000     1.006000  
1 1 1 16 30 19 o 1.239000  0.4067000     1.277000  0.5884000     1.200000  0.5617000     0.7639000E-01  0.8134000 
1 1 1 16 30 20 o 1.561000  0.4420000     1.083000  0.5227000     2.038000  0.7128000     -0.9558000     0.8840000 
1 1 1 16 30 21 o 1.353000  0.4481000     1.395000  0.6226000     1.312000  0.6445000     0.8242000E-01  0.8961000 
1 1 1 16 30 22 o 1.462000  0.4548000     1.280000  0.5920000     1.644000  0.6907000     -0.3636000     0.9096000 
1 1 1 16 31 0  o 2.619000  0.4784000     2.619000  0.4784000     2.619000  0.4784000     0.000000       0.000000  
1 1 1 16 31 1  o 2.839000  0.2910000     2.909000  0.4004000     2.768000  0.4223000     0.1413000      0.5819000 
1 1 1 16 31 2  o 6.606000  0.1620000     6.351000  0.2337000     6.861000  0.2245000     -0.5104000     0.3240000 
1 1 1 16 31 3  f 9.518000  0.1489000     9.460000  0.2104000     9.576000  0.2108000     -0.1157000     0.2979000 
1 1 1 16 31 4  o 4.409000  0.2118000     4.528000  0.2936000     4.290000  0.3053000     0.2375000      0.4236000 
1 1 1 16 31 5  o 8.510000  0.1567000     8.681000  0.2197000     8.339000  0.2235000     0.3411000      0.3134000 
1 1 1 16 31 6  o 6.783000  0.1763000     7.017000  0.2462000     6.549000  0.2524000     0.4679000      0.3526000 
1 1 1 16 31 7  o 6.671000  0.2030000     6.550000  0.3151000     6.791000  0.2560000     -0.2415000     0.4060000 
1 1 1 16 31 8  o 16.75000  0.2173000     16.58000  0.2545000     16.91000  0.3522000     -0.3314000     0.4345000 
1 1 1 16 31 9  o 10.71000  0.2233000     10.43000  0.2458000     10.99000  0.3728000     -0.5601000     0.4466000 
1 1 1 16 31 10 o 4.163000  0.3395000     4.274000  0.5236000     4.051000  0.4322000     0.2225000      0.6789000 
1 1 1 16 31 11 f 3.718000  0.3565000     4.262000  0.4126000     3.175000  0.5815000     1.087000       0.7130000 
1 1 1 16 31 12 o 5.462000  0.2514000     5.382000  0.3496000     5.543000  0.3613000     -0.1609000     0.5027000 
1 1 1 16 31 13 o 5.391000  0.2646000     5.483000  0.3679000     5.300000  0.3804000     0.1828000      0.5292000 
1 1 1 16 31 14 o 6.478000  0.2383000     6.588000  0.3234000     6.369000  0.3501000     0.2192000      0.4766000 
1 1 1 16 31 15 o 2.517000  0.5660000     2.214000  0.7694000     2.819000  0.8305000     -0.6055000     1.132000  
1 1 1 16 31 16 o 1.978000  0.4996000     2.003000  0.7162000     1.954000  0.6966000     0.4934000E-01  0.9991000 
1 1 1 16 31 17 o 1.782000  0.5128000     1.533000  0.7031000     2.030000  0.7466000     -0.4973000     1.026000  
1 1 1 16 31 18 o 1.813000  0.4999000     1.941000  0.7166000     1.685000  0.6972000     0.2558000      0.9998000 
1 1 1 16 31 19 o 1.466000  0.4468000     1.371000  0.6106000     1.561000  0.6524000     -0.1903000     0.8935000 
1 1 1 16 31 20 o 2.082000  0.4623000     2.779000  0.6814000     1.384000  0.6249000     1.395000       0.9246000 
1 1 1 16 31 21 o 1.179000  0.3972000     1.160000  0.5522000     1.198000  0.5710000     -0.3762000E-01 0.7943000 
1 1 1 16 31 22 o 1.174000  0.3977000     0.9639000 0.4785000     1.384000  0.6352000     -0.4204000     0.7953000 
1 1 1 16 32 0  o 6.342000  0.2360000     6.342000  0.2360000     6.342000  0.2360000     -0.000000      0.000000  
1 1 1 16 32 1  o 11.55000  0.1502000     11.73000  0.2140000     11.37000  0.2109000     0.3546000      0.3005000 
1 1 1 16 32 2  o 7.291000  0.1604000     7.457000  0.2240000     7.125000  0.2295000     0.3321000      0.3207000 
1 1 1 16 32 3  o 11.36000  0.1516000     11.44000  0.2148000     11.27000  0.2140000     0.1738000      0.3032000 
1 1 1 16 32 4  o 5.911000  0.1992000     6.043000  0.2533000     5.780000  0.3075000     0.2638000      0.3984000 
1 1 1 16 32 5  o 7.242000  0.1708000     7.302000  0.2412000     7.181000  0.2420000     0.1213000      0.3417000 
1 1 1 16 32 6  o 7.690000  0.1692000     7.885000  0.2376000     7.496000  0.2410000     0.3885000      0.3385000 
1 1 1 16 32 7  o 5.945000  0.2576000     5.738000  0.4050000     6.152000  0.3184000     -0.4140000     0.5152000 
1 1 1 16 32 8  o 5.660000  0.2271000     5.739000  0.2992000     5.582000  0.3417000     0.1570000      0.4542000 
1 1 1 16 32 9  o 14.90000  0.2335000     15.09000  0.3591000     14.70000  0.2985000     0.3945000      0.4670000 
1 1 1 16 32 10 o 1.850000  0.4441000     2.404000  0.6663000     1.297000  0.5873000     1.107000       0.8882000 
1 1 1 16 32 11 o 6.227000  0.2319000     6.077000  0.3292000     6.378000  0.3268000     -0.3009000     0.4638000 
1 1 1 16 32 12 o 5.928000  0.2470000     6.092000  0.3332000     5.765000  0.3649000     0.3267000      0.4941000 
1 1 1 16 32 13 o 2.495000  0.4943000     2.363000  0.6959000     2.627000  0.7020000     -0.2638000     0.9885000 
1 1 1 16 32 14 o 1.798000  0.4961000     1.812000  0.6974000     1.783000  0.7059000     0.2941000E-01  0.9923000 
1 1 1 16 32 15 o 2.231000  0.5216000     2.088000  0.7178000     2.375000  0.7569000     -0.2868000     1.043000  
1 1 1 16 32 16 o 2.956000  0.5555000     2.770000  0.6963000     3.142000  0.8656000     -0.3717000     1.111000  
1 1 1 16 32 17 o 2.069000  0.5213000     2.091000  0.7962000     2.047000  0.6730000     0.4410000E-01  1.043000  
1 1 1 16 32 18 o 1.420000  0.4459000     1.454000  0.6407000     1.387000  0.6202000     0.6750000E-01  0.8917000 
1 1 1 16 32 19 o 2.129000  0.5126000     2.039000  0.7135000     2.220000  0.7363000     -0.1810000     1.025000  
1 1 1 16 32 20 o 1.631000  0.4695000     1.906000  0.7097000     1.357000  0.6150000     0.5492000      0.9391000 
1 1 1 16 32 21 o 1.309000  0.4252000     1.444000  0.6383000     1.174000  0.5620000     0.2701000      0.8505000 
1 1 1 16 32 22 o 1.659000  0.5621000     1.375000  0.6637000     1.944000  0.9075000     -0.5687000     1.124000  
1 1 1 16 33 0  o 11.04000  0.2159000     11.04000  0.2159000     11.04000  0.2159000     0.000000       0.000000  
1 1 1 16 33 1  o 1.981000  0.3980000     1.868000  0.5798000     2.095000  0.5455000     -0.2272000     0.7960000 
1 1 1 16 33 2  o 5.193000  0.1922000     5.116000  0.2730000     5.270000  0.2708000     -0.1538000     0.3845000 
1 1 1 16 33 3  o 6.020000  0.1824000     5.873000  0.2606000     6.168000  0.2552000     -0.2945000     0.3647000 
1 1 1 16 33 4  o 3.834000  0.2535000     3.823000  0.3615000     3.845000  0.3554000     -0.2262000E-01 0.5070000 
1 1 1 16 33 5  o 9.738000  0.1611000     9.989000  0.2250000     9.487000  0.2305000     0.5025000      0.3221000 
1 1 1 16 33 6  o 14.09000  0.2186000     13.83000  0.3380000     14.35000  0.2773000     -0.5112000     0.4372000 
1 1 1 16 33 7  o 3.193000  0.3573000     2.485000  0.5705000     3.901000  0.4304000     -1.416000      0.7146000 
1 1 1 16 33 8  o 3.920000  0.3770000     4.549000  0.3896000     3.291000  0.6456000     1.258000       0.7540000 
1 1 1 16 33 9  o 6.952000  0.2030000     6.929000  0.2903000     6.976000  0.2837000     -0.4689000E-01 0.4060000 
1 1 1 16 33 10 o 6.430000  0.2187000     6.433000  0.3112000     6.427000  0.3074000     0.6398000E-02  0.4374000 
1 1 1 16 33 11 o 10.42000  0.1870000     10.37000  0.2650000     10.48000  0.2640000     -0.1143000     0.3741000 
1 1 1 16 33 12 o 5.336000  0.2671000     5.466000  0.3610000     5.205000  0.3936000     0.2606000      0.5341000 
1 1 1 16 33 13 o 1.744000  0.4419000     2.379000  0.7022000     1.110000  0.5367000     1.268000       0.8838000 
1 1 1 16 33 14 o 6.957000  0.2922000     6.645000  0.4818000     7.269000  0.3308000     -0.6237000     0.5845000 
1 1 1 16 33 15 f 5.002000  0.2930000     4.937000  0.4179000     5.067000  0.4107000     -0.1298000     0.5860000 
1 1 1 16 33 16 o 4.462000  0.4285000     4.455000  0.6472000     4.469000  0.5619000     -0.1410000E-01 0.8570000 
1 1 1 16 33 17 o 2.358000  0.5171000     2.354000  0.8041000     2.361000  0.6505000     -0.7507000E-02 1.034000  
1 1 1 16 33 18 o 1.508000  0.4592000     1.389000  0.6199000     1.628000  0.6776000     -0.2384000     0.9184000 
1 1 1 16 33 19 o 1.985000  0.4909000     1.627000  0.6675000     2.343000  0.7199000     -0.7160000     0.9817000 
1 1 1 16 33 20 o 1.554000  0.5034000     1.418000  0.6398000     1.690000  0.7773000     -0.2718000     1.007000  
1 1 1 16 33 21 o 1.908000  0.4886000     1.491000  0.6492000     2.325000  0.7303000     -0.8332000     0.9771000 
1 1 1 16 34 0  o 8.953000  0.2224000     8.953000  0.2224000     8.953000  0.2224000     -0.000000      0.000000  
1 1 1 16 34 1  o 13.44000  0.1602000     13.53000  0.2279000     13.34000  0.2252000     0.1929000      0.3204000 
1 1 1 16 34 2  o 12.59000  0.1589000     12.42000  0.2240000     12.76000  0.2254000     -0.3419000     0.3178000 
1 1 1 16 34 3  o 21.65000  0.2004000     21.64000  0.2833000     21.65000  0.2834000     -0.1221000E-01 0.4008000 
1 1 1 16 34 4  o 5.690000  0.1994000     5.408000  0.2877000     5.972000  0.2763000     -0.5645000     0.3989000 
1 1 1 16 34 5  o 4.149000  0.3222000     3.726000  0.5476000     4.571000  0.3395000     -0.8454000     0.6443000 
1 1 1 16 34 6  o 6.942000  0.2810000     7.000000  0.2628000     6.883000  0.4968000     0.1172000      0.5620000 
1 1 1 16 34 7  o 2.551000  0.4566000     3.253000  0.5147000     1.849000  0.7544000     1.404000       0.9132000 
1 1 1 16 34 8  o 3.905000  0.3293000     3.964000  0.5007000     3.846000  0.4278000     0.1174000      0.6586000 
1 1 1 16 34 9  o 1.808000  0.4595000     1.525000  0.6214000     2.091000  0.6770000     -0.5663000     0.9190000 
1 1 1 16 34 10 o 4.354000  0.3074000     4.017000  0.4646000     4.691000  0.4028000     -0.6747000     0.6149000 
1 1 1 16 34 11 o 2.079000  0.4805000     2.390000  0.6723000     1.769000  0.6867000     0.6208000      0.9611000 
1 1 1 16 34 12 o 2.864000  0.4636000     2.996000  0.6132000     2.732000  0.6955000     0.2640000      0.9272000 
1 1 1 16 34 13 f 6.081000  0.2570000     6.277000  0.3502000     5.885000  0.3762000     0.3919000      0.5139000 
1 1 1 16 34 14 o 2.047000  0.5459000     1.991000  0.7147000     2.102000  0.8253000     -0.1109000     1.092000  
1 1 1 16 34 15 o 5.443000  0.2915000     5.180000  0.4006000     5.707000  0.4237000     -0.5270000     0.5831000 
1 1 1 16 34 16 o 5.364000  0.3160000     5.178000  0.5071000     5.550000  0.3770000     -0.3718000     0.6319000 
1 1 1 16 34 17 o 2.650000  0.4204000     1.674000  0.6648000     3.626000  0.5146000     -1.951000      0.8407000 
1 1 1 16 34 18 o 1.249000  0.4142000     1.554000  0.6882000     0.9436000 0.4613000     0.6099000      0.8285000 
1 1 1 16 34 19 o 3.563000  0.4120000     2.579000  0.6863000     4.548000  0.4562000     -1.969000      0.8241000 
1 1 1 16 34 20 o 1.449000  0.4763000     1.279000  0.5890000     1.618000  0.7487000     -0.3396000     0.9526000 
1 1 1 16 34 21 o 1.244000  0.4093000     1.496000  0.6517000     0.9918000 0.4954000     0.5040000      0.8186000 
1 1 1 16 35 0  o 10.66000  0.2247000     10.66000  0.2247000     10.66000  0.2247000     0.000000       0.000000  
1 1 1 16 35 1  o 9.453000  0.1600000     9.321000  0.2266000     9.584000  0.2260000     -0.2630000     0.3200000 
1 1 1 16 35 2  o 19.31000  0.1878000     19.26000  0.2653000     19.35000  0.2660000     -0.8236000E-01 0.3757000 
1 1 1 16 35 3  o 17.29000  0.1958000     17.28000  0.2956000     17.29000  0.2569000     -0.9058000E-02 0.3916000 
1 1 1 16 35 4  o 3.729000  0.3664000     3.469000  0.6027000     3.989000  0.4168000     -0.5202000     0.7328000 
1 1 1 16 35 5  o 3.300000  0.4408000     2.642000  0.5611000     3.958000  0.6799000     -1.317000      0.8815000 
1 1 1 16 35 6  o 1.626000  0.4719000     1.715000  0.6508000     1.537000  0.6836000     0.1779000      0.9439000 
1 1 1 16 35 7  o 8.131000  0.2032000     8.198000  0.3103000     8.064000  0.2623000     0.1337000      0.4064000 
1 1 1 16 35 8  o 10.95000  0.1744000     10.54000  0.2449000     11.36000  0.2483000     -0.8209000     0.3487000 
1 1 1 16 35 9  o 7.416000  0.2033000     7.482000  0.2836000     7.350000  0.2915000     0.1320000      0.4067000 
1 1 1 16 35 10 o 5.834000  0.2425000     5.973000  0.3335000     5.695000  0.3522000     0.2775000      0.4850000 
1 1 1 16 35 11 f 2.033000  0.4965000     2.037000  0.6995000     2.029000  0.7048000     0.7964000E-02  0.9930000 
1 1 1 16 35 12 o 3.726000  0.3631000     3.546000  0.5370000     3.906000  0.4890000     -0.3596000     0.7263000 
1 1 1 16 35 13 o 2.079000  0.5481000     2.298000  0.8371000     1.860000  0.7077000     0.4374000      1.096000  
1 1 1 16 35 14 o 2.061000  0.5074000     1.970000  0.7129000     2.151000  0.7223000     -0.1815000     1.015000  
1 1 1 16 35 15 o 3.190000  0.5463000     2.793000  0.7108000     3.586000  0.8298000     -0.7933000     1.093000  
1 1 1 16 35 16 o 1.678000  0.4768000     1.514000  0.6428000     1.841000  0.7042000     -0.3267000     0.9535000 
1 1 1 16 35 17 o 1.629000  0.4564000     1.756000  0.6630000     1.503000  0.6273000     0.2534000      0.9127000 
1 1 1 16 35 18 o 1.862000  0.4913000     1.876000  0.7373000     1.847000  0.6496000     0.2926000E-01  0.9826000 
1 1 1 16 35 19 o 1.812000  0.4777000     1.340000  0.6065000     2.283000  0.7383000     -0.9428000     0.9554000 
1 1 1 16 35 20 o 2.291000  0.5153000     2.293000  0.7166000     2.289000  0.7406000     0.3773000E-02  1.031000  
1 1 1 16 35 21 o 1.424000  0.4436000     1.070000  0.5231000     1.778000  0.7167000     -0.7081000     0.8873000 
1 1 1 16 36 0  o 12.50000  0.2310000     12.50000  0.2310000     12.50000  0.2310000     -0.000000      0.000000  
1 1 1 16 36 1  o 7.614000  0.1895000     7.686000  0.2879000     7.543000  0.2465000     0.1436000      0.3790000 
1 1 1 16 36 2  o 7.513000  0.2167000     7.599000  0.3546000     7.427000  0.2493000     0.1717000      0.4335000 
1 1 1 16 36 3  o 8.499000  0.2465000     8.556000  0.3488000     8.441000  0.3482000     0.1146000      0.4929000 
1 1 1 16 36 4  o 16.38000  0.2991000     16.66000  0.2556000     16.10000  0.5408000     0.5594000      0.5981000 
1 1 1 16 36 5  o 10.27000  0.2214000     10.17000  0.3342000     10.38000  0.2906000     -0.2153000     0.4429000 
1 1 1 16 36 6  o 8.286000  0.2006000     8.234000  0.3095000     8.339000  0.2554000     -0.1055000     0.4013000 
1 1 1 16 36 7  o 2.658000  0.3989000     3.589000  0.4583000     1.727000  0.6530000     1.862000       0.7978000 
1 1 1 16 36 8  o 2.692000  0.4315000     3.030000  0.5577000     2.355000  0.6587000     0.6757000      0.8631000 
1 1 1 16 36 9  o 6.881000  0.2133000     6.831000  0.2983000     6.931000  0.3050000     -0.9939000E-01 0.4267000 
1 1 1 16 36 10 o 8.652000  0.1955000     8.285000  0.2800000     9.018000  0.2729000     -0.7337000     0.3910000 
1 1 1 16 36 11 o 4.654000  0.2976000     4.530000  0.4334000     4.778000  0.4081000     -0.2480000     0.5953000 
1 1 1 16 36 12 o 1.800000  0.4812000     2.032000  0.7010000     1.567000  0.6594000     0.4651000      0.9624000 
1 1 1 16 36 13 o 4.389000  0.4122000     4.467000  0.5038000     4.310000  0.6525000     0.1566000      0.8244000 
1 1 1 16 36 14 o 1.176000  0.3945000     1.199000  0.5647000     1.152000  0.5509000     0.4655000E-01  0.7889000 
1 1 1 16 36 15 o 5.891000  0.3259000     5.823000  0.5383000     5.958000  0.3677000     -0.1353000     0.6518000 
1 1 1 16 36 16 o 3.469000  0.3915000     4.047000  0.4563000     2.892000  0.6364000     1.156000       0.7830000 
1 1 1 16 36 17 o 1.861000  0.4807000     1.926000  0.6881000     1.795000  0.6714000     0.1315000      0.9613000 
1 1 1 16 36 18 o 1.834000  0.4759000     1.795000  0.6786000     1.872000  0.6675000     -0.7711000E-01 0.9519000 
1 1 1 16 36 19 o 1.759000  0.5167000     2.049000  0.7911000     1.470000  0.6650000     0.5790000      1.033000  
1 1 1 16 36 20 o 1.434000  0.4460000     1.397000  0.6253000     1.471000  0.6362000     -0.7379000E-01 0.8921000 
1 1 1 16 37 0  o 1.255000  0.8312000     1.255000  0.8312000     1.255000  0.8312000     0.000000       0.000000  
1 1 1 16 37 1  o 3.020000  0.5719000     2.381000  0.7289000     3.660000  0.8814000     -1.279000      1.144000  
1 1 1 16 37 2  o 8.215000  0.3330000     8.215000  0.3330000     ?         ?             ?              ?         
1 1 1 16 37 3  o 8.901000  0.2412000     9.049000  0.3319000     8.754000  0.3501000     0.2949000      0.4824000 
1 1 1 16 37 4  o 11.76000  0.2037000     11.75000  0.3293000     11.77000  0.2400000     -0.2322000E-01 0.4075000 
1 1 1 16 37 5  o 7.309000  0.2090000     7.243000  0.3178000     7.374000  0.2716000     -0.1308000     0.4180000 
1 1 1 16 37 6  o 1.662000  0.4346000     1.258000  0.5654000     2.066000  0.6602000     -0.8073000     0.8693000 
1 1 1 16 37 7  o 7.189000  0.2001000     7.213000  0.2799000     7.164000  0.2859000     0.4972000E-01  0.4001000 
1 1 1 16 37 8  o 8.521000  0.1880000     8.649000  0.2596000     8.393000  0.2719000     0.2562000      0.3760000 
1 1 1 16 37 9  o 6.785000  0.2154000     6.606000  0.3075000     6.964000  0.3016000     -0.3586000     0.4308000 
1 1 1 16 37 10 o 4.435000  0.3046000     4.095000  0.4606000     4.776000  0.3987000     -0.6807000     0.6092000 
1 1 1 16 37 11 o 4.041000  0.3373000     3.865000  0.4990000     4.217000  0.4540000     -0.3527000     0.6746000 
1 1 1 16 37 12 f 1.745000  0.5036000     2.044000  0.7804000     1.446000  0.6366000     0.5989000      1.007000  
1 1 1 16 37 13 o 4.744000  0.3091000     4.339000  0.4492000     5.150000  0.4247000     -0.8119000     0.6182000 
1 1 1 16 37 14 o 2.133000  0.5127000     2.706000  0.7312000     1.560000  0.7188000     1.146000       1.025000  
1 1 1 16 37 15 o 1.876000  0.4846000     2.244000  0.7159000     1.508000  0.6533000     0.7357000      0.9692000 
1 1 1 16 37 16 o 2.347000  0.4854000     2.040000  0.7009000     2.655000  0.6719000     -0.6147000     0.9709000 
1 1 1 16 37 17 o 1.355000  0.4221000     1.567000  0.6491000     1.143000  0.5397000     0.4239000      0.8442000 
1 1 1 16 37 18 o 1.844000  0.4666000     2.135000  0.6763000     1.552000  0.6429000     0.5834000      0.9331000 
1 1 1 16 37 19 o 2.817000  0.5221000     3.773000  0.7062000     1.861000  0.7692000     1.912000       1.044000  
1 1 1 16 37 20 o 1.545000  0.4522000     1.889000  0.7025000     1.201000  0.5697000     0.6882000      0.9045000 
1 1 1 16 38 0  o 4.926000  0.3837000     4.926000  0.3837000     4.926000  0.3837000     -0.000000      0.000000  
1 1 1 16 38 1  o 9.769000  0.1964000     9.737000  0.2794000     9.801000  0.2762000     -0.6350000E-01 0.3929000 
1 1 1 16 38 2  o 3.242000  0.3660000     3.473000  0.5189000     3.011000  0.5163000     0.4623000      0.7320000 
1 1 1 16 38 3  f 8.722000  0.1769000     8.718000  0.2507000     8.725000  0.2496000     -0.7124000E-02 0.3538000 
1 1 1 16 38 4  o 9.509000  0.1748000     9.489000  0.2458000     9.529000  0.2486000     -0.4002000E-01 0.3496000 
1 1 1 16 38 5  o 9.094000  0.1791000     9.079000  0.2536000     9.109000  0.2531000     -0.3007000E-01 0.3583000 
1 1 1 16 38 6  o 7.054000  0.2020000     7.178000  0.2785000     6.931000  0.2925000     0.2472000      0.4039000 
1 1 1 16 38 7  o 8.218000  0.1898000     8.067000  0.2712000     8.369000  0.2657000     -0.3018000     0.3797000 
1 1 1 16 38 8  o 4.411000  0.2976000     4.034000  0.4584000     4.788000  0.3798000     -0.7536000     0.5953000 
1 1 1 16 38 9  o 5.383000  0.2587000     5.599000  0.3556000     5.167000  0.3758000     0.4317000      0.5174000 
1 1 1 16 38 10 o 7.794000  0.2129000     7.999000  0.3006000     7.589000  0.3014000     0.4106000      0.4257000 
1 1 1 16 38 11 o 3.580000  0.3734000     3.623000  0.5260000     3.537000  0.5302000     0.8523000E-01  0.7469000 
1 1 1 16 38 12 o 2.057000  0.5574000     2.553000  0.8610000     1.561000  0.7081000     0.9918000      1.115000  
1 1 1 16 38 13 o 1.698000  0.4718000     2.041000  0.7158000     1.355000  0.6148000     0.6857000      0.9436000 
1 1 1 16 38 14 o 1.895000  0.5318000     1.734000  0.7719000     2.056000  0.7316000     -0.3220000     1.064000  
1 1 1 16 38 15 o 1.923000  0.4826000     1.586000  0.6631000     2.260000  0.7014000     -0.6742000     0.9652000 
1 1 1 16 38 16 o 1.390000  0.4319000     1.195000  0.5609000     1.585000  0.6570000     -0.3893000     0.8639000 
1 1 1 16 38 17 o 3.675000  0.3542000     3.736000  0.4892000     3.614000  0.5124000     0.1210000      0.7085000 
1 1 1 16 38 18 o 1.720000  0.4640000     1.741000  0.6543000     1.699000  0.6580000     0.4196000E-01  0.9280000 
1 1 1 16 38 19 o 1.348000  0.4288000     1.274000  0.6005000     1.422000  0.6123000     -0.1477000     0.8576000 
1 1 1 16 38 20 o 1.106000  0.3838000     0.9412000 0.4701000     1.271000  0.6068000     -0.3297000     0.7676000 
1 1 1 16 39 0  o 7.938000  0.2580000     7.938000  0.2580000     7.938000  0.2580000     0.000000       0.000000  
1 1 1 16 39 1  o 5.747000  0.2149000     5.942000  0.2970000     5.552000  0.3108000     0.3896000      0.4299000 
1 1 1 16 39 2  f 6.219000  0.2070000     6.375000  0.2834000     6.063000  0.3018000     0.3116000      0.4140000 
1 1 1 16 39 3  o 6.447000  0.2077000     6.696000  0.2866000     6.198000  0.3006000     0.4979000      0.4153000 
1 1 1 16 39 4  o 16.67000  0.1850000     16.95000  0.2626000     16.39000  0.2607000     0.5567000      0.3700000 
1 1 1 16 39 5  f 8.428000  0.1862000     8.668000  0.2576000     8.188000  0.2691000     0.4794000      0.3725000 
1 1 1 16 39 6  o 7.074000  0.2071000     6.940000  0.2936000     7.208000  0.2922000     -0.2675000     0.4142000 
1 1 1 16 39 7  o 13.77000  0.1803000     13.92000  0.2542000     13.63000  0.2559000     0.2818000      0.3607000 
1 1 1 16 39 8  o 7.877000  0.2027000     7.855000  0.2876000     7.899000  0.2856000     -0.4391000E-01 0.4053000 
1 1 1 16 39 9  f 6.770000  0.2219000     6.657000  0.3166000     6.883000  0.3111000     -0.2262000     0.4438000 
1 1 1 16 39 10 o 2.519000  0.4792000     2.112000  0.7144000     2.926000  0.6388000     -0.8143000     0.9583000 
1 1 1 16 39 11 o 8.114000  0.2644000     7.907000  0.4389000     8.320000  0.2950000     -0.4127000     0.5288000 
1 1 1 16 39 12 o 2.062000  0.4892000     2.564000  0.7012000     1.560000  0.6823000     1.003000       0.9784000 
1 1 1 16 39 13 o 1.635000  0.5000000     1.747000  0.7056000     1.522000  0.7086000     0.2248000      1.000000  
1 1 1 16 39 14 o 1.308000  0.4202000     1.529000  0.6543000     1.087000  0.5275000     0.4417000      0.8404000 
1 1 1 16 39 15 o 1.685000  0.4834000     1.609000  0.6728000     1.762000  0.6942000     -0.1537000     0.9668000 
1 1 1 16 39 16 o 3.024000  0.4483000     2.702000  0.6759000     3.345000  0.5891000     -0.6436000     0.8966000 
1 1 1 16 39 17 o 1.471000  0.4413000     1.388000  0.6054000     1.553000  0.6422000     -0.1650000     0.8826000 
1 1 1 16 39 18 o 1.818000  0.5069000     2.472000  0.8552000     1.164000  0.5445000     1.308000       1.014000  
1 1 1 16 39 19 o 1.900000  0.4800000     2.062000  0.6895000     1.737000  0.6681000     0.3257000      0.9601000 
1 1 1 16 39 20 o 1.039000  0.5341000     ?         ?             1.039000  0.5341000     ?              ?         
1 1 1 16 40 0  o 0.8071000 0.5573000     0.8071000 0.5573000     0.8071000 0.5573000     -0.000000      0.000000  
1 1 1 16 40 1  o 3.467000  0.3332000     3.497000  0.4575000     3.436000  0.4845000     0.6084000E-01  0.6663000 
1 1 1 16 40 2  o 10.38000  0.1735000     10.27000  0.2447000     10.49000  0.2461000     -0.2197000     0.3471000 
1 1 1 16 40 3  o 4.314000  0.2749000     4.352000  0.3883000     4.276000  0.3892000     0.7652000E-01  0.5498000 
1 1 1 16 40 4  o 3.851000  0.3137000     4.088000  0.4108000     3.614000  0.4742000     0.4737000      0.6274000 
1 1 1 16 40 5  o 3.629000  0.3484000     3.190000  0.5419000     4.068000  0.4381000     -0.8779000     0.6968000 
1 1 1 16 40 6  o 2.178000  0.4668000     2.336000  0.6512000     2.021000  0.6690000     0.3148000      0.9336000 
1 1 1 16 40 7  o 11.13000  0.1825000     11.42000  0.2574000     10.85000  0.2586000     0.5747000      0.3649000 
1 1 1 16 40 8  o 1.862000  0.4816000     2.074000  0.6954000     1.651000  0.6666000     0.4230000      0.9632000 
1 1 1 16 40 9  o 6.899000  0.2212000     6.650000  0.3135000     7.149000  0.3121000     -0.4991000     0.4424000 
1 1 1 16 40 10 o 4.247000  0.3200000     3.845000  0.4904000     4.649000  0.4111000     -0.8043000     0.6399000 
1 1 1 16 40 11 o 1.415000  0.4632000     1.297000  0.6046000     1.532000  0.7019000     -0.2354000     0.9264000 
1 1 1 16 40 12 o 2.463000  0.5229000     2.541000  0.6961000     2.385000  0.7804000     0.1557000      1.046000  
1 1 1 16 40 13 o 4.333000  0.4292000     4.056000  0.7350000     4.609000  0.4436000     -0.5526000     0.8584000 
1 1 1 16 40 14 f 1.825000  0.4813000     2.091000  0.7107000     1.559000  0.6492000     0.5322000      0.9625000 
1 1 1 16 40 15 f 1.797000  0.4685000     2.268000  0.7157000     1.326000  0.6048000     0.9420000      0.9370000 
1 1 1 16 40 16 o 1.774000  0.4790000     1.557000  0.6482000     1.990000  0.7055000     -0.4337000     0.9581000 
1 1 1 16 40 17 o 1.468000  0.4443000     1.540000  0.6388000     1.396000  0.6177000     0.1440000      0.8886000 
1 1 1 16 40 18 o 1.743000  0.4873000     2.027000  0.7131000     1.459000  0.6643000     0.5677000      0.9746000 
1 1 1 16 40 19 o 1.924000  0.4800000     1.662000  0.6654000     2.186000  0.6921000     -0.5246000     0.9601000 
1 1 1 16 41 0  o 8.828000  0.2603000     8.828000  0.2603000     8.828000  0.2603000     0.000000       0.000000  
1 1 1 16 41 1  o 10.48000  0.1771000     10.54000  0.2515000     10.42000  0.2493000     0.1271000      0.3541000 
1 1 1 16 41 2  o 16.18000  0.1833000     16.33000  0.2592000     16.04000  0.2593000     0.2947000      0.3667000 
1 1 1 16 41 3  o 15.52000  0.1820000     15.65000  0.2573000     15.40000  0.2573000     0.2533000      0.3639000 
1 1 1 16 41 4  o 1.686000  0.4526000     1.476000  0.6135000     1.897000  0.6657000     -0.4209000     0.9052000 
1 1 1 16 41 5  o 4.852000  0.2662000     4.638000  0.3861000     5.066000  0.3664000     -0.4286000     0.5323000 
1 1 1 16 41 6  f 11.01000  0.1830000     11.02000  0.2584000     11.00000  0.2592000     0.1820000E-01  0.3660000 
1 1 1 16 41 7  o 11.56000  0.1855000     11.70000  0.2634000     11.42000  0.2614000     0.2767000      0.3711000 
1 1 1 16 41 8  o 7.091000  0.2176000     6.956000  0.3090000     7.227000  0.3064000     -0.2705000     0.4352000 
1 1 1 16 41 9  o 2.039000  0.4978000     2.135000  0.6991000     1.943000  0.7088000     0.1926000      0.9956000 
1 1 1 16 41 10 o 2.948000  0.5290000     3.060000  0.8094000     2.837000  0.6813000     0.2236000      1.058000  
1 1 1 16 41 11 o 2.408000  0.5113000     2.266000  0.7181000     2.549000  0.7282000     -0.2827000     1.023000  
1 1 1 16 41 12 o 3.097000  0.4946000     3.710000  0.5723000     2.483000  0.8069000     1.227000       0.9892000 
1 1 1 16 41 13 o 3.478000  0.4043000     3.210000  0.6126000     3.747000  0.5277000     -0.5372000     0.8086000 
1 1 1 16 41 14 o 1.463000  0.4415000     1.799000  0.6997000     1.127000  0.5387000     0.6720000      0.8831000 
1 1 1 16 41 15 o 3.999000  0.3476000     4.196000  0.4721000     3.801000  0.5102000     0.3953000      0.6951000 
1 1 1 16 41 16 o 2.963000  0.4409000     2.648000  0.6697000     3.278000  0.5735000     -0.6306000     0.8817000 
1 1 1 16 41 17 o 1.250000  0.4168000     1.533000  0.6833000     0.9670000 0.4773000     0.5661000      0.8335000 
1 1 1 16 41 18 o 1.492000  0.4518000     1.549000  0.6462000     1.434000  0.6314000     0.1151000      0.9035000 
1 1 1 16 41 19 o 1.528000  0.4660000     1.800000  0.7007000     1.256000  0.6146000     0.5438000      0.9320000 
1 1 1 16 42 0  o 4.909000  0.3669000     4.909000  0.3669000     4.909000  0.3669000     -0.000000      0.000000  
1 1 1 16 42 1  o 2.685000  0.4312000     2.721000  0.6032000     2.650000  0.6164000     0.7092000E-01  0.8625000 
1 1 1 16 42 2  o 6.307000  0.2148000     6.348000  0.3035000     6.266000  0.3040000     0.8211000E-01  0.4296000 
1 1 1 16 42 3  o 2.295000  0.4546000     2.607000  0.6192000     1.982000  0.6659000     0.6250000      0.9093000 
1 1 1 16 42 4  o 3.497000  0.3480000     3.735000  0.4507000     3.259000  0.5304000     0.4761000      0.6960000 
1 1 1 16 42 5  o 6.735000  0.2167000     7.043000  0.2970000     6.428000  0.3157000     0.6156000      0.4334000 
1 1 1 16 42 6  o 4.612000  0.2954000     4.881000  0.3984000     4.343000  0.4364000     0.5380000      0.5909000 
1 1 1 16 42 7  o 6.686000  0.2276000     6.664000  0.3261000     6.708000  0.3177000     -0.4404000E-01 0.4553000 
1 1 1 16 42 8  o 3.484000  0.3939000     3.456000  0.5523000     3.512000  0.5617000     -0.5553000E-01 0.7878000 
1 1 1 16 42 9  o 2.341000  0.5322000     2.694000  0.7991000     1.988000  0.7031000     0.7063000      1.064000  
1 1 1 16 42 10 o 4.436000  0.3735000     4.732000  0.4126000     4.141000  0.6226000     0.5906000      0.7469000 
1 1 1 16 42 11 o 2.892000  0.5437000     3.048000  0.6549000     2.735000  0.8679000     0.3133000      1.087000  
1 1 1 16 42 12 o 1.457000  0.4631000     1.472000  0.6710000     1.442000  0.6384000     0.2999000E-01  0.9261000 
1 1 1 16 42 13 o 1.684000  0.4770000     1.798000  0.6904000     1.570000  0.6583000     0.2283000      0.9539000 
1 1 1 16 42 14 o 4.253000  0.3290000     3.967000  0.4902000     4.539000  0.4389000     -0.5728000     0.6580000 
1 1 1 16 42 15 o 1.245000  0.4001000     0.9652000 0.4762000     1.525000  0.6431000     -0.5595000     0.8002000 
1 1 1 16 42 16 o 1.677000  0.4647000     1.941000  0.6897000     1.412000  0.6231000     0.5288000      0.9295000 
1 1 1 16 42 17 o 2.690000  0.5729000     2.852000  0.8561000     2.527000  0.7617000     0.3248000      1.146000  
1 1 1 16 42 18 o 1.453000  0.4193000     0.9759000 0.4800000     1.931000  0.6876000     -0.9548000     0.8386000 
1 1 1 16 43 0  o 9.045000  0.2648000     9.045000  0.2648000     9.045000  0.2648000     0.000000       0.000000  
1 1 1 16 43 1  o 2.848000  0.4164000     3.327000  0.5120000     2.369000  0.6568000     0.9584000      0.8328000 
1 1 1 16 43 2  o 6.744000  0.2126000     6.916000  0.2920000     6.571000  0.3091000     0.3447000      0.4252000 
1 1 1 16 43 3  o 4.679000  0.2784000     4.784000  0.3821000     4.573000  0.4051000     0.2108000      0.5569000 
1 1 1 16 43 4  o 2.146000  0.4507000     1.603000  0.6490000     2.689000  0.6256000     -1.087000      0.9014000 
1 1 1 16 43 5  o 10.25000  0.1874000     10.05000  0.2662000     10.46000  0.2638000     -0.4051000     0.3748000 
1 1 1 16 43 6  o 5.824000  0.2465000     5.800000  0.3487000     5.848000  0.3484000     -0.4847000E-01 0.4929000 
1 1 1 16 43 7  o 1.796000  0.4862000     1.945000  0.7042000     1.647000  0.6705000     0.2971000      0.9724000 
1 1 1 16 43 8  o 5.680000  0.2812000     5.859000  0.4213000     5.501000  0.3726000     0.3579000      0.5624000 
1 1 1 16 43 9  o 1.572000  0.4802000     1.851000  0.7372000     1.293000  0.6156000     0.5584000      0.9604000 
1 1 1 16 43 10 o 2.062000  0.4858000     2.524000  0.6778000     1.600000  0.6961000     0.9243000      0.9716000 
1 1 1 16 43 11 o 2.418000  0.5516000     2.853000  0.8445000     1.982000  0.7100000     0.8713000      1.103000  
1 1 1 16 43 12 o 4.406000  0.3265000     4.515000  0.4494000     4.298000  0.4737000     0.2173000      0.6529000 
1 1 1 16 43 13 o 4.917000  0.3021000     4.834000  0.4309000     5.001000  0.4237000     -0.1663000     0.6043000 
1 1 1 16 43 14 o 1.551000  0.4625000     1.484000  0.6419000     1.619000  0.6661000     -0.1341000     0.9250000 
1 1 1 16 43 15 o 2.390000  0.4745000     2.080000  0.6863000     2.700000  0.6555000     -0.6198000     0.9490000 
1 1 1 16 43 16 o 2.127000  0.4991000     1.994000  0.7054000     2.259000  0.7062000     -0.2648000     0.9982000 
1 1 1 16 43 17 o 1.671000  0.4480000     2.145000  0.6819000     1.198000  0.5813000     0.9469000      0.8960000 
1 1 1 16 43 18 o 1.399000  0.4416000     1.242000  0.5688000     1.557000  0.6757000     -0.3156000     0.8832000 
1 1 1 16 44 0  o 6.264000  0.3843000     6.264000  0.3843000     6.264000  0.3843000     0.000000       0.000000  
1 1 1 16 44 1  o 6.090000  0.2315000     6.334000  0.3210000     5.846000  0.3337000     0.4884000      0.4630000 
1 1 1 16 44 2  o 4.496000  0.2945000     4.533000  0.4121000     4.458000  0.4208000     0.7555000E-01  0.5889000 
1 1 1 16 44 3  o 6.667000  0.2204000     6.820000  0.3045000     6.514000  0.3187000     0.3056000      0.4408000 
1 1 1 16 44 4  o 3.066000  0.4127000     3.050000  0.5929000     3.083000  0.5742000     -0.3237000E-01 0.8254000 
1 1 1 16 44 5  o 5.095000  0.2722000     5.288000  0.3745000     4.903000  0.3951000     0.3844000      0.5444000 
1 1 1 16 44 6  o 9.436000  0.1961000     9.364000  0.2763000     9.508000  0.2782000     -0.1440000     0.3921000 
1 1 1 16 44 7  o 6.835000  0.2285000     6.958000  0.3228000     6.712000  0.3234000     0.2465000      0.4569000 
1 1 1 16 44 8  o 6.651000  0.3144000     7.338000  0.4634000     5.963000  0.4252000     1.376000       0.6289000 
1 1 1 16 44 9  o 3.151000  0.4711000     2.981000  0.6548000     3.320000  0.6776000     -0.3390000     0.9423000 
1 1 1 16 44 10 o 1.931000  0.5241000     1.496000  0.6895000     2.366000  0.7895000     -0.8701000     1.048000  
1 1 1 16 44 11 o 2.364000  0.5000000     2.615000  0.6976000     2.113000  0.7164000     0.5027000      1.000000  
1 1 1 16 44 12 o 1.859000  0.4451000     2.485000  0.6818000     1.232000  0.5725000     1.252000       0.8903000 
1 1 1 16 44 13 o 5.384000  0.2726000     5.182000  0.3946000     5.586000  0.3762000     -0.4038000     0.5452000 
1 1 1 16 44 14 o 2.166000  0.4990000     2.161000  0.7062000     2.171000  0.7052000     -0.1046000E-01 0.9980000 
1 1 1 16 44 15 o 1.636000  0.4686000     1.613000  0.6592000     1.660000  0.6661000     -0.4673000E-01 0.9371000 
1 1 1 16 44 16 o 1.839000  0.5256000     2.075000  0.8180000     1.604000  0.6601000     0.4714000      1.051000  
1 1 1 16 44 17 o 1.369000  0.4326000     1.266000  0.5786000     1.472000  0.6432000     -0.2063000     0.8651000 
1 1 1 16 44 18 o 1.847000  0.5486000     2.000000  0.7804000     1.693000  0.7712000     0.3062000      1.097000  
1 1 1 16 45 0  o 11.42000  0.2624000     11.42000  0.2624000     11.42000  0.2624000     -0.000000      0.000000  
1 1 1 16 45 1  o 1.607000  0.4615000     1.534000  0.6360000     1.680000  0.6690000     -0.1462000     0.9230000 
1 1 1 16 45 2  o 4.383000  0.3047000     4.600000  0.4081000     4.167000  0.4526000     0.4337000      0.6094000 
1 1 1 16 45 3  o 6.275000  0.2327000     6.496000  0.3199000     6.054000  0.3380000     0.4424000      0.4654000 
1 1 1 16 45 4  o 4.215000  0.3112000     4.134000  0.4418000     4.297000  0.4383000     -0.1628000     0.6223000 
1 1 1 16 45 5  o 2.409000  0.4781000     2.541000  0.6555000     2.278000  0.6960000     0.2630000      0.9561000 
1 1 1 16 45 6  o 7.110000  0.2227000     6.925000  0.3195000     7.295000  0.3104000     -0.3701000     0.4454000 
1 1 1 16 45 7  o 5.194000  0.3632000     5.411000  0.5499000     4.977000  0.4745000     0.4343000      0.7263000 
1 1 1 16 45 8  o 9.165000  0.2374000     9.180000  0.2899000     9.149000  0.3760000     0.3122000E-01  0.4748000 
1 1 1 16 45 9  o 6.915000  0.3050000     6.799000  0.4703000     7.031000  0.3885000     -0.2315000     0.6101000 
1 1 1 16 45 10 o 2.340000  0.4253000     3.375000  0.6044000     1.305000  0.5986000     2.070000       0.8506000 
1 1 1 16 45 11 o 1.613000  0.4704000     1.453000  0.6360000     1.772000  0.6932000     -0.3187000     0.9408000 
1 1 1 16 45 12 o 3.139000  0.4239000     3.164000  0.5804000     3.114000  0.6181000     0.5000000E-01  0.8479000 
1 1 1 16 45 13 o 3.136000  0.4261000     3.410000  0.5483000     2.862000  0.6524000     0.5483000      0.8522000 
1 1 1 16 45 14 o 1.562000  0.4600000     1.756000  0.6871000     1.368000  0.6116000     0.3878000      0.9199000 
1 1 1 16 45 15 o 2.031000  0.4977000     1.932000  0.7029000     2.129000  0.7048000     -0.1968000     0.9954000 
1 1 1 16 45 16 o 1.636000  0.4540000     2.060000  0.6972000     1.213000  0.5818000     0.8476000      0.9081000 
1 1 1 16 45 17 o 1.460000  0.4474000     1.293000  0.5870000     1.626000  0.6754000     -0.3333000     0.8948000 
1 1 1 16 46 0  o 4.500000  0.4435000     4.500000  0.4435000     4.500000  0.4435000     0.000000       0.000000  
1 1 1 16 46 1  o 8.263000  0.2052000     8.567000  0.2826000     7.958000  0.2976000     0.6097000      0.4104000 
1 1 1 16 46 2  o 3.162000  0.4121000     3.543000  0.5242000     2.782000  0.6359000     0.7612000      0.8242000 
1 1 1 16 46 3  o 5.007000  0.2733000     5.359000  0.3627000     4.654000  0.4090000     0.7046000      0.5466000 
1 1 1 16 46 4  o 2.319000  0.4619000     1.804000  0.6787000     2.834000  0.6267000     -1.031000      0.9238000 
1 1 1 16 46 5  o 9.518000  0.2174000     9.248000  0.3333000     9.787000  0.2792000     -0.5385000     0.4348000 
1 1 1 16 46 6  f 8.004000  0.2792000     8.026000  0.4291000     7.983000  0.3575000     0.4329000E-01  0.5585000 
1 1 1 16 46 7  o 2.469000  0.5409000     2.443000  0.7030000     2.494000  0.8223000     -0.5170000E-01 1.082000  
1 1 1 16 46 8  o 2.245000  0.5561000     2.036000  0.8005000     2.454000  0.7722000     -0.4187000     1.112000  
1 1 1 16 46 9  f 3.414000  0.4451000     3.534000  0.6650000     3.295000  0.5919000     0.2389000      0.8903000 
1 1 1 16 46 10 o 2.098000  0.4827000     1.581000  0.6754000     2.614000  0.6898000     -1.034000      0.9654000 
1 1 1 16 46 11 o 2.000000  0.4445000     1.315000  0.5935000     2.685000  0.6619000     -1.369000      0.8890000 
1 1 1 16 46 12 o 1.722000  0.4821000     1.691000  0.6800000     1.753000  0.6836000     -0.6196000E-01 0.9642000 
1 1 1 16 46 13 o 3.358000  0.3912000     3.689000  0.5047000     3.026000  0.5978000     0.6632000      0.7823000 
1 1 1 16 46 14 o 2.067000  0.4971000     1.992000  0.6877000     2.142000  0.7181000     -0.1501000     0.9942000 
1 1 1 16 46 15 o 2.036000  0.5381000     2.028000  0.8099000     2.043000  0.7086000     -0.1553000E-01 1.076000  
1 1 1 16 46 16 o 1.180000  0.3928000     1.116000  0.5361000     1.244000  0.5742000     -0.1281000     0.7856000 
1 1 1 16 46 17 o 1.390000  0.4520000     1.341000  0.6053000     1.440000  0.6715000     -0.9901000E-01 0.9041000 
1 1 1 16 47 0  o 2.923000  0.6937000     2.923000  0.6937000     2.923000  0.6937000     0.000000       0.000000  
1 1 1 16 47 1  o 7.030000  0.2219000     6.840000  0.3161000     7.219000  0.3114000     -0.3783000     0.4437000 
1 1 1 16 47 2  o 2.221000  0.4683000     2.746000  0.6500000     1.696000  0.6743000     1.051000       0.9366000 
1 1 1 16 47 3  o 4.705000  0.2899000     4.735000  0.4138000     4.676000  0.4061000     0.5936000E-01  0.5798000 
1 1 1 16 47 4  o 3.156000  0.5064000     3.198000  0.8140000     3.114000  0.6027000     0.8435000E-01  1.013000  
1 1 1 16 47 5  o 1.694000  0.5197000     1.818000  0.7239000     1.570000  0.7457000     0.2483000      1.039000  
1 1 1 16 47 6  o 3.586000  0.5461000     4.478000  0.4862000     2.694000  0.9779000     1.784000       1.092000  
1 1 1 16 47 7  o 3.570000  0.4891000     3.468000  0.7483000     3.671000  0.6300000     -0.2033000     0.9782000 
1 1 1 16 47 8  o 2.757000  0.5134000     2.705000  0.7869000     2.810000  0.6597000     -0.1046000     1.027000  
1 1 1 16 47 9  o 6.042000  0.2571000     6.249000  0.3545000     5.835000  0.3724000     0.4144000      0.5141000 
1 1 1 16 47 10 o 1.939000  0.4969000     2.167000  0.7216000     1.711000  0.6834000     0.4566000      0.9939000 
1 1 1 16 47 11 o 1.625000  0.4359000     1.059000  0.5118000     2.192000  0.7056000     -1.132000      0.8717000 
1 1 1 16 47 12 o 1.897000  0.4772000     1.622000  0.6580000     2.172000  0.6913000     -0.5502000     0.9544000 
1 1 1 16 47 13 o 1.648000  0.4724000     1.845000  0.7015000     1.451000  0.6329000     0.3933000      0.9448000 
1 1 1 16 47 14 o 3.344000  0.4151000     3.815000  0.4922000     2.873000  0.6686000     0.9418000      0.8302000 
1 1 1 16 47 15 o 1.081000  0.3761000     0.9871000 0.4872000     1.175000  0.5730000     -0.1875000     0.7521000 
1 1 1 16 47 16 o 1.555000  0.4697000     1.533000  0.6512000     1.577000  0.6772000     -0.4353000E-01 0.9395000 
1 1 1 16 48 0  o 2.633000  0.8693000     2.633000  0.8693000     2.633000  0.8693000     0.000000       0.000000  
1 1 1 16 48 1  o 5.108000  0.3256000     5.300000  0.4379000     4.917000  0.4821000     0.3832000      0.6513000 
1 1 1 16 48 2  o 4.918000  0.3751000     5.216000  0.5560000     4.619000  0.5037000     0.5966000      0.7503000 
1 1 1 16 48 3  o 5.460000  0.3784000     5.419000  0.5512000     5.501000  0.5185000     -0.8188000E-01 0.7567000 
1 1 1 16 48 4  o 1.772000  0.7155000     1.772000  0.7155000     ?         ?             ?              ?         
1 1 1 16 48 5  f 2.632000  0.5248000     2.902000  0.7200000     2.361000  0.7636000     0.5411000      1.050000  
1 1 1 16 48 6  o 3.597000  0.4167000     4.272000  0.5260000     2.923000  0.6465000     1.350000       0.8335000 
1 1 1 16 48 7  o 3.201000  0.4276000     3.407000  0.5799000     2.996000  0.6285000     0.4118000      0.8551000 
1 1 1 16 48 8  o 1.949000  0.4880000     2.365000  0.7187000     1.534000  0.6602000     0.8309000      0.9760000 
1 1 1 16 48 9  o 5.355000  0.2785000     5.141000  0.4003000     5.569000  0.3873000     -0.4283000     0.5570000 
1 1 1 16 48 10 f 4.865000  0.2985000     5.040000  0.4113000     4.691000  0.4328000     0.3495000      0.5970000 
1 1 1 16 48 11 o 1.339000  0.4241000     1.165000  0.5487000     1.512000  0.6469000     -0.3467000     0.8483000 
1 1 1 16 48 12 o 1.388000  0.4332000     1.467000  0.6331000     1.309000  0.5914000     0.1582000      0.8663000 
1 1 1 16 48 13 o 1.709000  0.4358000     2.355000  0.7032000     1.064000  0.5150000     1.291000       0.8717000 
1 1 1 16 48 14 o 1.609000  0.4991000     2.133000  0.8510000     1.085000  0.5218000     1.048000       0.9982000 
1 1 1 16 48 15 o 2.259000  0.4873000     2.551000  0.6779000     1.966000  0.7004000     0.5842000      0.9747000 
1 1 1 16 48 16 o 1.994000  0.5303000     2.274000  0.7621000     1.713000  0.7375000     0.5612000      1.061000  
1 1 1 16 49 0  f 2.848000  1.044000      2.848000  1.044000      2.848000  1.044000      -0.000000      0.000000  
1 1 1 16 49 1  o 3.228000  0.5958000     3.726000  0.6966000     2.730000  0.9667000     0.9959000      1.192000  
1 1 1 16 49 2  o 5.816000  0.4557000     6.292000  0.4620000     5.339000  0.7856000     0.9532000      0.9114000 
1 1 1 16 49 3  o 3.666000  0.5242000     3.900000  0.7093000     3.432000  0.7720000     0.4678000      1.048000  
1 1 1 16 49 4  o 1.822000  0.5001000     1.719000  0.7121000     1.926000  0.7025000     -0.2069000     1.000000  
1 1 1 16 49 5  o 2.763000  0.4985000     3.219000  0.6913000     2.306000  0.7183000     0.9131000      0.9969000 
1 1 1 16 49 6  f 3.768000  0.3839000     3.346000  0.6054000     4.190000  0.4722000     -0.8443000     0.7678000 
1 1 1 16 49 7  o 3.982000  0.3549000     3.745000  0.5324000     4.219000  0.4694000     -0.4739000     0.7098000 
1 1 1 16 49 8  o 1.284000  0.4128000     1.522000  0.6507000     1.045000  0.5080000     0.4770000      0.8255000 
1 1 1 16 49 9  o 3.104000  0.4398000     2.805000  0.6826000     3.404000  0.5547000     -0.5989000     0.8796000 
1 1 1 16 49 10 o 1.292000  0.4122000     1.036000  0.5054000     1.549000  0.6512000     -0.5135000     0.8243000 
1 1 1 16 49 11 o 2.039000  0.4838000     1.675000  0.6694000     2.403000  0.6988000     -0.7276000     0.9677000 
1 1 1 16 49 12 o 4.563000  0.3108000     4.606000  0.4374000     4.520000  0.4417000     0.8669000E-01  0.6216000 
1 1 1 16 49 13 o 4.391000  0.3355000     4.564000  0.4700000     4.217000  0.4790000     0.3466000      0.6711000 
1 1 1 16 49 14 o 2.336000  0.5181000     2.721000  0.6795000     1.952000  0.7824000     0.7694000      1.036000  
1 1 1 16 49 15 o 1.300000  0.4238000     1.476000  0.6328000     1.124000  0.5638000     0.3519000      0.8475000 
1 1 1 16 50 0  o 1.670000  0.8554000     1.670000  0.8554000     1.670000  0.8554000     -0.000000      0.000000  
1 1 1 16 50 1  o 2.613000  0.4821000     2.024000  0.7534000     3.201000  0.6017000     -1.176000      0.9642000 
1 1 1 16 50 2  o 2.353000  0.5133000     2.235000  0.7287000     2.471000  0.7232000     -0.2357000     1.027000  
1 1 1 16 50 3  o 6.057000  0.2536000     5.838000  0.3622000     6.277000  0.3551000     -0.4383000     0.5072000 
1 1 1 16 50 4  o 1.699000  0.4762000     1.534000  0.6484000     1.864000  0.6975000     -0.3293000     0.9523000 
1 1 1 16 50 5  o 4.948000  0.2915000     4.542000  0.4362000     5.353000  0.3869000     -0.8110000     0.5831000 
1 1 1 16 50 6  o 2.242000  0.4963000     1.828000  0.7057000     2.657000  0.6981000     -0.8283000     0.9927000 
1 1 1 16 50 7  o 4.735000  0.3046000     4.877000  0.4218000     4.594000  0.4396000     0.2832000      0.6092000 
1 1 1 16 50 8  o 2.518000  0.4817000     2.939000  0.6495000     2.096000  0.7116000     0.8427000      0.9635000 
1 1 1 16 50 9  f 5.863000  0.2605000     6.369000  0.3544000     5.358000  0.3820000     1.012000       0.5211000 
1 1 1 16 50 10 o 4.014000  0.3547000     3.467000  0.5521000     4.561000  0.4456000     -1.094000      0.7095000 
1 1 1 16 50 11 o 1.273000  0.4131000     1.373000  0.6110000     1.173000  0.5562000     0.1994000      0.8263000 
1 1 1 16 50 12 o 5.266000  0.2865000     5.302000  0.4044000     5.230000  0.4060000     0.7226000E-01  0.5730000 
1 1 1 16 50 13 o 3.074000  0.5238000     4.206000  0.7323000     1.943000  0.7491000     2.263000       1.048000  
1 1 1 16 50 14 o 1.277000  0.4163000     1.136000  0.5425000     1.417000  0.6317000     -0.2807000     0.8326000 
1 1 1 16 50 15 o 1.910000  0.5322000     1.463000  0.6749000     2.357000  0.8230000     -0.8940000     1.064000  
1 1 1 16 51 0  o 1.049000  0.6847000     1.049000  0.6847000     1.049000  0.6847000     -0.000000      0.000000  
1 1 1 16 51 1  o 2.656000  0.4824000     2.425000  0.7096000     2.888000  0.6537000     -0.4629000     0.9647000 
1 1 1 16 51 2  o 7.922000  0.2241000     7.768000  0.3164000     8.077000  0.3176000     -0.3093000     0.4483000 
1 1 1 16 51 3  o 5.780000  0.2658000     6.098000  0.3508000     5.462000  0.3993000     0.6360000      0.5315000 
1 1 1 16 51 4  o 2.160000  0.4841000     2.569000  0.6795000     1.751000  0.6898000     0.8180000      0.9683000 
1 1 1 16 51 5  o 4.359000  0.3148000     4.474000  0.4350000     4.244000  0.4551000     0.2296000      0.6295000 
1 1 1 16 51 6  o 2.853000  0.4645000     2.931000  0.6386000     2.775000  0.6748000     0.1567000      0.9291000 
1 1 1 16 51 7  o 2.980000  0.4479000     2.665000  0.6699000     3.296000  0.5946000     -0.6304000     0.8957000 
1 1 1 16 51 8  o 2.113000  0.4999000     2.333000  0.7145000     1.893000  0.6993000     0.4392000      0.9997000 
1 1 1 16 51 9  o 1.470000  0.4454000     1.749000  0.6910000     1.191000  0.5621000     0.5585000      0.8907000 
1 1 1 16 51 10 o 4.048000  0.3481000     4.443000  0.4343000     3.652000  0.5442000     0.7903000      0.6963000 
1 1 1 16 51 11 o 4.396000  0.3194000     4.161000  0.4732000     4.631000  0.4290000     -0.4699000     0.6387000 
1 1 1 16 51 12 o 1.433000  0.4672000     1.753000  0.7669000     1.113000  0.5339000     0.6403000      0.9344000 
1 1 1 16 51 13 o 1.527000  0.4688000     1.474000  0.6378000     1.581000  0.6874000     -0.1063000     0.9377000 
1 1 1 16 51 14 o 1.395000  0.4685000     1.218000  0.5817000     1.573000  0.7345000     -0.3557000     0.9369000 
1 1 1 16 52 0  o 1.324000  0.7833000     1.324000  0.7833000     1.324000  0.7833000     0.000000       0.000000  
1 1 1 16 52 1  o 4.561000  0.3111000     4.624000  0.4382000     4.498000  0.4417000     0.1251000      0.6222000 
1 1 1 16 52 2  o 5.997000  0.2575000     5.995000  0.3621000     5.998000  0.3663000     -0.2303000E-02 0.5151000 
1 1 1 16 52 3  o 5.439000  0.2729000     5.040000  0.3989000     5.838000  0.3726000     -0.7975000     0.5458000 
1 1 1 16 52 4  o 2.021000  0.4782000     1.522000  0.6469000     2.519000  0.7045000     -0.9968000     0.9564000 
1 1 1 16 52 5  o 1.225000  0.4030000     1.183000  0.5584000     1.267000  0.5813000     -0.8455000E-01 0.8061000 
1 1 1 16 52 6  f 5.987000  0.2576000     6.337000  0.3450000     5.637000  0.3825000     0.7004000      0.5151000 
1 1 1 16 52 7  o 2.089000  0.5015000     1.995000  0.7049000     2.183000  0.7135000     -0.1878000     1.003000  
1 1 1 16 52 8  o 2.213000  0.4793000     2.765000  0.6727000     1.662000  0.6830000     1.103000       0.9587000 
1 1 1 16 52 9  o 2.325000  0.4529000     1.580000  0.6673000     3.069000  0.6127000     -1.489000      0.9059000 
1 1 1 16 52 10 o 2.067000  0.5053000     1.965000  0.7125000     2.169000  0.7166000     -0.2040000     1.011000  
1 1 1 16 52 11 f 1.736000  0.4850000     1.470000  0.6660000     2.002000  0.7052000     -0.5314000     0.9700000 
1 1 1 16 52 12 o 1.554000  0.4856000     1.719000  0.7028000     1.389000  0.6705000     0.3299000      0.9713000 
1 1 1 16 52 13 o 1.465000  0.4782000     1.107000  0.5331000     1.823000  0.7941000     -0.7168000     0.9565000 
1 1 1 16 53 0  o 3.579000  0.5712000     3.579000  0.5712000     3.579000  0.5712000     -0.000000      0.000000  
1 1 1 16 53 1  o 3.413000  0.4062000     3.383000  0.5647000     3.443000  0.5840000     -0.6052000E-01 0.8123000 
1 1 1 16 53 2  o 4.880000  0.2960000     4.658000  0.4322000     5.101000  0.4046000     -0.4428000     0.5920000 
1 1 1 16 53 3  o 4.600000  0.3143000     5.315000  0.3871000     3.885000  0.4952000     1.430000       0.6286000 
1 1 1 16 53 4  o 3.589000  0.3787000     3.650000  0.5313000     3.527000  0.5398000     0.1235000      0.7574000 
1 1 1 16 53 5  o 3.227000  0.4161000     3.438000  0.5587000     3.016000  0.6168000     0.4226000      0.8323000 
1 1 1 16 53 6  o 2.446000  0.4894000     2.748000  0.6637000     2.144000  0.7193000     0.6041000      0.9787000 
1 1 1 16 53 7  o 1.317000  0.4233000     1.426000  0.6273000     1.208000  0.5685000     0.2183000      0.8466000 
1 1 1 16 53 8  o 3.438000  0.4106000     3.041000  0.6346000     3.835000  0.5210000     -0.7935000     0.8211000 
1 1 1 16 53 9  o 2.153000  0.5016000     1.918000  0.7169000     2.387000  0.7017000     -0.4692000     1.003000  
1 1 1 16 53 10 o 4.122000  0.3481000     3.803000  0.5316000     4.440000  0.4494000     -0.6370000     0.6961000 
1 1 1 16 53 11 o 2.892000  0.5201000     2.004000  0.8399000     3.780000  0.6135000     -1.776000      1.040000  
1 1 1 16 53 12 o 1.107000  0.3799000     1.057000  0.5153000     1.158000  0.5584000     -0.1014000     0.7598000 
1 1 1 16 53 13 o 2.615000  0.5208000     3.582000  0.7521000     1.648000  0.7206000     1.934000       1.042000  
1 1 1 16 54 0  o 1.440000  0.8018000     1.440000  0.8018000     1.440000  0.8018000     0.000000       0.000000  
1 1 1 16 54 1  o 3.655000  0.3766000     3.721000  0.5247000     3.588000  0.5404000     0.1326000      0.7532000 
1 1 1 16 54 2  o 3.099000  0.4375000     2.832000  0.6433000     3.366000  0.5930000     -0.5337000     0.8749000 
1 1 1 16 54 3  o 3.231000  0.4189000     3.456000  0.5654000     3.006000  0.6181000     0.4508000      0.8377000 
1 1 1 16 54 4  o 6.143000  0.2754000     6.558000  0.4000000     5.728000  0.3786000     0.8306000      0.5508000 
1 1 1 16 54 5  o 2.563000  0.4714000     3.020000  0.6224000     2.105000  0.7081000     0.9151000      0.9428000 
1 1 1 16 54 6  o 1.462000  0.4491000     1.430000  0.6293000     1.495000  0.6409000     -0.6474000E-01 0.8982000 
1 1 1 16 54 7  o 2.133000  0.5094000     2.066000  0.7162000     2.199000  0.7245000     -0.1329000     1.019000  
1 1 1 16 54 8  o 2.351000  0.5095000     2.556000  0.7179000     2.146000  0.7231000     0.4101000      1.019000  
1 1 1 16 54 9  o 1.311000  0.4261000     1.361000  0.6174000     1.260000  0.5874000     0.1012000      0.8522000 
1 1 1 16 54 10 o 1.442000  0.4573000     1.092000  0.5459000     1.792000  0.7339000     -0.7006000     0.9146000 
1 1 1 16 54 11 o 3.313000  0.4862000     4.010000  0.5011000     2.616000  0.8335000     1.394000       0.9725000 
1 1 1 16 54 12 o 2.226000  0.5355000     2.563000  0.7449000     1.889000  0.7695000     0.6745000      1.071000  
1 1 1 16 55 0  o 1.075000  0.6941000     1.075000  0.6941000     1.075000  0.6941000     -0.000000      0.000000  
1 1 1 16 55 1  o 4.119000  0.3473000     3.765000  0.5182000     4.474000  0.4625000     -0.7095000     0.6946000 
1 1 1 16 55 2  o 1.836000  0.4960000     1.881000  0.7027000     1.791000  0.7002000     0.8959000E-01  0.9920000 
1 1 1 16 55 3  o 6.122000  0.2561000     5.911000  0.3739000     6.334000  0.3501000     -0.4229000     0.5123000 
1 1 1 16 55 4  o 3.370000  0.4120000     3.310000  0.6068000     3.430000  0.5574000     -0.1203000     0.8240000 
1 1 1 16 55 5  o 1.364000  0.4326000     1.323000  0.5990000     1.406000  0.6243000     -0.8266000E-01 0.8652000 
1 1 1 16 55 6  o 3.752000  0.3835000     3.946000  0.5012000     3.557000  0.5807000     0.3885000      0.7670000 
1 1 1 16 55 7  o 1.459000  0.4531000     1.335000  0.6088000     1.583000  0.6712000     -0.2484000     0.9062000 
1 1 1 16 55 8  o 2.058000  0.4976000     2.410000  0.7208000     1.705000  0.6862000     0.7052000      0.9952000 
1 1 1 16 55 9  o 2.951000  0.5409000     2.376000  0.8939000     3.527000  0.6092000     -1.151000      1.082000  
1 1 1 16 55 10 o 2.365000  0.5168000     2.813000  0.6687000     1.916000  0.7880000     0.8970000      1.034000  
1 1 1 16 55 11 o 1.382000  0.4471000     1.539000  0.6674000     1.224000  0.5952000     0.3143000      0.8942000 
1 1 1 16 56 0  o 0.6557000 0.4764000     0.6557000 0.4764000     0.6557000 0.4764000     -0.000000      0.000000  
1 1 1 16 56 1  o 4.061000  0.3836000     4.330000  0.5427000     3.792000  0.5423000     0.5380000      0.7672000 
1 1 1 16 56 2  f 1.453000  0.4502000     1.461000  0.6382000     1.444000  0.6352000     0.1629000E-01  0.9005000 
1 1 1 16 56 3  o 1.395000  0.4409000     1.377000  0.6171000     1.412000  0.6299000     -0.3514000E-01 0.8818000 
1 1 1 16 56 4  o 4.605000  0.3236000     4.488000  0.4698000     4.723000  0.4451000     -0.2350000     0.6472000 
1 1 1 16 56 5  o 1.638000  0.4748000     1.416000  0.6308000     1.859000  0.7097000     -0.4431000     0.9495000 
1 1 1 16 56 6  o 1.847000  0.4975000     1.629000  0.6793000     2.066000  0.7271000     -0.4366000     0.9950000 
1 1 1 16 56 7  o 2.319000  0.5091000     2.341000  0.7236000     2.296000  0.7164000     0.4471000E-01  1.018000  
1 1 1 16 56 8  o 2.124000  0.5566000     1.839000  0.8042000     2.409000  0.7696000     -0.5698000     1.113000  
1 1 1 16 56 9  o 5.554000  0.4873000     6.121000  0.3828000     4.988000  0.8962000     1.134000       0.9745000 
1 1 1 16 56 10 o 2.112000  0.5599000     2.032000  0.7690000     2.192000  0.8139000     -0.1602000     1.120000  
1 1 1 16 56 11 o 1.186000  0.6049000     ?         ?             1.186000  0.6049000     ?              ?         
1 1 1 16 57 0  o 5.052000  0.4460000     5.052000  0.4460000     5.052000  0.4460000     0.000000       0.000000  
1 1 1 16 57 1  o 5.027000  0.3047000     5.115000  0.4238000     4.940000  0.4380000     0.1747000      0.6095000 
1 1 1 16 57 2  o 2.525000  0.4958000     2.933000  0.6679000     2.117000  0.7330000     0.8160000      0.9916000 
1 1 1 16 57 3  o 1.388000  0.4376000     1.564000  0.6629000     1.211000  0.5714000     0.3525000      0.8752000 
1 1 1 16 57 4  o 3.413000  0.4183000     2.999000  0.6447000     3.826000  0.5332000     -0.8275000     0.8366000 
1 1 1 16 57 5  o 1.230000  0.4063000     1.241000  0.5783000     1.219000  0.5708000     0.2135000E-01  0.8126000 
1 1 1 16 57 6  o 1.820000  0.4900000     1.401000  0.6495000     2.238000  0.7338000     -0.8372000     0.9800000 
1 1 1 16 57 7  o 1.356000  0.4503000     1.331000  0.6405000     1.381000  0.6330000     -0.5028000E-01 0.9006000 
1 1 1 16 57 8  o 1.679000  0.5069000     1.806000  0.7184000     1.552000  0.7153000     0.2549000      1.014000  
1 1 1 16 57 9  o 1.837000  0.5289000     1.652000  0.7029000     2.022000  0.7905000     -0.3700000     1.058000  
1 1 1 16 57 10 o 1.731000  0.5623000     1.937000  0.8650000     1.524000  0.7188000     0.4126000      1.125000  
1 1 1 16 58 0  o 3.810000  0.5745000     3.810000  0.5745000     3.810000  0.5745000     0.000000       0.000000  
1 1 1 16 58 1  o 2.389000  0.4983000     2.044000  0.7249000     2.733000  0.6839000     -0.6889000     0.9965000 
1 1 1 16 58 2  o 3.348000  0.4416000     2.837000  0.7004000     3.859000  0.5380000     -1.021000      0.8832000 
1 1 1 16 58 3  f 1.908000  0.4913000     2.150000  0.7080000     1.666000  0.6814000     0.4845000      0.9827000 
1 1 1 16 58 4  o 2.081000  0.4832000     1.557000  0.6635000     2.606000  0.7025000     -1.049000      0.9663000 
1 1 1 16 58 5  f 2.601000  0.5723000     2.746000  0.8839000     2.456000  0.7271000     0.2897000      1.145000  
1 1 1 16 58 6  o 1.986000  0.5007000     2.638000  0.7593000     1.335000  0.6528000     1.303000       1.001000  
1 1 1 16 58 7  o 3.059000  0.6498000     3.247000  0.6947000     2.870000  1.098000      0.3768000      1.300000  
1 1 1 16 58 8  o 1.381000  0.4585000     1.343000  0.6417000     1.418000  0.6551000     -0.7484000E-01 0.9170000 
1 1 1 16 58 9  o 1.774000  0.5781000     1.866000  0.8251000     1.681000  0.8099000     0.1853000      1.156000  
1 1 1 16 59 0  o 1.712000  0.8683000     1.712000  0.8683000     1.712000  0.8683000     0.000000       0.000000  
1 1 1 16 59 1  o 1.253000  0.4131000     1.245000  0.5801000     1.261000  0.5883000     -0.1671000E-01 0.8262000 
1 1 1 16 59 2  o 3.085000  0.4990000     3.528000  0.6886000     2.642000  0.7224000     0.8856000      0.9980000 
1 1 1 16 59 3  o 1.573000  0.5027000     1.857000  0.7993000     1.290000  0.6099000     0.5673000      1.005000  
1 1 1 16 59 4  o 1.460000  0.4847000     1.543000  0.7151000     1.376000  0.6545000     0.1673000      0.9694000 
1 1 1 16 59 5  o 2.849000  0.7629000     2.849000  0.7629000     ?         ?             ?              ?         
1 1 1 16 59 6  o 2.863000  0.5526000     3.186000  0.7316000     2.540000  0.8283000     0.6467000      1.105000  
1 1 1 16 59 7  o 1.154000  0.3934000     1.024000  0.5107000     1.284000  0.5984000     -0.2599000     0.7867000 
1 1 1 16 60 0  o 4.939000  1.033000      4.939000  1.033000      4.939000  1.033000      0.000000       0.000000  
1 1 1 16 60 1  o 2.901000  0.7360000     2.072000  0.9248000     3.730000  1.145000      -1.658000      1.472000  
1 1 1 16 60 2  o 1.764000  0.7763000     1.764000  0.7763000     ?         ?             ?              ?         
1 1 1 16 60 3  o 1.749000  0.5663000     1.298000  0.6133000     2.200000  0.9523000     -0.9014000     1.133000  
1 1 1 16 60 4  o 2.097000  0.5864000     2.001000  0.8043000     2.193000  0.8537000     -0.1922000     1.173000  
1 1 1 16 60 5  o 3.007000  0.5159000     2.664000  0.8125000     3.349000  0.6360000     -0.6850000     1.032000  
1 1 1 16 60 6  o 2.358000  0.5440000     2.306000  0.8054000     2.409000  0.7316000     -0.1035000     1.088000  
1 1 1 16 61 0  o 1.356000  0.8285000     1.356000  0.8285000     1.356000  0.8285000     0.000000       0.000000  
1 1 1 16 61 1  o 1.486000  0.4779000     1.540000  0.6955000     1.432000  0.6557000     0.1075000      0.9558000 
1 1 1 16 61 2  f 1.634000  0.4916000     1.976000  0.7768000     1.291000  0.6029000     0.6856000      0.9833000 
1 1 1 16 61 3  o 1.253000  0.4201000     1.449000  0.6618000     1.057000  0.5177000     0.3919000      0.8403000 
1 1 1 16 61 4  o 1.399000  0.4445000     1.282000  0.5977000     1.516000  0.6579000     -0.2343000     0.8889000 
1 1 1 16 62 0  o 0.8561000 0.6308000     0.8561000 0.6308000     0.8561000 0.6308000     0.000000       0.000000  
1 1 1 17 0  1  o 9.377000  0.1684000     9.377000  0.1684000     9.377000  0.1684000     -0.000000      0.000000  
1 1 1 17 0  2  o 0.5935000 0.4123000     0.5935000 0.4123000     0.5935000 0.4123000     -0.000000      0.000000  
1 1 1 17 0  3  o 6.376000  0.1651000     6.376000  0.1651000     6.376000  0.1651000     -0.000000      0.000000  
1 1 1 17 0  4  o 6.163000  0.1630000     6.163000  0.1630000     6.163000  0.1630000     0.000000       0.000000  
1 1 1 17 0  5  o 18.61000  0.2313000     18.61000  0.2313000     18.61000  0.2313000     0.000000       0.000000  
1 1 1 17 0  6  o 9.983000  0.2250000     9.983000  0.2250000     9.983000  0.2250000     -0.000000      0.000000  
1 1 1 17 0  7  o 9.426000  0.2065000     9.426000  0.2065000     9.426000  0.2065000     0.000000       0.000000  
1 1 1 17 0  8  o 2.108000  0.7120000     2.108000  0.7120000     2.108000  0.7120000     -0.000000      0.000000  
1 1 1 17 0  9  o 8.606000  0.2457000     8.606000  0.2457000     8.606000  0.2457000     0.000000       0.000000  
1 1 1 17 0  10 o 1.585000  0.8070000     1.585000  0.8070000     1.585000  0.8070000     0.000000       0.000000  
1 1 1 17 0  11 o 4.681000  0.4286000     4.681000  0.4286000     4.681000  0.4286000     0.000000       0.000000  
1 1 1 17 0  12 o 11.12000  0.2772000     11.12000  0.2772000     11.12000  0.2772000     0.000000       0.000000  
1 1 1 17 0  13 o 19.07000  0.2975000     19.07000  0.2975000     19.07000  0.2975000     0.000000       0.000000  
1 1 1 17 0  14 o 5.008000  0.5201000     5.008000  0.5201000     5.008000  0.5201000     -0.000000      0.000000  
1 1 1 17 0  15 o 5.075000  0.5853000     5.075000  0.5853000     5.075000  0.5853000     0.000000       0.000000  
1 1 1 17 0  16 o 4.491000  0.7223000     4.491000  0.7223000     4.491000  0.7223000     0.000000       0.000000  
1 1 1 17 0  17 o 1.822000  1.035000      1.822000  1.035000      1.822000  1.035000      0.000000       0.000000  
1 1 1 17 0  18 o 1.218000  0.8218000     1.218000  0.8218000     1.218000  0.8218000     -0.000000      0.000000  
1 1 1 17 0  19 o 1.384000  0.8842000     1.384000  0.8842000     1.384000  0.8842000     0.000000       0.000000  
1 1 1 17 0  20 o 1.455000  0.8917000     1.455000  0.8917000     1.455000  0.8917000     0.000000       0.000000  
1 1 1 17 0  21 o 1.818000  0.9809000     1.818000  0.9809000     1.818000  0.9809000     -0.000000      0.000000  
1 1 1 17 0  22 f 1.938000  0.9237000     1.938000  0.9237000     1.938000  0.9237000     0.000000       0.000000  
1 1 1 17 0  23 o 0.9487000 0.6518000     0.9487000 0.6518000     0.9487000 0.6518000     -0.000000      0.000000  
1 1 1 17 0  24 o 0.8377000 0.5971000     0.8377000 0.5971000     0.8377000 0.5971000     0.000000       0.000000  
1 1 1 17 0  25 o 0.8692000 0.6103000     0.8692000 0.6103000     0.8692000 0.6103000     0.000000       0.000000  
1 1 1 17 1  1  o 8.443000  0.1366000     8.399000  0.2376000     8.487000  0.1349000     -0.8847000E-01 0.2732000 
1 1 1 17 1  2  o 8.143000  0.1488000     8.095000  0.2736000     8.192000  0.1170000     -0.9731000E-01 0.2975000 
1 1 1 17 1  3  o 1.548000  0.2288000     1.079000  0.3153000     2.016000  0.3317000     -0.9366000     0.4577000 
1 1 1 17 1  4  o 4.668000  0.1329000     4.660000  0.1947000     4.676000  0.1810000     -0.1543000E-01 0.2658000 
1 1 1 17 1  5  o 10.76000  0.1246000     10.67000  0.1771000     10.85000  0.1755000     -0.1807000     0.2493000 
1 1 1 17 1  6  o 15.55000  0.1780000     15.44000  0.2512000     15.66000  0.2524000     -0.2231000     0.3561000 
1 1 1 17 1  7  o 5.351000  0.1870000     5.431000  0.2571000     5.271000  0.2715000     0.1604000      0.3740000 
1 1 1 17 1  8  o 9.075000  0.1604000     8.686000  0.2264000     9.463000  0.2274000     -0.7770000     0.3209000 
1 1 1 17 1  9  o 10.34000  0.1663000     10.34000  0.2325000     10.34000  0.2380000     -0.5684000E-03 0.3327000 
1 1 1 17 1  10 o 6.176000  0.2265000     6.604000  0.2962000     5.749000  0.3428000     0.8551000      0.4530000 
1 1 1 17 1  11 o 7.968000  0.2107000     7.812000  0.2996000     8.123000  0.2963000     -0.3103000     0.4214000 
1 1 1 17 1  12 o 10.28000  0.2000000     10.31000  0.2822000     10.24000  0.2835000     0.6301000E-01  0.4000000 
1 1 1 17 1  13 o 8.345000  0.2363000     8.165000  0.3328000     8.526000  0.3355000     -0.3614000     0.4726000 
1 1 1 17 1  14 o 2.658000  0.5484000     3.269000  0.7511000     2.046000  0.7991000     1.222000       1.097000  
1 1 1 17 1  15 o 17.46000  0.2227000     17.52000  0.3141000     17.40000  0.3157000     0.1200000      0.4453000 
1 1 1 17 1  16 o 6.034000  0.3756000     6.556000  0.4880000     5.511000  0.5712000     1.044000       0.7513000 
1 1 1 17 1  17 o 5.025000  0.4500000     5.001000  0.6328000     5.048000  0.6400000     -0.4667000E-01 0.9000000 
1 1 1 17 1  18 o 1.951000  0.5744000     1.438000  0.6908000     2.464000  0.9180000     -1.026000      1.149000  
1 1 1 17 1  19 o 2.278000  0.6165000     2.177000  0.8590000     2.379000  0.8846000     -0.2019000     1.233000  
1 1 1 17 1  20 o 4.552000  0.4250000     4.533000  0.5984000     4.570000  0.6036000     -0.3632000E-01 0.8499000 
1 1 1 17 1  21 o 3.714000  0.5088000     3.671000  0.7248000     3.757000  0.7143000     -0.8599000E-01 1.018000  
1 1 1 17 1  22 f 2.179000  0.5483000     2.213000  0.7707000     2.145000  0.7800000     0.6806000E-01  1.097000  
1 1 1 17 1  23 o 1.196000  0.4066000     1.155000  0.5585000     1.236000  0.5910000     -0.8075000E-01 0.8131000 
1 1 1 17 1  24 o 1.463000  0.4735000     1.305000  0.6240000     1.621000  0.7123000     -0.3154000     0.9470000 
1 1 1 17 1  25 o 1.178000  0.4013000     1.288000  0.6053000     1.068000  0.5272000     0.2197000      0.8026000 
1 1 1 17 2  0  o 5.159000  0.1811000     5.159000  0.1811000     5.159000  0.1811000     0.000000       0.000000  
1 1 1 17 2  1  o 10.41000  0.1522000     10.34000  0.2628000     10.47000  0.1534000     -0.1313000     0.3043000 
1 1 1 17 2  2  o 8.572000  0.8949000E-01 8.669000  0.1322000     8.476000  0.1207000     0.1924000      0.1790000 
1 1 1 17 2  3  o 5.996000  0.8842000E-01 6.041000  0.1191000     5.951000  0.1308000     0.9003000E-01  0.1768000 
1 1 1 17 2  4  o 8.203000  0.1275000     8.123000  0.1370000     8.282000  0.2150000     -0.1589000     0.2549000 
1 1 1 17 2  5  o 1.371000  0.3242000     1.001000  0.4445000     1.740000  0.4720000     -0.7385000     0.6483000 
1 1 1 17 2  6  o 8.790000  0.1621000     8.871000  0.2301000     8.710000  0.2283000     0.1617000      0.3241000 
1 1 1 17 2  7  o 6.633000  0.1659000     6.486000  0.2380000     6.779000  0.2311000     -0.2927000     0.3318000 
1 1 1 17 2  8  o 2.567000  0.3944000     2.409000  0.5842000     2.725000  0.5298000     -0.3160000     0.7887000 
1 1 1 17 2  9  o 5.833000  0.2150000     5.527000  0.3149000     6.140000  0.2928000     -0.6133000     0.4301000 
1 1 1 17 2  10 o 12.57000  0.1754000     12.53000  0.2487000     12.61000  0.2474000     -0.8285000E-01 0.3508000 
1 1 1 17 2  11 o 11.00000  0.2021000     11.09000  0.2634000     10.91000  0.3066000     0.1755000      0.4042000 
1 1 1 17 2  12 f 14.51000  0.1913000     14.50000  0.2690000     14.53000  0.2720000     -0.2654000E-01 0.3825000 
1 1 1 17 2  13 o 9.830000  0.2181000     9.324000  0.3096000     10.34000  0.3074000     -1.013000      0.4363000 
1 1 1 17 2  14 o 9.423000  0.2403000     9.812000  0.3282000     9.033000  0.3510000     0.7792000      0.4805000 
1 1 1 17 2  15 o 4.290000  0.4818000     4.552000  0.6185000     4.027000  0.7390000     0.5243000      0.9636000 
1 1 1 17 2  16 o 9.215000  0.2787000     8.821000  0.3987000     9.608000  0.3896000     -0.7875000     0.5574000 
1 1 1 17 2  17 o 4.005000  0.5576000     3.181000  0.8963000     4.829000  0.6636000     -1.648000      1.115000  
1 1 1 17 2  18 o 3.222000  0.6303000     3.765000  0.8407000     2.679000  0.9392000     1.086000       1.261000  
1 1 1 17 2  19 o 2.408000  0.5865000     1.766000  0.7811000     3.051000  0.8752000     -1.285000      1.173000  
1 1 1 17 2  20 o 3.400000  0.5467000     3.198000  0.7977000     3.602000  0.7479000     -0.4043000     1.093000  
1 1 1 17 2  21 o 2.012000  0.5608000     2.337000  0.8463000     1.687000  0.7360000     0.6506000      1.122000  
1 1 1 17 2  22 f 2.409000  0.5384000     2.735000  0.7535000     2.082000  0.7691000     0.6524000      1.077000  
1 1 1 17 2  23 o 1.473000  0.4598000     1.149000  0.5587000     1.797000  0.7305000     -0.6479000     0.9197000 
1 1 1 17 2  24 o 1.351000  0.4510000     1.311000  0.6237000     1.392000  0.6517000     -0.8099000E-01 0.9020000 
1 1 1 17 2  25 o 1.248000  0.4203000     1.249000  0.5955000     1.248000  0.5932000     0.2036000E-03  0.8406000 
1 1 1 17 3  0  f 2.361000  0.2580000     2.361000  0.2580000     2.361000  0.2580000     -0.000000      0.000000  
1 1 1 17 3  1  o 6.153000  0.9512000E-01 6.135000  0.1359000     6.170000  0.1331000     -0.3412000E-01 0.1902000 
1 1 1 17 3  2  o 14.95000  0.1244000     15.07000  0.1755000     14.82000  0.1763000     0.2527000      0.2487000 
1 1 1 17 3  3  o 11.17000  0.1174000     11.29000  0.1481000     11.05000  0.1823000     0.2416000      0.2349000 
1 1 1 17 3  4  o 1.517000  0.2613000     1.322000  0.3642000     1.712000  0.3748000     -0.3909000     0.5226000 
1 1 1 17 3  5  o 4.891000  0.1514000     4.988000  0.1563000     4.795000  0.2593000     0.1928000      0.3028000 
1 1 1 17 3  6  o 4.098000  0.2459000     4.416000  0.3341000     3.781000  0.3610000     0.6355000      0.4919000 
1 1 1 17 3  7  o 4.277000  0.2169000     4.712000  0.2826000     3.843000  0.3292000     0.8686000      0.4339000 
1 1 1 17 3  8  o 4.799000  0.2254000     4.944000  0.3126000     4.655000  0.3247000     0.2888000      0.4507000 
1 1 1 17 3  9  o 13.64000  0.1661000     13.61000  0.2356000     13.67000  0.2341000     -0.6509000E-01 0.3321000 
1 1 1 17 3  10 o 6.204000  0.2229000     6.262000  0.3142000     6.145000  0.3163000     0.1172000      0.4458000 
1 1 1 17 3  11 o 9.031000  0.2329000     8.874000  0.3364000     9.187000  0.3222000     -0.3130000     0.4658000 
1 1 1 17 3  12 o 10.85000  0.1987000     11.09000  0.2792000     10.60000  0.2827000     0.4953000      0.3974000 
1 1 1 17 3  13 o 12.49000  0.2032000     12.67000  0.2856000     12.30000  0.2891000     0.3788000      0.4064000 
1 1 1 17 3  14 o 8.800000  0.2682000     8.568000  0.3590000     9.031000  0.3984000     -0.4631000     0.5363000 
1 1 1 17 3  15 o 10.12000  0.2503000     9.715000  0.3594000     10.52000  0.3485000     -0.8040000     0.5006000 
1 1 1 17 3  16 o 4.395000  0.5133000     4.741000  0.6633000     4.049000  0.7835000     0.6920000      1.027000  
1 1 1 17 3  17 o 2.094000  0.6158000     2.139000  0.8765000     2.049000  0.8652000     0.8972000E-01  1.232000  
1 1 1 17 3  18 o 6.912000  0.3476000     6.792000  0.4997000     7.033000  0.4835000     -0.2412000     0.6953000 
1 1 1 17 3  19 o 2.839000  0.5996000     2.227000  0.8662000     3.451000  0.8294000     -1.225000      1.199000  
1 1 1 17 3  20 o 1.766000  0.5422000     1.635000  0.7362000     1.898000  0.7963000     -0.2629000     1.084000  
1 1 1 17 3  21 o 2.152000  0.5690000     1.777000  0.7676000     2.527000  0.8402000     -0.7494000     1.138000  
1 1 1 17 3  22 o 1.235000  0.4183000     1.183000  0.5716000     1.287000  0.6108000     -0.1037000     0.8366000 
1 1 1 17 3  23 o 1.537000  0.4776000     1.371000  0.6363000     1.703000  0.7123000     -0.3317000     0.9551000 
1 1 1 17 3  24 o 2.061000  0.5558000     2.215000  0.7975000     1.908000  0.7743000     0.3069000      1.112000  
1 1 1 17 3  25 o 1.652000  0.4745000     1.141000  0.5555000     2.163000  0.7695000     -1.022000      0.9491000 
1 1 1 17 4  0  o 0.5679000 0.3166000     0.5679000 0.3166000     0.5679000 0.3166000     -0.000000      0.000000  
1 1 1 17 4  1  o 7.087000  0.8190000E-01 6.982000  0.1193000     7.192000  0.1123000     -0.2104000     0.1638000 
1 1 1 17 4  2  o 10.16000  0.9571000E-01 10.22000  0.1330000     10.10000  0.1377000     0.1298000      0.1914000 
1 1 1 17 4  3  o 17.19000  0.1446000     17.19000  0.2029000     17.18000  0.2061000     0.1232000E-01  0.2892000 
1 1 1 17 4  4  o 11.05000  0.1465000     11.16000  0.1759000     10.94000  0.2342000     0.2201000      0.2929000 
1 1 1 17 4  5  o 7.723000  0.1098000     7.838000  0.1425000     7.608000  0.1671000     0.2292000      0.2196000 
1 1 1 17 4  6  o 17.14000  0.2352000     17.46000  0.3330000     16.82000  0.3323000     0.6319000      0.4704000 
1 1 1 17 4  7  o 5.881000  0.1765000     5.907000  0.2537000     5.855000  0.2453000     0.5181000E-01  0.3529000 
1 1 1 17 4  8  o 12.79000  0.1566000     12.70000  0.2217000     12.88000  0.2212000     -0.1765000     0.3132000 
1 1 1 17 4  9  o 10.82000  0.1649000     10.39000  0.2328000     11.25000  0.2335000     -0.8613000     0.3298000 
1 1 1 17 4  10 o 12.25000  0.1755000     12.27000  0.2493000     12.23000  0.2470000     0.3275000E-01  0.3509000 
1 1 1 17 4  11 o 14.48000  0.2145000     14.40000  0.3042000     14.56000  0.3024000     -0.1593000     0.4290000 
1 1 1 17 4  12 o 3.948000  0.3872000     4.107000  0.5367000     3.790000  0.5582000     0.3165000      0.7744000 
1 1 1 17 4  13 o 15.64000  0.2028000     15.32000  0.2873000     15.96000  0.2862000     -0.6393000     0.4056000 
1 1 1 17 4  14 o 8.259000  0.3085000     7.478000  0.4689000     9.039000  0.4010000     -1.561000      0.6170000 
1 1 1 17 4  15 o 6.372000  0.3351000     6.287000  0.4718000     6.458000  0.4762000     -0.1711000     0.6703000 
1 1 1 17 4  16 o 4.981000  0.6597000     4.538000  0.9984000     5.425000  0.8625000     -0.8871000     1.319000  
1 1 1 17 4  17 o 2.012000  0.6047000     1.934000  0.8369000     2.090000  0.8730000     -0.1561000     1.209000  
1 1 1 17 4  18 o 3.274000  0.6336000     3.314000  0.8952000     3.234000  0.8970000     0.7917000E-01  1.267000  
1 1 1 17 4  19 o 2.428000  0.5745000     1.626000  0.7471000     3.230000  0.8731000     -1.605000      1.149000  
1 1 1 17 4  20 o 2.667000  0.5978000     2.391000  0.8509000     2.942000  0.8398000     -0.5509000     1.196000  
1 1 1 17 4  21 o 1.467000  0.4802000     1.352000  0.6435000     1.581000  0.7130000     -0.2290000     0.9604000 
1 1 1 17 4  22 o 1.621000  0.4928000     1.450000  0.6535000     1.792000  0.7379000     -0.3422000     0.9857000 
1 1 1 17 4  23 o 1.450000  0.4604000     1.552000  0.6767000     1.347000  0.6245000     0.2041000      0.9208000 
1 1 1 17 4  24 o 1.620000  0.4998000     1.384000  0.6465000     1.856000  0.7623000     -0.4720000     0.9996000 
1 1 1 17 4  25 o 1.337000  0.4409000     1.293000  0.6094000     1.382000  0.6374000     -0.8986000E-01 0.8818000 
1 1 1 17 5  0  o 16.95000  0.1925000     16.95000  0.1925000     16.95000  0.1925000     -0.000000      0.000000  
1 1 1 17 5  1  f 1.988000  0.1217000     2.077000  0.1735000     1.898000  0.1707000     0.1795000      0.2434000 
1 1 1 17 5  2  o 5.772000  0.8378000E-01 5.794000  0.1328000     5.750000  0.1021000     0.4448000E-01  0.1676000 
1 1 1 17 5  3  o 14.76000  0.1294000     14.77000  0.1808000     14.75000  0.1851000     0.2003000E-01  0.2588000 
1 1 1 17 5  4  o 9.567000  0.1669000     9.621000  0.1682000     9.513000  0.2884000     0.1071000      0.3339000 
1 1 1 17 5  5  o 11.87000  0.1253000     11.83000  0.1741000     11.91000  0.1802000     -0.8085000E-01 0.2506000 
1 1 1 17 5  6  o 11.20000  0.1496000     11.25000  0.2325000     11.15000  0.1885000     0.1003000      0.2993000 
1 1 1 17 5  7  o 1.270000  0.3724000     1.135000  0.4476000     1.404000  0.5952000     -0.2683000     0.7447000 
1 1 1 17 5  8  o 7.299000  0.1725000     7.352000  0.2454000     7.246000  0.2425000     0.1061000      0.3450000 
1 1 1 17 5  9  o 5.433000  0.2535000     5.232000  0.3759000     5.633000  0.3402000     -0.4012000     0.5070000 
1 1 1 17 5  10 o 2.744000  0.4479000     2.833000  0.6251000     2.655000  0.6417000     0.1777000      0.8958000 
1 1 1 17 5  11 o 4.375000  0.3790000     4.730000  0.4927000     4.020000  0.5760000     0.7104000      0.7580000 
1 1 1 17 5  12 o 11.70000  0.1963000     11.53000  0.2800000     11.88000  0.2753000     -0.3503000     0.3926000 
1 1 1 17 5  13 o 19.17000  0.2117000     19.21000  0.3011000     19.12000  0.2977000     0.9290000E-01  0.4234000 
1 1 1 17 5  14 o 11.63000  0.2238000     11.47000  0.3176000     11.79000  0.3152000     -0.3156000     0.4475000 
1 1 1 17 5  15 o 5.920000  0.3540000     5.964000  0.5000000     5.876000  0.5012000     0.8777000E-01  0.7079000 
1 1 1 17 5  16 o 6.319000  0.4192000     6.744000  0.5639000     5.893000  0.6205000     0.8504000      0.8384000 
1 1 1 17 5  17 o 2.799000  0.6363000     3.278000  0.9023000     2.320000  0.8976000     0.9578000      1.273000  
1 1 1 17 5  18 o 2.246000  0.6227000     2.512000  0.9133000     1.980000  0.8468000     0.5324000      1.245000  
1 1 1 17 5  19 o 2.566000  0.6190000     2.208000  0.8679000     2.924000  0.8829000     -0.7157000     1.238000  
1 1 1 17 5  20 o 1.879000  0.5542000     2.156000  0.8385000     1.603000  0.7247000     0.5535000      1.108000  
1 1 1 17 5  21 o 1.531000  0.4906000     1.349000  0.6455000     1.712000  0.7390000     -0.3629000     0.9812000 
1 1 1 17 5  22 o 1.586000  0.4843000     1.352000  0.6316000     1.820000  0.7343000     -0.4677000     0.9685000 
1 1 1 17 5  23 o 1.286000  0.4283000     1.350000  0.6258000     1.222000  0.5850000     0.1279000      0.8567000 
1 1 1 17 5  24 o 1.157000  0.4003000     1.255000  0.6021000     1.058000  0.5278000     0.1971000      0.8007000 
1 1 1 17 5  25 o 1.133000  0.3904000     1.056000  0.5229000     1.211000  0.5798000     -0.1558000     0.7808000 
1 1 1 17 6  0  o 18.76000  0.2127000     18.76000  0.2127000     18.76000  0.2127000     -0.000000      0.000000  
1 1 1 17 6  1  o 6.266000  0.7679000E-01 6.337000  0.1086000     6.195000  0.1086000     0.1414000      0.1536000 
1 1 1 17 6  2  o 7.873000  0.9120000E-01 8.078000  0.1446000     7.668000  0.1112000     0.4101000      0.1824000 
1 1 1 17 6  3  o 4.903000  0.9912000E-01 5.001000  0.1572000     4.805000  0.1208000     0.1954000      0.1982000 
1 1 1 17 6  4  f 6.544000  0.1381000     6.699000  0.1504000     6.388000  0.2315000     0.3113000      0.2761000 
1 1 1 17 6  5  o 2.859000  0.1931000     2.716000  0.2696000     3.002000  0.2767000     -0.2861000     0.3863000 
1 1 1 17 6  6  o 13.95000  0.1721000     14.11000  0.2450000     13.78000  0.2418000     0.3290000      0.3442000 
1 1 1 17 6  7  o 3.866000  0.1842000     3.833000  0.2408000     3.899000  0.2789000     -0.6558000E-01 0.3685000 
1 1 1 17 6  8  o 16.21000  0.1736000     16.20000  0.2040000     16.21000  0.2810000     -0.1386000E-01 0.3472000 
1 1 1 17 6  9  o 7.823000  0.2058000     7.677000  0.2935000     7.969000  0.2884000     -0.2920000     0.4115000 
1 1 1 17 6  10 o 11.54000  0.1741000     11.54000  0.2469000     11.55000  0.2455000     -0.1159000E-01 0.3482000 
1 1 1 17 6  11 o 8.115000  0.2833000     7.871000  0.4504000     8.360000  0.3438000     -0.4897000     0.5667000 
1 1 1 17 6  12 o 8.248000  0.2229000     8.268000  0.3160000     8.229000  0.3145000     0.3909000E-01  0.4458000 
1 1 1 17 6  13 o 9.140000  0.2263000     8.935000  0.3226000     9.346000  0.3176000     -0.4110000     0.4527000 
1 1 1 17 6  14 o 14.53000  0.2123000     14.81000  0.3002000     14.25000  0.3002000     0.5571000      0.4245000 
1 1 1 17 6  15 o 9.954000  0.2502000     9.934000  0.3544000     9.973000  0.3532000     -0.3894000E-01 0.5003000 
1 1 1 17 6  16 o 5.302000  0.4877000     5.292000  0.6938000     5.312000  0.6856000     -0.1971000E-01 0.9754000 
1 1 1 17 6  17 o 4.559000  0.5019000     4.582000  0.7045000     4.536000  0.7151000     0.4639000E-01  1.004000  
1 1 1 17 6  18 o 2.097000  0.6150000     2.029000  0.8590000     2.165000  0.8803000     -0.1364000     1.230000  
1 1 1 17 6  19 o 1.645000  0.5399000     1.895000  0.8383000     1.395000  0.6805000     0.5002000      1.080000  
1 1 1 17 6  20 o 3.539000  0.5238000     3.480000  0.7611000     3.598000  0.7197000     -0.1184000     1.048000  
1 1 1 17 6  21 o 1.960000  0.5250000     1.351000  0.6448000     2.569000  0.8288000     -1.218000      1.050000  
1 1 1 17 6  22 f 1.391000  0.4521000     1.484000  0.6679000     1.297000  0.6097000     0.1868000      0.9043000 
1 1 1 17 6  23 o 1.840000  0.5061000     2.195000  0.7672000     1.484000  0.6604000     0.7112000      1.012000  
1 1 1 17 6  24 o 2.581000  0.5885000     2.299000  0.8823000     2.863000  0.7789000     -0.5638000     1.177000  
1 1 1 17 6  25 o 1.254000  0.4187000     1.002000  0.4990000     1.507000  0.6726000     -0.5047000     0.8375000 
1 1 1 17 7  0  o 0.7573000 0.3880000     0.7573000 0.3880000     0.7573000 0.3880000     0.000000       0.000000  
1 1 1 17 7  1  o 11.66000  0.1038000     11.62000  0.1458000     11.70000  0.1478000     -0.7936000E-01 0.2076000 
1 1 1 17 7  2  o 10.87000  0.1020000     10.81000  0.1436000     10.92000  0.1450000     -0.1151000     0.2041000 
1 1 1 17 7  3  f 7.984000  0.1003000     8.050000  0.1589000     7.918000  0.1224000     0.1314000      0.2006000 
1 1 1 17 7  4  o 6.928000  0.1098000     6.883000  0.1514000     6.973000  0.1590000     -0.8984000E-01 0.2196000 
1 1 1 17 7  5  o 8.415000  0.1325000     8.527000  0.1642000     8.303000  0.2081000     0.2241000      0.2651000 
1 1 1 17 7  6  o 6.925000  0.1340000     6.996000  0.1819000     6.853000  0.1968000     0.1432000      0.2679000 
1 1 1 17 7  7  o 8.350000  0.1374000     8.423000  0.1899000     8.277000  0.1988000     0.1458000      0.2749000 
1 1 1 17 7  8  o 12.67000  0.1418000     12.78000  0.1874000     12.56000  0.2128000     0.2206000      0.2836000 
1 1 1 17 7  9  o 20.09000  0.2447000     20.19000  0.2981000     19.98000  0.3881000     0.2100000      0.4894000 
1 1 1 17 7  10 o 17.18000  0.2014000     17.25000  0.2624000     17.11000  0.3057000     0.1379000      0.4028000 
1 1 1 17 7  11 f 5.128000  0.4180000     4.931000  0.5989000     5.326000  0.5832000     -0.3943000     0.8359000 
1 1 1 17 7  12 o 6.068000  0.2738000     6.345000  0.3681000     5.790000  0.4055000     0.5547000      0.5477000 
1 1 1 17 7  13 o 6.599000  0.2758000     6.817000  0.3790000     6.381000  0.4006000     0.4358000      0.5515000 
1 1 1 17 7  14 o 7.546000  0.3065000     7.152000  0.4520000     7.941000  0.4141000     -0.7884000     0.6129000 
1 1 1 17 7  15 o 5.712000  0.3638000     5.993000  0.4870000     5.431000  0.5407000     0.5614000      0.7276000 
1 1 1 17 7  16 o 7.100000  0.3793000     6.886000  0.5389000     7.314000  0.5340000     -0.4285000     0.7587000 
1 1 1 17 7  17 o 2.614000  0.6456000     2.736000  0.9129000     2.492000  0.9131000     0.2438000      1.291000  
1 1 1 17 7  18 o 2.064000  0.6000000     2.315000  0.8924000     1.813000  0.8023000     0.5020000      1.200000  
1 1 1 17 7  19 o 2.416000  0.6435000     2.699000  0.9476000     2.133000  0.8708000     0.5658000      1.287000  
1 1 1 17 7  20 o 1.586000  0.5024000     1.387000  0.6523000     1.784000  0.7643000     -0.3964000     1.005000  
1 1 1 17 7  21 o 2.870000  0.6164000     3.291000  0.9071000     2.450000  0.8349000     0.8414000      1.233000  
1 1 1 17 7  22 o 1.581000  0.4824000     1.781000  0.7252000     1.382000  0.6363000     0.3989000      0.9648000 
1 1 1 17 7  23 o 2.417000  0.5089000     2.949000  0.6977000     1.886000  0.7410000     1.063000       1.018000  
1 1 1 17 7  24 o 1.633000  0.5210000     2.018000  0.8432000     1.249000  0.6123000     0.7686000      1.042000  
1 1 1 17 7  25 o 1.756000  0.4840000     2.232000  0.7566000     1.281000  0.6038000     0.9507000      0.9680000 
1 1 1 17 8  0  o 11.37000  0.1464000     11.37000  0.1464000     11.37000  0.1464000     0.000000       0.000000  
1 1 1 17 8  1  o 17.76000  0.1459000     17.64000  0.2046000     17.87000  0.2081000     -0.2320000     0.2918000 
1 1 1 17 8  2  o 14.29000  0.1242000     14.37000  0.1764000     14.20000  0.1751000     0.1616000      0.2485000 
1 1 1 17 8  3  o 7.671000  0.1239000     7.482000  0.1918000     7.861000  0.1569000     -0.3786000     0.2478000 
1 1 1 17 8  4  o 3.160000  0.1566000     3.065000  0.2508000     3.255000  0.1876000     -0.1899000     0.3132000 
1 1 1 17 8  5  o 1.795000  0.3466000     1.519000  0.4801000     2.071000  0.5002000     -0.5523000     0.6933000 
1 1 1 17 8  6  o 2.886000  0.2267000     3.006000  0.2787000     2.765000  0.3577000     0.2412000      0.4534000 
1 1 1 17 8  7  o 5.447000  0.1602000     5.552000  0.2152000     5.343000  0.2374000     0.2084000      0.3205000 
1 1 1 17 8  8  o 1.802000  0.3698000     1.963000  0.4905000     1.641000  0.5535000     0.3219000      0.7396000 
1 1 1 17 8  9  f 6.636000  0.2852000     6.548000  0.2502000     6.725000  0.5126000     -0.1769000     0.5704000 
1 1 1 17 8  10 o 2.480000  0.4458000     2.631000  0.4739000     2.329000  0.7552000     0.3015000      0.8915000 
1 1 1 17 8  11 o 4.940000  0.3532000     5.598000  0.4418000     4.282000  0.5512000     1.316000       0.7064000 
1 1 1 17 8  12 o 22.87000  0.2222000     22.82000  0.3143000     22.92000  0.3142000     -0.1060000     0.4444000 
1 1 1 17 8  13 o 5.085000  0.3539000     5.579000  0.4528000     4.591000  0.5440000     0.9880000      0.7078000 
1 1 1 17 8  14 o 9.278000  0.2825000     9.542000  0.3870000     9.014000  0.4116000     0.5285000      0.5650000 
1 1 1 17 8  15 o 4.936000  0.4146000     4.547000  0.6363000     5.325000  0.5317000     -0.7786000     0.8292000 
1 1 1 17 8  16 o 9.274000  0.3614000     9.302000  0.5602000     9.245000  0.4568000     0.5673000E-01  0.7228000 
1 1 1 17 8  17 o 2.998000  0.5896000     3.893000  0.8008000     2.103000  0.8657000     1.790000       1.179000  
1 1 1 17 8  18 o 2.198000  0.5947000     2.708000  0.9098000     1.688000  0.7662000     1.020000       1.189000  
1 1 1 17 8  19 o 2.583000  0.6380000     2.922000  0.9213000     2.244000  0.8827000     0.6781000      1.276000  
1 1 1 17 8  20 o 1.687000  0.5050000     2.102000  0.8024000     1.272000  0.6133000     0.8300000      1.010000  
1 1 1 17 8  21 o 3.281000  0.6224000     2.369000  0.9109000     4.193000  0.8485000     -1.824000      1.245000  
1 1 1 17 8  22 o 1.635000  0.4938000     1.732000  0.7185000     1.538000  0.6776000     0.1944000      0.9876000 
1 1 1 17 8  23 o 2.367000  0.5354000     2.138000  0.7545000     2.597000  0.7597000     -0.4588000     1.071000  
1 1 1 17 8  24 o 1.762000  0.5453000     1.724000  0.7527000     1.799000  0.7892000     -0.7433000E-01 1.091000  
1 1 1 17 8  25 o 1.559000  0.4767000     1.792000  0.7272000     1.327000  0.6167000     0.4654000      0.9535000 
1 1 1 17 9  0  o 0.3949000 0.2787000     0.3949000 0.2787000     0.3949000 0.2787000     -0.000000      0.000000  
1 1 1 17 9  1  o 3.884000  0.1042000     3.985000  0.1440000     3.783000  0.1507000     0.2024000      0.2084000 
1 1 1 17 9  2  f 10.25000  0.1031000     10.25000  0.1455000     10.25000  0.1462000     0.1081000E-02  0.2063000 
1 1 1 17 9  3  o 12.66000  0.1485000     12.71000  0.1917000     12.61000  0.2267000     0.9881000E-01  0.2969000 
1 1 1 17 9  4  o 8.238000  0.1121000     8.313000  0.1761000     8.163000  0.1388000     0.1500000      0.2242000 
1 1 1 17 9  5  o 11.81000  0.2149000     11.99000  0.3995000     11.63000  0.1585000     0.3561000      0.4298000 
1 1 1 17 9  6  o 2.008000  0.3042000     2.611000  0.3369000     1.405000  0.5066000     1.206000       0.6084000 
1 1 1 17 9  7  o 3.844000  0.2065000     3.608000  0.2847000     4.079000  0.2992000     -0.4710000     0.4130000 
1 1 1 17 9  8  o 6.158000  0.1645000     6.163000  0.2242000     6.153000  0.2408000     0.1003000E-01  0.3290000 
1 1 1 17 9  9  o 15.89000  0.2134000     15.79000  0.2357000     16.00000  0.3559000     -0.2092000     0.4269000 
1 1 1 17 9  10 o 3.391000  0.2910000     3.062000  0.4378000     3.719000  0.3833000     -0.6569000     0.5819000 
1 1 1 17 9  11 o 14.57000  0.2167000     14.74000  0.3057000     14.40000  0.3071000     0.3359000      0.4333000 
1 1 1 17 9  12 o 8.527000  0.2197000     8.545000  0.2431000     8.509000  0.3659000     0.3630000E-01  0.4393000 
1 1 1 17 9  13 o 5.773000  0.3108000     5.972000  0.4320000     5.573000  0.4469000     0.3995000      0.6216000 
1 1 1 17 9  14 o 8.864000  0.2881000     8.907000  0.4162000     8.821000  0.3986000     0.8591000E-01  0.5763000 
1 1 1 17 9  15 o 9.953000  0.2475000     9.792000  0.3547000     10.11000  0.3453000     -0.3207000     0.4950000 
1 1 1 17 9  16 o 3.688000  0.6627000     5.034000  0.9252000     2.342000  0.9490000     2.692000       1.325000  
1 1 1 17 9  17 o 2.229000  0.5968000     1.650000  0.7597000     2.809000  0.9207000     -1.159000      1.194000  
1 1 1 17 9  18 o 3.588000  0.5823000     3.460000  0.8543000     3.716000  0.7916000     -0.2564000     1.165000  
1 1 1 17 9  19 o 2.703000  0.6428000     2.338000  0.8972000     3.069000  0.9209000     -0.7306000     1.286000  
1 1 1 17 9  20 o 3.721000  0.4780000     3.933000  0.6308000     3.509000  0.7184000     0.4238000      0.9560000 
1 1 1 17 9  21 o 2.928000  0.6429000     2.913000  0.9372000     2.943000  0.8803000     -0.3010000E-01 1.286000  
1 1 1 17 9  22 o 1.736000  0.4836000     2.226000  0.7641000     1.246000  0.5929000     0.9794000      0.9671000 
1 1 1 17 9  23 o 1.497000  0.4575000     1.886000  0.7380000     1.109000  0.5410000     0.7772000      0.9151000 
1 1 1 17 9  24 o 1.468000  0.4795000     1.614000  0.7235000     1.322000  0.6293000     0.2913000      0.9589000 
1 1 1 17 9  25 o 1.488000  0.4681000     1.420000  0.6457000     1.556000  0.6779000     -0.1359000     0.9362000 
1 1 1 17 10 0  o 6.105000  0.1324000     6.105000  0.1324000     6.105000  0.1324000     0.000000       0.000000  
1 1 1 17 10 1  o 8.507000  0.9615000E-01 8.597000  0.1354000     8.417000  0.1366000     0.1795000      0.1923000 
1 1 1 17 10 2  o 13.00000  0.1467000     13.03000  0.2392000     12.97000  0.1698000     0.6151000E-01  0.2934000 
1 1 1 17 10 3  o 6.069000  0.1065000     6.223000  0.1452000     5.916000  0.1558000     0.3068000      0.2130000 
1 1 1 17 10 4  o 5.856000  0.1502000     5.882000  0.1670000     5.830000  0.2498000     0.5219000E-01  0.3005000 
1 1 1 17 10 5  o 10.79000  0.1270000     10.79000  0.2006000     10.78000  0.1557000     0.1159000E-01  0.2540000 
1 1 1 17 10 6  o 19.25000  0.1731000     19.14000  0.2417000     19.37000  0.2478000     -0.2270000     0.3461000 
1 1 1 17 10 7  o 15.77000  0.1585000     15.88000  0.2219000     15.65000  0.2263000     0.2333000      0.3169000 
1 1 1 17 10 8  o 18.33000  0.1756000     18.43000  0.2463000     18.24000  0.2504000     0.1885000      0.3512000 
1 1 1 17 10 9  o 9.453000  0.1657000     9.297000  0.2183000     9.609000  0.2493000     -0.3128000     0.3313000 
1 1 1 17 10 10 o 9.179000  0.1649000     9.175000  0.2326000     9.182000  0.2338000     -0.6829000E-02 0.3298000 
1 1 1 17 10 11 o 19.33000  0.1932000     18.97000  0.2705000     19.69000  0.2760000     -0.7228000     0.3864000 
1 1 1 17 10 12 o 8.652000  0.2181000     8.373000  0.2423000     8.931000  0.3626000     -0.5587000     0.4361000 
1 1 1 17 10 13 o 14.91000  0.2092000     15.10000  0.2414000     14.72000  0.3418000     0.3815000      0.4184000 
1 1 1 17 10 14 o 3.955000  0.7083000     4.784000  0.8283000     3.127000  1.149000      1.657000       1.417000  
1 1 1 17 10 15 o 2.637000  0.5849000     2.094000  0.8342000     3.181000  0.8200000     -1.087000      1.170000  
1 1 1 17 10 16 o 6.243000  0.4259000     6.591000  0.5854000     5.895000  0.6189000     0.6958000      0.8519000 
1 1 1 17 10 17 o 6.856000  0.3527000     6.387000  0.5348000     7.326000  0.4599000     -0.9397000     0.7053000 
1 1 1 17 10 18 o 2.347000  0.6201000     2.478000  0.8874000     2.217000  0.8664000     0.2607000      1.240000  
1 1 1 17 10 19 o 2.003000  0.6292000     1.931000  0.8828000     2.075000  0.8969000     -0.1444000     1.258000  
1 1 1 17 10 20 o 2.595000  0.5467000     3.057000  0.7509000     2.133000  0.7949000     0.9234000      1.093000  
1 1 1 17 10 21 o 2.058000  0.5793000     1.974000  0.8057000     2.142000  0.8325000     -0.1687000     1.159000  
1 1 1 17 10 22 f 1.280000  0.4207000     1.504000  0.6607000     1.056000  0.5209000     0.4474000      0.8414000 
1 1 1 17 10 23 o 2.800000  0.5045000     3.294000  0.6615000     2.306000  0.7620000     0.9880000      1.009000  
1 1 1 17 10 24 o 1.354000  0.4506000     1.161000  0.5729000     1.547000  0.6955000     -0.3858000     0.9011000 
1 1 1 17 10 25 f 1.243000  0.4206000     1.314000  0.6169000     1.171000  0.5718000     0.1434000      0.8411000 
1 1 1 17 11 0  o 4.749000  0.1480000     4.749000  0.1480000     4.749000  0.1480000     0.000000       0.000000  
1 1 1 17 11 1  o 7.308000  0.1057000     7.174000  0.1604000     7.443000  0.1376000     -0.2690000     0.2114000 
1 1 1 17 11 2  o 10.48000  0.1358000     10.41000  0.1735000     10.55000  0.2089000     -0.1367000     0.2715000 
1 1 1 17 11 3  o 6.279000  0.1145000     6.347000  0.1489000     6.210000  0.1741000     0.1369000      0.2291000 
1 1 1 17 11 4  o 6.825000  0.1466000     6.896000  0.2217000     6.755000  0.1918000     0.1403000      0.2931000 
1 1 1 17 11 5  o 1.535000  0.2879000     1.835000  0.3754000     1.235000  0.4365000     0.5994000      0.5757000 
1 1 1 17 11 6  o 7.683000  0.1310000     7.950000  0.2078000     7.417000  0.1595000     0.5327000      0.2619000 
1 1 1 17 11 7  o 16.60000  0.1624000     16.66000  0.2271000     16.55000  0.2322000     0.1067000      0.3248000 
1 1 1 17 11 8  o 10.55000  0.1699000     10.29000  0.2021000     10.81000  0.2731000     -0.5171000     0.3398000 
1 1 1 17 11 9  o 2.458000  0.3737000     2.618000  0.4705000     2.299000  0.5807000     0.3188000      0.7474000 
1 1 1 17 11 10 o 2.867000  0.3744000     2.937000  0.4522000     2.796000  0.5967000     0.1410000      0.7487000 
1 1 1 17 11 11 o 4.134000  0.2679000     4.385000  0.3518000     3.883000  0.4041000     0.5023000      0.5357000 
1 1 1 17 11 12 o 18.80000  0.1964000     18.69000  0.2771000     18.91000  0.2785000     -0.2210000     0.3929000 
1 1 1 17 11 13 o 5.480000  0.2414000     5.315000  0.3242000     5.644000  0.3577000     -0.3290000     0.4828000 
1 1 1 17 11 14 o 9.612000  0.2916000     9.960000  0.2841000     9.264000  0.5093000     0.6959000      0.5832000 
1 1 1 17 11 15 o 3.168000  0.5607000     2.777000  0.6667000     3.558000  0.9017000     -0.7812000     1.121000  
1 1 1 17 11 16 o 3.166000  0.6593000     3.900000  0.9086000     2.432000  0.9555000     1.467000       1.319000  
1 1 1 17 11 17 o 2.789000  0.5822000     1.819000  0.8115000     3.758000  0.8350000     -1.939000      1.164000  
1 1 1 17 11 18 o 2.627000  0.5811000     3.333000  0.8344000     1.921000  0.8091000     1.412000       1.162000  
1 1 1 17 11 19 o 2.572000  0.7050000     2.483000  1.007000      2.661000  0.9866000     -0.1777000     1.410000  
1 1 1 17 11 20 o 1.717000  0.5023000     1.324000  0.6244000     2.110000  0.7871000     -0.7853000     1.005000  
1 1 1 17 11 21 o 1.581000  0.5063000     1.482000  0.6856000     1.680000  0.7451000     -0.1978000     1.013000  
1 1 1 17 11 22 o 1.630000  0.4920000     1.754000  0.7218000     1.506000  0.6688000     0.2474000      0.9840000 
1 1 1 17 11 23 o 1.719000  0.4774000     1.243000  0.5890000     2.195000  0.7516000     -0.9523000     0.9549000 
1 1 1 17 11 24 o 1.710000  0.5084000     2.130000  0.8099000     1.290000  0.6149000     0.8400000      1.017000  
1 1 1 17 11 25 o 1.200000  0.4182000     1.054000  0.5277000     1.346000  0.6489000     -0.2925000     0.8364000 
1 1 1 17 12 0  o 6.693000  0.1718000     6.693000  0.1718000     6.693000  0.1718000     0.000000       0.000000  
1 1 1 17 12 1  o 6.037000  0.1620000     6.025000  0.1645000     6.049000  0.2792000     -0.2374000E-01 0.3240000 
1 1 1 17 12 2  o 12.28000  0.1502000     12.41000  0.1686000     12.15000  0.2485000     0.2685000      0.3003000 
1 1 1 17 12 3  o 8.906000  0.1430000     9.054000  0.2196000     8.757000  0.1833000     0.2969000      0.2860000 
1 1 1 17 12 4  o 5.500000  0.1170000     5.522000  0.1661000     5.477000  0.1648000     0.4490000E-01  0.2340000 
1 1 1 17 12 5  o 6.086000  0.1198000     6.162000  0.1677000     6.010000  0.1711000     0.1523000      0.2395000 
1 1 1 17 12 6  o 7.389000  0.1325000     7.373000  0.2080000     7.406000  0.1644000     -0.3301000E-01 0.2651000 
1 1 1 17 12 7  o 3.601000  0.2071000     3.463000  0.3349000     3.738000  0.2436000     -0.2747000     0.4142000 
1 1 1 17 12 8  o 5.829000  0.1899000     6.066000  0.2524000     5.592000  0.2838000     0.4735000      0.3798000 
1 1 1 17 12 9  o 4.380000  0.2293000     4.440000  0.3042000     4.319000  0.3432000     0.1210000      0.4586000 
1 1 1 17 12 10 o 9.075000  0.2052000     8.720000  0.2985000     9.430000  0.2817000     -0.7103000     0.4105000 
1 1 1 17 12 11 o 7.511000  0.1945000     7.658000  0.2693000     7.363000  0.2806000     0.2953000      0.3890000 
1 1 1 17 12 12 o 5.997000  0.2316000     5.478000  0.3477000     6.516000  0.3060000     -1.038000      0.4631000 
1 1 1 17 12 13 o 10.50000  0.2017000     10.50000  0.2646000     10.51000  0.3045000     -0.1042000E-01 0.4034000 
1 1 1 17 12 14 o 6.332000  0.3743000     6.544000  0.3394000     6.121000  0.6672000     0.4231000      0.7486000 
1 1 1 17 12 15 o 9.293000  0.2579000     9.367000  0.2791000     9.219000  0.4337000     0.1482000      0.5158000 
1 1 1 17 12 16 o 3.475000  0.5648000     3.622000  0.6106000     3.327000  0.9504000     0.2954000      1.130000  
1 1 1 17 12 17 o 3.020000  0.5305000     3.845000  0.5294000     2.195000  0.9194000     1.650000       1.061000  
1 1 1 17 12 18 o 1.959000  0.5668000     1.615000  0.7355000     2.303000  0.8625000     -0.6879000     1.134000  
1 1 1 17 12 19 o 1.962000  0.6016000     1.837000  0.8325000     2.087000  0.8687000     -0.2502000     1.203000  
1 1 1 17 12 20 o 2.391000  0.5328000     2.968000  0.7602000     1.815000  0.7466000     1.153000       1.066000  
1 1 1 17 12 21 o 1.823000  0.5357000     1.935000  0.7540000     1.711000  0.7613000     0.2235000      1.071000  
1 1 1 17 12 22 o 3.101000  0.4931000     3.421000  0.6491000     2.781000  0.7424000     0.6393000      0.9862000 
1 1 1 17 12 23 o 1.839000  0.5168000     1.832000  0.7331000     1.845000  0.7286000     -0.1277000E-01 1.034000  
1 1 1 17 12 24 o 1.148000  0.3999000     1.262000  0.6116000     1.034000  0.5154000     0.2276000      0.7998000 
1 1 1 17 13 0  o 11.94000  0.3240000     11.94000  0.3240000     11.94000  0.3240000     0.000000       0.000000  
1 1 1 17 13 1  f 5.120000  0.1515000     5.189000  0.2109000     5.051000  0.2175000     0.1377000      0.3029000 
1 1 1 17 13 2  f 10.25000  0.1449000     10.32000  0.2216000     10.18000  0.1868000     0.1434000      0.2898000 
1 1 1 17 13 3  o 11.37000  0.1190000     11.42000  0.1685000     11.32000  0.1681000     0.9572000E-01  0.2380000 
1 1 1 17 13 4  o 7.789000  0.1128000     7.707000  0.1602000     7.870000  0.1588000     -0.1623000     0.2255000 
1 1 1 17 13 5  o 4.585000  0.1373000     4.683000  0.1885000     4.488000  0.1997000     0.1957000      0.2746000 
1 1 1 17 13 6  o 18.33000  0.1653000     18.64000  0.2368000     18.02000  0.2307000     0.6213000      0.3306000 
1 1 1 17 13 7  o 13.50000  0.1512000     13.33000  0.2379000     13.66000  0.1868000     -0.3284000     0.3024000 
1 1 1 17 13 8  f 19.04000  0.2909000     19.43000  0.2943000     18.64000  0.5020000     0.7894000      0.5819000 
1 1 1 17 13 9  o 5.031000  0.2056000     5.017000  0.2825000     5.046000  0.2989000     -0.2938000E-01 0.4112000 
1 1 1 17 13 10 o 10.84000  0.2901000     10.47000  0.5270000     11.20000  0.2428000     -0.7329000     0.5802000 
1 1 1 17 13 11 o 7.252000  0.1930000     7.234000  0.2625000     7.270000  0.2831000     -0.3594000E-01 0.3861000 
1 1 1 17 13 12 o 9.862000  0.1881000     9.539000  0.2695000     10.18000  0.2625000     -0.6455000     0.3763000 
1 1 1 17 13 13 o 8.469000  0.2149000     8.501000  0.3168000     8.437000  0.2904000     0.6310000E-01  0.4298000 
1 1 1 17 13 14 o 8.225000  0.2223000     7.999000  0.3100000     8.451000  0.3186000     -0.4521000     0.4446000 
1 1 1 17 13 15 o 5.349000  0.3139000     5.434000  0.4064000     5.263000  0.4785000     0.1713000      0.6278000 
1 1 1 17 13 16 o 3.616000  0.4372000     2.970000  0.6705000     4.262000  0.5613000     -1.292000      0.8744000 
1 1 1 17 13 17 o 5.195000  0.4050000     4.716000  0.4811000     5.674000  0.6517000     -0.9583000     0.8101000 
1 1 1 17 13 18 o 5.369000  0.3903000     5.525000  0.3892000     5.213000  0.6767000     0.3116000      0.7806000 
1 1 1 17 13 19 o 3.554000  0.6954000     2.590000  0.9577000     4.517000  1.008000      -1.926000      1.391000  
1 1 1 17 13 20 o 2.320000  0.5606000     2.222000  0.7772000     2.419000  0.8081000     -0.1964000     1.121000  
1 1 1 17 13 21 o 1.337000  0.4398000     1.468000  0.6608000     1.207000  0.5807000     0.2616000      0.8797000 
1 1 1 17 13 22 o 1.866000  0.4836000     1.276000  0.6021000     2.456000  0.7570000     -1.179000      0.9673000 
1 1 1 17 13 23 o 1.365000  0.4404000     1.503000  0.6624000     1.226000  0.5805000     0.2771000      0.8808000 
1 1 1 17 13 24 o 1.462000  0.4611000     1.399000  0.6366000     1.526000  0.6672000     -0.1262000     0.9222000 
1 1 1 17 14 0  o 11.28000  0.1636000     11.28000  0.1636000     11.28000  0.1636000     -0.000000      0.000000  
1 1 1 17 14 1  o 4.700000  0.1193000     4.652000  0.1679000     4.749000  0.1697000     -0.9737000E-01 0.2387000 
1 1 1 17 14 2  o 6.655000  0.1081000     6.604000  0.1516000     6.706000  0.1541000     -0.1022000     0.2161000 
1 1 1 17 14 3  o 13.93000  0.1326000     13.89000  0.1870000     13.97000  0.1879000     -0.7817000E-01 0.2651000 
1 1 1 17 14 4  o 7.805000  0.1141000     7.643000  0.1617000     7.968000  0.1610000     -0.3247000     0.2282000 
1 1 1 17 14 5  o 18.15000  0.1621000     18.19000  0.2300000     18.11000  0.2285000     0.8286000E-01  0.3242000 
1 1 1 17 14 6  o 22.43000  0.1920000     22.37000  0.2706000     22.49000  0.2726000     -0.1122000     0.3841000 
1 1 1 17 14 7  o 21.78000  0.1900000     21.71000  0.2678000     21.84000  0.2695000     -0.1299000     0.3799000 
1 1 1 17 14 8  o 8.142000  0.1707000     7.878000  0.2435000     8.407000  0.2393000     -0.5287000     0.3414000 
1 1 1 17 14 9  o 9.703000  0.1598000     9.810000  0.2204000     9.596000  0.2315000     0.2132000      0.3197000 
1 1 1 17 14 10 o 7.187000  0.2214000     7.316000  0.3552000     7.059000  0.2646000     0.2563000      0.4429000 
1 1 1 17 14 11 o 6.663000  0.2028000     6.467000  0.2782000     6.860000  0.2951000     -0.3933000     0.4056000 
1 1 1 17 14 12 o 8.220000  0.1980000     8.279000  0.2721000     8.161000  0.2879000     0.1175000      0.3961000 
1 1 1 17 14 13 o 10.34000  0.1971000     10.32000  0.2786000     10.35000  0.2788000     -0.2883000E-01 0.3941000 
1 1 1 17 14 14 o 9.731000  0.2534000     10.05000  0.2987000     9.411000  0.4094000     0.6402000      0.5068000 
1 1 1 17 14 15 o 7.469000  0.2779000     7.820000  0.3732000     7.117000  0.4120000     0.7039000      0.5559000 
1 1 1 17 14 16 o 6.651000  0.2726000     6.781000  0.3717000     6.520000  0.3988000     0.2612000      0.5451000 
1 1 1 17 14 17 o 5.109000  0.3356000     5.098000  0.4684000     5.120000  0.4807000     -0.2189000E-01 0.6712000 
1 1 1 17 14 18 o 3.419000  0.5459000     3.292000  0.6473000     3.547000  0.8793000     -0.2543000     1.092000  
1 1 1 17 14 19 o 1.859000  0.5878000     1.353000  0.6233000     2.365000  0.9967000     -1.012000      1.176000  
1 1 1 17 14 20 o 1.341000  0.4365000     1.428000  0.6187000     1.255000  0.6159000     0.1733000      0.8730000 
1 1 1 17 14 21 o 1.709000  0.4896000     1.850000  0.6602000     1.569000  0.7232000     0.2805000      0.9792000 
1 1 1 17 14 22 o 2.404000  0.5364000     2.409000  0.7540000     2.398000  0.7632000     0.1096000E-01  1.073000  
1 1 1 17 14 23 o 1.502000  0.4746000     1.430000  0.6461000     1.574000  0.6953000     -0.1447000     0.9491000 
1 1 1 17 14 24 o 0.9802000 0.3459000     0.9523000 0.4781000     1.008000  0.5000000     -0.5587000E-01 0.6918000 
1 1 1 17 15 0  o 2.113000  0.3358000     2.113000  0.3358000     2.113000  0.3358000     0.000000       0.000000  
1 1 1 17 15 1  o 8.054000  0.1089000     8.094000  0.1532000     8.014000  0.1548000     0.8005000E-01  0.2178000 
1 1 1 17 15 2  o 6.450000  0.1120000     6.343000  0.1575000     6.556000  0.1592000     -0.2128000     0.2239000 
1 1 1 17 15 3  o 14.50000  0.1369000     14.56000  0.1937000     14.44000  0.1937000     0.1138000      0.2739000 
1 1 1 17 15 4  o 7.227000  0.1184000     7.275000  0.1676000     7.179000  0.1673000     0.9597000E-01  0.2368000 
1 1 1 17 15 5  o 6.573000  0.1253000     6.666000  0.1765000     6.479000  0.1779000     0.1875000      0.2506000 
1 1 1 17 15 6  o 4.589000  0.1570000     4.585000  0.2200000     4.592000  0.2241000     -0.7444000E-02 0.3140000 
1 1 1 17 15 7  o 6.160000  0.1604000     6.129000  0.2498000     6.191000  0.2014000     -0.6219000E-01 0.3209000 
1 1 1 17 15 8  o 13.37000  0.1591000     13.48000  0.2525000     13.27000  0.1936000     0.2129000      0.3182000 
1 1 1 17 15 9  o 8.428000  0.1901000     8.305000  0.2576000     8.550000  0.2796000     -0.2451000     0.3802000 
1 1 1 17 15 10 o 10.92000  0.1685000     10.92000  0.2348000     10.91000  0.2418000     0.1060000E-01  0.3371000 
1 1 1 17 15 11 o 9.150000  0.1837000     8.928000  0.2566000     9.372000  0.2628000     -0.4442000     0.3673000 
1 1 1 17 15 12 o 3.823000  0.3415000     3.690000  0.4909000     3.956000  0.4748000     -0.2662000     0.6830000 
1 1 1 17 15 13 o 9.710000  0.2205000     9.502000  0.3132000     9.918000  0.3104000     -0.4160000     0.4409000 
1 1 1 17 15 14 o 7.831000  0.2321000     8.024000  0.3209000     7.638000  0.3355000     0.3866000      0.4643000 
1 1 1 17 15 15 f 6.825000  0.3054000     7.390000  0.4161000     6.261000  0.4472000     1.129000       0.6109000 
1 1 1 17 15 16 o 10.13000  0.2187000     10.38000  0.3065000     9.874000  0.3120000     0.5106000      0.4374000 
1 1 1 17 15 17 o 1.689000  0.5107000     1.824000  0.7511000     1.554000  0.6922000     0.2701000      1.021000  
1 1 1 17 15 18 o 2.216000  0.5240000     2.696000  0.7468000     1.736000  0.7353000     0.9594000      1.048000  
1 1 1 17 15 19 o 3.100000  0.5121000     3.649000  0.6911000     2.550000  0.7559000     1.099000       1.024000  
1 1 1 17 15 20 o 1.957000  0.5443000     1.969000  0.6870000     1.946000  0.8444000     0.2271000E-01  1.089000  
1 1 1 17 15 21 o 1.562000  0.4849000     1.279000  0.5748000     1.845000  0.7811000     -0.5668000     0.9698000 
1 1 1 17 15 22 f 1.078000  0.3683000     1.166000  0.5401000     0.9896000 0.5009000     0.1766000      0.7366000 
1 1 1 17 15 23 o 1.451000  0.4549000     1.539000  0.6331000     1.363000  0.6533000     0.1756000      0.9098000 
1 1 1 17 15 24 o 1.556000  0.4933000     1.464000  0.6560000     1.647000  0.7369000     -0.1835000     0.9866000 
1 1 1 17 16 0  o 0.4362000 0.3122000     0.4362000 0.3122000     0.4362000 0.3122000     0.000000       0.000000  
1 1 1 17 16 1  o 5.013000  0.1240000     5.157000  0.1721000     4.869000  0.1786000     0.2879000      0.2480000 
1 1 1 17 16 2  o 6.094000  0.1174000     6.043000  0.1649000     6.145000  0.1670000     -0.1023000     0.2347000 
1 1 1 17 16 3  o 13.49000  0.1328000     13.27000  0.1862000     13.71000  0.1893000     -0.4447000     0.2655000 
1 1 1 17 16 4  o 14.64000  0.1411000     14.79000  0.2004000     14.50000  0.1988000     0.2843000      0.2822000 
1 1 1 17 16 5  o 16.34000  0.1532000     16.41000  0.2168000     16.26000  0.2164000     0.1454000      0.3063000 
1 1 1 17 16 6  o 9.976000  0.1304000     10.07000  0.1850000     9.888000  0.1838000     0.1773000      0.2608000 
1 1 1 17 16 7  o 10.39000  0.1770000     10.36000  0.2711000     10.41000  0.2276000     -0.4737000E-01 0.3540000 
1 1 1 17 16 8  o 7.393000  0.1455000     7.505000  0.2020000     7.282000  0.2093000     0.2224000      0.2909000 
1 1 1 17 16 9  o 12.12000  0.2839000     11.97000  0.5163000     12.27000  0.2362000     -0.3038000     0.5677000 
1 1 1 17 16 10 o 12.69000  0.1712000     13.00000  0.2389000     12.38000  0.2454000     0.6170000      0.3425000 
1 1 1 17 16 11 o 4.850000  0.2536000     4.731000  0.3607000     4.970000  0.3565000     -0.2390000     0.5072000 
1 1 1 17 16 12 o 1.673000  0.4654000     1.391000  0.6142000     1.955000  0.6995000     -0.5636000     0.9309000 
1 1 1 17 16 13 f 6.308000  0.3548000     5.989000  0.3841000     6.628000  0.5967000     -0.6394000     0.7097000 
1 1 1 17 16 14 o 6.485000  0.2742000     6.432000  0.3754000     6.538000  0.3998000     -0.1053000     0.5485000 
1 1 1 17 16 15 o 2.393000  0.7096000     3.219000  1.237000      1.567000  0.6963000     1.652000       1.419000  
1 1 1 17 16 16 o 2.692000  0.5201000     3.388000  0.6998000     1.996000  0.7697000     1.392000       1.040000  
1 1 1 17 16 17 o 2.049000  0.5392000     2.137000  0.7628000     1.961000  0.7624000     0.1762000      1.078000  
1 1 1 17 16 18 o 2.797000  0.7571000     3.267000  1.248000      2.327000  0.8570000     0.9403000      1.514000  
1 1 1 17 16 19 o 3.384000  0.4744000     3.710000  0.6058000     3.058000  0.7303000     0.6523000      0.9489000 
1 1 1 17 16 20 o 1.661000  0.4967000     1.722000  0.7144000     1.599000  0.6902000     0.1225000      0.9934000 
1 1 1 17 16 21 o 2.292000  0.5017000     1.999000  0.7055000     2.585000  0.7137000     -0.5868000     1.003000  
1 1 1 17 16 22 o 1.460000  0.4257000     1.069000  0.5071000     1.851000  0.6839000     -0.7821000     0.8514000 
1 1 1 17 16 23 o 1.349000  0.4459000     1.352000  0.5980000     1.346000  0.6615000     0.6023000E-02  0.8918000 
1 1 1 17 16 24 o 1.120000  0.3892000     0.9979000 0.4838000     1.242000  0.6097000     -0.2437000     0.7783000 
1 1 1 17 17 0  o 6.040000  0.1674000     6.040000  0.1674000     6.040000  0.1674000     0.000000       0.000000  
1 1 1 17 17 1  o 11.11000  0.1208000     11.16000  0.1711000     11.06000  0.1707000     0.9581000E-01  0.2417000 
1 1 1 17 17 2  o 14.69000  0.1387000     14.73000  0.1962000     14.65000  0.1962000     0.8701000E-01  0.2775000 
1 1 1 17 17 3  o 16.54000  0.1507000     16.26000  0.2105000     16.82000  0.2158000     -0.5562000     0.3015000 
1 1 1 17 17 4  o 16.01000  0.1501000     15.87000  0.2106000     16.16000  0.2138000     -0.2976000     0.3001000 
1 1 1 17 17 5  o 15.86000  0.1511000     16.08000  0.2149000     15.64000  0.2126000     0.4321000      0.3023000 
1 1 1 17 17 6  o 16.74000  0.1590000     16.73000  0.2248000     16.74000  0.2248000     -0.1366000E-01 0.3179000 
1 1 1 17 17 7  o 14.12000  0.2285000     13.89000  0.2359000     14.34000  0.3913000     -0.4453000     0.4569000 
1 1 1 17 17 8  o 19.50000  0.1973000     19.45000  0.2998000     19.54000  0.2565000     -0.8566000E-01 0.3946000 
1 1 1 17 17 9  o 13.02000  0.2084000     13.42000  0.3668000     12.62000  0.1980000     0.8038000      0.4168000 
1 1 1 17 17 10 o 19.05000  0.2067000     18.96000  0.3098000     19.15000  0.2736000     -0.1974000     0.4134000 
1 1 1 17 17 11 o 4.100000  0.3086000     4.377000  0.3934000     3.823000  0.4757000     0.5538000      0.6173000 
1 1 1 17 17 12 o 6.552000  0.2321000     6.125000  0.3420000     6.979000  0.3138000     -0.8538000     0.4641000 
1 1 1 17 17 13 o 8.310000  0.3057000     8.293000  0.2963000     8.327000  0.5349000     -0.3374000E-01 0.6115000 
1 1 1 17 17 14 o 6.119000  0.2693000     5.907000  0.3757000     6.332000  0.3860000     -0.4247000     0.5386000 
1 1 1 17 17 15 o 2.002000  0.5873000     1.868000  0.8686000     2.136000  0.7909000     -0.2683000     1.175000  
1 1 1 17 17 16 o 1.567000  0.4917000     1.541000  0.6841000     1.592000  0.7064000     -0.5132000E-01 0.9834000 
1 1 1 17 17 17 o 2.675000  0.5525000     2.628000  0.7989000     2.723000  0.7635000     -0.9540000E-01 1.105000  
1 1 1 17 17 18 o 2.033000  0.5278000     1.510000  0.6754000     2.556000  0.8114000     -1.046000      1.056000  
1 1 1 17 17 19 o 2.747000  0.4951000     3.359000  0.6585000     2.135000  0.7396000     1.225000       0.9902000 
1 1 1 17 17 20 o 2.531000  0.6842000     2.667000  1.139000      2.395000  0.7592000     0.2727000      1.368000  
1 1 1 17 17 21 o 1.660000  0.4804000     1.511000  0.6500000     1.808000  0.7075000     -0.2974000     0.9608000 
1 1 1 17 17 22 o 1.126000  0.3775000     1.245000  0.5723000     1.006000  0.4926000     0.2393000      0.7551000 
1 1 1 17 17 23 o 2.161000  0.4634000     2.874000  0.6696000     1.447000  0.6407000     1.427000       0.9268000 
1 1 1 17 17 24 o 1.206000  0.3983000     1.367000  0.6095000     1.046000  0.5128000     0.3205000      0.7965000 
1 1 1 17 18 0  o 7.735000  0.1644000     7.735000  0.1644000     7.735000  0.1644000     -0.000000      0.000000  
1 1 1 17 18 1  o 20.86000  0.1773000     20.88000  0.2508000     20.85000  0.2507000     0.2957000E-01  0.3547000 
1 1 1 17 18 2  o 8.587000  0.1183000     8.519000  0.1668000     8.655000  0.1677000     -0.1360000     0.2366000 
1 1 1 17 18 3  o 14.99000  0.1434000     14.94000  0.2019000     15.04000  0.2037000     -0.1005000     0.2868000 
1 1 1 17 18 4  o 15.82000  0.1499000     15.78000  0.2112000     15.85000  0.2127000     -0.7002000E-01 0.2998000 
1 1 1 17 18 5  o 13.15000  0.1396000     13.29000  0.1981000     13.01000  0.1968000     0.2717000      0.2792000 
1 1 1 17 18 6  o 7.154000  0.1667000     7.378000  0.2709000     6.930000  0.1942000     0.4477000      0.3333000 
1 1 1 17 18 7  f 6.034000  0.1542000     5.823000  0.2211000     6.246000  0.2150000     -0.4226000     0.3084000 
1 1 1 17 18 8  f 9.814000  0.1893000     9.807000  0.2228000     9.821000  0.3061000     -0.1376000E-01 0.3786000 
1 1 1 17 18 9  o 14.56000  0.1592000     14.78000  0.2271000     14.34000  0.2231000     0.4407000      0.3183000 
1 1 1 17 18 10 o 11.26000  0.1680000     11.13000  0.2651000     11.39000  0.2064000     -0.2567000     0.3360000 
1 1 1 17 18 11 o 6.122000  0.2245000     5.772000  0.3215000     6.471000  0.3135000     -0.6992000     0.4490000 
1 1 1 17 18 12 f 9.683000  0.1922000     9.467000  0.2686000     9.899000  0.2751000     -0.4319000     0.3845000 
1 1 1 17 18 13 o 8.887000  0.2222000     8.649000  0.2892000     9.124000  0.3373000     -0.4750000     0.4443000 
1 1 1 17 18 14 f 2.059000  0.5315000     1.400000  0.6400000     2.718000  0.8488000     -1.318000      1.063000  
1 1 1 17 18 15 o 3.454000  0.4725000     3.430000  0.6490000     3.478000  0.6870000     -0.4733000E-01 0.9450000 
1 1 1 17 18 16 o 2.451000  0.5606000     2.215000  0.7784000     2.686000  0.8070000     -0.4710000     1.121000  
1 1 1 17 18 17 o 5.416000  0.3189000     5.686000  0.4297000     5.147000  0.4712000     0.5387000      0.6378000 
1 1 1 17 18 18 o 3.745000  0.6649000     4.270000  0.5898000     3.220000  1.192000      1.050000       1.330000  
1 1 1 17 18 19 o 3.385000  0.4496000     3.752000  0.5696000     3.019000  0.6958000     0.7334000      0.8992000 
1 1 1 17 18 20 o 1.809000  0.6057000     2.317000  1.050000      1.300000  0.6036000     1.017000       1.211000  
1 1 1 17 18 21 o 1.891000  0.4989000     1.886000  0.6936000     1.895000  0.7173000     -0.9289000E-02 0.9978000 
1 1 1 17 18 22 o 1.906000  0.4940000     1.988000  0.6962000     1.824000  0.7011000     0.1637000      0.9880000 
1 1 1 17 18 23 o 1.550000  0.5219000     1.348000  0.6152000     1.752000  0.8433000     -0.4042000     1.044000  
1 1 1 17 18 24 o 1.159000  0.3884000     1.214000  0.5676000     1.105000  0.5303000     0.1092000      0.7768000 
1 1 1 17 19 0  o 17.63000  0.2228000     17.63000  0.2228000     17.63000  0.2228000     -0.000000      0.000000  
1 1 1 17 19 1  o 8.881000  0.1192000     8.792000  0.1689000     8.970000  0.1683000     -0.1786000     0.2384000 
1 1 1 17 19 2  o 20.38000  0.1761000     20.18000  0.2471000     20.58000  0.2509000     -0.4031000     0.3521000 
1 1 1 17 19 3  o 9.276000  0.1240000     9.173000  0.1748000     9.380000  0.1759000     -0.2068000     0.2480000 
1 1 1 17 19 4  o 23.43000  0.1985000     23.41000  0.2802000     23.44000  0.2812000     -0.3722000E-01 0.3970000 
1 1 1 17 19 5  o 8.373000  0.1313000     8.661000  0.1858000     8.086000  0.1856000     0.5757000      0.2626000 
1 1 1 17 19 6  o 21.44000  0.2408000     21.65000  0.3086000     21.22000  0.3698000     0.4391000      0.4817000 
1 1 1 17 19 7  f 10.23000  0.1407000     10.15000  0.1985000     10.30000  0.1995000     -0.1544000     0.2814000 
1 1 1 17 19 8  o 17.87000  0.2255000     17.65000  0.3441000     18.10000  0.2916000     -0.4544000     0.4510000 
1 1 1 17 19 9  o 16.52000  0.1986000     16.58000  0.2827000     16.47000  0.2790000     0.1070000      0.3972000 
1 1 1 17 19 10 o 18.84000  0.1767000     18.85000  0.2614000     18.83000  0.2378000     0.2842000E-01  0.3534000 
1 1 1 17 19 11 o 8.443000  0.1848000     8.861000  0.2857000     8.024000  0.2344000     0.8375000      0.3695000 
1 1 1 17 19 12 o 4.967000  0.3016000     4.976000  0.3995000     4.958000  0.4519000     0.1791000E-01  0.6032000 
1 1 1 17 19 13 o 7.392000  0.2315000     7.804000  0.3115000     6.979000  0.3425000     0.8250000      0.4630000 
1 1 1 17 19 14 o 1.684000  0.5105000     1.869000  0.7384000     1.500000  0.7052000     0.3689000      1.021000  
1 1 1 17 19 15 o 11.21000  0.2139000     11.05000  0.3000000     11.37000  0.3049000     -0.3199000     0.4277000 
1 1 1 17 19 16 o 6.482000  0.2797000     6.662000  0.3767000     6.303000  0.4137000     0.3589000      0.5595000 
1 1 1 17 19 17 o 4.438000  0.4014000     4.963000  0.4732000     3.912000  0.6485000     1.050000       0.8028000 
1 1 1 17 19 18 o 1.777000  0.5438000     1.930000  0.7579000     1.624000  0.7800000     0.3066000      1.088000  
1 1 1 17 19 19 o 1.179000  0.4010000     1.239000  0.5877000     1.119000  0.5456000     0.1193000      0.8020000 
1 1 1 17 19 20 o 1.892000  0.4999000     1.475000  0.6937000     2.310000  0.7201000     -0.8350000     0.9998000 
1 1 1 17 19 21 o 1.652000  0.4643000     2.018000  0.7157000     1.285000  0.5916000     0.7337000      0.9286000 
1 1 1 17 19 22 o 1.299000  0.4167000     1.341000  0.5987000     1.258000  0.5798000     0.8295000E-01  0.8335000 
1 1 1 17 19 23 o 1.366000  0.4613000     1.060000  0.5157000     1.672000  0.7650000     -0.6125000     0.9226000 
1 1 1 17 19 24 o 1.229000  0.4046000     1.389000  0.6204000     1.070000  0.5194000     0.3191000      0.8092000 
1 1 1 17 20 0  o 14.82000  0.2019000     14.82000  0.2019000     14.82000  0.2019000     0.000000       0.000000  
1 1 1 17 20 1  o 1.775000  0.3011000     1.403000  0.4652000     2.146000  0.3824000     -0.7433000     0.6022000 
1 1 1 17 20 2  o 7.430000  0.1256000     7.441000  0.1773000     7.420000  0.1778000     0.2157000E-01  0.2511000 
1 1 1 17 20 3  o 27.06000  0.2233000     27.15000  0.3164000     26.98000  0.3153000     0.1673000      0.4467000 
1 1 1 17 20 4  o 20.73000  0.1817000     20.65000  0.2561000     20.82000  0.2578000     -0.1731000     0.3634000 
1 1 1 17 20 5  o 9.020000  0.1620000     8.868000  0.2636000     9.172000  0.1885000     -0.3034000     0.3240000 
1 1 1 17 20 6  o 8.677000  0.1427000     8.573000  0.1944000     8.780000  0.2090000     -0.2070000     0.2855000 
1 1 1 17 20 7  o 18.14000  0.2253000     18.11000  0.2762000     18.17000  0.3561000     -0.6847000E-01 0.4506000 
1 1 1 17 20 8  o 10.72000  0.1485000     10.83000  0.2084000     10.61000  0.2116000     0.2237000      0.2970000 
1 1 1 17 20 9  o 16.53000  0.1699000     16.15000  0.2381000     16.92000  0.2425000     -0.7692000     0.3398000 
1 1 1 17 20 10 o 2.410000  0.3834000     2.633000  0.4957000     2.187000  0.5851000     0.4455000      0.7668000 
1 1 1 17 20 11 o 15.83000  0.1872000     16.01000  0.2967000     15.65000  0.2283000     0.3630000      0.3744000 
1 1 1 17 20 12 o 5.009000  0.3947000     4.755000  0.4648000     5.263000  0.6381000     -0.5088000     0.7895000 
1 1 1 17 20 13 o 2.387000  0.5106000     1.842000  0.7167000     2.931000  0.7275000     -1.089000      1.021000  
1 1 1 17 20 14 o 9.846000  0.4224000     8.819000  0.7873000     10.87000  0.3062000     -2.055000      0.8447000 
1 1 1 17 20 15 o 3.256000  0.4941000     3.373000  0.6683000     3.139000  0.7281000     0.2341000      0.9883000 
1 1 1 17 20 16 o 3.301000  0.4959000     3.449000  0.6549000     3.152000  0.7447000     0.2970000      0.9917000 
1 1 1 17 20 17 o 4.951000  0.3447000     4.530000  0.5016000     5.371000  0.4730000     -0.8405000     0.6894000 
1 1 1 17 20 18 o 4.279000  0.4392000     3.715000  0.5932000     4.843000  0.6479000     -1.128000      0.8785000 
1 1 1 17 20 19 o 1.603000  0.4835000     1.709000  0.7022000     1.496000  0.6650000     0.2132000      0.9671000 
1 1 1 17 20 20 o 1.434000  0.4487000     1.509000  0.6534000     1.359000  0.6153000     0.1496000      0.8975000 
1 1 1 17 20 21 o 1.693000  0.4674000     2.044000  0.7080000     1.342000  0.6104000     0.7012000      0.9347000 
1 1 1 17 20 22 o 1.371000  0.4299000     1.561000  0.6534000     1.180000  0.5588000     0.3811000      0.8598000 
1 1 1 17 20 23 o 1.416000  0.4702000     1.267000  0.5844000     1.564000  0.7367000     -0.2973000     0.9404000 
1 1 1 17 20 24 o 1.310000  0.4560000     1.540000  0.7283000     1.080000  0.5487000     0.4593000      0.9119000 
1 1 1 17 21 0  o 18.85000  0.2377000     18.85000  0.2377000     18.85000  0.2377000     -0.000000      0.000000  
1 1 1 17 21 1  o 22.22000  0.1899000     22.01000  0.2664000     22.43000  0.2706000     -0.4201000     0.3798000 
1 1 1 17 21 2  o 10.87000  0.1299000     10.85000  0.1821000     10.88000  0.1853000     -0.2599000E-01 0.2599000 
1 1 1 17 21 3  o 14.30000  0.1444000     14.22000  0.2036000     14.38000  0.2050000     -0.1578000     0.2889000 
1 1 1 17 21 4  o 6.717000  0.1523000     6.420000  0.2368000     7.013000  0.1917000     -0.5928000     0.3046000 
1 1 1 17 21 5  o 22.26000  0.2477000     22.37000  0.3162000     22.16000  0.3814000     0.2066000      0.4954000 
1 1 1 17 21 6  o 6.747000  0.1595000     6.893000  0.2104000     6.601000  0.2397000     0.2916000      0.3189000 
1 1 1 17 21 7  o 5.922000  0.2036000     5.891000  0.3311000     5.954000  0.2369000     -0.6293000E-01 0.4071000 
1 1 1 17 21 8  o 7.630000  0.1537000     7.627000  0.2145000     7.632000  0.2202000     -0.4682000E-02 0.3074000 
1 1 1 17 21 9  o 12.73000  0.1557000     12.70000  0.2184000     12.76000  0.2219000     -0.5701000E-01 0.3114000 
1 1 1 17 21 10 o 17.05000  0.1772000     17.13000  0.2531000     16.96000  0.2482000     0.1686000      0.3545000 
1 1 1 17 21 11 f 9.104000  0.1653000     9.037000  0.2364000     9.171000  0.2311000     -0.1343000     0.3306000 
1 1 1 17 21 12 o 6.314000  0.2772000     6.308000  0.4199000     6.321000  0.3620000     -0.1295000E-01 0.5544000 
1 1 1 17 21 13 f 5.452000  0.2865000     5.222000  0.3956000     5.681000  0.4144000     -0.4591000     0.5729000 
1 1 1 17 21 14 o 3.904000  0.5943000     3.894000  1.033000      3.915000  0.5876000     -0.2135000E-01 1.189000  
1 1 1 17 21 15 o 4.663000  0.3748000     4.222000  0.5676000     5.104000  0.4898000     -0.8825000     0.7497000 
1 1 1 17 21 16 o 2.843000  0.5245000     2.086000  0.7733000     3.600000  0.7087000     -1.514000      1.049000  
1 1 1 17 21 17 o 2.605000  0.5184000     3.173000  0.6706000     2.037000  0.7906000     1.136000       1.037000  
1 1 1 17 21 18 o 3.365000  0.4710000     3.557000  0.6003000     3.173000  0.7258000     0.3838000      0.9419000 
1 1 1 17 21 19 o 1.556000  0.4712000     1.818000  0.7151000     1.294000  0.6138000     0.5241000      0.9424000 
1 1 1 17 21 20 o 1.423000  0.4451000     1.625000  0.6793000     1.221000  0.5754000     0.4045000      0.8903000 
1 1 1 17 21 21 o 1.400000  0.4419000     1.278000  0.5882000     1.521000  0.6598000     -0.2430000     0.8839000 
1 1 1 17 21 22 o 1.823000  0.4795000     2.090000  0.6974000     1.556000  0.6582000     0.5338000      0.9589000 
1 1 1 17 21 23 f 1.347000  0.4190000     1.694000  0.6781000     1.000000  0.4925000     0.6935000      0.8381000 
1 1 1 17 22 0  f 6.442000  0.1896000     6.442000  0.1896000     6.442000  0.1896000     -0.000000      0.000000  
1 1 1 17 22 1  o 10.51000  0.1296000     10.54000  0.1834000     10.48000  0.1831000     0.5541000E-01  0.2591000 
1 1 1 17 22 2  o 10.95000  0.1314000     10.97000  0.1853000     10.93000  0.1862000     0.3939000E-01  0.2628000 
1 1 1 17 22 3  o 8.767000  0.1311000     8.882000  0.1847000     8.653000  0.1862000     0.2286000      0.2622000 
1 1 1 17 22 4  f 30.42000  0.3238000     30.78000  0.5058000     30.05000  0.4043000     0.7317000      0.6476000 
1 1 1 17 22 5  o 14.37000  0.1634000     14.34000  0.2127000     14.41000  0.2482000     -0.6904000E-01 0.3269000 
1 1 1 17 22 6  o 13.96000  0.1772000     14.23000  0.2481000     13.69000  0.2530000     0.5353000      0.3544000 
1 1 1 17 22 7  o 15.38000  0.1603000     15.57000  0.2275000     15.20000  0.2258000     0.3690000      0.3206000 
1 1 1 17 22 8  o 5.155000  0.1902000     5.179000  0.2640000     5.131000  0.2739000     0.4800000E-01  0.3804000 
1 1 1 17 22 9  o 11.25000  0.1561000     11.48000  0.2202000     11.01000  0.2214000     0.4676000      0.3123000 
1 1 1 17 22 10 o 19.58000  0.1903000     19.51000  0.2689000     19.65000  0.2694000     -0.1440000     0.3807000 
1 1 1 17 22 11 o 6.809000  0.1893000     6.853000  0.2664000     6.765000  0.2690000     0.8714000E-01  0.3786000 
1 1 1 17 22 12 o 9.556000  0.1982000     9.589000  0.3057000     9.522000  0.2523000     0.6688000E-01  0.3964000 
1 1 1 17 22 13 o 6.626000  0.2941000     7.046000  0.3578000     6.206000  0.4669000     0.8402000      0.5883000 
1 1 1 17 22 14 o 6.002000  0.2956000     5.887000  0.4175000     6.118000  0.4187000     -0.2314000     0.5913000 
1 1 1 17 22 15 o 3.620000  0.4700000     3.796000  0.5910000     3.444000  0.7310000     0.3513000      0.9400000 
1 1 1 17 22 16 f 4.841000  0.3540000     4.852000  0.4847000     4.830000  0.5161000     0.2193000E-01  0.7080000 
1 1 1 17 22 17 o 6.163000  0.3165000     5.481000  0.4554000     6.846000  0.4397000     -1.365000      0.6330000 
1 1 1 17 22 18 o 2.277000  0.5358000     2.326000  0.7429000     2.228000  0.7724000     0.9796000E-01  1.072000  
1 1 1 17 22 19 o 1.883000  0.5501000     2.098000  0.8287000     1.668000  0.7238000     0.4298000      1.100000  
1 1 1 17 22 20 o 1.480000  0.4644000     1.463000  0.6461000     1.496000  0.6672000     -0.3280000E-01 0.9288000 
1 1 1 17 22 21 o 1.415000  0.4432000     1.579000  0.6650000     1.251000  0.5861000     0.3284000      0.8865000 
1 1 1 17 22 22 o 1.699000  0.4701000     1.956000  0.6953000     1.442000  0.6329000     0.5136000      0.9402000 
1 1 1 17 22 23 o 1.432000  0.4411000     1.119000  0.5363000     1.744000  0.7006000     -0.6245000     0.8823000 
1 1 1 17 23 0  o 7.669000  0.1874000     7.669000  0.1874000     7.669000  0.1874000     0.000000       0.000000  
1 1 1 17 23 1  o 6.887000  0.1354000     6.895000  0.1893000     6.879000  0.1938000     0.1628000E-01  0.2709000 
1 1 1 17 23 2  o 1.431000  0.3593000     1.247000  0.5165000     1.614000  0.4997000     -0.3664000     0.7187000 
1 1 1 17 23 3  o 16.55000  0.2062000     16.48000  0.3200000     16.63000  0.2602000     -0.1426000     0.4124000 
1 1 1 17 23 4  o 6.880000  0.1714000     7.035000  0.2012000     6.726000  0.2777000     0.3093000      0.3429000 
1 1 1 17 23 5  f 14.52000  0.1994000     14.61000  0.2440000     14.43000  0.3155000     0.1787000      0.3988000 
1 1 1 17 23 6  o 15.87000  0.1767000     15.77000  0.2689000     15.97000  0.2292000     -0.2022000     0.3533000 
1 1 1 17 23 7  o 14.13000  0.1562000     14.12000  0.2202000     14.15000  0.2216000     -0.2617000E-01 0.3124000 
1 1 1 17 23 8  o 15.28000  0.1634000     15.21000  0.2306000     15.35000  0.2316000     -0.1387000     0.3268000 
1 1 1 17 23 9  o 8.477000  0.1621000     8.442000  0.2327000     8.511000  0.2259000     -0.6853000E-01 0.3243000 
1 1 1 17 23 10 o 6.848000  0.1797000     6.878000  0.2511000     6.817000  0.2572000     0.6083000E-01  0.3595000 
1 1 1 17 23 11 o 4.235000  0.3372000     4.027000  0.5520000     4.444000  0.3876000     -0.4173000     0.6745000 
1 1 1 17 23 12 o 11.18000  0.1755000     10.91000  0.2473000     11.45000  0.2489000     -0.5397000     0.3509000 
1 1 1 17 23 13 o 5.974000  0.3216000     6.218000  0.4264000     5.730000  0.4816000     0.4877000      0.6433000 
1 1 1 17 23 14 o 2.257000  0.5380000     2.332000  0.7469000     2.182000  0.7745000     0.1499000      1.076000  
1 1 1 17 23 15 o 6.435000  0.2846000     5.908000  0.4050000     6.963000  0.4000000     -1.055000      0.5693000 
1 1 1 17 23 16 o 6.204000  0.2836000     6.378000  0.3831000     6.030000  0.4182000     0.3486000      0.5671000 
1 1 1 17 23 17 o 3.578000  0.5957000     4.086000  0.5730000     3.069000  1.045000      1.017000       1.191000  
1 1 1 17 23 18 o 1.344000  0.4397000     1.252000  0.5928000     1.435000  0.6495000     -0.1828000     0.8794000 
1 1 1 17 23 19 o 3.006000  0.5854000     2.280000  1.023000      3.732000  0.5702000     -1.452000      1.171000  
1 1 1 17 23 20 o 2.001000  0.5122000     1.889000  0.7106000     2.112000  0.7378000     -0.2223000     1.024000  
1 1 1 17 23 21 o 1.760000  0.4718000     2.157000  0.7148000     1.363000  0.6161000     0.7940000      0.9436000 
1 1 1 17 23 22 o 1.911000  0.5156000     2.024000  0.7280000     1.798000  0.7302000     0.2259000      1.031000  
1 1 1 17 23 23 o 1.648000  0.4768000     1.553000  0.6524000     1.742000  0.6955000     -0.1883000     0.9535000 
1 1 1 17 24 0  o 4.564000  0.2852000     4.564000  0.2852000     4.564000  0.2852000     0.000000       0.000000  
1 1 1 17 24 1  o 18.83000  0.1989000     19.02000  0.2834000     18.64000  0.2793000     0.3793000      0.3979000 
1 1 1 17 24 2  f 13.69000  0.2066000     13.47000  0.2904000     13.90000  0.2940000     -0.4292000     0.4133000 
1 1 1 17 24 3  o 11.81000  0.1710000     11.98000  0.1987000     11.63000  0.2783000     0.3519000      0.3419000 
1 1 1 17 24 4  o 17.58000  0.1937000     17.49000  0.2700000     17.66000  0.2778000     -0.1663000     0.3874000 
1 1 1 17 24 5  o 7.243000  0.1631000     7.113000  0.2553000     7.372000  0.2032000     -0.2587000     0.3263000 
1 1 1 17 24 6  o 4.079000  0.2104000     3.864000  0.3143000     4.294000  0.2798000     -0.4292000     0.4209000 
1 1 1 17 24 7  o 21.12000  0.1928000     21.10000  0.2719000     21.15000  0.2734000     -0.4562000E-01 0.3856000 
1 1 1 17 24 8  o 16.85000  0.1717000     16.51000  0.2412000     17.18000  0.2445000     -0.6696000     0.3434000 
1 1 1 17 24 9  f 8.925000  0.1612000     8.996000  0.2291000     8.853000  0.2268000     0.1426000      0.3224000 
1 1 1 17 24 10 o 10.01000  0.1651000     9.832000  0.2341000     10.19000  0.2329000     -0.3574000     0.3303000 
1 1 1 17 24 11 o 7.871000  0.2272000     7.765000  0.2801000     7.977000  0.3579000     -0.2121000     0.4545000 
1 1 1 17 24 12 o 6.147000  0.2223000     6.222000  0.3037000     6.073000  0.3247000     0.1491000      0.4445000 
1 1 1 17 24 13 o 4.046000  0.6198000     3.506000  1.170000      4.586000  0.4098000     -1.080000      1.240000  
1 1 1 17 24 14 o 8.203000  0.2370000     8.175000  0.3314000     8.231000  0.3391000     -0.5590000E-01 0.4741000 
1 1 1 17 24 15 o 3.899000  0.4533000     4.332000  0.5254000     3.467000  0.7387000     0.8658000      0.9065000 
1 1 1 17 24 16 o 3.029000  0.5115000     2.988000  0.7036000     3.070000  0.7425000     -0.8182000E-01 1.023000  
1 1 1 17 24 17 o 1.959000  0.5784000     1.754000  0.7226000     2.164000  0.9032000     -0.4106000     1.157000  
1 1 1 17 24 18 o 2.183000  0.5223000     1.971000  0.7317000     2.396000  0.7455000     -0.4244000     1.045000  
1 1 1 17 24 19 o 2.478000  0.5550000     2.256000  0.8317000     2.700000  0.7351000     -0.4432000     1.110000  
1 1 1 17 24 20 o 3.371000  0.4242000     3.449000  0.5771000     3.293000  0.6219000     0.1562000      0.8484000 
1 1 1 17 24 21 o 1.481000  0.4483000     1.781000  0.6970000     1.181000  0.5640000     0.6005000      0.8966000 
1 1 1 17 24 22 o 2.263000  0.5969000     2.191000  0.7555000     2.336000  0.9243000     -0.1445000     1.194000  
1 1 1 17 24 23 o 1.276000  0.4145000     1.149000  0.5448000     1.404000  0.6249000     -0.2553000     0.8290000 
1 1 1 17 25 0  o 10.81000  0.2738000     10.81000  0.2738000     10.81000  0.2738000     -0.000000      0.000000  
1 1 1 17 25 1  f 16.10000  0.3128000     16.10000  0.3128000     ?         ?             ?              ?         
1 1 1 17 25 2  o 34.18000  0.3572000     34.53000  0.4559000     33.84000  0.5500000     0.6976000      0.7144000 
1 1 1 17 25 3  o 21.29000  0.2454000     21.60000  0.3825000     20.98000  0.3075000     0.6111000      0.4908000 
1 1 1 17 25 4  o 5.686000  0.1785000     5.433000  0.2778000     5.940000  0.2242000     -0.5069000     0.3570000 
1 1 1 17 25 5  o 5.536000  0.1700000     5.625000  0.2388000     5.447000  0.2419000     0.1785000      0.3399000 
1 1 1 17 25 6  o 25.89000  0.2222000     25.74000  0.3121000     26.04000  0.3163000     -0.2966000     0.4444000 
1 1 1 17 25 7  o 13.13000  0.1558000     12.91000  0.2200000     13.35000  0.2208000     -0.4327000     0.3117000 
1 1 1 17 25 8  o 3.685000  0.2561000     3.919000  0.3388000     3.452000  0.3840000     0.4677000      0.5121000 
1 1 1 17 25 9  o 10.21000  0.1598000     10.26000  0.2250000     10.16000  0.2270000     0.1028000      0.3196000 
1 1 1 17 25 10 o 7.282000  0.2057000     7.506000  0.3112000     7.058000  0.2692000     0.4477000      0.4115000 
1 1 1 17 25 11 o 1.637000  0.4420000     1.861000  0.6304000     1.414000  0.6198000     0.4474000      0.8841000 
1 1 1 17 25 12 o 7.272000  0.2120000     7.458000  0.2741000     7.086000  0.3234000     0.3717000      0.4239000 
1 1 1 17 25 13 o 5.767000  0.2381000     5.755000  0.3366000     5.779000  0.3369000     -0.2391000E-01 0.4763000 
1 1 1 17 25 14 o 4.077000  0.3599000     4.101000  0.5691000     4.054000  0.4408000     0.4742000E-01  0.7199000 
1 1 1 17 25 15 o 2.318000  0.5457000     2.298000  0.7534000     2.337000  0.7897000     -0.3912000E-01 1.091000  
1 1 1 17 25 16 o 3.934000  0.4296000     3.871000  0.6118000     3.998000  0.6032000     -0.1264000     0.8592000 
1 1 1 17 25 17 o 1.391000  0.4530000     1.305000  0.6057000     1.477000  0.6738000     -0.1724000     0.9060000 
1 1 1 17 25 18 o 2.043000  0.5349000     2.243000  0.7674000     1.843000  0.7453000     0.3993000      1.070000  
1 1 1 17 25 19 o 1.721000  0.4949000     1.665000  0.6922000     1.776000  0.7074000     -0.1113000     0.9897000 
1 1 1 17 25 20 o 1.853000  0.4769000     2.261000  0.7065000     1.445000  0.6409000     0.8156000      0.9539000 
1 1 1 17 25 21 o 1.638000  0.4740000     1.811000  0.6951000     1.465000  0.6447000     0.3463000      0.9480000 
1 1 1 17 25 22 o 1.155000  0.4069000     0.9553000 0.4738000     1.355000  0.6617000     -0.4000000     0.8139000 
1 1 1 17 25 23 o 1.191000  0.3982000     1.299000  0.5982000     1.083000  0.5259000     0.2165000      0.7965000 
1 1 1 17 26 0  o 18.54000  0.2802000     18.54000  0.2802000     18.54000  0.2802000     -0.000000      0.000000  
1 1 1 17 26 1  o 19.32000  0.1915000     19.79000  0.2937000     18.84000  0.2459000     0.9507000      0.3831000 
1 1 1 17 26 2  o 7.732000  0.1534000     7.482000  0.2327000     7.981000  0.1999000     -0.4988000     0.3067000 
1 1 1 17 26 3  o 12.88000  0.1466000     12.88000  0.2068000     12.88000  0.2078000     0.9317000E-03  0.2932000 
1 1 1 17 26 4  o 12.48000  0.1471000     12.22000  0.2067000     12.73000  0.2095000     -0.5141000     0.2943000 
1 1 1 17 26 5  o 25.53000  0.2195000     25.50000  0.3096000     25.55000  0.3112000     -0.5004000E-01 0.4389000 
1 1 1 17 26 6  o 13.01000  0.1535000     13.07000  0.2166000     12.95000  0.2176000     0.1160000      0.3071000 
1 1 1 17 26 7  o 8.817000  0.1547000     8.830000  0.2196000     8.804000  0.2178000     0.2592000E-01  0.3093000 
1 1 1 17 26 8  o 6.852000  0.1917000     7.131000  0.2366000     6.574000  0.3017000     0.5573000      0.3834000 
1 1 1 17 26 9  o 6.448000  0.1841000     6.619000  0.2588000     6.276000  0.2620000     0.3429000      0.3683000 
1 1 1 17 26 10 o 3.884000  0.3797000     3.710000  0.5663000     4.058000  0.5061000     -0.3481000     0.7595000 
1 1 1 17 26 11 o 1.784000  0.4198000     1.154000  0.5365000     2.413000  0.6457000     -1.259000      0.8395000 
1 1 1 17 26 12 o 3.578000  0.4255000     3.947000  0.4631000     3.209000  0.7140000     0.7383000      0.8511000 
1 1 1 17 26 13 o 5.497000  0.2520000     5.069000  0.3703000     5.925000  0.3418000     -0.8560000     0.5039000 
1 1 1 17 26 14 o 6.032000  0.2756000     5.997000  0.4339000     6.066000  0.3400000     -0.6871000E-01 0.5512000 
1 1 1 17 26 15 o 7.317000  0.2521000     7.288000  0.3386000     7.345000  0.3737000     -0.5663000E-01 0.5043000 
1 1 1 17 26 16 o 3.101000  0.5262000     3.165000  0.7251000     3.038000  0.7628000     0.1268000      1.052000  
1 1 1 17 26 17 o 2.616000  0.5227000     2.331000  0.7680000     2.902000  0.7093000     -0.5713000     1.045000  
1 1 1 17 26 18 f 1.531000  0.4856000     1.455000  0.6736000     1.607000  0.6997000     -0.1526000     0.9713000 
1 1 1 17 26 19 o 1.381000  0.4391000     1.523000  0.6573000     1.239000  0.5824000     0.2843000      0.8782000 
1 1 1 17 26 20 o 2.099000  0.4205000     3.009000  0.6150000     1.190000  0.5735000     1.820000       0.8409000 
1 1 1 17 26 21 o 1.336000  0.4320000     1.392000  0.6252000     1.281000  0.5964000     0.1118000      0.8640000 
1 1 1 17 26 22 o 1.178000  0.3979000     1.186000  0.5595000     1.170000  0.5659000     0.1657000E-01  0.7957000 
1 1 1 17 26 23 o 1.022000  0.3694000     0.9440000 0.4875000     1.099000  0.5552000     -0.1551000     0.7388000 
1 1 1 17 27 0  o 0.8026000 0.5198000     0.8026000 0.5198000     0.8026000 0.5198000     0.000000       0.000000  
1 1 1 17 27 1  o 19.67000  0.1798000     19.33000  0.2513000     20.02000  0.2573000     -0.6941000     0.3596000 
1 1 1 17 27 2  o 3.625000  0.2153000     3.728000  0.2954000     3.522000  0.3131000     0.2061000      0.4305000 
1 1 1 17 27 3  o 14.38000  0.1542000     14.41000  0.2174000     14.35000  0.2188000     0.5326000E-01  0.3084000 
1 1 1 17 27 4  o 10.44000  0.1443000     10.59000  0.2038000     10.29000  0.2044000     0.2977000      0.2886000 
1 1 1 17 27 5  o 1.622000  0.3907000     1.498000  0.5476000     1.746000  0.5573000     -0.2473000     0.7813000 
1 1 1 17 27 6  o 7.335000  0.1579000     7.456000  0.2208000     7.214000  0.2258000     0.2422000      0.3158000 
1 1 1 17 27 7  o 6.972000  0.1790000     7.073000  0.2675000     6.870000  0.2380000     0.2023000      0.3580000 
1 1 1 17 27 8  o 2.583000  0.3570000     2.302000  0.5493000     2.865000  0.4562000     -0.5628000     0.7141000 
1 1 1 17 27 9  o 3.445000  0.3122000     3.104000  0.4849000     3.786000  0.3932000     -0.6817000     0.6243000 
1 1 1 17 27 10 o 5.238000  0.2818000     5.581000  0.3102000     4.896000  0.4706000     0.6851000      0.5636000 
1 1 1 17 27 11 o 8.770000  0.1944000     8.601000  0.2573000     8.938000  0.2916000     -0.3377000     0.3888000 
1 1 1 17 27 12 o 3.301000  0.4391000     3.125000  0.6952000     3.478000  0.5367000     -0.3526000     0.8783000 
1 1 1 17 27 13 f 2.466000  0.4643000     2.091000  0.6866000     2.841000  0.6253000     -0.7504000     0.9287000 
1 1 1 17 27 14 o 5.626000  0.2472000     5.711000  0.3400000     5.541000  0.3590000     0.1702000      0.4945000 
1 1 1 17 27 15 o 2.392000  0.5341000     2.869000  0.7557000     1.915000  0.7551000     0.9546000      1.068000  
1 1 1 17 27 16 o 2.439000  0.6389000     2.209000  0.8093000     2.669000  0.9888000     -0.4598000     1.278000  
1 1 1 17 27 17 o 2.643000  0.5082000     2.895000  0.6946000     2.391000  0.7421000     0.5035000      1.016000  
1 1 1 17 27 18 o 2.088000  0.6567000     2.736000  1.146000      1.440000  0.6416000     1.296000       1.313000  
1 1 1 17 27 19 o 1.802000  0.4786000     2.215000  0.7234000     1.389000  0.6268000     0.8268000      0.9572000 
1 1 1 17 27 20 o 1.952000  0.5025000     1.841000  0.6894000     2.063000  0.7311000     -0.2211000     1.005000  
1 1 1 17 27 21 o 1.317000  0.4222000     1.089000  0.5231000     1.546000  0.6629000     -0.4577000     0.8444000 
1 1 1 17 27 22 o 1.476000  0.4492000     1.212000  0.5720000     1.739000  0.6927000     -0.5270000     0.8984000 
1 1 1 17 28 0  o 9.323000  0.2012000     9.323000  0.2012000     9.323000  0.2012000     0.000000       0.000000  
1 1 1 17 28 1  o 4.182000  0.1996000     3.997000  0.2917000     4.367000  0.2724000     -0.3697000     0.3991000 
1 1 1 17 28 2  o 4.235000  0.2026000     3.841000  0.3062000     4.629000  0.2653000     -0.7882000     0.4052000 
1 1 1 17 28 3  o 3.075000  0.2740000     3.472000  0.3321000     2.678000  0.4359000     0.7948000      0.5480000 
1 1 1 17 28 4  o 19.75000  0.1832000     19.60000  0.2576000     19.89000  0.2605000     -0.2876000     0.3664000 
1 1 1 17 28 5  o 14.11000  0.1562000     13.96000  0.2195000     14.27000  0.2223000     -0.3107000     0.3124000 
1 1 1 17 28 6  o 7.542000  0.1579000     7.589000  0.2225000     7.495000  0.2242000     0.9444000E-01  0.3158000 
1 1 1 17 28 7  o 1.824000  0.3814000     2.388000  0.5429000     1.260000  0.5358000     1.128000       0.7627000 
1 1 1 17 28 8  o 1.337000  0.3876000     1.044000  0.4885000     1.630000  0.6020000     -0.5857000     0.7753000 
1 1 1 17 28 9  o 7.124000  0.2303000     6.947000  0.3776000     7.302000  0.2636000     -0.3545000     0.4605000 
1 1 1 17 28 10 o 2.895000  0.3936000     2.961000  0.5177000     2.829000  0.5931000     0.1318000      0.7872000 
1 1 1 17 28 11 o 5.932000  0.3018000     5.897000  0.3389000     5.967000  0.4994000     -0.7021000E-01 0.6035000 
1 1 1 17 28 12 o 6.220000  0.2284000     6.181000  0.3131000     6.258000  0.3327000     -0.7742000E-01 0.4569000 
1 1 1 17 28 13 o 2.161000  0.4923000     2.297000  0.6808000     2.025000  0.7112000     0.2716000      0.9845000 
1 1 1 17 28 14 o 4.003000  0.3523000     4.342000  0.4507000     3.663000  0.5417000     0.6790000      0.7046000 
1 1 1 17 28 15 o 6.436000  0.2585000     6.829000  0.3950000     6.043000  0.3337000     0.7856000      0.5171000 
1 1 1 17 28 16 o 2.791000  0.5265000     3.700000  0.6160000     1.882000  0.8539000     1.818000       1.053000  
1 1 1 17 28 17 o 2.246000  0.5197000     2.453000  0.7235000     2.038000  0.7461000     0.4157000      1.039000  
1 1 1 17 28 18 o 1.540000  0.4862000     1.613000  0.7294000     1.467000  0.6430000     0.1457000      0.9723000 
1 1 1 17 28 19 o 1.304000  0.4202000     1.093000  0.5294000     1.516000  0.6528000     -0.4225000     0.8405000 
1 1 1 17 28 20 o 2.701000  0.4824000     3.028000  0.6311000     2.373000  0.7298000     0.6556000      0.9649000 
1 1 1 17 28 21 o 1.572000  0.4784000     1.248000  0.5853000     1.896000  0.7569000     -0.6475000     0.9568000 
1 1 1 17 28 22 o 1.914000  0.4742000     1.346000  0.6180000     2.481000  0.7195000     -1.135000      0.9485000 
1 1 1 17 29 0  o 9.795000  0.2039000     9.795000  0.2039000     9.795000  0.2039000     -0.000000      0.000000  
1 1 1 17 29 1  o 5.525000  0.1677000     5.434000  0.2367000     5.616000  0.2376000     -0.1820000     0.3353000 
1 1 1 17 29 2  o 11.13000  0.1449000     11.19000  0.2048000     11.07000  0.2050000     0.1168000      0.2898000 
1 1 1 17 29 3  o 7.281000  0.1522000     7.354000  0.2153000     7.207000  0.2152000     0.1473000      0.3044000 
1 1 1 17 29 4  o 2.766000  0.3014000     2.904000  0.3994000     2.628000  0.4515000     0.2765000      0.6028000 
1 1 1 17 29 5  o 3.831000  0.2531000     3.794000  0.3336000     3.868000  0.3808000     -0.7386000E-01 0.5062000 
1 1 1 17 29 6  f 8.137000  0.1573000     8.226000  0.2206000     8.047000  0.2242000     0.1790000      0.3145000 
1 1 1 17 29 7  o 5.896000  0.1895000     5.889000  0.2670000     5.903000  0.2690000     -0.1403000E-01 0.3790000 
1 1 1 17 29 8  o 9.655000  0.1651000     9.778000  0.2343000     9.532000  0.2327000     0.2457000      0.3303000 
1 1 1 17 29 9  o 15.77000  0.2234000     15.99000  0.2845000     15.54000  0.3444000     0.4540000      0.4467000 
1 1 1 17 29 10 o 5.980000  0.2339000     6.297000  0.2972000     5.664000  0.3613000     0.6335000      0.4679000 
1 1 1 17 29 11 o 6.970000  0.2625000     7.109000  0.4257000     6.831000  0.3073000     0.2775000      0.5250000 
1 1 1 17 29 12 o 7.610000  0.2080000     7.664000  0.2871000     7.557000  0.3011000     0.1072000      0.4160000 
1 1 1 17 29 13 o 11.75000  0.1880000     12.17000  0.2608000     11.33000  0.2707000     0.8476000      0.3759000 
1 1 1 17 29 14 o 6.177000  0.2408000     6.303000  0.3235000     6.051000  0.3568000     0.2514000      0.4816000 
1 1 1 17 29 15 o 3.153000  0.4735000     3.506000  0.6897000     2.800000  0.6490000     0.7066000      0.9470000 
1 1 1 17 29 16 o 2.522000  0.5212000     2.040000  0.7532000     3.004000  0.7207000     -0.9643000     1.042000  
1 1 1 17 29 17 o 1.997000  0.5226000     2.081000  0.7209000     1.914000  0.7568000     0.1670000      1.045000  
1 1 1 17 29 18 o 2.185000  0.5009000     1.824000  0.7066000     2.547000  0.7101000     -0.7235000     1.002000  
1 1 1 17 29 19 o 1.550000  0.4549000     1.786000  0.6799000     1.314000  0.6046000     0.4713000      0.9099000 
1 1 1 17 29 20 f 2.085000  0.5074000     2.061000  0.7142000     2.108000  0.7208000     -0.4710000E-01 1.015000  
1 1 1 17 29 21 o 1.817000  0.5391000     1.915000  0.7268000     1.719000  0.7964000     0.1952000      1.078000  
1 1 1 17 29 22 o 1.698000  0.4907000     1.815000  0.7085000     1.581000  0.6791000     0.2344000      0.9814000 
1 1 1 17 30 0  o 5.961000  0.2332000     5.961000  0.2332000     5.961000  0.2332000     -0.000000      0.000000  
1 1 1 17 30 1  o 7.914000  0.1485000     7.497000  0.2132000     8.331000  0.2067000     -0.8336000     0.2969000 
1 1 1 17 30 2  o 10.01000  0.1461000     9.961000  0.2062000     10.06000  0.2070000     -0.9678000E-01 0.2921000 
1 1 1 17 30 3  o 10.25000  0.1473000     10.49000  0.2086000     10.00000  0.2081000     0.4830000      0.2946000 
1 1 1 17 30 4  o 13.48000  0.1551000     13.52000  0.2197000     13.44000  0.2189000     0.8610000E-01  0.3102000 
1 1 1 17 30 5  o 5.154000  0.1948000     5.054000  0.2764000     5.254000  0.2745000     -0.1997000     0.3895000 
1 1 1 17 30 6  o 17.32000  0.1763000     17.51000  0.2503000     17.13000  0.2483000     0.3871000      0.3525000 
1 1 1 17 30 7  f 12.87000  0.1629000     12.73000  0.2290000     13.00000  0.2319000     -0.2665000     0.3259000 
1 1 1 17 30 8  o 3.692000  0.3842000     3.375000  0.6109000     4.009000  0.4661000     -0.6341000     0.7685000 
1 1 1 17 30 9  o 2.719000  0.4017000     3.070000  0.5045000     2.367000  0.6253000     0.7030000      0.8034000 
1 1 1 17 30 10 o 7.964000  0.2527000     7.696000  0.2981000     8.231000  0.4082000     -0.5351000     0.5055000 
1 1 1 17 30 11 o 8.862000  0.1929000     8.656000  0.2678000     9.068000  0.2777000     -0.4114000     0.3858000 
1 1 1 17 30 12 o 11.16000  0.1973000     10.92000  0.2594000     11.39000  0.2974000     -0.4740000     0.3946000 
1 1 1 17 30 13 o 5.686000  0.2465000     5.787000  0.3353000     5.586000  0.3613000     0.2016000      0.4930000 
1 1 1 17 30 14 o 4.897000  0.2890000     5.283000  0.3764000     4.511000  0.4386000     0.7719000      0.5780000 
1 1 1 17 30 15 f 1.413000  0.4660000     1.366000  0.6503000     1.460000  0.6676000     -0.9323000E-01 0.9320000 
1 1 1 17 30 16 o 2.357000  0.5259000     2.373000  0.8036000     2.342000  0.6785000     0.3134000E-01  1.052000  
1 1 1 17 30 17 o 2.461000  0.5798000     1.984000  0.9239000     2.938000  0.7008000     -0.9542000     1.160000  
1 1 1 17 30 18 o 1.359000  0.4340000     1.252000  0.5807000     1.465000  0.6452000     -0.2128000     0.8680000 
1 1 1 17 30 19 o 1.447000  0.4488000     1.369000  0.6187000     1.524000  0.6502000     -0.1555000     0.8975000 
1 1 1 17 30 20 f 2.003000  0.4986000     1.759000  0.6917000     2.246000  0.7184000     -0.4869000     0.9972000 
1 1 1 17 30 21 o 1.863000  0.4998000     2.284000  0.7234000     1.441000  0.6898000     0.8428000      0.9995000 
1 1 1 17 30 22 o 1.071000  0.3686000     1.147000  0.5473000     0.9953000 0.4938000     0.1514000      0.7372000 
1 1 1 17 31 0  o 20.38000  0.2651000     20.38000  0.2651000     20.38000  0.2651000     -0.000000      0.000000  
1 1 1 17 31 1  o 10.28000  0.1461000     10.37000  0.2083000     10.18000  0.2050000     0.1851000      0.2922000 
1 1 1 17 31 2  o 12.82000  0.1519000     13.15000  0.2157000     12.50000  0.2139000     0.6482000      0.3037000 
1 1 1 17 31 3  o 19.76000  0.1853000     19.50000  0.2592000     20.02000  0.2648000     -0.5205000     0.3705000 
1 1 1 17 31 4  o 5.617000  0.1834000     5.637000  0.2578000     5.598000  0.2610000     0.3930000E-01  0.3669000 
1 1 1 17 31 5  o 10.12000  0.1560000     10.23000  0.2185000     10.01000  0.2227000     0.2220000      0.3120000 
1 1 1 17 31 6  f 8.805000  0.1640000     9.067000  0.2300000     8.544000  0.2339000     0.5222000      0.3281000 
1 1 1 17 31 7  o 4.789000  0.2598000     5.667000  0.3495000     3.911000  0.3845000     1.756000       0.5196000 
1 1 1 17 31 8  o 13.58000  0.2024000     13.48000  0.2406000     13.67000  0.3256000     -0.1973000     0.4048000 
1 1 1 17 31 9  o 8.690000  0.1986000     9.105000  0.2552000     8.275000  0.3042000     0.8304000      0.3971000 
1 1 1 17 31 10 o 2.555000  0.5000000     2.737000  0.7489000     2.374000  0.6626000     0.3631000      0.9999000 
1 1 1 17 31 11 o 1.247000  0.4071000     1.228000  0.5687000     1.266000  0.5827000     -0.3794000E-01 0.8143000 
1 1 1 17 31 12 o 4.505000  0.2998000     4.527000  0.4020000     4.483000  0.4450000     0.4487000E-01  0.5997000 
1 1 1 17 31 13 o 9.047000  0.2017000     9.286000  0.2812000     8.808000  0.2892000     0.4781000      0.4034000 
1 1 1 17 31 14 o 2.718000  0.4618000     2.168000  0.6970000     3.269000  0.6058000     -1.101000      0.9235000 
1 1 1 17 31 15 o 2.798000  0.5057000     3.298000  0.5861000     2.298000  0.8243000     1.001000       1.011000  
1 1 1 17 31 16 o 1.551000  0.4750000     1.830000  0.7546000     1.271000  0.5770000     0.5585000      0.9499000 
1 1 1 17 31 17 f 2.375000  0.5835000     2.389000  0.9029000     2.361000  0.7395000     0.2775000E-01  1.167000  
1 1 1 17 31 18 o 2.135000  0.5070000     2.292000  0.7065000     1.977000  0.7274000     0.3147000      1.014000  
1 1 1 17 31 19 o 1.977000  0.4920000     1.667000  0.6653000     2.286000  0.7250000     -0.6187000     0.9840000 
1 1 1 17 31 20 o 1.686000  0.4805000     1.501000  0.6409000     1.870000  0.7159000     -0.3690000     0.9609000 
1 1 1 17 31 21 o 1.418000  0.4510000     1.228000  0.5738000     1.609000  0.6958000     -0.3817000     0.9019000 
1 1 1 17 32 0  o 6.514000  0.2337000     6.514000  0.2337000     6.514000  0.2337000     -0.000000      0.000000  
1 1 1 17 32 1  o 9.193000  0.1503000     9.127000  0.2128000     9.259000  0.2122000     -0.1318000     0.3005000 
1 1 1 17 32 2  o 12.85000  0.1542000     12.80000  0.2177000     12.90000  0.2185000     -0.1071000     0.3085000 
1 1 1 17 32 3  o 10.39000  0.1521000     10.27000  0.2144000     10.50000  0.2159000     -0.2331000     0.3043000 
1 1 1 17 32 4  o 4.762000  0.2129000     4.880000  0.2921000     4.644000  0.3097000     0.2359000      0.4258000 
1 1 1 17 32 5  o 17.00000  0.1759000     16.75000  0.2468000     17.24000  0.2507000     -0.4873000     0.3518000 
1 1 1 17 32 6  o 11.95000  0.1625000     11.87000  0.2281000     12.04000  0.2314000     -0.1679000     0.3249000 
1 1 1 17 32 7  o 4.927000  0.2833000     4.978000  0.3692000     4.877000  0.4297000     0.1009000      0.5666000 
1 1 1 17 32 8  o 6.945000  0.2107000     6.573000  0.2853000     7.318000  0.3101000     -0.7443000     0.4214000 
1 1 1 17 32 9  o 16.81000  0.2423000     16.78000  0.3696000     16.84000  0.3132000     -0.6159000E-01 0.4845000 
1 1 1 17 32 10 o 6.146000  0.2267000     6.598000  0.3084000     5.693000  0.3324000     0.9047000      0.4535000 
1 1 1 17 32 11 o 5.656000  0.2512000     5.421000  0.3660000     5.891000  0.3442000     -0.4694000     0.5024000 
1 1 1 17 32 12 f 2.967000  0.4299000     2.700000  0.6280000     3.233000  0.5872000     -0.5328000     0.8598000 
1 1 1 17 32 13 o 2.270000  0.5021000     2.085000  0.7144000     2.454000  0.7058000     -0.3697000     1.004000  
1 1 1 17 32 14 o 1.191000  0.4024000     1.122000  0.5501000     1.260000  0.5874000     -0.1382000     0.8048000 
1 1 1 17 32 15 o 1.949000  0.5005000     2.000000  0.7006000     1.898000  0.7149000     0.1019000      1.001000  
1 1 1 17 32 16 o 3.477000  0.4746000     2.495000  0.6751000     4.459000  0.6672000     -1.964000      0.9491000 
1 1 1 17 32 17 o 2.021000  0.5123000     2.492000  0.8145000     1.550000  0.6217000     0.9414000      1.025000  
1 1 1 17 32 18 o 3.626000  0.3915000     3.457000  0.5799000     3.795000  0.5262000     -0.3373000     0.7830000 
1 1 1 17 32 19 o 2.314000  0.5052000     1.997000  0.7079000     2.632000  0.7210000     -0.6351000     1.010000  
1 1 1 17 32 20 o 1.671000  0.4958000     1.473000  0.6530000     1.868000  0.7461000     -0.3953000     0.9915000 
1 1 1 17 32 21 f 1.539000  0.4518000     2.050000  0.7492000     1.028000  0.5049000     1.022000       0.9035000 
1 1 1 17 33 0  o 5.281000  0.2726000     5.281000  0.2726000     5.281000  0.2726000     -0.000000      0.000000  
1 1 1 17 33 1  o 10.79000  0.1535000     10.76000  0.2159000     10.82000  0.2183000     -0.5447000E-01 0.3070000 
1 1 1 17 33 2  o 3.491000  0.2642000     3.382000  0.3832000     3.600000  0.3638000     -0.2174000     0.5284000 
1 1 1 17 33 3  o 1.340000  0.3777000     1.633000  0.5798000     1.047000  0.4842000     0.5867000      0.7554000 
1 1 1 17 33 4  o 16.74000  0.1745000     16.77000  0.2473000     16.70000  0.2463000     0.6665000E-01  0.3490000 
1 1 1 17 33 5  o 13.52000  0.1648000     13.15000  0.2314000     13.88000  0.2346000     -0.7307000     0.3296000 
1 1 1 17 33 6  o 6.277000  0.2579000     6.129000  0.4054000     6.424000  0.3189000     -0.2950000     0.5157000 
1 1 1 17 33 7  o 7.779000  0.1891000     7.892000  0.2454000     7.667000  0.2878000     0.2246000      0.3782000 
1 1 1 17 33 8  o 5.833000  0.2998000     5.539000  0.3569000     6.127000  0.4819000     -0.5875000     0.5997000 
1 1 1 17 33 9  o 3.462000  0.3933000     3.277000  0.6306000     3.647000  0.4701000     -0.3704000     0.7866000 
1 1 1 17 33 10 o 1.745000  0.4678000     1.441000  0.6273000     2.049000  0.6942000     -0.6073000     0.9356000 
1 1 1 17 33 11 o 7.883000  0.2058000     7.872000  0.2910000     7.894000  0.2909000     -0.2184000E-01 0.4115000 
1 1 1 17 33 12 o 1.931000  0.4932000     1.737000  0.6804000     2.124000  0.7141000     -0.3870000     0.9864000 
1 1 1 17 33 13 o 2.580000  0.4885000     2.348000  0.7252000     2.812000  0.6546000     -0.4642000     0.9770000 
1 1 1 17 33 14 f 2.495000  0.5858000     2.610000  0.8508000     2.380000  0.8054000     0.2301000      1.172000  
1 1 1 17 33 15 o 4.701000  0.3002000     4.717000  0.4230000     4.686000  0.4261000     0.3119000E-01  0.6004000 
1 1 1 17 33 16 o 1.892000  0.5392000     2.064000  0.7927000     1.721000  0.7310000     0.3435000      1.078000  
1 1 1 17 33 17 o 3.637000  0.4126000     3.489000  0.7081000     3.785000  0.4239000     -0.2961000     0.8252000 
1 1 1 17 33 18 o 1.528000  0.4595000     1.601000  0.6606000     1.456000  0.6387000     0.1451000      0.9189000 
1 1 1 17 33 19 o 1.379000  0.4311000     1.094000  0.5255000     1.665000  0.6835000     -0.5709000     0.8621000 
1 1 1 17 33 20 o 1.983000  0.5689000     1.281000  0.6004000     2.685000  0.9664000     -1.404000      1.138000  
1 1 1 17 33 21 o 1.810000  0.4998000     1.667000  0.6864000     1.953000  0.7266000     -0.2854000     0.9995000 
1 1 1 17 34 0  o 9.166000  0.2240000     9.166000  0.2240000     9.166000  0.2240000     -0.000000      0.000000  
1 1 1 17 34 1  o 13.28000  0.1603000     13.36000  0.2267000     13.20000  0.2268000     0.1620000      0.3207000 
1 1 1 17 34 2  o 10.79000  0.1570000     10.91000  0.2216000     10.67000  0.2225000     0.2324000      0.3141000 
1 1 1 17 34 3  o 12.96000  0.1613000     12.99000  0.2278000     12.92000  0.2284000     0.7857000E-01  0.3225000 
1 1 1 17 34 4  o 9.222000  0.1658000     9.126000  0.2342000     9.319000  0.2349000     -0.1923000     0.3317000 
1 1 1 17 34 5  o 17.52000  0.2362000     17.38000  0.3647000     17.65000  0.3002000     -0.2668000     0.4724000 
1 1 1 17 34 6  o 5.438000  0.2612000     5.521000  0.3060000     5.355000  0.4235000     0.1663000      0.5225000 
1 1 1 17 34 7  o 3.455000  0.4435000     3.185000  0.5540000     3.726000  0.6927000     -0.5405000     0.8870000 
1 1 1 17 34 8  o 1.629000  0.4652000     1.700000  0.6838000     1.557000  0.6309000     0.1434000      0.9304000 
1 1 1 17 34 9  o 5.392000  0.2425000     5.318000  0.3529000     5.465000  0.3327000     -0.1464000     0.4850000 
1 1 1 17 34 10 o 7.374000  0.2117000     6.978000  0.3058000     7.771000  0.2928000     -0.7927000     0.4234000 
1 1 1 17 34 11 o 6.804000  0.2221000     6.390000  0.3256000     7.219000  0.3023000     -0.8287000     0.4443000 
1 1 1 17 34 12 o 4.102000  0.3305000     4.331000  0.4350000     3.874000  0.4977000     0.4569000      0.6611000 
1 1 1 17 34 13 o 2.483000  0.4989000     2.647000  0.6949000     2.319000  0.7160000     0.3283000      0.9978000 
1 1 1 17 34 14 o 6.367000  0.2988000     6.092000  0.3617000     6.641000  0.4757000     -0.5486000     0.5976000 
1 1 1 17 34 15 o 6.096000  0.2616000     6.180000  0.3457000     6.012000  0.3928000     0.1683000      0.5233000 
1 1 1 17 34 16 o 1.968000  0.5061000     1.847000  0.7264000     2.090000  0.7050000     -0.2429000     1.012000  
1 1 1 17 34 17 o 1.340000  0.4177000     1.209000  0.5588000     1.472000  0.6210000     -0.2630000     0.8354000 
1 1 1 17 34 18 o 2.279000  0.5256000     2.452000  0.7595000     2.107000  0.7268000     0.3449000      1.051000  
1 1 1 17 34 19 o 1.504000  0.4485000     1.728000  0.6732000     1.281000  0.5930000     0.4472000      0.8971000 
1 1 1 17 34 20 o 2.092000  0.5651000     1.598000  0.6694000     2.586000  0.9107000     -0.9884000     1.130000  
1 1 1 17 34 21 o 1.370000  0.4332000     1.636000  0.6818000     1.103000  0.5347000     0.5333000      0.8665000 
1 1 1 17 35 0  o 4.202000  0.3436000     4.202000  0.3436000     4.202000  0.3436000     -0.000000      0.000000  
1 1 1 17 35 1  o 3.789000  0.2710000     4.363000  0.3303000     3.216000  0.4297000     1.148000       0.5420000 
1 1 1 17 35 2  o 9.251000  0.1629000     9.212000  0.2290000     9.290000  0.2318000     -0.7790000E-01 0.3258000 
1 1 1 17 35 3  f 4.301000  0.2692000     4.175000  0.4219000     4.427000  0.3344000     -0.2522000     0.5383000 
1 1 1 17 35 4  o 5.833000  0.2687000     5.609000  0.4276000     6.057000  0.3255000     -0.4485000     0.5374000 
1 1 1 17 35 5  o 10.16000  0.2530000     9.936000  0.2381000     10.38000  0.4466000     -0.4435000     0.5061000 
1 1 1 17 35 6  o 4.567000  0.3412000     4.638000  0.3849000     4.495000  0.5635000     0.1423000      0.6824000 
1 1 1 17 35 7  o 5.500000  0.2551000     5.743000  0.3788000     5.257000  0.3417000     0.4861000      0.5102000 
1 1 1 17 35 8  o 10.11000  0.1783000     9.871000  0.2500000     10.36000  0.2542000     -0.4873000     0.3565000 
1 1 1 17 35 9  o 4.069000  0.3133000     3.950000  0.4437000     4.188000  0.4425000     -0.2381000     0.6266000 
1 1 1 17 35 10 o 3.890000  0.3381000     4.293000  0.4296000     3.488000  0.5223000     0.8055000      0.6763000 
1 1 1 17 35 11 o 3.735000  0.3725000     4.084000  0.4654000     3.387000  0.5817000     0.6966000      0.7450000 
1 1 1 17 35 12 o 3.233000  0.4287000     3.970000  0.4814000     2.496000  0.7095000     1.475000       0.8574000 
1 1 1 17 35 13 o 1.855000  0.5248000     1.699000  0.7603000     2.011000  0.7237000     -0.3124000     1.050000  
1 1 1 17 35 14 o 1.758000  0.4884000     1.618000  0.6668000     1.899000  0.7138000     -0.2817000     0.9768000 
1 1 1 17 35 15 f 1.770000  0.5276000     1.421000  0.6302000     2.119000  0.8464000     -0.6985000     1.055000  
1 1 1 17 35 16 o 2.818000  0.4341000     3.175000  0.5529000     2.462000  0.6693000     0.7132000      0.8681000 
1 1 1 17 35 17 o 2.198000  0.4594000     1.835000  0.6705000     2.562000  0.6282000     -0.7273000     0.9188000 
1 1 1 17 35 18 o 1.934000  0.4542000     1.548000  0.6762000     2.320000  0.6067000     -0.7713000     0.9085000 
1 1 1 17 35 19 o 3.132000  0.4883000     3.360000  0.5792000     2.903000  0.7862000     0.4563000      0.9765000 
1 1 1 17 35 20 o 1.663000  0.4804000     1.505000  0.6456000     1.822000  0.7115000     -0.3165000     0.9608000 
1 1 1 17 36 0  o 5.352000  0.3029000     5.352000  0.3029000     5.352000  0.3029000     -0.000000      0.000000  
1 1 1 17 36 1  o 12.61000  0.1780000     12.23000  0.2687000     12.99000  0.2334000     -0.7604000     0.3560000 
1 1 1 17 36 2  o 9.361000  0.2063000     9.522000  0.3377000     9.201000  0.2371000     0.3203000      0.4126000 
1 1 1 17 36 3  o 2.422000  0.4820000     1.810000  0.6726000     3.034000  0.6905000     -1.224000      0.9639000 
1 1 1 17 36 4  o 8.513000  0.2940000     8.707000  0.2512000     8.319000  0.5316000     0.3877000      0.5879000 
1 1 1 17 36 5  o 6.642000  0.2567000     6.853000  0.3764000     6.431000  0.3490000     0.4217000      0.5133000 
1 1 1 17 36 6  o 11.01000  0.1895000     11.06000  0.2903000     10.95000  0.2437000     0.1121000      0.3791000 
1 1 1 17 36 7  o 8.895000  0.1828000     8.851000  0.2578000     8.940000  0.2592000     -0.8904000E-01 0.3656000 
1 1 1 17 36 8  o 11.10000  0.1788000     11.24000  0.2506000     10.96000  0.2551000     0.2884000      0.3576000 
1 1 1 17 36 9  o 3.710000  0.3541000     3.808000  0.4880000     3.612000  0.5131000     0.1963000      0.7081000 
1 1 1 17 36 10 o 9.508000  0.1909000     9.541000  0.2684000     9.474000  0.2714000     0.6775000E-01  0.3817000 
1 1 1 17 36 11 o 5.208000  0.2707000     5.229000  0.3751000     5.187000  0.3905000     0.4270000E-01  0.5414000 
1 1 1 17 36 12 o 1.591000  0.4721000     1.613000  0.6658000     1.569000  0.6695000     0.4453000E-01  0.9442000 
1 1 1 17 36 13 f 2.293000  0.5496000     2.460000  0.7354000     2.126000  0.8170000     0.3341000      1.099000  
1 1 1 17 36 14 o 2.002000  0.4695000     2.578000  0.6884000     1.427000  0.6387000     1.151000       0.9390000 
1 1 1 17 36 15 o 2.697000  0.4822000     1.898000  0.7785000     3.495000  0.5693000     -1.596000      0.9645000 
1 1 1 17 36 16 o 1.273000  0.4083000     1.266000  0.5751000     1.280000  0.5797000     -0.1352000E-01 0.8166000 
1 1 1 17 36 17 o 1.511000  0.4403000     1.358000  0.5951000     1.664000  0.6492000     -0.3064000     0.8807000 
1 1 1 17 36 18 o 2.829000  0.4567000     3.095000  0.7037000     2.563000  0.5822000     0.5313000      0.9133000 
1 1 1 17 36 19 o 2.004000  0.5126000     1.482000  0.6526000     2.527000  0.7906000     -1.045000      1.025000  
1 1 1 17 36 20 o 1.480000  0.4512000     1.173000  0.5593000     1.787000  0.7082000     -0.6145000     0.9024000 
1 1 1 17 37 0  o 2.204000  1.074000      2.204000  1.074000      2.204000  1.074000      0.000000       0.000000  
1 1 1 17 37 1  o 2.238000  0.5860000     2.265000  0.7394000     2.211000  0.9093000     0.5405000E-01  1.172000  
1 1 1 17 37 2  o 4.928000  0.3634000     4.928000  0.3634000     ?         ?             ?              ?         
1 1 1 17 37 3  o 11.76000  0.2354000     12.07000  0.3278000     11.44000  0.3378000     0.6288000      0.4707000 
1 1 1 17 37 4  o 5.404000  0.2689000     5.424000  0.4340000     5.384000  0.3177000     0.4010000E-01  0.5379000 
1 1 1 17 37 5  o 8.954000  0.1949000     9.024000  0.2948000     8.885000  0.2551000     0.1397000      0.3899000 
1 1 1 17 37 6  o 8.481000  0.1865000     8.593000  0.2616000     8.369000  0.2659000     0.2241000      0.3730000 
1 1 1 17 37 7  o 3.404000  0.3566000     3.321000  0.5010000     3.486000  0.5076000     -0.1653000     0.7132000 
1 1 1 17 37 8  o 4.183000  0.2961000     4.580000  0.3742000     3.787000  0.4591000     0.7936000      0.5923000 
1 1 1 17 37 9  o 3.126000  0.4135000     3.047000  0.6031000     3.205000  0.5658000     -0.1575000     0.8270000 
1 1 1 17 37 10 f 4.263000  0.3132000     4.328000  0.4305000     4.198000  0.4549000     0.1299000      0.6263000 
1 1 1 17 37 11 o 7.344000  0.2253000     7.244000  0.3178000     7.443000  0.3193000     -0.1993000     0.4505000 
1 1 1 17 37 12 o 1.895000  0.5283000     1.904000  0.7924000     1.886000  0.6990000     0.1785000E-01  1.057000  
1 1 1 17 37 13 o 1.579000  0.4664000     1.676000  0.6724000     1.481000  0.6464000     0.1958000      0.9327000 
1 1 1 17 37 14 o 1.336000  0.4464000     1.259000  0.5904000     1.413000  0.6696000     -0.1533000     0.8927000 
1 1 1 17 37 15 o 1.441000  0.4306000     1.105000  0.5271000     1.777000  0.6812000     -0.6724000     0.8613000 
1 1 1 17 37 16 o 1.903000  0.4758000     1.579000  0.6432000     2.226000  0.7012000     -0.6474000     0.9515000 
1 1 1 17 37 17 o 1.729000  0.4622000     1.864000  0.6729000     1.594000  0.6337000     0.2702000      0.9243000 
1 1 1 17 37 18 o 1.100000  0.3692000     1.000000  0.4871000     1.200000  0.5549000     -0.1998000     0.7384000 
1 1 1 17 37 19 o 1.376000  0.4205000     0.9105000 0.4595000     1.842000  0.7044000     -0.9310000     0.8410000 
1 1 1 17 37 20 o 1.633000  0.4746000     1.838000  0.7074000     1.429000  0.6328000     0.4086000      0.9492000 
1 1 1 17 38 0  o 2.152000  0.8167000     2.152000  0.8167000     2.152000  0.8167000     0.000000       0.000000  
1 1 1 17 38 1  f 7.441000  0.2134000     7.169000  0.3056000     7.714000  0.2979000     -0.5448000     0.4268000 
1 1 1 17 38 2  o 9.100000  0.1892000     8.835000  0.2873000     9.365000  0.2462000     -0.5296000     0.3784000 
1 1 1 17 38 3  o 8.084000  0.1989000     7.704000  0.3059000     8.464000  0.2543000     -0.7597000     0.3978000 
1 1 1 17 38 4  o 7.698000  0.1897000     7.618000  0.2668000     7.779000  0.2698000     -0.1609000     0.3795000 
1 1 1 17 38 5  o 7.201000  0.1982000     7.221000  0.2777000     7.181000  0.2828000     0.3928000E-01  0.3964000 
1 1 1 17 38 6  o 1.775000  0.4601000     1.959000  0.6577000     1.591000  0.6436000     0.3685000      0.9202000 
1 1 1 17 38 7  o 6.369000  0.2218000     6.266000  0.3138000     6.471000  0.3136000     -0.2043000     0.4436000 
1 1 1 17 38 8  o 4.003000  0.3595000     3.955000  0.5561000     4.051000  0.4557000     -0.9553000E-01 0.7190000 
1 1 1 17 38 9  o 4.550000  0.2918000     4.447000  0.4197000     4.653000  0.4054000     -0.2058000     0.5835000 
1 1 1 17 38 10 o 3.459000  0.4013000     3.102000  0.6315000     3.816000  0.4954000     -0.7137000     0.8026000 
1 1 1 17 38 11 o 5.746000  0.2621000     5.354000  0.3836000     6.138000  0.3573000     -0.7834000     0.5242000 
1 1 1 17 38 12 o 3.365000  0.4835000     3.476000  0.5989000     3.254000  0.7593000     0.2217000      0.9670000 
1 1 1 17 38 13 f 2.753000  0.4692000     2.288000  0.7097000     3.218000  0.6140000     -0.9304000     0.9384000 
1 1 1 17 38 14 o 2.172000  0.5335000     2.718000  0.8190000     1.627000  0.6838000     1.090000       1.067000  
1 1 1 17 38 15 o 2.795000  0.4583000     2.612000  0.6814000     2.977000  0.6131000     -0.3644000     0.9166000 
1 1 1 17 38 16 o 2.397000  0.4593000     2.933000  0.6105000     1.860000  0.6865000     1.073000       0.9186000 
1 1 1 17 38 17 o 1.278000  0.4062000     1.425000  0.6154000     1.131000  0.5304000     0.2942000      0.8124000 
1 1 1 17 38 18 o 1.664000  0.4611000     1.476000  0.6264000     1.853000  0.6769000     -0.3773000     0.9223000 
1 1 1 17 38 19 f 1.510000  0.4654000     1.526000  0.6796000     1.493000  0.6361000     0.3287000E-01  0.9308000 
1 1 1 17 39 0  o 0.7329000 0.5120000     0.7329000 0.5120000     0.7329000 0.5120000     -0.000000      0.000000  
1 1 1 17 39 1  o 10.81000  0.1706000     10.64000  0.2426000     10.98000  0.2400000     -0.3418000     0.3412000 
1 1 1 17 39 2  o 5.207000  0.2291000     5.285000  0.3179000     5.129000  0.3300000     0.1562000      0.4582000 
1 1 1 17 39 3  o 7.137000  0.1937000     7.111000  0.2749000     7.164000  0.2728000     -0.5309000E-01 0.3873000 
1 1 1 17 39 4  o 1.457000  0.4305000     1.515000  0.6167000     1.399000  0.6009000     0.1162000      0.8611000 
1 1 1 17 39 5  o 4.735000  0.2601000     4.709000  0.3672000     4.761000  0.3685000     -0.5171000E-01 0.5202000 
1 1 1 17 39 6  o 12.35000  0.1796000     12.16000  0.2530000     12.53000  0.2550000     -0.3678000     0.3592000 
1 1 1 17 39 7  o 9.899000  0.1836000     9.850000  0.2596000     9.948000  0.2596000     -0.9785000E-01 0.3671000 
1 1 1 17 39 8  o 2.682000  0.4384000     3.108000  0.5595000     2.255000  0.6751000     0.8526000      0.8768000 
1 1 1 17 39 9  o 2.644000  0.4431000     2.066000  0.6824000     3.222000  0.5654000     -1.156000      0.8862000 
1 1 1 17 39 10 o 6.105000  0.2441000     5.896000  0.3506000     6.314000  0.3399000     -0.4182000     0.4883000 
1 1 1 17 39 11 o 1.892000  0.5066000     1.544000  0.7094000     2.241000  0.7235000     -0.6967000     1.013000  
1 1 1 17 39 12 o 2.501000  0.4939000     2.622000  0.6692000     2.379000  0.7266000     0.2430000      0.9878000 
1 1 1 17 39 13 o 2.572000  0.5453000     2.985000  0.6828000     2.160000  0.8505000     0.8249000      1.091000  
1 1 1 17 39 14 o 1.466000  0.4454000     1.673000  0.6746000     1.258000  0.5817000     0.4149000      0.8908000 
1 1 1 17 39 15 o 2.505000  0.4658000     2.080000  0.7013000     2.931000  0.6133000     -0.8516000     0.9316000 
1 1 1 17 39 16 o 1.471000  0.4315000     1.795000  0.6697000     1.147000  0.5445000     0.6486000      0.8631000 
1 1 1 17 39 17 o 1.328000  0.4152000     1.312000  0.5831000     1.345000  0.5913000     -0.3332000E-01 0.8304000 
1 1 1 17 39 18 o 1.596000  0.4448000     1.177000  0.5768000     2.014000  0.6771000     -0.8366000     0.8895000 
1 1 1 17 39 19 o 1.409000  0.4333000     1.487000  0.6284000     1.332000  0.5966000     0.1555000      0.8665000 
1 1 1 17 40 0  o 1.875000  0.7856000     1.875000  0.7856000     1.875000  0.7856000     -0.000000      0.000000  
1 1 1 17 40 1  o 1.724000  0.4543000     1.762000  0.6484000     1.686000  0.6365000     0.7608000E-01  0.9086000 
1 1 1 17 40 2  o 4.565000  0.2624000     4.707000  0.3598000     4.423000  0.3819000     0.2835000      0.5247000 
1 1 1 17 40 3  o 6.058000  0.2161000     6.279000  0.2988000     5.836000  0.3123000     0.4435000      0.4322000 
1 1 1 17 40 4  o 6.972000  0.2021000     7.047000  0.2820000     6.897000  0.2895000     0.1503000      0.4042000 
1 1 1 17 40 5  o 4.229000  0.2951000     4.381000  0.3976000     4.078000  0.4361000     0.3036000      0.5902000 
1 1 1 17 40 6  o 12.15000  0.1799000     12.21000  0.2523000     12.10000  0.2566000     0.1172000      0.3599000 
1 1 1 17 40 7  o 9.360000  0.1901000     9.216000  0.2708000     9.504000  0.2668000     -0.2877000     0.3802000 
1 1 1 17 40 8  o 1.749000  0.4799000     1.711000  0.6686000     1.786000  0.6887000     -0.7499000E-01 0.9599000 
1 1 1 17 40 9  o 3.826000  0.3561000     3.620000  0.5285000     4.032000  0.4773000     -0.4114000     0.7121000 
1 1 1 17 40 10 o 2.620000  0.4489000     3.373000  0.5566000     1.867000  0.7045000     1.506000       0.8978000 
1 1 1 17 40 11 o 2.150000  0.5631000     1.928000  0.7320000     2.371000  0.8559000     -0.4435000     1.126000  
1 1 1 17 40 12 o 1.205000  0.4019000     1.343000  0.6091000     1.067000  0.5244000     0.2756000      0.8038000 
1 1 1 17 40 13 o 1.967000  0.5361000     2.140000  0.8136000     1.794000  0.6982000     0.3459000      1.072000  
1 1 1 17 40 14 o 3.646000  0.4040000     4.706000  0.4207000     2.586000  0.6899000     2.120000       0.8081000 
1 1 1 17 40 15 o 3.212000  0.4203000     3.459000  0.5473000     2.966000  0.6381000     0.4933000      0.8407000 
1 1 1 17 40 16 o 4.453000  0.3017000     4.175000  0.4418000     4.731000  0.4112000     -0.5561000     0.6035000 
1 1 1 17 40 17 o 1.393000  0.4308000     1.392000  0.6034000     1.394000  0.6151000     -0.2285000E-02 0.8617000 
1 1 1 17 40 18 o 2.000000  0.5121000     2.100000  0.6908000     1.900000  0.7561000     0.1993000      1.024000  
1 1 1 17 40 19 o 1.313000  0.4158000     1.486000  0.6319000     1.140000  0.5405000     0.3452000      0.8315000 
1 1 1 17 41 0  o 3.543000  0.4816000     3.543000  0.4816000     3.543000  0.4816000     -0.000000      0.000000  
1 1 1 17 41 1  o 8.731000  0.1843000     8.790000  0.2582000     8.671000  0.2629000     0.1191000      0.3685000 
1 1 1 17 41 2  o 7.512000  0.2126000     7.505000  0.2749000     7.518000  0.3245000     -0.1277000E-01 0.4253000 
1 1 1 17 41 3  o 4.118000  0.2919000     4.186000  0.4033000     4.049000  0.4222000     0.1371000      0.5839000 
1 1 1 17 41 4  o 8.836000  0.1866000     8.769000  0.2630000     8.903000  0.2648000     -0.1333000     0.3732000 
1 1 1 17 41 5  o 4.312000  0.2964000     4.591000  0.3841000     4.032000  0.4514000     0.5595000      0.5928000 
1 1 1 17 41 6  o 14.97000  0.1851000     14.86000  0.2602000     15.08000  0.2634000     -0.2190000     0.3702000 
1 1 1 17 41 7  o 5.370000  0.2575000     5.400000  0.3589000     5.341000  0.3694000     0.5896000E-01  0.5151000 
1 1 1 17 41 8  o 6.121000  0.2410000     6.100000  0.3405000     6.142000  0.3412000     -0.4278000E-01 0.4820000 
1 1 1 17 41 9  o 4.338000  0.3224000     4.098000  0.4688000     4.577000  0.4427000     -0.4793000     0.6448000 
1 1 1 17 41 10 o 1.685000  0.5142000     1.718000  0.7438000     1.652000  0.7101000     0.6679000E-01  1.028000  
1 1 1 17 41 11 o 2.118000  0.5036000     2.188000  0.7108000     2.048000  0.7136000     0.1394000      1.007000  
1 1 1 17 41 12 o 2.507000  0.5446000     2.530000  0.7291000     2.485000  0.8092000     0.4517000E-01  1.089000  
1 1 1 17 41 13 o 2.131000  0.5018000     1.934000  0.7149000     2.328000  0.7045000     -0.3940000     1.004000  
1 1 1 17 41 14 o 2.507000  0.4364000     1.695000  0.6764000     3.318000  0.5516000     -1.624000      0.8728000 
1 1 1 17 41 15 o 2.187000  0.4971000     2.245000  0.7051000     2.129000  0.7009000     0.1164000      0.9942000 
1 1 1 17 41 16 o 1.894000  0.4743000     2.152000  0.6785000     1.636000  0.6629000     0.5159000      0.9486000 
1 1 1 17 41 17 f 1.939000  0.5134000     1.875000  0.7508000     2.003000  0.7003000     -0.1282000     1.027000  
1 1 1 17 41 18 o 2.927000  0.4312000     3.134000  0.5643000     2.720000  0.6520000     0.4142000      0.8623000 
1 1 1 17 42 0  o 5.303000  0.3489000     5.303000  0.3489000     5.303000  0.3489000     -0.000000      0.000000  
1 1 1 17 42 1  o 8.555000  0.1887000     8.516000  0.2663000     8.593000  0.2675000     -0.7733000E-01 0.3775000 
1 1 1 17 42 2  f 6.505000  0.2148000     6.692000  0.2966000     6.318000  0.3108000     0.3740000      0.4296000 
1 1 1 17 42 3  o 8.793000  0.1874000     8.536000  0.2675000     9.049000  0.2626000     -0.5131000     0.3749000 
1 1 1 17 42 4  o 2.805000  0.4244000     3.027000  0.5593000     2.583000  0.6386000     0.4446000      0.8489000 
1 1 1 17 42 5  o 9.314000  0.1885000     9.353000  0.2658000     9.275000  0.2673000     0.7806000E-01  0.3770000 
1 1 1 17 42 6  o 6.057000  0.2369000     6.053000  0.3312000     6.061000  0.3389000     -0.8789000E-02 0.4738000 
1 1 1 17 42 7  o 3.941000  0.3372000     3.903000  0.4849000     3.979000  0.4686000     -0.7687000E-01 0.6743000 
1 1 1 17 42 8  o 3.502000  0.3842000     3.700000  0.5133000     3.304000  0.5717000     0.3960000      0.7684000 
1 1 1 17 42 9  o 3.635000  0.4134000     3.686000  0.6209000     3.584000  0.5459000     0.1019000      0.8268000 
1 1 1 17 42 10 o 1.852000  0.5131000     1.958000  0.7040000     1.746000  0.7465000     0.2118000      1.026000  
1 1 1 17 42 11 o 6.404000  0.3133000     6.542000  0.3644000     6.267000  0.5098000     0.2748000      0.6266000 
1 1 1 17 42 12 o 2.778000  0.5032000     3.197000  0.7133000     2.359000  0.7099000     0.8377000      1.006000  
1 1 1 17 42 13 o 2.067000  0.4910000     1.787000  0.6959000     2.347000  0.6929000     -0.5598000     0.9820000 
1 1 1 17 42 14 o 1.397000  0.4334000     1.428000  0.6204000     1.366000  0.6052000     0.6211000E-01  0.8667000 
1 1 1 17 42 15 o 1.081000  0.3658000     1.019000  0.4943000     1.143000  0.5393000     -0.1240000     0.7315000 
1 1 1 17 42 16 o 1.957000  0.4671000     2.460000  0.6930000     1.454000  0.6265000     1.006000       0.9342000 
1 1 1 17 42 17 o 2.131000  0.5842000     2.338000  0.8732000     1.923000  0.7762000     0.4149000      1.168000  
1 1 1 17 42 18 o 0.9258000 0.3249000     0.9500000 0.4686000     0.9017000 0.4502000     0.4833000E-01  0.6498000 
1 1 1 17 43 0  o 19.28000  0.2823000     19.28000  0.2823000     19.28000  0.2823000     -0.000000      0.000000  
1 1 1 17 43 1  o 9.061000  0.1863000     8.919000  0.2654000     9.203000  0.2616000     -0.2842000     0.3726000 
1 1 1 17 43 2  o 4.417000  0.2803000     4.616000  0.3833000     4.217000  0.4092000     0.3993000      0.5607000 
1 1 1 17 43 3  o 2.390000  0.4697000     2.599000  0.6361000     2.180000  0.6912000     0.4194000      0.9394000 
1 1 1 17 43 4  o 4.190000  0.2999000     3.847000  0.4461000     4.533000  0.4011000     -0.6861000     0.5999000 
1 1 1 17 43 5  o 8.719000  0.1953000     8.645000  0.2768000     8.792000  0.2757000     -0.1473000     0.3907000 
1 1 1 17 43 6  o 2.679000  0.4620000     2.520000  0.6711000     2.839000  0.6351000     -0.3191000     0.9240000 
1 1 1 17 43 7  o 4.855000  0.2877000     4.770000  0.4090000     4.940000  0.4048000     -0.1698000     0.5755000 
1 1 1 17 43 8  o 4.059000  0.4090000     3.500000  0.6992000     4.618000  0.4247000     -1.118000      0.8181000 
1 1 1 17 43 9  o 1.929000  0.5377000     1.858000  0.7254000     2.000000  0.7938000     -0.1414000     1.075000  
1 1 1 17 43 10 f 6.226000  0.2735000     6.767000  0.3332000     5.684000  0.4337000     1.083000       0.5469000 
1 1 1 17 43 11 o 1.137000  0.3944000     1.249000  0.6089000     1.024000  0.5013000     0.2253000      0.7887000 
1 1 1 17 43 12 o 2.319000  0.4938000     2.654000  0.6762000     1.984000  0.7198000     0.6705000      0.9876000 
1 1 1 17 43 13 o 1.386000  0.4310000     1.467000  0.6292000     1.304000  0.5892000     0.1624000      0.8619000 
1 1 1 17 43 14 o 1.925000  0.4841000     1.979000  0.6915000     1.872000  0.6776000     0.1074000      0.9681000 
1 1 1 17 43 15 o 2.702000  0.4518000     2.286000  0.6885000     3.117000  0.5853000     -0.8313000     0.9037000 
1 1 1 17 43 16 o 2.697000  0.4444000     3.329000  0.5442000     2.064000  0.7027000     1.265000       0.8888000 
1 1 1 17 43 17 o 2.360000  0.4698000     3.007000  0.6187000     1.712000  0.7071000     1.295000       0.9396000 
1 1 1 17 43 18 o 1.634000  0.5307000     1.341000  0.6180000     1.927000  0.8629000     -0.5860000     1.061000  
1 1 1 17 44 0  o 14.10000  0.2591000     14.10000  0.2591000     14.10000  0.2591000     -0.000000      0.000000  
1 1 1 17 44 1  o 6.844000  0.2166000     6.580000  0.3177000     7.108000  0.2944000     -0.5284000     0.4331000 
1 1 1 17 44 2  o 2.881000  0.4230000     3.389000  0.5125000     2.373000  0.6732000     1.015000       0.8461000 
1 1 1 17 44 3  o 8.226000  0.1969000     8.245000  0.2747000     8.208000  0.2823000     0.3693000E-01  0.3939000 
1 1 1 17 44 4  o 4.120000  0.3075000     4.111000  0.4314000     4.128000  0.4385000     -0.1765000E-01 0.6151000 
1 1 1 17 44 5  f 7.841000  0.2084000     7.863000  0.2921000     7.819000  0.2973000     0.4372000E-01  0.4168000 
1 1 1 17 44 6  o 4.160000  0.3228000     4.350000  0.4366000     3.971000  0.4757000     0.3791000      0.6457000 
1 1 1 17 44 7  o 4.605000  0.3371000     4.675000  0.5229000     4.534000  0.4254000     0.1409000      0.6741000 
1 1 1 17 44 8  o 1.718000  0.5088000     1.747000  0.7243000     1.688000  0.7148000     0.5951000E-01  1.018000  
1 1 1 17 44 9  o 3.329000  0.4458000     4.249000  0.4635000     2.409000  0.7616000     1.841000       0.8916000 
1 1 1 17 44 10 o 3.263000  0.5115000     2.562000  0.8324000     3.964000  0.5947000     -1.402000      1.023000  
1 1 1 17 44 11 o 2.274000  0.4639000     2.912000  0.6451000     1.636000  0.6669000     1.276000       0.9278000 
1 1 1 17 44 12 o 3.050000  0.4284000     3.293000  0.5538000     2.806000  0.6538000     0.4870000      0.8568000 
1 1 1 17 44 13 f 1.225000  0.3996000     1.383000  0.6149000     1.067000  0.5104000     0.3164000      0.7992000 
1 1 1 17 44 14 f 1.274000  0.4022000     1.018000  0.4965000     1.531000  0.6328000     -0.5134000     0.8043000 
1 1 1 17 44 15 o 1.830000  0.4852000     1.840000  0.6991000     1.821000  0.6730000     0.1985000E-01  0.9704000 
1 1 1 17 44 16 o 1.609000  0.5012000     1.585000  0.7204000     1.632000  0.6971000     -0.4710000E-01 1.002000  
1 1 1 17 44 17 o 3.536000  0.3930000     3.836000  0.5167000     3.237000  0.5923000     0.5984000      0.7860000 
1 1 1 17 45 0  o 1.911000  0.8487000     1.911000  0.8487000     1.911000  0.8487000     -0.000000      0.000000  
1 1 1 17 45 1  o 4.615000  0.2889000     4.378000  0.4297000     4.852000  0.3865000     -0.4740000     0.5779000 
1 1 1 17 45 2  f 2.219000  0.4616000     1.672000  0.6663000     2.766000  0.6389000     -1.094000      0.9231000 
1 1 1 17 45 3  o 5.982000  0.2375000     6.143000  0.3304000     5.821000  0.3411000     0.3225000      0.4749000 
1 1 1 17 45 4  o 1.896000  0.4623000     2.340000  0.6757000     1.452000  0.6313000     0.8878000      0.9247000 
1 1 1 17 45 5  f 7.625000  0.2122000     7.669000  0.2958000     7.582000  0.3044000     0.8707000E-01  0.4244000 
1 1 1 17 45 6  f 6.818000  0.2481000     6.885000  0.3691000     6.751000  0.3318000     0.1334000      0.4962000 
1 1 1 17 45 7  o 4.365000  0.4337000     4.968000  0.6185000     3.761000  0.6081000     1.206000       0.8674000 
1 1 1 17 45 8  o 2.391000  0.5299000     2.563000  0.6990000     2.219000  0.7966000     0.3438000      1.060000  
1 1 1 17 45 9  o 1.894000  0.5289000     1.602000  0.6889000     2.186000  0.8028000     -0.5843000     1.058000  
1 1 1 17 45 10 o 1.832000  0.4338000     1.086000  0.5347000     2.578000  0.6832000     -1.491000      0.8676000 
1 1 1 17 45 11 o 1.776000  0.4756000     1.471000  0.6339000     2.081000  0.7091000     -0.6104000     0.9511000 
1 1 1 17 45 12 o 5.434000  0.2693000     5.624000  0.3610000     5.243000  0.3998000     0.3810000      0.5386000 
1 1 1 17 45 13 o 1.967000  0.4779000     2.320000  0.6936000     1.615000  0.6575000     0.7048000      0.9557000 
1 1 1 17 45 14 f 1.424000  0.4286000     1.098000  0.5228000     1.750000  0.6792000     -0.6522000     0.8571000 
1 1 1 17 45 15 o 2.274000  0.4228000     3.162000  0.5812000     1.387000  0.6142000     1.775000       0.8456000 
1 1 1 17 45 16 o 2.742000  0.4985000     3.232000  0.6034000     2.252000  0.7935000     0.9799000      0.9969000 
1 1 1 17 45 17 o 1.222000  0.4032000     1.191000  0.5562000     1.254000  0.5838000     -0.6345000E-01 0.8064000 
1 1 1 17 46 0  o 1.833000  0.8496000     1.833000  0.8496000     1.833000  0.8496000     -0.000000      0.000000  
1 1 1 17 46 1  o 2.397000  0.4763000     2.666000  0.6415000     2.127000  0.7042000     0.5390000      0.9526000 
1 1 1 17 46 2  o 1.682000  0.4714000     1.731000  0.6717000     1.633000  0.6616000     0.9787000E-01  0.9428000 
1 1 1 17 46 3  o 3.531000  0.3781000     2.797000  0.6239000     4.266000  0.4271000     -1.469000      0.7561000 
1 1 1 17 46 4  o 3.592000  0.3771000     4.044000  0.4590000     3.141000  0.5983000     0.9034000      0.7541000 
1 1 1 17 46 5  o 1.654000  0.4886000     1.756000  0.7259000     1.551000  0.6543000     0.2054000      0.9773000 
1 1 1 17 46 6  o 2.707000  0.5377000     3.371000  0.7583000     2.042000  0.7626000     1.328000       1.075000  
1 1 1 17 46 7  o 5.547000  0.3188000     5.422000  0.3907000     5.672000  0.5039000     -0.2501000     0.6376000 
1 1 1 17 46 8  o 5.662000  0.3409000     6.106000  0.4935000     5.218000  0.4705000     0.8882000      0.6819000 
1 1 1 17 46 9  o 3.672000  0.4169000     3.627000  0.6413000     3.718000  0.5328000     -0.9150000E-01 0.8338000 
1 1 1 17 46 10 o 3.923000  0.3451000     4.092000  0.4650000     3.754000  0.5102000     0.3383000      0.6903000 
1 1 1 17 46 11 f 2.011000  0.4701000     1.529000  0.6465000     2.493000  0.6827000     -0.9637000     0.9403000 
1 1 1 17 46 12 o 4.459000  0.3122000     3.890000  0.4841000     5.028000  0.3943000     -1.139000      0.6244000 
1 1 1 17 46 13 o 3.013000  0.4339000     2.903000  0.6330000     3.122000  0.5938000     -0.2192000     0.8679000 
1 1 1 17 46 14 o 1.882000  0.4874000     2.046000  0.6902000     1.717000  0.6883000     0.3290000      0.9748000 
1 1 1 17 46 15 o 2.668000  0.5384000     2.279000  0.8675000     3.058000  0.6380000     -0.7789000     1.077000  
1 1 1 17 46 16 o 1.091000  0.3696000     1.056000  0.5099000     1.125000  0.5351000     -0.6884000E-01 0.7391000 
1 1 1 17 47 0  o 0.9573000 0.6377000     0.9573000 0.6377000     0.9573000 0.6377000     0.000000       0.000000  
1 1 1 17 47 1  o 7.010000  0.2244000     7.476000  0.3004000     6.544000  0.3335000     0.9326000      0.4488000 
1 1 1 17 47 2  o 3.220000  0.4004000     3.020000  0.6018000     3.421000  0.5282000     -0.4011000     0.8007000 
1 1 1 17 47 3  o 4.338000  0.3455000     4.197000  0.5484000     4.479000  0.4204000     -0.2821000     0.6911000 
1 1 1 17 47 4  o 3.385000  0.4765000     3.344000  0.7820000     3.427000  0.5446000     -0.8220000E-01 0.9530000 
1 1 1 17 47 5  o 2.842000  0.5701000     3.325000  0.6337000     2.358000  0.9479000     0.9675000      1.140000  
1 1 1 17 47 6  o 1.858000  0.5733000     1.305000  0.6066000     2.410000  0.9729000     -1.105000      1.147000  
1 1 1 17 47 7  o 2.100000  0.5509000     2.494000  0.8350000     1.705000  0.7187000     0.7887000      1.102000  
1 1 1 17 47 8  o 3.665000  0.4128000     3.829000  0.6237000     3.502000  0.5411000     0.3265000      0.8257000 
1 1 1 17 47 9  o 2.302000  0.4769000     1.798000  0.6936000     2.805000  0.6546000     -1.007000      0.9537000 
1 1 1 17 47 10 o 2.754000  0.4716000     2.626000  0.6872000     2.883000  0.6462000     -0.2572000     0.9433000 
1 1 1 17 47 11 o 2.415000  0.4859000     2.390000  0.6806000     2.440000  0.6935000     -0.5079000E-01 0.9717000 
1 1 1 17 47 12 o 1.636000  0.4523000     1.288000  0.5865000     1.984000  0.6888000     -0.6965000     0.9047000 
1 1 1 17 47 13 o 3.228000  0.4150000     3.501000  0.5480000     2.955000  0.6233000     0.5463000      0.8300000 
1 1 1 17 47 14 o 4.771000  0.2953000     4.570000  0.4269000     4.972000  0.4082000     -0.4023000     0.5907000 
1 1 1 17 47 15 o 1.603000  0.4589000     1.956000  0.6944000     1.250000  0.6002000     0.7052000      0.9178000 
1 1 1 17 47 16 o 1.598000  0.4746000     1.425000  0.6255000     1.772000  0.7140000     -0.3470000     0.9493000 
1 1 1 17 48 0  o 2.589000  0.8823000     2.589000  0.8823000     2.589000  0.8823000     0.000000       0.000000  
1 1 1 17 48 1  o 2.174000  0.5352000     2.175000  0.7529000     2.173000  0.7608000     0.1860000E-02  1.070000  
1 1 1 17 48 2  o 3.394000  0.5182000     3.708000  0.7504000     3.081000  0.7147000     0.6265000      1.036000  
1 1 1 17 48 3  o 1.946000  0.5456000     1.675000  0.7057000     2.217000  0.8323000     -0.5426000     1.091000  
1 1 1 17 48 4  o 2.543000  0.7502000     2.543000  0.7502000     ?         ?             ?              ?         
1 1 1 17 48 5  o 1.401000  0.4491000     1.635000  0.6963000     1.167000  0.5673000     0.4679000      0.8981000 
1 1 1 17 48 6  o 2.656000  0.5014000     2.997000  0.7207000     2.315000  0.6973000     0.6822000      1.003000  
1 1 1 17 48 7  o 4.064000  0.3419000     4.622000  0.4363000     3.506000  0.5264000     1.116000       0.6837000 
1 1 1 17 48 8  o 1.710000  0.4804000     1.886000  0.7056000     1.533000  0.6522000     0.3527000      0.9609000 
1 1 1 17 48 9  o 3.412000  0.3964000     3.214000  0.5917000     3.610000  0.5275000     -0.3962000     0.7927000 
1 1 1 17 48 10 o 3.552000  0.3786000     3.693000  0.5152000     3.411000  0.5550000     0.2821000      0.7573000 
1 1 1 17 48 11 o 3.595000  0.3720000     3.869000  0.4887000     3.322000  0.5609000     0.5464000      0.7440000 
1 1 1 17 48 12 o 2.645000  0.4662000     2.618000  0.6677000     2.672000  0.6509000     -0.5390000E-01 0.9325000 
1 1 1 17 48 13 o 1.368000  0.4328000     1.499000  0.6442000     1.237000  0.5782000     0.2618000      0.8656000 
1 1 1 17 48 14 o 1.703000  0.5202000     1.991000  0.8188000     1.415000  0.6419000     0.5760000      1.040000  
1 1 1 17 48 15 o 1.723000  0.4323000     2.429000  0.7054000     1.017000  0.4998000     1.412000       0.8645000 
1 1 1 17 49 0  o 1.452000  0.9464000     1.452000  0.9464000     1.452000  0.9464000     0.000000       0.000000  
1 1 1 17 49 1  o 2.393000  0.6277000     2.412000  0.8278000     2.374000  0.9439000     0.3763000E-01  1.255000  
1 1 1 17 49 2  o 3.980000  0.5879000     4.706000  0.6020000     3.254000  1.010000      1.452000       1.176000  
1 1 1 17 49 3  o 3.218000  0.5562000     2.924000  0.7975000     3.511000  0.7755000     -0.5867000     1.112000  
1 1 1 17 49 4  o 2.414000  0.5130000     2.132000  0.7789000     2.696000  0.6678000     -0.5635000     1.026000  
1 1 1 17 49 5  o 3.367000  0.4329000     3.352000  0.6671000     3.382000  0.5518000     -0.2984000E-01 0.8657000 
1 1 1 17 49 6  o 2.191000  0.4975000     2.008000  0.7039000     2.375000  0.7033000     -0.3670000     0.9950000 
1 1 1 17 49 7  o 2.501000  0.4813000     3.018000  0.6308000     1.984000  0.7272000     1.034000       0.9626000 
1 1 1 17 49 8  o 2.716000  0.4625000     2.347000  0.7025000     3.086000  0.6020000     -0.7389000     0.9251000 
1 1 1 17 49 9  o 1.941000  0.4709000     2.404000  0.6942000     1.478000  0.6363000     0.9269000      0.9417000 
1 1 1 17 49 10 o 2.767000  0.4617000     3.089000  0.6141000     2.445000  0.6895000     0.6444000      0.9233000 
1 1 1 17 49 11 o 3.177000  0.4158000     2.883000  0.6363000     3.470000  0.5353000     -0.5865000     0.8315000 
1 1 1 17 49 12 o 1.818000  0.4841000     1.811000  0.6817000     1.825000  0.6874000     -0.1326000E-01 0.9681000 
1 1 1 17 49 13 o 1.624000  0.4429000     1.075000  0.5307000     2.173000  0.7091000     -1.098000      0.8857000 
1 1 1 17 49 14 o 1.370000  0.4506000     1.199000  0.5635000     1.541000  0.7033000     -0.3422000     0.9012000 
1 1 1 17 49 15 o 1.411000  0.4442000     1.457000  0.6286000     1.364000  0.6278000     0.9267000E-01  0.8885000 
1 1 1 17 50 0  o 0.6934000 0.5004000     0.6934000 0.5004000     0.6934000 0.5004000     -0.000000      0.000000  
1 1 1 17 50 1  o 3.963000  0.3830000     3.697000  0.6154000     4.229000  0.4562000     -0.5313000     0.7661000 
1 1 1 17 50 2  o 5.238000  0.2759000     5.234000  0.3952000     5.243000  0.3852000     -0.9101000E-02 0.5519000 
1 1 1 17 50 3  o 7.680000  0.2236000     7.376000  0.3191000     7.984000  0.3134000     -0.6083000     0.4473000 
1 1 1 17 50 4  f 2.875000  0.4569000     2.916000  0.6546000     2.834000  0.6377000     0.8116000E-01  0.9139000 
1 1 1 17 50 5  o 4.415000  0.3148000     4.299000  0.4538000     4.530000  0.4365000     -0.2315000     0.6296000 
1 1 1 17 50 6  o 4.380000  0.3160000     4.652000  0.4243000     4.108000  0.4683000     0.5440000      0.6319000 
1 1 1 17 50 7  o 2.285000  0.5033000     2.303000  0.7118000     2.267000  0.7116000     0.3537000E-01  1.007000  
1 1 1 17 50 8  o 1.564000  0.4542000     1.316000  0.5951000     1.811000  0.6863000     -0.4947000     0.9084000 
1 1 1 17 50 9  o 1.633000  0.4710000     1.716000  0.6783000     1.549000  0.6535000     0.1676000      0.9419000 
1 1 1 17 50 10 o 1.803000  0.4840000     1.948000  0.7027000     1.657000  0.6658000     0.2912000      0.9680000 
1 1 1 17 50 11 o 1.552000  0.4598000     1.505000  0.6354000     1.598000  0.6647000     -0.9290000E-01 0.9195000 
1 1 1 17 50 12 o 1.928000  0.4837000     2.250000  0.7087000     1.606000  0.6585000     0.6437000      0.9674000 
1 1 1 17 50 13 o 1.906000  0.5253000     2.468000  0.8459000     1.343000  0.6232000     1.125000       1.051000  
1 1 1 17 50 14 o 2.050000  0.4932000     1.849000  0.6933000     2.250000  0.7017000     -0.4013000     0.9865000 
1 1 1 17 51 0  f 3.133000  0.6464000     3.133000  0.6464000     3.133000  0.6464000     0.000000       0.000000  
1 1 1 17 51 1  o 1.939000  0.4898000     2.183000  0.7037000     1.695000  0.6814000     0.4875000      0.9796000 
1 1 1 17 51 2  o 2.684000  0.4842000     2.736000  0.6618000     2.632000  0.7070000     0.1038000      0.9685000 
1 1 1 17 51 3  o 2.461000  0.4913000     2.468000  0.6797000     2.453000  0.7096000     0.1524000E-01  0.9826000 
1 1 1 17 51 4  o 3.328000  0.4083000     3.641000  0.5321000     3.016000  0.6193000     0.6252000      0.8165000 
1 1 1 17 51 5  o 5.590000  0.2602000     5.406000  0.3734000     5.775000  0.3625000     -0.3688000     0.5204000 
1 1 1 17 51 6  o 4.500000  0.3181000     4.179000  0.4768000     4.821000  0.4211000     -0.6419000     0.6361000 
1 1 1 17 51 7  o 2.001000  0.4851000     1.552000  0.6527000     2.449000  0.7178000     -0.8980000     0.9702000 
1 1 1 17 51 8  o 1.909000  0.4888000     2.148000  0.7105000     1.669000  0.6716000     0.4792000      0.9777000 
1 1 1 17 51 9  o 3.261000  0.4214000     3.288000  0.5995000     3.233000  0.5924000     0.5517000E-01  0.8429000 
1 1 1 17 51 10 o 1.467000  0.4462000     1.277000  0.5836000     1.657000  0.6750000     -0.3794000     0.8923000 
1 1 1 17 51 11 o 2.556000  0.4756000     2.292000  0.6981000     2.819000  0.6460000     -0.5271000     0.9512000 
1 1 1 17 51 12 o 2.653000  0.5440000     2.423000  0.8703000     2.883000  0.6527000     -0.4596000     1.088000  
1 1 1 17 51 13 o 2.840000  0.4891000     2.572000  0.6940000     3.108000  0.6894000     -0.5354000     0.9782000 
1 1 1 17 51 14 o 1.493000  0.5074000     1.345000  0.6371000     1.641000  0.7898000     -0.2959000     1.015000  
1 1 1 17 52 0  o 1.050000  0.6794000     1.050000  0.6794000     1.050000  0.6794000     0.000000       0.000000  
1 1 1 17 52 1  o 2.358000  0.4447000     1.503000  0.6431000     3.212000  0.6142000     -1.709000      0.8893000 
1 1 1 17 52 2  f 1.836000  0.4875000     1.985000  0.7032000     1.687000  0.6752000     0.2983000      0.9749000 
1 1 1 17 52 3  o 4.174000  0.3287000     3.980000  0.4834000     4.367000  0.4454000     -0.3871000     0.6573000 
1 1 1 17 52 4  o 2.409000  0.4846000     2.273000  0.6991000     2.546000  0.6713000     -0.2729000     0.9692000 
1 1 1 17 52 5  o 3.359000  0.4018000     3.545000  0.5283000     3.173000  0.6054000     0.3720000      0.8035000 
1 1 1 17 52 6  o 3.478000  0.3901000     3.134000  0.5906000     3.821000  0.5099000     -0.6871000     0.7803000 
1 1 1 17 52 7  o 1.603000  0.4695000     1.568000  0.6594000     1.639000  0.6685000     -0.7139000E-01 0.9389000 
1 1 1 17 52 8  o 1.706000  0.4836000     1.743000  0.6905000     1.669000  0.6772000     0.7447000E-01  0.9671000 
1 1 1 17 52 9  o 1.499000  0.4547000     1.693000  0.6861000     1.306000  0.5968000     0.3876000      0.9093000 
1 1 1 17 52 10 o 1.726000  0.4747000     1.518000  0.6425000     1.933000  0.6991000     -0.4153000     0.9495000 
1 1 1 17 52 11 o 1.789000  0.4883000     1.484000  0.6739000     2.093000  0.7069000     -0.6088000     0.9767000 
1 1 1 17 52 12 o 1.347000  0.4334000     1.563000  0.6631000     1.130000  0.5584000     0.4336000      0.8669000 
1 1 1 17 52 13 o 1.650000  0.4685000     1.226000  0.5701000     2.073000  0.7436000     -0.8473000     0.9370000 
1 1 1 17 53 0  o 3.176000  0.6600000     3.176000  0.6600000     3.176000  0.6600000     -0.000000      0.000000  
1 1 1 17 53 1  o 3.608000  0.3773000     3.561000  0.5369000     3.656000  0.5301000     -0.9454000E-01 0.7545000 
1 1 1 17 53 2  o 3.558000  0.3793000     3.493000  0.5409000     3.623000  0.5320000     -0.1294000     0.7587000 
1 1 1 17 53 3  o 2.620000  0.4446000     1.906000  0.6907000     3.335000  0.5601000     -1.429000      0.8893000 
1 1 1 17 53 4  o 2.095000  0.4357000     1.318000  0.5969000     2.872000  0.6350000     -1.554000      0.8715000 
1 1 1 17 53 5  o 1.707000  0.4774000     1.630000  0.6631000     1.784000  0.6871000     -0.1539000     0.9549000 
1 1 1 17 53 6  o 2.017000  0.4943000     1.969000  0.6951000     2.065000  0.7029000     -0.9610000E-01 0.9886000 
1 1 1 17 53 7  o 2.009000  0.4802000     1.529000  0.6465000     2.488000  0.7103000     -0.9585000     0.9604000 
1 1 1 17 53 8  o 1.787000  0.4847000     2.094000  0.7264000     1.480000  0.6419000     0.6143000      0.9694000 
1 1 1 17 53 9  o 1.146000  0.3861000     1.279000  0.5912000     1.012000  0.4968000     0.2668000      0.7723000 
1 1 1 17 53 10 o 2.140000  0.5027000     1.943000  0.6977000     2.338000  0.7238000     -0.3943000     1.005000  
1 1 1 17 53 11 o 5.044000  0.3762000     4.741000  0.5053000     5.346000  0.5576000     -0.6047000     0.7525000 
1 1 1 17 53 12 o 1.466000  0.4561000     1.660000  0.6868000     1.271000  0.6003000     0.3882000      0.9122000 
1 1 1 17 54 0  o 2.953000  0.7252000     2.953000  0.7252000     2.953000  0.7252000     -0.000000      0.000000  
1 1 1 17 54 1  o 3.196000  0.4286000     2.599000  0.6937000     3.792000  0.5035000     -1.193000      0.8572000 
1 1 1 17 54 2  o 2.741000  0.4535000     3.478000  0.5431000     2.004000  0.7264000     1.473000       0.9070000 
1 1 1 17 54 3  o 1.397000  0.4372000     1.450000  0.6282000     1.345000  0.6082000     0.1052000      0.8744000 
1 1 1 17 54 4  o 2.982000  0.4449000     3.036000  0.6149000     2.927000  0.6431000     0.1087000      0.8898000 
1 1 1 17 54 5  o 3.605000  0.3792000     3.311000  0.5777000     3.900000  0.4914000     -0.5887000     0.7584000 
1 1 1 17 54 6  o 2.429000  0.4688000     3.043000  0.6318000     1.815000  0.6929000     1.228000       0.9377000 
1 1 1 17 54 7  o 1.213000  0.3997000     1.386000  0.6171000     1.040000  0.5081000     0.3461000      0.7994000 
1 1 1 17 54 8  o 1.587000  0.4712000     1.738000  0.6945000     1.437000  0.6371000     0.3010000      0.9424000 
1 1 1 17 54 9  o 1.198000  0.3951000     1.437000  0.6308000     0.9593000 0.4760000     0.4782000      0.7903000 
1 1 1 17 54 10 o 1.416000  0.4688000     1.689000  0.7558000     1.143000  0.5550000     0.5459000      0.9377000 
1 1 1 17 54 11 o 1.715000  0.5054000     1.357000  0.6115000     2.072000  0.8048000     -0.7158000     1.011000  
1 1 1 17 55 0  o 5.852000  0.3793000     5.852000  0.3793000     5.852000  0.3793000     0.000000       0.000000  
1 1 1 17 55 1  o 2.005000  0.5028000     1.931000  0.7105000     2.079000  0.7116000     -0.1484000     1.006000  
1 1 1 17 55 2  o 1.718000  0.4815000     1.839000  0.6949000     1.598000  0.6667000     0.2407000      0.9630000 
1 1 1 17 55 3  o 5.197000  0.2855000     4.885000  0.4246000     5.509000  0.3817000     -0.6238000     0.5709000 
1 1 1 17 55 4  o 2.372000  0.4764000     2.853000  0.6369000     1.891000  0.7085000     0.9617000      0.9527000 
1 1 1 17 55 5  o 7.218000  0.2367000     7.350000  0.3292000     7.087000  0.3401000     0.2638000      0.4734000 
1 1 1 17 55 6  o 1.394000  0.4337000     1.054000  0.5117000     1.735000  0.7004000     -0.6806000     0.8674000 
1 1 1 17 55 7  o 1.836000  0.4720000     2.298000  0.7128000     1.374000  0.6188000     0.9238000      0.9439000 
1 1 1 17 55 8  o 1.776000  0.4598000     2.358000  0.7259000     1.195000  0.5644000     1.163000       0.9195000 
1 1 1 17 55 9  o 1.620000  0.5020000     1.389000  0.6682000     1.851000  0.7495000     -0.4620000     1.004000  
1 1 1 17 55 10 o 1.724000  0.5012000     1.901000  0.7138000     1.548000  0.7037000     0.3529000      1.002000  
1 1 1 17 55 11 o 1.808000  0.5155000     1.288000  0.6048000     2.328000  0.8350000     -1.041000      1.031000  
1 1 1 17 56 0  o 1.855000  0.8792000     1.855000  0.8792000     1.855000  0.8792000     -0.000000      0.000000  
1 1 1 17 56 1  o 1.251000  0.4121000     1.183000  0.5606000     1.320000  0.6043000     -0.1372000     0.8242000 
1 1 1 17 56 2  o 2.571000  0.4968000     2.516000  0.6994000     2.627000  0.7059000     -0.1111000     0.9937000 
1 1 1 17 56 3  o 2.021000  0.5067000     1.963000  0.7147000     2.078000  0.7184000     -0.1148000     1.013000  
1 1 1 17 56 4  o 1.412000  0.4299000     1.040000  0.5080000     1.784000  0.6938000     -0.7444000     0.8599000 
1 1 1 17 56 5  o 7.148000  0.2435000     7.007000  0.3471000     7.290000  0.3417000     -0.2828000     0.4870000 
1 1 1 17 56 6  o 6.024000  0.2678000     6.094000  0.3742000     5.954000  0.3831000     0.1398000      0.5355000 
1 1 1 17 56 7  o 1.840000  0.4929000     1.606000  0.6730000     2.075000  0.7202000     -0.4699000     0.9857000 
1 1 1 17 56 8  f 1.855000  0.5495000     2.063000  0.8432000     1.648000  0.7048000     0.4150000      1.099000  
1 1 1 17 56 9  o 1.737000  0.4724000     2.266000  0.7337000     1.209000  0.5953000     1.057000       0.9449000 
1 1 1 17 56 10 o 2.347000  0.5352000     2.942000  0.7574000     1.752000  0.7565000     1.190000       1.070000  
1 1 1 17 57 0  o 3.581000  0.6104000     3.581000  0.6104000     3.581000  0.6104000     0.000000       0.000000  
1 1 1 17 57 1  o 1.419000  0.4430000     1.227000  0.5721000     1.612000  0.6764000     -0.3854000     0.8860000 
1 1 1 17 57 2  o 2.356000  0.4910000     2.820000  0.6716000     1.892000  0.7166000     0.9287000      0.9821000 
1 1 1 17 57 3  o 1.559000  0.4564000     1.859000  0.6993000     1.258000  0.5867000     0.6012000      0.9129000 
1 1 1 17 57 4  o 5.327000  0.2918000     5.691000  0.3887000     4.962000  0.4354000     0.7292000      0.5837000 
1 1 1 17 57 5  o 4.641000  0.3177000     4.850000  0.4338000     4.432000  0.4641000     0.4173000      0.6353000 
1 1 1 17 57 6  o 2.804000  0.5149000     3.126000  0.7439000     2.481000  0.7121000     0.6451000      1.030000  
1 1 1 17 57 7  o 1.284000  0.4382000     1.384000  0.6626000     1.185000  0.5736000     0.1989000      0.8764000 
1 1 1 17 57 8  o 1.941000  0.5537000     1.732000  0.7031000     2.149000  0.8557000     -0.4171000     1.107000  
1 1 1 17 57 9  f 1.494000  0.4783000     1.396000  0.6426000     1.592000  0.7088000     -0.1961000     0.9567000 
1 1 1 17 58 0  o 1.231000  0.7550000     1.231000  0.7550000     1.231000  0.7550000     0.000000       0.000000  
1 1 1 17 58 1  f 1.618000  0.4743000     1.622000  0.6747000     1.613000  0.6667000     0.9102000E-02  0.9485000 
1 1 1 17 58 2  o 2.691000  0.4951000     2.403000  0.7223000     2.979000  0.6773000     -0.5761000     0.9902000 
1 1 1 17 58 3  o 1.804000  0.4873000     2.093000  0.7220000     1.515000  0.6546000     0.5787000      0.9746000 
1 1 1 17 58 4  o 2.533000  0.4533000     1.561000  0.6909000     3.504000  0.5871000     -1.942000      0.9067000 
1 1 1 17 58 5  o 2.430000  0.5023000     1.768000  0.7821000     3.093000  0.6305000     -1.325000      1.005000  
1 1 1 17 58 6  o 2.290000  0.6027000     2.493000  0.7884000     2.088000  0.9119000     0.4050000      1.205000  
1 1 1 17 58 7  o 2.514000  0.6480000     2.598000  0.7820000     2.430000  1.033000      0.1684000      1.296000  
1 1 1 17 58 8  o 1.692000  0.5386000     1.322000  0.6600000     2.062000  0.8513000     -0.7401000     1.077000  
1 1 1 17 59 0  o 1.468000  0.8280000     1.468000  0.8280000     1.468000  0.8280000     0.000000       0.000000  
1 1 1 17 59 1  o 4.564000  0.3555000     4.491000  0.5483000     4.637000  0.4525000     -0.1463000     0.7109000 
1 1 1 17 59 2  o 1.870000  0.5110000     1.605000  0.7057000     2.135000  0.7392000     -0.5298000     1.022000  
1 1 1 17 59 3  o 1.586000  0.5022000     1.889000  0.7979000     1.283000  0.6100000     0.6058000      1.004000  
1 1 1 17 59 4  o 3.152000  0.5357000     3.965000  0.6148000     2.339000  0.8773000     1.627000       1.071000  
1 1 1 17 59 5  o 1.250000  0.5965000     1.250000  0.5965000     ?         ?             ?              ?         
1 1 1 17 59 6  o 2.273000  0.5036000     2.993000  0.7269000     1.553000  0.6970000     1.441000       1.007000  
1 1 1 17 60 0  o 2.202000  1.215000      2.202000  1.215000      2.202000  1.215000      0.000000       0.000000  
1 1 1 17 60 1  f 1.499000  0.4997000     1.680000  0.7505000     1.318000  0.6601000     0.3614000      0.9995000 
1 1 1 17 60 2  o 1.189000  0.5870000     1.189000  0.5870000     ?         ?             ?              ?         
1 1 1 17 60 3  o 1.717000  0.5217000     2.025000  0.7730000     1.409000  0.7008000     0.6163000      1.043000  
1 1 1 17 60 4  o 2.220000  0.5994000     2.396000  0.8589000     2.045000  0.8363000     0.3504000      1.199000  
1 1 1 17 60 5  o 1.425000  0.5032000     1.558000  0.7679000     1.292000  0.6506000     0.2663000      1.006000  
1 1 1 17 61 0  f 1.654000  0.9225000     1.654000  0.9225000     1.654000  0.9225000     -0.000000      0.000000  
1 1 1 17 61 1  o 1.493000  0.4757000     1.618000  0.7070000     1.367000  0.6365000     0.2509000      0.9514000 
1 1 1 17 61 2  o 1.756000  0.5622000     1.555000  0.7595000     1.957000  0.8291000     -0.4013000     1.124000  
1 1 1 18 0  1  o 7.475000  0.1495000     7.475000  0.1495000     7.475000  0.1495000     -0.000000      0.000000  
1 1 1 18 0  2  o 12.68000  0.2325000     12.68000  0.2325000     12.68000  0.2325000     0.000000       0.000000  
1 1 1 18 0  3  o 5.457000  0.1213000     5.457000  0.1213000     5.457000  0.1213000     -0.000000      0.000000  
1 1 1 18 0  4  o 2.137000  0.4486000     2.137000  0.4486000     2.137000  0.4486000     0.000000       0.000000  
1 1 1 18 0  5  o 12.63000  0.1856000     12.63000  0.1856000     12.63000  0.1856000     0.000000       0.000000  
1 1 1 18 0  6  f 14.69000  0.2430000     14.69000  0.2430000     14.69000  0.2430000     0.000000       0.000000  
1 1 1 18 0  7  o 4.558000  0.3097000     4.558000  0.3097000     4.558000  0.3097000     -0.000000      0.000000  
1 1 1 18 0  8  o 2.420000  0.6785000     2.420000  0.6785000     2.420000  0.6785000     0.000000       0.000000  
1 1 1 18 0  9  o 8.287000  0.2488000     8.287000  0.2488000     8.287000  0.2488000     0.000000       0.000000  
1 1 1 18 0  10 o 0.9637000 0.6361000     0.9637000 0.6361000     0.9637000 0.6361000     0.000000       0.000000  
1 1 1 18 0  11 o 10.60000  0.2661000     10.60000  0.2661000     10.60000  0.2661000     0.000000       0.000000  
1 1 1 18 0  12 o 8.715000  0.3070000     8.715000  0.3070000     8.715000  0.3070000     0.000000       0.000000  
1 1 1 18 0  13 o 13.42000  0.2880000     13.42000  0.2880000     13.42000  0.2880000     -0.000000      0.000000  
1 1 1 18 0  14 o 3.729000  0.7961000     3.729000  0.7961000     3.729000  0.7961000     -0.000000      0.000000  
1 1 1 18 0  15 o 1.232000  0.8177000     1.232000  0.8177000     1.232000  0.8177000     0.000000       0.000000  
1 1 1 18 0  16 o 6.592000  0.4972000     6.592000  0.4972000     6.592000  0.4972000     0.000000       0.000000  
1 1 1 18 0  17 o 2.186000  1.111000      2.186000  1.111000      2.186000  1.111000      0.000000       0.000000  
1 1 1 18 0  18 o 2.996000  1.038000      2.996000  1.038000      2.996000  1.038000      0.000000       0.000000  
1 1 1 18 0  19 o 1.915000  1.004000      1.915000  1.004000      1.915000  1.004000      -0.000000      0.000000  
1 1 1 18 0  20 o 0.8910000 0.6262000     0.8910000 0.6262000     0.8910000 0.6262000     0.000000       0.000000  
1 1 1 18 0  21 o 1.167000  0.7704000     1.167000  0.7704000     1.167000  0.7704000     -0.000000      0.000000  
1 1 1 18 0  22 o 1.733000  0.8958000     1.733000  0.8958000     1.733000  0.8958000     0.000000       0.000000  
1 1 1 18 0  23 o 1.356000  0.8166000     1.356000  0.8166000     1.356000  0.8166000     0.000000       0.000000  
1 1 1 18 0  24 o 1.136000  0.7542000     1.136000  0.7542000     1.136000  0.7542000     -0.000000      0.000000  
1 1 1 18 0  25 o 1.066000  0.7166000     1.066000  0.7166000     1.066000  0.7166000     -0.000000      0.000000  
1 1 1 18 1  1  o 5.657000  0.1447000     5.641000  0.2302000     5.673000  0.1754000     -0.3167000E-01 0.2894000 
1 1 1 18 1  2  o 15.24000  0.2148000     15.19000  0.3740000     15.30000  0.2114000     -0.1146000     0.4296000 
1 1 1 18 1  3  o 5.491000  0.1006000     5.653000  0.1094000     5.329000  0.1687000     0.3246000      0.2011000 
1 1 1 18 1  4  o 4.380000  0.1576000     4.338000  0.1483000     4.421000  0.2781000     -0.8343000E-01 0.3151000 
1 1 1 18 1  5  o 6.341000  0.1355000     6.403000  0.1952000     6.279000  0.1881000     0.1245000      0.2711000 
1 1 1 18 1  6  o 4.941000  0.2137000     4.580000  0.3223000     5.302000  0.2807000     -0.7217000     0.4274000 
1 1 1 18 1  7  o 5.450000  0.1876000     5.316000  0.2746000     5.584000  0.2557000     -0.2679000     0.3752000 
1 1 1 18 1  8  o 12.51000  0.1580000     12.69000  0.2234000     12.33000  0.2234000     0.3632000      0.3159000 
1 1 1 18 1  9  o 11.56000  0.1662000     11.60000  0.2326000     11.52000  0.2374000     0.8323000E-01  0.3323000 
1 1 1 18 1  10 o 6.274000  0.2246000     6.284000  0.3120000     6.263000  0.3232000     0.2125000E-01  0.4492000 
1 1 1 18 1  11 o 2.062000  0.5144000     2.053000  0.7201000     2.071000  0.7348000     -0.1731000E-01 1.029000  
1 1 1 18 1  12 o 4.185000  0.3756000     4.443000  0.4856000     3.928000  0.5732000     0.5144000      0.7513000 
1 1 1 18 1  13 o 6.979000  0.2669000     6.970000  0.3712000     6.988000  0.3837000     -0.1835000E-01 0.5339000 
1 1 1 18 1  14 o 9.124000  0.2451000     9.034000  0.3441000     9.214000  0.3491000     -0.1802000     0.4902000 
1 1 1 18 1  15 o 5.667000  0.3759000     6.365000  0.4678000     4.968000  0.5886000     1.397000       0.7518000 
1 1 1 18 1  16 o 4.206000  0.5263000     3.699000  0.8089000     4.712000  0.6737000     -1.013000      1.053000  
1 1 1 18 1  17 o 3.300000  0.6081000     3.817000  0.7916000     2.783000  0.9232000     1.035000       1.216000  
1 1 1 18 1  18 o 4.147000  0.5248000     3.652000  0.8055000     4.642000  0.6728000     -0.9904000     1.050000  
1 1 1 18 1  19 o 3.764000  0.5192000     3.354000  0.8022000     4.174000  0.6593000     -0.8197000     1.038000  
1 1 1 18 1  20 o 1.601000  0.4998000     1.487000  0.6733000     1.716000  0.7387000     -0.2290000     0.9995000 
1 1 1 18 1  21 o 1.881000  0.5432000     1.800000  0.7533000     1.962000  0.7827000     -0.1626000     1.086000  
1 1 1 18 1  22 o 1.532000  0.4724000     1.335000  0.6194000     1.729000  0.7133000     -0.3942000     0.9447000 
1 1 1 18 1  23 o 2.329000  0.5392000     2.357000  0.7592000     2.301000  0.7659000     0.5660000E-01  1.078000  
1 1 1 18 1  24 o 1.673000  0.5084000     1.828000  0.7464000     1.519000  0.6904000     0.3098000      1.017000  
1 1 1 18 1  25 o 1.495000  0.4697000     1.659000  0.7016000     1.331000  0.6246000     0.3283000      0.9394000 
1 1 1 18 2  0  o 3.399000  0.2114000     3.399000  0.2114000     3.399000  0.2114000     0.000000       0.000000  
1 1 1 18 2  1  o 10.73000  0.1566000     10.69000  0.2701000     10.76000  0.1585000     -0.7291000E-01 0.3132000 
1 1 1 18 2  2  o 9.347000  0.1572000     9.385000  0.2874000     9.309000  0.1274000     0.7581000E-01  0.3144000 
1 1 1 18 2  3  o 3.123000  0.1173000     3.281000  0.1480000     2.965000  0.1820000     0.3158000      0.2346000 
1 1 1 18 2  4  o 7.663000  0.1282000     7.450000  0.1360000     7.875000  0.2173000     -0.4247000     0.2563000 
1 1 1 18 2  5  o 3.033000  0.2448000     2.823000  0.3423000     3.243000  0.3501000     -0.4199000     0.4896000 
1 1 1 18 2  6  o 1.247000  0.3758000     1.003000  0.4755000     1.491000  0.5821000     -0.4877000     0.7516000 
1 1 1 18 2  7  o 6.650000  0.1667000     6.695000  0.2373000     6.605000  0.2344000     0.9083000E-01  0.3335000 
1 1 1 18 2  8  o 6.382000  0.1886000     6.470000  0.2652000     6.295000  0.2683000     0.1756000      0.3772000 
1 1 1 18 2  9  o 11.65000  0.1649000     11.45000  0.2346000     11.86000  0.2319000     -0.4121000     0.3299000 
1 1 1 18 2  10 o 8.784000  0.1890000     8.602000  0.2686000     8.965000  0.2660000     -0.3634000     0.3780000 
1 1 1 18 2  11 o 3.852000  0.3774000     3.603000  0.5594000     4.102000  0.5069000     -0.4992000     0.7549000 
1 1 1 18 2  12 o 8.460000  0.2209000     8.200000  0.3185000     8.721000  0.3062000     -0.5210000     0.4419000 
1 1 1 18 2  13 o 1.527000  0.4779000     1.153000  0.5666000     1.901000  0.7698000     -0.7482000     0.9558000 
1 1 1 18 2  14 o 8.072000  0.2625000     7.993000  0.3700000     8.151000  0.3723000     -0.1582000     0.5249000 
1 1 1 18 2  15 o 6.937000  0.3134000     6.893000  0.4440000     6.981000  0.4423000     -0.8802000E-01 0.6267000 
1 1 1 18 2  16 o 2.688000  0.6380000     2.988000  0.8916000     2.388000  0.9127000     0.6000000      1.276000  
1 1 1 18 2  17 o 1.786000  0.5659000     1.771000  0.7940000     1.800000  0.8065000     -0.2970000E-01 1.132000  
1 1 1 18 2  18 o 3.285000  0.6122000     3.522000  0.8345000     3.048000  0.8959000     0.4740000      1.224000  
1 1 1 18 2  19 o 2.078000  0.5655000     2.516000  0.8543000     1.639000  0.7412000     0.8774000      1.131000  
1 1 1 18 2  20 o 1.861000  0.4977000     2.493000  0.7979000     1.229000  0.5951000     1.264000       0.9954000 
1 1 1 18 2  21 f 1.732000  0.5076000     2.198000  0.8111000     1.266000  0.6104000     0.9316000      1.015000  
1 1 1 18 2  22 o 2.187000  0.5145000     1.674000  0.7047000     2.701000  0.7499000     -1.028000      1.029000  
1 1 1 18 2  23 o 1.907000  0.5231000     1.996000  0.7485000     1.817000  0.7308000     0.1794000      1.046000  
1 1 1 18 2  24 o 1.669000  0.4997000     2.049000  0.7848000     1.288000  0.6188000     0.7612000      0.9994000 
1 1 1 18 2  25 o 1.224000  0.4161000     1.329000  0.6250000     1.118000  0.5495000     0.2113000      0.8322000 
1 1 1 18 3  0  o 7.692000  0.1582000     7.692000  0.1582000     7.692000  0.1582000     0.000000       0.000000  
1 1 1 18 3  1  o 3.946000  0.1353000     4.249000  0.2509000     3.644000  0.1012000     0.6051000      0.2706000 
1 1 1 18 3  2  o 7.457000  0.8711000E-01 7.430000  0.1264000     7.484000  0.1199000     -0.5362000E-01 0.1742000 
1 1 1 18 3  3  o 13.63000  0.1209000     13.51000  0.1672000     13.75000  0.1747000     -0.2385000     0.2418000 
1 1 1 18 3  4  o 4.803000  0.1229000     4.610000  0.1653000     4.996000  0.1819000     -0.3861000     0.2458000 
1 1 1 18 3  5  o 5.593000  0.1355000     5.314000  0.1536000     5.872000  0.2233000     -0.5584000     0.2710000 
1 1 1 18 3  6  o 1.613000  0.4423000     1.351000  0.5648000     1.874000  0.6807000     -0.5233000     0.8845000 
1 1 1 18 3  7  o 3.814000  0.2462000     3.924000  0.3365000     3.705000  0.3595000     0.2185000      0.4924000 
1 1 1 18 3  8  o 12.32000  0.1569000     12.33000  0.2246000     12.30000  0.2191000     0.3412000E-01  0.3138000 
1 1 1 18 3  9  o 7.841000  0.1856000     7.562000  0.2676000     8.120000  0.2572000     -0.5583000     0.3712000 
1 1 1 18 3  10 o 8.281000  0.1951000     8.178000  0.2758000     8.384000  0.2761000     -0.2063000     0.3902000 
1 1 1 18 3  11 o 7.708000  0.2346000     7.544000  0.3114000     7.872000  0.3509000     -0.3280000     0.4692000 
1 1 1 18 3  12 o 12.44000  0.1948000     12.42000  0.2766000     12.46000  0.2744000     -0.4634000E-01 0.3896000 
1 1 1 18 3  13 o 4.534000  0.3809000     4.132000  0.5781000     4.936000  0.4962000     -0.8036000     0.7619000 
1 1 1 18 3  14 o 12.63000  0.2168000     12.77000  0.3044000     12.49000  0.3087000     0.2852000      0.4335000 
1 1 1 18 3  15 o 7.565000  0.3007000     7.564000  0.4179000     7.567000  0.4325000     -0.3227000E-02 0.6014000 
1 1 1 18 3  16 o 5.266000  0.4370000     4.634000  0.6722000     5.898000  0.5588000     -1.264000      0.8741000 
1 1 1 18 3  17 o 3.687000  0.6029000     3.360000  0.8947000     4.015000  0.8084000     -0.6551000     1.206000  
1 1 1 18 3  18 o 2.423000  0.6263000     2.215000  0.8689000     2.631000  0.9023000     -0.4159000     1.253000  
1 1 1 18 3  19 o 2.545000  0.6105000     2.664000  0.8643000     2.425000  0.8626000     0.2394000      1.221000  
1 1 1 18 3  20 o 4.443000  0.3999000     4.643000  0.5486000     4.243000  0.5821000     0.3999000      0.7999000 
1 1 1 18 3  21 o 1.292000  0.4360000     1.190000  0.5832000     1.394000  0.6482000     -0.2047000     0.8719000 
1 1 1 18 3  22 o 1.461000  0.4575000     1.168000  0.5637000     1.755000  0.7209000     -0.5868000     0.9151000 
1 1 1 18 3  23 o 2.025000  0.5308000     1.876000  0.7427000     2.174000  0.7585000     -0.2980000     1.062000  
1 1 1 18 3  24 o 1.160000  0.4010000     1.112000  0.5481000     1.209000  0.5856000     -0.9708000E-01 0.8021000 
1 1 1 18 3  25 o 1.341000  0.4474000     1.171000  0.5735000     1.511000  0.6868000     -0.3400000     0.8947000 
1 1 1 18 4  0  o 4.607000  0.9411000E-01 4.607000  0.9411000E-01 4.607000  0.9411000E-01 0.000000       0.000000  
1 1 1 18 4  1  o 15.33000  0.1356000     15.37000  0.2041000     15.28000  0.1786000     0.9411000E-01  0.2712000 
1 1 1 18 4  2  o 3.168000  0.1014000     3.070000  0.1416000     3.267000  0.1452000     -0.1977000     0.2028000 
1 1 1 18 4  3  o 4.685000  0.1020000     4.713000  0.1389000     4.657000  0.1493000     0.5562000E-01  0.2039000 
1 1 1 18 4  4  o 4.961000  0.1479000     4.984000  0.1626000     4.939000  0.2471000     0.4552000E-01  0.2958000 
1 1 1 18 4  5  o 1.538000  0.3023000     1.571000  0.4057000     1.504000  0.4482000     0.6786000E-01  0.6046000 
1 1 1 18 4  6  o 13.19000  0.1881000     13.20000  0.2207000     13.18000  0.3046000     0.1254000E-01  0.3761000 
1 1 1 18 4  7  o 13.00000  0.1542000     13.09000  0.1813000     12.92000  0.2495000     0.1644000      0.3084000 
1 1 1 18 4  8  o 4.590000  0.2352000     4.332000  0.3491000     4.849000  0.3153000     -0.5169000     0.4704000 
1 1 1 18 4  9  f 15.81000  0.1971000     15.62000  0.2786000     16.00000  0.2788000     -0.3738000     0.3941000 
1 1 1 18 4  10 o 19.57000  0.1954000     19.57000  0.2767000     19.58000  0.2760000     -0.5007000E-02 0.3908000 
1 1 1 18 4  11 o 3.721000  0.4560000     4.042000  0.5942000     3.400000  0.6917000     0.6411000      0.9119000 
1 1 1 18 4  12 o 10.62000  0.2033000     10.71000  0.2876000     10.53000  0.2874000     0.1752000      0.4066000 
1 1 1 18 4  13 o 8.454000  0.2361000     8.629000  0.3327000     8.279000  0.3352000     0.3496000      0.4723000 
1 1 1 18 4  14 o 2.690000  0.5818000     3.072000  0.8166000     2.308000  0.8289000     0.7639000      1.164000  
1 1 1 18 4  15 o 8.017000  0.2816000     7.944000  0.4066000     8.090000  0.3896000     -0.1455000     0.5631000 
1 1 1 18 4  16 o 5.333000  0.4360000     5.506000  0.5846000     5.161000  0.6471000     0.3456000      0.8720000 
1 1 1 18 4  17 o 5.927000  0.3857000     5.506000  0.5798000     6.347000  0.5090000     -0.8408000     0.7715000 
1 1 1 18 4  18 o 2.652000  0.6187000     3.043000  0.8751000     2.261000  0.8749000     0.7823000      1.237000  
1 1 1 18 4  19 o 2.566000  0.6078000     1.908000  0.8282000     3.223000  0.8899000     -1.314000      1.216000  
1 1 1 18 4  20 o 3.293000  0.5067000     3.137000  0.7390000     3.449000  0.6934000     -0.3118000     1.013000  
1 1 1 18 4  21 o 1.917000  0.5538000     2.116000  0.8222000     1.717000  0.7420000     0.3990000      1.108000  
1 1 1 18 4  22 o 2.354000  0.5251000     2.752000  0.7421000     1.955000  0.7432000     0.7973000      1.050000  
1 1 1 18 4  23 o 1.092000  0.3789000     0.9249000 0.4661000     1.259000  0.5976000     -0.3340000     0.7579000 
1 1 1 18 4  24 f 1.503000  0.4724000     1.918000  0.7752000     1.088000  0.5400000     0.8307000      0.9448000 
1 1 1 18 4  25 f 1.820000  0.5650000     2.069000  0.8394000     1.572000  0.7565000     0.4969000      1.130000  
1 1 1 18 5  0  o 20.66000  0.2657000     20.66000  0.2657000     20.66000  0.2657000     -0.000000      0.000000  
1 1 1 18 5  1  o 5.634000  0.7975000E-01 5.510000  0.1264000     5.758000  0.9727000E-01 -0.2483000     0.1595000 
1 1 1 18 5  2  o 2.122000  0.1426000     2.212000  0.2270000     2.032000  0.1726000     0.1798000      0.2852000 
1 1 1 18 5  3  o 7.484000  0.9688000E-01 7.516000  0.1341000     7.452000  0.1399000     0.6429000E-01  0.1938000 
1 1 1 18 5  4  o 11.72000  0.1538000     11.72000  0.1872000     11.72000  0.2440000     -0.6224000E-02 0.3075000 
1 1 1 18 5  5  o 5.459000  0.1258000     5.452000  0.1716000     5.466000  0.1840000     -0.1476000E-01 0.2516000 
1 1 1 18 5  6  o 14.73000  0.2437000     14.49000  0.4396000     14.96000  0.2103000     -0.4627000     0.4873000 
1 1 1 18 5  7  o 9.219000  0.1498000     8.989000  0.1679000     9.449000  0.2482000     -0.4609000     0.2996000 
1 1 1 18 5  8  o 14.77000  0.1674000     14.62000  0.1965000     14.93000  0.2712000     -0.3066000     0.3349000 
1 1 1 18 5  9  o 8.054000  0.2033000     8.037000  0.2890000     8.071000  0.2860000     -0.3457000E-01 0.4066000 
1 1 1 18 5  10 o 10.20000  0.1793000     10.12000  0.2557000     10.28000  0.2514000     -0.1640000     0.3586000 
1 1 1 18 5  11 o 6.886000  0.2724000     6.985000  0.3765000     6.788000  0.3938000     0.1972000      0.5448000 
1 1 1 18 5  12 o 5.440000  0.2964000     5.677000  0.4043000     5.203000  0.4335000     0.4732000      0.5928000 
1 1 1 18 5  13 o 9.552000  0.2274000     10.40000  0.3107000     8.705000  0.3321000     1.693000       0.4548000 
1 1 1 18 5  14 o 7.236000  0.2891000     6.844000  0.4291000     7.628000  0.3874000     -0.7835000     0.5781000 
1 1 1 18 5  15 o 4.233000  0.5063000     5.191000  0.5685000     3.274000  0.8378000     1.916000       1.013000  
1 1 1 18 5  16 o 6.747000  0.3808000     6.415000  0.5222000     7.078000  0.5543000     -0.6624000     0.7615000 
1 1 1 18 5  17 o 2.986000  0.6540000     3.148000  0.9070000     2.824000  0.9424000     0.3237000      1.308000  
1 1 1 18 5  18 o 2.820000  0.5882000     3.540000  0.8116000     2.099000  0.8516000     1.441000       1.176000  
1 1 1 18 5  19 o 4.458000  0.4770000     4.447000  0.6809000     4.469000  0.6681000     -0.2249000E-01 0.9539000 
1 1 1 18 5  20 o 2.020000  0.5392000     1.693000  0.7245000     2.348000  0.7987000     -0.6552000     1.078000  
1 1 1 18 5  21 o 1.420000  0.4728000     1.420000  0.6643000     1.420000  0.6730000     0.5126000E-04  0.9456000 
1 1 1 18 5  22 f 2.847000  0.5047000     2.569000  0.7567000     3.126000  0.6682000     -0.5572000     1.009000  
1 1 1 18 5  23 o 1.326000  0.4322000     1.157000  0.5595000     1.495000  0.6588000     -0.3387000     0.8644000 
1 1 1 18 5  24 o 1.658000  0.5192000     2.103000  0.8487000     1.213000  0.5983000     0.8903000      1.038000  
1 1 1 18 5  25 o 1.224000  0.4274000     1.293000  0.6326000     1.155000  0.5750000     0.1376000      0.8549000 
1 1 1 18 6  0  o 2.318000  0.1686000     2.318000  0.1686000     2.318000  0.1686000     -0.000000      0.000000  
1 1 1 18 6  1  o 5.747000  0.7761000E-01 5.726000  0.1104000     5.767000  0.1091000     -0.4122000E-01 0.1552000 
1 1 1 18 6  2  o 0.6412000 0.2083000     0.6762000 0.3116000     0.6061000 0.2764000     0.7004000E-01  0.4165000 
1 1 1 18 6  3  f 8.506000  0.1095000     8.578000  0.1605000     8.434000  0.1489000     0.1437000      0.2190000 
1 1 1 18 6  4  o 11.10000  0.1448000     11.01000  0.1622000     11.20000  0.2399000     -0.1977000     0.2896000 
1 1 1 18 6  5  o 4.650000  0.1363000     4.624000  0.1832000     4.677000  0.2020000     -0.5286000E-01 0.2727000 
1 1 1 18 6  6  f 9.719000  0.1691000     9.512000  0.2832000     9.927000  0.1849000     -0.4150000     0.3382000 
1 1 1 18 6  7  o 18.11000  0.1683000     17.98000  0.2352000     18.23000  0.2409000     -0.2534000     0.3366000 
1 1 1 18 6  8  o 6.543000  0.1819000     6.265000  0.2017000     6.821000  0.3029000     -0.5562000     0.3639000 
1 1 1 18 6  9  o 6.501000  0.2241000     6.061000  0.2358000     6.941000  0.3811000     -0.8804000     0.4481000 
1 1 1 18 6  10 o 13.25000  0.1760000     13.58000  0.2512000     12.93000  0.2465000     0.6525000      0.3520000 
1 1 1 18 6  11 o 5.192000  0.3397000     5.116000  0.4796000     5.267000  0.4814000     -0.1511000     0.6795000 
1 1 1 18 6  12 o 10.73000  0.2010000     10.82000  0.2860000     10.64000  0.2825000     0.1803000      0.4020000 
1 1 1 18 6  13 o 8.790000  0.2307000     8.601000  0.3291000     8.980000  0.3234000     -0.3790000     0.4614000 
1 1 1 18 6  14 o 1.719000  0.5465000     1.807000  0.7983000     1.631000  0.7467000     0.1752000      1.093000  
1 1 1 18 6  15 o 4.788000  0.4333000     4.899000  0.5955000     4.676000  0.6295000     0.2231000      0.8666000 
1 1 1 18 6  16 o 6.512000  0.4129000     6.576000  0.5816000     6.448000  0.5862000     0.1277000      0.8258000 
1 1 1 18 6  17 o 3.121000  0.6226000     3.752000  0.8374000     2.490000  0.9216000     1.262000       1.245000  
1 1 1 18 6  18 o 2.509000  0.5886000     1.801000  0.7932000     3.217000  0.8698000     -1.415000      1.177000  
1 1 1 18 6  19 o 1.874000  0.5589000     2.230000  0.8665000     1.518000  0.7062000     0.7118000      1.118000  
1 1 1 18 6  20 o 1.930000  0.4953000     2.581000  0.7817000     1.278000  0.6084000     1.303000       0.9905000 
1 1 1 18 6  21 o 2.457000  0.5727000     2.485000  0.8220000     2.428000  0.7975000     0.5733000E-01  1.145000  
1 1 1 18 6  22 o 1.592000  0.4835000     1.591000  0.6814000     1.592000  0.6861000     -0.8024000E-03 0.9670000 
1 1 1 18 6  23 o 1.454000  0.4575000     1.669000  0.7015000     1.239000  0.5874000     0.4302000      0.9149000 
1 1 1 18 6  24 o 1.326000  0.4531000     1.202000  0.5949000     1.449000  0.6836000     -0.2473000     0.9062000 
1 1 1 18 6  25 o 1.004000  0.5167000     1.004000  0.5167000     ?         ?             ?              ?         
1 1 1 18 7  0  o 10.95000  0.1404000     10.95000  0.1404000     10.95000  0.1404000     0.000000       0.000000  
1 1 1 18 7  1  o 12.75000  0.1112000     12.76000  0.1566000     12.74000  0.1578000     0.2314000E-01  0.2223000 
1 1 1 18 7  2  o 4.084000  0.9607000E-01 4.145000  0.1362000     4.023000  0.1355000     0.1224000      0.1921000 
1 1 1 18 7  3  o 10.49000  0.1142000     10.64000  0.1755000     10.35000  0.1460000     0.2980000      0.2283000 
1 1 1 18 7  4  o 10.03000  0.1144000     10.19000  0.1591000     9.863000  0.1644000     0.3278000      0.2288000 
1 1 1 18 7  5  o 7.818000  0.1327000     7.832000  0.1631000     7.804000  0.2093000     0.2786000E-01  0.2654000 
1 1 1 18 7  6  o 13.71000  0.1413000     13.84000  0.1989000     13.59000  0.2009000     0.2461000      0.2827000 
1 1 1 18 7  7  o 2.350000  0.3127000     2.475000  0.4073000     2.224000  0.4745000     0.2510000      0.6253000 
1 1 1 18 7  8  o 3.184000  0.2522000     3.164000  0.3269000     3.204000  0.3840000     -0.4043000E-01 0.5043000 
1 1 1 18 7  9  o 9.469000  0.2584000     9.532000  0.2314000     9.405000  0.4622000     0.1267000      0.5169000 
1 1 1 18 7  10 o 12.83000  0.1912000     12.62000  0.2484000     13.05000  0.2906000     -0.4293000     0.3823000 
1 1 1 18 7  11 o 11.52000  0.2525000     11.19000  0.3945000     11.84000  0.3155000     -0.6453000     0.5051000 
1 1 1 18 7  12 o 6.871000  0.2512000     7.112000  0.3463000     6.630000  0.3639000     0.4822000      0.5023000 
1 1 1 18 7  13 o 10.41000  0.2168000     10.31000  0.3087000     10.52000  0.3044000     -0.2144000     0.4335000 
1 1 1 18 7  14 o 7.199000  0.3189000     6.982000  0.4676000     7.416000  0.4338000     -0.4340000     0.6379000 
1 1 1 18 7  15 o 1.898000  0.5723000     1.850000  0.8006000     1.946000  0.8180000     -0.9614000E-01 1.145000  
1 1 1 18 7  16 o 7.406000  0.3727000     7.373000  0.5317000     7.439000  0.5224000     -0.6554000E-01 0.7454000 
1 1 1 18 7  17 o 5.558000  0.4006000     5.197000  0.6011000     5.920000  0.5296000     -0.7236000     0.8011000 
1 1 1 18 7  18 o 2.704000  0.6127000     3.222000  0.8670000     2.186000  0.8660000     1.036000       1.225000  
1 1 1 18 7  19 o 2.492000  0.6084000     2.595000  0.8695000     2.389000  0.8511000     0.2059000      1.217000  
1 1 1 18 7  20 o 1.604000  0.4973000     1.632000  0.7079000     1.577000  0.6985000     0.5485000E-01  0.9945000 
1 1 1 18 7  21 o 2.285000  0.5467000     2.899000  0.8106000     1.670000  0.7338000     1.230000       1.093000  
1 1 1 18 7  22 o 1.538000  0.4680000     1.245000  0.5875000     1.831000  0.7285000     -0.5865000     0.9359000 
1 1 1 18 7  23 o 1.559000  0.4760000     1.338000  0.6206000     1.781000  0.7220000     -0.4425000     0.9520000 
1 1 1 18 7  24 o 1.189000  0.4105000     0.9853000 0.4974000     1.393000  0.6533000     -0.4075000     0.8211000 
1 1 1 18 8  0  o 11.14000  0.1451000     11.14000  0.1451000     11.14000  0.1451000     0.000000       0.000000  
1 1 1 18 8  1  o 8.152000  0.8936000E-01 8.100000  0.1254000     8.204000  0.1273000     -0.1039000     0.1787000 
1 1 1 18 8  2  o 15.73000  0.1344000     15.72000  0.1896000     15.75000  0.1906000     -0.2827000E-01 0.2689000 
1 1 1 18 8  3  o 10.77000  0.1573000     10.79000  0.2154000     10.75000  0.2294000     0.3892000E-01  0.3147000 
1 1 1 18 8  4  o 2.410000  0.2044000     2.293000  0.3399000     2.526000  0.2272000     -0.2327000     0.4088000 
1 1 1 18 8  5  o 2.292000  0.3126000     2.317000  0.3979000     2.267000  0.4823000     0.5032000E-01  0.6253000 
1 1 1 18 8  6  o 0.9590000 0.3019000     1.074000  0.4504000     0.8437000 0.4021000     0.2305000      0.6038000 
1 1 1 18 8  7  o 7.733000  0.1436000     7.743000  0.1952000     7.723000  0.2106000     0.2004000E-01  0.2872000 
1 1 1 18 8  8  o 8.187000  0.1481000     8.488000  0.2057000     7.886000  0.2130000     0.6014000      0.2961000 
1 1 1 18 8  9  f 6.004000  0.3128000     6.029000  0.4330000     5.980000  0.4516000     0.4953000E-01  0.6257000 
1 1 1 18 8  10 o 26.64000  0.2432000     26.91000  0.2952000     26.37000  0.3865000     0.5422000      0.4863000 
1 1 1 18 8  11 o 15.00000  0.2458000     14.94000  0.3800000     15.07000  0.3117000     -0.1311000     0.4915000 
1 1 1 18 8  12 o 18.70000  0.2035000     18.74000  0.2882000     18.66000  0.2874000     0.8120000E-01  0.4070000 
1 1 1 18 8  13 o 9.040000  0.2314000     9.077000  0.3304000     9.003000  0.3240000     0.7429000E-01  0.4628000 
1 1 1 18 8  14 f 6.588000  0.3508000     6.433000  0.5148000     6.743000  0.4768000     -0.3105000     0.7017000 
1 1 1 18 8  15 o 8.669000  0.2748000     8.586000  0.3932000     8.751000  0.3838000     -0.1652000     0.5495000 
1 1 1 18 8  16 o 4.964000  0.5428000     5.266000  0.7061000     4.661000  0.8246000     0.6051000      1.086000  
1 1 1 18 8  17 o 2.988000  0.6413000     2.911000  0.9030000     3.065000  0.9110000     -0.1543000     1.283000  
1 1 1 18 8  18 o 4.900000  0.4282000     4.792000  0.6130000     5.008000  0.5980000     -0.2157000     0.8564000 
1 1 1 18 8  19 o 2.300000  0.6016000     2.129000  0.8415000     2.471000  0.8599000     -0.3414000     1.203000  
1 1 1 18 8  20 o 2.802000  0.5077000     2.025000  0.7723000     3.580000  0.6594000     -1.555000      1.015000  
1 1 1 18 8  21 o 1.712000  0.5326000     1.688000  0.7627000     1.736000  0.7436000     -0.4837000E-01 1.065000  
1 1 1 18 8  22 o 1.468000  0.4555000     1.124000  0.5431000     1.812000  0.7313000     -0.6887000     0.9109000 
1 1 1 18 8  23 o 1.256000  0.4152000     1.050000  0.5168000     1.462000  0.6501000     -0.4121000     0.8305000 
1 1 1 18 8  24 o 1.970000  0.5543000     2.000000  0.7938000     1.940000  0.7738000     0.5992000E-01  1.109000  
1 1 1 18 9  0  o 1.786000  0.2952000     1.786000  0.2952000     1.786000  0.2952000     0.000000       0.000000  
1 1 1 18 9  1  o 8.182000  0.9348000E-01 8.316000  0.1317000     8.048000  0.1327000     0.2676000      0.1870000 
1 1 1 18 9  2  o 8.547000  0.9717000E-01 8.531000  0.1370000     8.563000  0.1378000     -0.3142000E-01 0.1943000 
1 1 1 18 9  3  o 11.45000  0.1397000     11.35000  0.1789000     11.56000  0.2146000     -0.2102000     0.2794000 
1 1 1 18 9  4  o 9.181000  0.1157000     9.371000  0.1836000     8.991000  0.1408000     0.3808000      0.2314000 
1 1 1 18 9  5  o 8.845000  0.2327000     8.964000  0.4099000     8.726000  0.2205000     0.2377000      0.4655000 
1 1 1 18 9  6  o 4.133000  0.1764000     4.231000  0.2271000     4.035000  0.2699000     0.1957000      0.3527000 
1 1 1 18 9  7  o 9.258000  0.1399000     9.459000  0.1935000     9.057000  0.2020000     0.4016000      0.2797000 
1 1 1 18 9  8  o 8.073000  0.1515000     8.071000  0.2070000     8.074000  0.2212000     -0.3147000E-02 0.3030000 
1 1 1 18 9  9  o 14.63000  0.2066000     14.64000  0.2308000     14.62000  0.3427000     0.2554000E-01  0.4132000 
1 1 1 18 9  10 o 9.640000  0.1621000     9.625000  0.2259000     9.654000  0.2324000     -0.2917000E-01 0.3241000 
1 1 1 18 9  11 o 10.40000  0.2286000     10.30000  0.3225000     10.50000  0.3240000     -0.1960000     0.4571000 
1 1 1 18 9  12 o 9.649000  0.2105000     9.719000  0.2303000     9.579000  0.3525000     0.1400000      0.4211000 
1 1 1 18 9  13 o 5.717000  0.3414000     5.774000  0.4533000     5.659000  0.5106000     0.1150000      0.6828000 
1 1 1 18 9  14 o 16.49000  0.2939000     16.62000  0.4250000     16.35000  0.4060000     0.2668000      0.5877000 
1 1 1 18 9  15 o 2.725000  0.6111000     3.204000  0.8677000     2.245000  0.8607000     0.9583000      1.222000  
1 1 1 18 9  16 o 3.101000  0.7818000     3.179000  1.111000      3.023000  1.100000      0.1562000      1.564000  
1 1 1 18 9  17 o 6.136000  0.3726000     5.955000  0.5375000     6.317000  0.5163000     -0.3620000     0.7453000 
1 1 1 18 9  18 o 2.048000  0.5823000     2.356000  0.8735000     1.740000  0.7701000     0.6153000      1.165000  
1 1 1 18 9  19 o 5.038000  0.5250000     5.407000  0.8027000     4.669000  0.6768000     0.7376000      1.050000  
1 1 1 18 9  20 f 3.365000  0.4723000     3.268000  0.6993000     3.462000  0.6351000     -0.1937000     0.9447000 
1 1 1 18 9  21 o 1.717000  0.5487000     1.501000  0.7055000     1.933000  0.8406000     -0.4318000     1.097000  
1 1 1 18 9  22 o 1.434000  0.4549000     1.526000  0.6671000     1.341000  0.6188000     0.1856000      0.9099000 
1 1 1 18 9  23 o 1.350000  0.4393000     1.212000  0.5793000     1.487000  0.6606000     -0.2751000     0.8786000 
1 1 1 18 9  24 o 1.665000  0.5334000     1.684000  0.7441000     1.645000  0.7645000     0.3865000E-01  1.067000  
1 1 1 18 10 0  o 1.410000  0.4099000     1.410000  0.4099000     1.410000  0.4099000     0.000000       0.000000  
1 1 1 18 10 1  o 11.39000  0.1090000     11.41000  0.1537000     11.37000  0.1546000     0.4767000E-01  0.2180000 
1 1 1 18 10 2  o 7.710000  0.1216000     7.710000  0.1986000     7.709000  0.1402000     0.1086000E-02  0.2431000 
1 1 1 18 10 3  o 8.381000  0.1028000     8.420000  0.1451000     8.342000  0.1458000     0.7847000E-01  0.2057000 
1 1 1 18 10 4  f 4.996000  0.1540000     4.789000  0.1626000     5.203000  0.2616000     -0.4132000     0.3080000 
1 1 1 18 10 5  o 21.41000  0.1902000     21.57000  0.3037000     21.25000  0.2290000     0.3210000      0.3803000 
1 1 1 18 10 6  o 11.93000  0.1553000     12.03000  0.2407000     11.82000  0.1964000     0.2171000      0.3107000 
1 1 1 18 10 7  o 7.574000  0.1807000     7.002000  0.2800000     8.146000  0.2284000     -1.144000      0.3614000 
1 1 1 18 10 8  o 2.476000  0.3334000     2.456000  0.4404000     2.496000  0.5008000     -0.3972000E-01 0.6669000 
1 1 1 18 10 9  o 13.17000  0.1693000     13.07000  0.2226000     13.27000  0.2553000     -0.1947000     0.3387000 
1 1 1 18 10 10 o 10.82000  0.1646000     10.74000  0.2329000     10.90000  0.2326000     -0.1563000     0.3291000 
1 1 1 18 10 11 o 8.538000  0.2155000     8.383000  0.3497000     8.693000  0.2519000     -0.3093000     0.4310000 
1 1 1 18 10 12 o 10.00000  0.1718000     9.792000  0.2296000     10.21000  0.2556000     -0.4168000     0.3436000 
1 1 1 18 10 13 o 4.000000  0.4418000     4.492000  0.3882000     3.509000  0.7938000     0.9830000      0.8836000 
1 1 1 18 10 14 o 2.064000  0.6246000     1.418000  0.6280000     2.710000  1.080000      -1.291000      1.249000  
1 1 1 18 10 15 o 5.615000  0.3790000     5.309000  0.5629000     5.921000  0.5077000     -0.6122000     0.7581000 
1 1 1 18 10 16 o 2.170000  0.6511000     1.923000  0.8950000     2.418000  0.9459000     -0.4955000     1.302000  
1 1 1 18 10 17 o 3.704000  0.5904000     3.792000  0.8335000     3.616000  0.8365000     0.1761000      1.181000  
1 1 1 18 10 18 o 7.015000  0.3129000     7.288000  0.4403000     6.742000  0.4447000     0.5462000      0.6258000 
1 1 1 18 10 19 o 2.655000  0.6685000     2.025000  0.9079000     3.285000  0.9815000     -1.260000      1.337000  
1 1 1 18 10 20 o 1.601000  0.4896000     1.819000  0.7405000     1.383000  0.6405000     0.4360000      0.9791000 
1 1 1 18 10 21 o 1.985000  0.5766000     2.183000  0.8584000     1.787000  0.7702000     0.3968000      1.153000  
1 1 1 18 10 22 o 1.882000  0.5053000     1.628000  0.6907000     2.136000  0.7376000     -0.5081000     1.011000  
1 1 1 18 10 23 o 1.341000  0.4342000     1.508000  0.6619000     1.173000  0.5621000     0.3349000      0.8684000 
1 1 1 18 10 24 o 1.753000  0.5492000     1.391000  0.6572000     2.115000  0.8802000     -0.7236000     1.098000  
1 1 1 18 11 0  o 7.930000  0.1392000     7.930000  0.1392000     7.930000  0.1392000     0.000000       0.000000  
1 1 1 18 11 1  o 9.233000  0.1109000     9.272000  0.1681000     9.194000  0.1446000     0.7864000E-01  0.2217000 
1 1 1 18 11 2  o 1.249000  0.2908000     1.494000  0.4038000     1.004000  0.4184000     0.4900000      0.5815000 
1 1 1 18 11 3  o 11.13000  0.1246000     11.04000  0.1619000     11.21000  0.1895000     -0.1667000     0.2492000 
1 1 1 18 11 4  o 6.904000  0.1475000     6.890000  0.2243000     6.918000  0.1918000     -0.2823000E-01 0.2951000 
1 1 1 18 11 5  o 16.20000  0.1415000     16.29000  0.2102000     16.11000  0.1893000     0.1755000      0.2829000 
1 1 1 18 11 6  o 21.61000  0.1937000     21.65000  0.3070000     21.58000  0.2363000     0.6421000E-01  0.3874000 
1 1 1 18 11 7  o 4.915000  0.1753000     4.965000  0.2343000     4.865000  0.2609000     0.9978000E-01  0.3507000 
1 1 1 18 11 8  o 16.54000  0.1782000     16.34000  0.2307000     16.75000  0.2716000     -0.4153000     0.3564000 
1 1 1 18 11 9  o 4.234000  0.2386000     4.269000  0.3235000     4.198000  0.3509000     0.7107000E-01  0.4772000 
1 1 1 18 11 10 o 18.63000  0.2033000     18.75000  0.2645000     18.52000  0.3088000     0.2219000      0.4066000 
1 1 1 18 11 11 o 11.62000  0.1719000     11.89000  0.2444000     11.36000  0.2419000     0.5315000      0.3439000 
1 1 1 18 11 12 o 10.84000  0.1796000     10.81000  0.2512000     10.86000  0.2567000     -0.5705000E-01 0.3591000 
1 1 1 18 11 13 o 9.663000  0.1930000     9.614000  0.2675000     9.713000  0.2782000     -0.9912000E-01 0.3860000 
1 1 1 18 11 14 o 11.87000  0.2678000     11.67000  0.2748000     12.07000  0.4598000     -0.4010000     0.5356000 
1 1 1 18 11 15 o 8.416000  0.2841000     8.560000  0.2948000     8.272000  0.4858000     0.2887000      0.5683000 
1 1 1 18 11 16 o 4.001000  0.6363000     3.726000  0.9755000     4.276000  0.8172000     -0.5507000     1.273000  
1 1 1 18 11 17 o 5.055000  0.4401000     5.123000  0.6227000     4.987000  0.6221000     0.1359000      0.8802000 
1 1 1 18 11 18 o 3.479000  0.5252000     4.713000  0.6038000     2.245000  0.8596000     2.468000       1.050000  
1 1 1 18 11 19 o 1.989000  0.6051000     2.072000  0.8771000     1.907000  0.8338000     0.1643000      1.210000  
1 1 1 18 11 20 o 1.519000  0.4774000     1.431000  0.6506000     1.607000  0.6989000     -0.1758000     0.9549000 
1 1 1 18 11 21 o 2.071000  0.5646000     2.208000  0.8098000     1.934000  0.7870000     0.2747000      1.129000  
1 1 1 18 11 22 o 1.910000  0.4725000     2.588000  0.7431000     1.233000  0.5838000     1.355000       0.9450000 
1 1 1 18 11 23 f 1.542000  0.4737000     1.549000  0.6683000     1.535000  0.6716000     0.1445000E-01  0.9474000 
1 1 1 18 11 24 o 1.170000  0.4063000     1.304000  0.6261000     1.037000  0.5179000     0.2662000      0.8125000 
1 1 1 18 12 0  o 8.838000  0.1724000     8.838000  0.1724000     8.838000  0.1724000     -0.000000      0.000000  
1 1 1 18 12 1  o 6.772000  0.1592000     6.780000  0.1619000     6.765000  0.2743000     0.1472000E-01  0.3185000 
1 1 1 18 12 2  o 3.690000  0.1462000     3.728000  0.1844000     3.652000  0.2268000     0.7585000E-01  0.2923000 
1 1 1 18 12 3  o 7.442000  0.1408000     7.457000  0.2141000     7.427000  0.1829000     0.3006000E-01  0.2816000 
1 1 1 18 12 4  o 5.999000  0.1154000     5.972000  0.1629000     6.026000  0.1635000     -0.5398000E-01 0.2308000 
1 1 1 18 12 5  o 12.23000  0.1271000     12.16000  0.1795000     12.30000  0.1800000     -0.1361000     0.2542000 
1 1 1 18 12 6  o 11.13000  0.1463000     11.23000  0.2167000     11.03000  0.1965000     0.1913000      0.2925000 
1 1 1 18 12 7  o 8.947000  0.1497000     9.004000  0.2184000     8.891000  0.2050000     0.1127000      0.2995000 
1 1 1 18 12 8  o 8.697000  0.1678000     8.832000  0.2283000     8.562000  0.2459000     0.2701000      0.3356000 
1 1 1 18 12 9  o 10.40000  0.1600000     10.49000  0.2215000     10.30000  0.2308000     0.1851000      0.3199000 
1 1 1 18 12 10 o 5.285000  0.2484000     5.243000  0.3251000     5.328000  0.3758000     -0.8516000E-01 0.4969000 
1 1 1 18 12 11 o 2.044000  0.4584000     2.281000  0.6357000     1.807000  0.6607000     0.4740000      0.9168000 
1 1 1 18 12 12 o 4.443000  0.2810000     4.600000  0.3801000     4.286000  0.4141000     0.3137000      0.5621000 
1 1 1 18 12 13 o 5.098000  0.2708000     5.277000  0.3663000     4.919000  0.3990000     0.3582000      0.5417000 
1 1 1 18 12 14 f 3.569000  0.4214000     3.227000  0.6166000     3.910000  0.5747000     -0.6834000     0.8429000 
1 1 1 18 12 15 o 5.914000  0.3385000     5.395000  0.3716000     6.432000  0.5659000     -1.037000      0.6770000 
1 1 1 18 12 16 o 4.894000  0.4904000     4.518000  0.6916000     5.269000  0.6956000     -0.7504000     0.9809000 
1 1 1 18 12 17 o 2.504000  0.6148000     2.263000  0.7609000     2.745000  0.9659000     -0.4818000     1.230000  
1 1 1 18 12 18 o 4.144000  0.4782000     4.079000  0.6988000     4.210000  0.6531000     -0.1311000     0.9565000 
1 1 1 18 12 19 o 2.121000  0.6054000     2.538000  0.9319000     1.704000  0.7732000     0.8343000      1.211000  
1 1 1 18 12 20 o 3.107000  0.4910000     2.543000  0.7738000     3.670000  0.6046000     -1.127000      0.9820000 
1 1 1 18 12 21 o 1.598000  0.5064000     1.574000  0.7031000     1.621000  0.7291000     -0.4666000E-01 1.013000  
1 1 1 18 12 22 o 1.588000  0.4768000     1.399000  0.6364000     1.777000  0.7101000     -0.3787000     0.9536000 
1 1 1 18 12 23 o 1.534000  0.4728000     1.618000  0.6904000     1.449000  0.6462000     0.1692000      0.9457000 
1 1 1 18 12 24 o 1.329000  0.4368000     1.311000  0.6101000     1.347000  0.6251000     -0.3574000E-01 0.8735000 
1 1 1 18 13 0  o 7.222000  0.2765000     7.222000  0.2765000     7.222000  0.2765000     0.000000       0.000000  
1 1 1 18 13 1  o 8.551000  0.1470000     8.672000  0.2066000     8.431000  0.2093000     0.2403000      0.2941000 
1 1 1 18 13 2  o 3.787000  0.1765000     3.733000  0.2681000     3.842000  0.2298000     -0.1088000     0.3531000 
1 1 1 18 13 3  o 10.32000  0.1252000     10.21000  0.1899000     10.43000  0.1632000     -0.2220000     0.2504000 
1 1 1 18 13 4  o 14.40000  0.1370000     14.30000  0.1927000     14.51000  0.1948000     -0.2067000     0.2741000 
1 1 1 18 13 5  o 23.89000  0.1993000     24.04000  0.2835000     23.73000  0.2803000     0.3105000      0.3987000 
1 1 1 18 13 6  o 12.22000  0.1335000     12.01000  0.1876000     12.43000  0.1901000     -0.4279000     0.2671000 
1 1 1 18 13 7  o 15.87000  0.1629000     16.05000  0.2594000     15.69000  0.1970000     0.3666000      0.3257000 
1 1 1 18 13 8  o 11.36000  0.2374000     11.67000  0.2392000     11.06000  0.4103000     0.6134000      0.4749000 
1 1 1 18 13 9  o 15.18000  0.1698000     15.27000  0.2396000     15.09000  0.2406000     0.1715000      0.3396000 
1 1 1 18 13 10 o 6.951000  0.3463000     7.145000  0.6326000     6.758000  0.2821000     0.3872000      0.6927000 
1 1 1 18 13 11 o 6.678000  0.2051000     6.353000  0.2911000     7.004000  0.2891000     -0.6513000     0.4103000 
1 1 1 18 13 12 o 1.615000  0.4517000     1.910000  0.6803000     1.319000  0.5945000     0.5918000      0.9035000 
1 1 1 18 13 13 o 4.416000  0.3328000     4.958000  0.4153000     3.874000  0.5202000     1.084000       0.6657000 
1 1 1 18 13 14 o 3.470000  0.4445000     4.258000  0.4893000     2.682000  0.7423000     1.576000       0.8891000 
1 1 1 18 13 15 o 5.064000  0.3247000     5.035000  0.4345000     5.092000  0.4826000     -0.5678000E-01 0.6494000 
1 1 1 18 13 16 o 4.664000  0.3531000     4.619000  0.4812000     4.710000  0.5170000     -0.9073000E-01 0.7062000 
1 1 1 18 13 17 o 1.913000  0.5679000     1.616000  0.6756000     2.211000  0.9129000     -0.5959000     1.136000  
1 1 1 18 13 18 o 2.160000  0.5574000     2.351000  0.7283000     1.968000  0.8439000     0.3832000      1.115000  
1 1 1 18 13 19 o 1.994000  0.5952000     1.472000  0.6606000     2.516000  0.9903000     -1.044000      1.190000  
1 1 1 18 13 20 o 2.150000  0.5207000     1.629000  0.7386000     2.672000  0.7341000     -1.044000      1.041000  
1 1 1 18 13 21 o 2.352000  0.5608000     2.580000  0.7492000     2.124000  0.8346000     0.4565000      1.122000  
1 1 1 18 13 22 o 1.382000  0.4453000     1.517000  0.6689000     1.248000  0.5881000     0.2688000      0.8907000 
1 1 1 18 13 23 o 2.292000  0.5113000     2.785000  0.7239000     1.799000  0.7224000     0.9859000      1.023000  
1 1 1 18 13 24 o 1.178000  0.4004000     1.116000  0.5433000     1.241000  0.5883000     -0.1248000     0.8008000 
1 1 1 18 14 0  o 16.89000  0.2084000     16.89000  0.2084000     16.89000  0.2084000     0.000000       0.000000  
1 1 1 18 14 1  o 12.17000  0.1205000     12.12000  0.1696000     12.23000  0.1712000     -0.1125000     0.2410000 
1 1 1 18 14 2  o 6.694000  0.1094000     6.750000  0.1531000     6.638000  0.1563000     0.1128000      0.2188000 
1 1 1 18 14 3  o 9.048000  0.1138000     9.034000  0.1597000     9.061000  0.1622000     -0.2735000E-01 0.2277000 
1 1 1 18 14 4  o 12.37000  0.1275000     12.34000  0.1801000     12.40000  0.1805000     -0.5784000E-01 0.2549000 
1 1 1 18 14 5  o 6.009000  0.1288000     5.940000  0.1839000     6.078000  0.1804000     -0.1383000     0.2576000 
1 1 1 18 14 6  o 12.02000  0.1329000     12.15000  0.1885000     11.89000  0.1875000     0.2552000      0.2658000 
1 1 1 18 14 7  f 8.232000  0.1418000     8.261000  0.2228000     8.203000  0.1753000     0.5779000E-01  0.2836000 
1 1 1 18 14 8  o 13.48000  0.1771000     13.45000  0.2505000     13.51000  0.2504000     -0.5712000E-01 0.3542000 
1 1 1 18 14 9  o 3.893000  0.2644000     3.997000  0.3453000     3.789000  0.4006000     0.2083000      0.5289000 
1 1 1 18 14 10 f 15.60000  0.2251000     15.57000  0.3744000     15.64000  0.2501000     -0.7407000E-01 0.4502000 
1 1 1 18 14 11 o 5.943000  0.2212000     5.784000  0.3053000     6.101000  0.3203000     -0.3172000     0.4425000 
1 1 1 18 14 12 o 1.730000  0.4783000     1.704000  0.6681000     1.755000  0.6845000     -0.5107000E-01 0.9565000 
1 1 1 18 14 13 o 11.86000  0.2061000     11.72000  0.2737000     11.99000  0.3083000     -0.2684000     0.4123000 
1 1 1 18 14 14 o 4.911000  0.3197000     5.357000  0.4154000     4.464000  0.4861000     0.8927000      0.6394000 
1 1 1 18 14 15 o 6.766000  0.2712000     6.779000  0.3472000     6.754000  0.4166000     0.2479000E-01  0.5423000 
1 1 1 18 14 16 o 4.703000  0.3634000     4.974000  0.4527000     4.432000  0.5686000     0.5417000      0.7268000 
1 1 1 18 14 17 o 2.557000  0.5262000     2.023000  0.7511000     3.090000  0.7372000     -1.067000      1.052000  
1 1 1 18 14 18 o 3.847000  0.4108000     3.916000  0.5317000     3.778000  0.6264000     0.1381000      0.8217000 
1 1 1 18 14 19 o 2.015000  0.5446000     2.089000  0.7043000     1.940000  0.8309000     0.1485000      1.089000  
1 1 1 18 14 20 o 2.058000  0.5271000     2.179000  0.6706000     1.937000  0.8134000     0.2413000      1.054000  
1 1 1 18 14 21 o 3.169000  0.4821000     2.874000  0.5819000     3.464000  0.7687000     -0.5898000     0.9641000 
1 1 1 18 14 22 o 1.348000  0.4492000     1.257000  0.5944000     1.438000  0.6737000     -0.1819000     0.8985000 
1 1 1 18 14 23 o 1.321000  0.4326000     1.411000  0.6387000     1.232000  0.5835000     0.1795000      0.8651000 
1 1 1 18 14 24 o 1.099000  0.3784000     0.9913000 0.4932000     1.206000  0.5739000     -0.2147000     0.7568000 
1 1 1 18 15 0  o 0.4326000 0.3099000     0.4326000 0.3099000     0.4326000 0.3099000     -0.000000      0.000000  
1 1 1 18 15 1  o 8.184000  0.1090000     8.103000  0.1529000     8.266000  0.1555000     -0.1626000     0.2181000 
1 1 1 18 15 2  o 13.87000  0.1322000     13.82000  0.1856000     13.92000  0.1882000     -0.9903000E-01 0.2644000 
1 1 1 18 15 3  o 9.748000  0.1167000     9.772000  0.1650000     9.725000  0.1652000     0.4753000E-01  0.2335000 
1 1 1 18 15 4  o 18.66000  0.1640000     18.61000  0.2314000     18.72000  0.2326000     -0.1132000     0.3281000 
1 1 1 18 15 5  o 5.713000  0.1324000     5.642000  0.1875000     5.784000  0.1870000     -0.1420000     0.2648000 
1 1 1 18 15 6  o 6.366000  0.1355000     6.202000  0.1927000     6.531000  0.1907000     -0.3296000     0.2711000 
1 1 1 18 15 7  o 10.58000  0.1502000     10.58000  0.2327000     10.58000  0.1900000     -0.7180000E-02 0.3004000 
1 1 1 18 15 8  o 11.64000  0.1534000     11.90000  0.2430000     11.38000  0.1872000     0.5226000      0.3068000 
1 1 1 18 15 9  o 9.734000  0.1785000     9.777000  0.2280000     9.690000  0.2747000     0.8690000E-01  0.3570000 
1 1 1 18 15 10 o 2.959000  0.3680000     2.890000  0.5076000     3.028000  0.5331000     -0.1372000     0.7361000 
1 1 1 18 15 11 o 8.199000  0.1895000     8.197000  0.2639000     8.201000  0.2720000     -0.3659000E-02 0.3790000 
1 1 1 18 15 12 o 5.158000  0.2680000     4.796000  0.3835000     5.520000  0.3745000     -0.7237000     0.5360000 
1 1 1 18 15 13 o 9.444000  0.2226000     9.233000  0.3108000     9.655000  0.3188000     -0.4223000     0.4453000 
1 1 1 18 15 14 o 5.862000  0.2832000     5.869000  0.3919000     5.855000  0.4089000     0.1339000E-01  0.5664000 
1 1 1 18 15 15 o 6.304000  0.3248000     5.795000  0.4936000     6.813000  0.4221000     -1.018000      0.6495000 
1 1 1 18 15 16 o 4.383000  0.3748000     4.594000  0.4761000     4.171000  0.5789000     0.4222000      0.7496000 
1 1 1 18 15 17 o 2.521000  0.5011000     1.755000  0.7174000     3.287000  0.6997000     -1.533000      1.002000  
1 1 1 18 15 18 o 2.307000  0.4806000     3.122000  0.6842000     1.493000  0.6753000     1.628000       0.9613000 
1 1 1 18 15 19 o 3.357000  0.4529000     3.317000  0.6294000     3.398000  0.6513000     -0.8101000E-01 0.9057000 
1 1 1 18 15 20 o 3.484000  0.4083000     3.143000  0.5593000     3.826000  0.5950000     -0.6838000     0.8166000 
1 1 1 18 15 21 o 1.467000  0.4677000     1.182000  0.5447000     1.752000  0.7605000     -0.5699000     0.9354000 
1 1 1 18 15 22 o 1.537000  0.4259000     1.992000  0.6581000     1.083000  0.5408000     0.9095000      0.8518000 
1 1 1 18 15 23 o 1.595000  0.5065000     1.348000  0.5996000     1.842000  0.8166000     -0.4944000     1.013000  
1 1 1 18 15 24 o 1.657000  0.4706000     1.876000  0.6555000     1.439000  0.6755000     0.4369000      0.9413000 
1 1 1 18 16 0  o 3.583000  0.2119000     3.583000  0.2119000     3.583000  0.2119000     0.000000       0.000000  
1 1 1 18 16 1  o 2.258000  0.2279000     2.098000  0.3392000     2.419000  0.3045000     -0.3206000     0.4559000 
1 1 1 18 16 2  o 12.93000  0.1288000     12.93000  0.1813000     12.93000  0.1829000     0.4021000E-02  0.2575000 
1 1 1 18 16 3  o 11.30000  0.1232000     11.32000  0.1743000     11.29000  0.1743000     0.3017000E-01  0.2465000 
1 1 1 18 16 4  o 29.23000  0.2550000     29.18000  0.3345000     29.29000  0.3850000     -0.1068000     0.5100000 
1 1 1 18 16 5  o 6.418000  0.1474000     6.444000  0.2255000     6.391000  0.1897000     0.5299000E-01  0.2947000 
1 1 1 18 16 6  o 9.934000  0.1298000     9.980000  0.1838000     9.887000  0.1835000     0.9286000E-01  0.2597000 
1 1 1 18 16 7  o 6.685000  0.1854000     6.529000  0.2819000     6.842000  0.2407000     -0.3134000     0.3707000 
1 1 1 18 16 8  o 4.924000  0.1720000     4.947000  0.2458000     4.900000  0.2408000     0.4697000E-01  0.3441000 
1 1 1 18 16 9  o 12.07000  0.2009000     11.91000  0.2984000     12.23000  0.2691000     -0.3172000     0.4018000 
1 1 1 18 16 10 o 6.167000  0.2052000     6.154000  0.2819000     6.180000  0.2983000     -0.2648000E-01 0.4104000 
1 1 1 18 16 11 o 13.87000  0.1784000     13.83000  0.2492000     13.91000  0.2554000     -0.7788000E-01 0.3568000 
1 1 1 18 16 12 o 8.261000  0.2062000     8.017000  0.2905000     8.505000  0.2927000     -0.4884000     0.4123000 
1 1 1 18 16 13 o 2.547000  0.5922000     2.937000  0.7076000     2.158000  0.9497000     0.7787000      1.184000  
1 1 1 18 16 14 o 2.353000  0.5599000     2.148000  0.7705000     2.559000  0.8125000     -0.4103000     1.120000  
1 1 1 18 16 15 o 5.541000  0.5984000     5.638000  1.106000      5.444000  0.4566000     0.1949000      1.197000  
1 1 1 18 16 16 o 8.039000  0.2392000     8.037000  0.3378000     8.042000  0.3388000     -0.5434000E-02 0.4784000 
1 1 1 18 16 17 o 3.847000  0.4130000     3.741000  0.5789000     3.952000  0.5891000     -0.2113000     0.8259000 
1 1 1 18 16 18 o 4.071000  0.4232000     4.131000  0.5593000     4.011000  0.6353000     0.1206000      0.8464000 
1 1 1 18 16 19 o 5.573000  0.2805000     5.456000  0.3943000     5.690000  0.3989000     -0.2338000     0.5609000 
1 1 1 18 16 20 o 2.682000  0.4995000     1.920000  0.7304000     3.443000  0.6816000     -1.523000      0.9990000 
1 1 1 18 16 21 f 2.151000  0.4314000     2.974000  0.6151000     1.329000  0.6050000     1.645000       0.8628000 
1 1 1 18 16 22 o 2.122000  0.5009000     1.911000  0.6937000     2.333000  0.7227000     -0.4216000     1.002000  
1 1 1 18 16 23 o 1.785000  0.4919000     1.499000  0.6268000     2.070000  0.7584000     -0.5714000     0.9839000 
1 1 1 18 16 24 o 1.147000  0.3954000     1.038000  0.4982000     1.256000  0.6141000     -0.2183000     0.7908000 
1 1 1 18 17 0  o 20.89000  0.2502000     20.89000  0.2502000     20.89000  0.2502000     -0.000000      0.000000  
1 1 1 18 17 1  o 20.05000  0.1712000     20.06000  0.2422000     20.03000  0.2421000     0.3481000E-01  0.3424000 
1 1 1 18 17 2  o 6.990000  0.1180000     7.113000  0.1657000     6.868000  0.1681000     0.2458000      0.2360000 
1 1 1 18 17 3  o 27.09000  0.2213000     27.05000  0.3125000     27.14000  0.3134000     -0.8949000E-01 0.4426000 
1 1 1 18 17 4  o 3.451000  0.1800000     3.414000  0.2567000     3.488000  0.2524000     -0.7445000E-01 0.3600000 
1 1 1 18 17 5  f 21.05000  0.1830000     20.91000  0.2575000     21.20000  0.2600000     -0.2844000     0.3659000 
1 1 1 18 17 6  o 8.682000  0.1326000     8.701000  0.1882000     8.662000  0.1868000     0.3934000E-01  0.2651000 
1 1 1 18 17 7  o 14.56000  0.1806000     14.55000  0.2146000     14.56000  0.2907000     -0.1185000E-02 0.3613000 
1 1 1 18 17 8  o 8.067000  0.1463000     8.257000  0.2033000     7.877000  0.2105000     0.3803000      0.2926000 
1 1 1 18 17 9  o 10.46000  0.2716000     10.88000  0.5063000     10.04000  0.1968000     0.8389000      0.5432000 
1 1 1 18 17 10 o 4.941000  0.2382000     4.776000  0.3324000     5.106000  0.3411000     -0.3298000     0.4763000 
1 1 1 18 17 11 o 6.657000  0.2100000     6.509000  0.2890000     6.805000  0.3048000     -0.2963000     0.4201000 
1 1 1 18 17 12 o 7.899000  0.2213000     8.284000  0.3149000     7.514000  0.3111000     0.7698000      0.4426000 
1 1 1 18 17 13 o 10.92000  0.2689000     11.16000  0.2734000     10.68000  0.4632000     0.4854000      0.5378000 
1 1 1 18 17 14 o 5.823000  0.2915000     6.092000  0.3775000     5.553000  0.4444000     0.5392000      0.5831000 
1 1 1 18 17 15 o 5.377000  0.4657000     5.764000  0.7889000     4.990000  0.4952000     0.7748000      0.9314000 
1 1 1 18 17 16 o 1.927000  0.5359000     1.991000  0.7511000     1.863000  0.7646000     0.1271000      1.072000  
1 1 1 18 17 17 o 4.672000  0.3630000     4.862000  0.4802000     4.483000  0.5444000     0.3789000      0.7260000 
1 1 1 18 17 18 o 3.020000  0.6365000     2.928000  0.7815000     3.111000  1.005000      -0.1827000     1.273000  
1 1 1 18 17 19 o 2.323000  0.5166000     2.162000  0.7326000     2.483000  0.7286000     -0.3209000     1.033000  
1 1 1 18 17 20 o 1.931000  0.5289000     2.319000  0.8105000     1.543000  0.6798000     0.7763000      1.058000  
1 1 1 18 17 21 o 2.613000  0.4721000     2.422000  0.6832000     2.804000  0.6516000     -0.3820000     0.9442000 
1 1 1 18 17 22 o 2.680000  0.4477000     3.462000  0.5398000     1.898000  0.7144000     1.563000       0.8954000 
1 1 1 18 17 23 o 1.766000  0.5469000     1.441000  0.6339000     2.090000  0.8915000     -0.6490000     1.094000  
1 1 1 18 17 24 o 1.595000  0.4786000     1.798000  0.7123000     1.391000  0.6393000     0.4067000      0.9571000 
1 1 1 18 18 0  o 19.91000  0.2421000     19.91000  0.2421000     19.91000  0.2421000     0.000000       0.000000  
1 1 1 18 18 1  o 13.09000  0.1311000     13.12000  0.1857000     13.06000  0.1852000     0.5702000E-01  0.2623000 
1 1 1 18 18 2  o 15.45000  0.1444000     15.45000  0.2036000     15.45000  0.2047000     -0.1865000E-02 0.2887000 
1 1 1 18 18 3  o 6.859000  0.1248000     6.826000  0.1763000     6.892000  0.1767000     -0.6551000E-01 0.2496000 
1 1 1 18 18 4  o 3.333000  0.1920000     3.252000  0.2766000     3.415000  0.2663000     -0.1630000     0.3840000 
1 1 1 18 18 5  o 14.32000  0.1455000     14.57000  0.2080000     14.07000  0.2035000     0.5051000      0.2910000 
1 1 1 18 18 6  o 12.95000  0.1751000     12.91000  0.2858000     12.99000  0.2023000     -0.7301000E-01 0.3502000 
1 1 1 18 18 7  o 10.41000  0.1491000     10.72000  0.2231000     10.10000  0.1980000     0.6240000      0.2983000 
1 1 1 18 18 8  o 13.75000  0.1923000     13.78000  0.2167000     13.72000  0.3178000     0.5703000E-01  0.3847000 
1 1 1 18 18 9  f 22.21000  0.1999000     21.79000  0.2788000     22.63000  0.2864000     -0.8444000     0.3997000 
1 1 1 18 18 10 o 8.674000  0.1730000     8.516000  0.2735000     8.831000  0.2119000     -0.3149000     0.3460000 
1 1 1 18 18 11 o 11.91000  0.1823000     11.96000  0.2525000     11.87000  0.2629000     0.8937000E-01  0.3645000 
1 1 1 18 18 12 o 7.390000  0.2155000     7.093000  0.3009000     7.686000  0.3085000     -0.5932000     0.4309000 
1 1 1 18 18 13 o 2.316000  0.5335000     2.189000  0.7352000     2.444000  0.7733000     -0.2550000     1.067000  
1 1 1 18 18 14 o 7.419000  0.2447000     7.419000  0.3327000     7.420000  0.3587000     -0.5817000E-03 0.4893000 
1 1 1 18 18 15 o 4.909000  0.3631000     4.627000  0.5388000     5.190000  0.4869000     -0.5635000     0.7263000 
1 1 1 18 18 16 o 2.401000  0.5455000     2.830000  0.7714000     1.973000  0.7715000     0.8567000      1.091000  
1 1 1 18 18 17 o 1.430000  0.4614000     1.231000  0.5875000     1.628000  0.7117000     -0.3973000     0.9228000 
1 1 1 18 18 18 f 2.114000  0.6371000     1.879000  0.7531000     2.349000  1.028000      -0.4706000     1.274000  
1 1 1 18 18 19 o 2.983000  0.4641000     2.331000  0.7379000     3.636000  0.5631000     -1.305000      0.9282000 
1 1 1 18 18 20 o 1.970000  0.5631000     1.766000  0.8648000     2.174000  0.7215000     -0.4076000     1.126000  
1 1 1 18 18 21 o 1.504000  0.4550000     1.565000  0.6522000     1.443000  0.6348000     0.1219000      0.9101000 
1 1 1 18 18 22 o 2.525000  0.4725000     2.224000  0.6981000     2.825000  0.6368000     -0.6006000     0.9449000 
1 1 1 18 18 23 o 1.852000  0.5867000     1.629000  0.6755000     2.074000  0.9595000     -0.4451000     1.173000  
1 1 1 18 19 0  o 11.33000  0.1778000     11.33000  0.1778000     11.33000  0.1778000     0.000000       0.000000  
1 1 1 18 19 1  o 21.32000  0.1816000     21.36000  0.2570000     21.29000  0.2565000     0.7090000E-01  0.3631000 
1 1 1 18 19 2  o 8.876000  0.1218000     8.898000  0.1707000     8.853000  0.1738000     0.4492000E-01  0.2436000 
1 1 1 18 19 3  o 19.41000  0.1711000     19.46000  0.2419000     19.35000  0.2421000     0.1098000      0.3422000 
1 1 1 18 19 4  o 5.679000  0.1585000     5.661000  0.2409000     5.697000  0.2062000     -0.3626000E-01 0.3171000 
1 1 1 18 19 5  o 9.152000  0.1317000     9.252000  0.1877000     9.052000  0.1849000     0.1999000      0.2635000 
1 1 1 18 19 6  o 19.74000  0.2261000     19.96000  0.2912000     19.51000  0.3460000     0.4555000      0.4522000 
1 1 1 18 19 7  o 10.93000  0.1422000     10.98000  0.2012000     10.87000  0.2010000     0.1119000      0.2844000 
1 1 1 18 19 8  o 13.71000  0.2032000     13.54000  0.3105000     13.88000  0.2622000     -0.3329000     0.4064000 
1 1 1 18 19 9  o 3.089000  0.2902000     3.278000  0.3794000     2.901000  0.4391000     0.3769000      0.5803000 
1 1 1 18 19 10 o 6.680000  0.1894000     6.638000  0.2970000     6.723000  0.2350000     -0.8451000E-01 0.3788000 
1 1 1 18 19 11 o 6.901000  0.2253000     6.410000  0.3407000     7.392000  0.2950000     -0.9827000     0.4507000 
1 1 1 18 19 12 f 2.304000  0.5213000     2.093000  0.7267000     2.515000  0.7476000     -0.4223000     1.043000  
1 1 1 18 19 13 o 4.245000  0.3651000     4.739000  0.4387000     3.750000  0.5836000     0.9892000      0.7301000 
1 1 1 18 19 14 o 6.254000  0.2990000     6.240000  0.3832000     6.268000  0.4592000     -0.2730000E-01 0.5981000 
1 1 1 18 19 15 o 5.016000  0.3435000     5.465000  0.4167000     4.567000  0.5463000     0.8983000      0.6870000 
1 1 1 18 19 16 o 2.474000  0.5545000     2.296000  0.7685000     2.651000  0.7996000     -0.3548000     1.109000  
1 1 1 18 19 17 o 3.209000  0.4918000     3.216000  0.6567000     3.203000  0.7323000     0.1305000E-01  0.9836000 
1 1 1 18 19 18 o 2.059000  0.5950000     1.692000  0.7054000     2.426000  0.9583000     -0.7339000     1.190000  
1 1 1 18 19 19 o 3.028000  0.4688000     2.960000  0.6730000     3.096000  0.6529000     -0.1359000     0.9377000 
1 1 1 18 19 20 o 1.527000  0.4854000     1.442000  0.6943000     1.611000  0.6787000     -0.1687000     0.9709000 
1 1 1 18 19 21 o 3.812000  0.3647000     3.972000  0.4912000     3.653000  0.5393000     0.3197000      0.7295000 
1 1 1 18 19 22 o 1.773000  0.4829000     1.760000  0.6812000     1.786000  0.6845000     -0.2538000E-01 0.9657000 
1 1 1 18 19 23 o 1.362000  0.4600000     1.144000  0.5428000     1.580000  0.7428000     -0.4360000     0.9200000 
1 1 1 18 20 0  o 10.98000  0.1792000     10.98000  0.1792000     10.98000  0.1792000     -0.000000      0.000000  
1 1 1 18 20 1  o 5.953000  0.1324000     6.030000  0.1878000     5.875000  0.1867000     0.1550000      0.2648000 
1 1 1 18 20 2  o 4.387000  0.1592000     4.620000  0.2167000     4.155000  0.2332000     0.4652000      0.3183000 
1 1 1 18 20 3  o 3.581000  0.1864000     3.411000  0.2692000     3.752000  0.2580000     -0.3410000     0.3728000 
1 1 1 18 20 4  o 18.87000  0.1855000     19.00000  0.2829000     18.73000  0.2400000     0.2646000      0.3710000 
1 1 1 18 20 5  o 14.67000  0.1847000     14.77000  0.3025000     14.56000  0.2118000     0.2059000      0.3693000 
1 1 1 18 20 6  o 7.762000  0.1475000     8.141000  0.2005000     7.383000  0.2164000     0.7571000      0.2950000 
1 1 1 18 20 7  o 7.856000  0.1934000     7.734000  0.2271000     7.978000  0.3132000     -0.2444000     0.3869000 
1 1 1 18 20 8  o 8.342000  0.1673000     8.588000  0.2584000     8.096000  0.2125000     0.4923000      0.3345000 
1 1 1 18 20 9  o 16.37000  0.1685000     16.53000  0.2392000     16.21000  0.2373000     0.3261000      0.3370000 
1 1 1 18 20 10 o 7.406000  0.1762000     7.555000  0.2402000     7.257000  0.2577000     0.2976000      0.3523000 
1 1 1 18 20 11 o 6.943000  0.2043000     6.992000  0.3197000     6.893000  0.2544000     0.9942000E-01  0.4086000 
1 1 1 18 20 12 o 3.908000  0.4831000     4.021000  0.5230000     3.794000  0.8124000     0.2261000      0.9661000 
1 1 1 18 20 13 o 5.881000  0.2806000     5.399000  0.4137000     6.363000  0.3791000     -0.9647000     0.5612000 
1 1 1 18 20 14 o 13.35000  0.2522000     13.23000  0.3748000     13.47000  0.3374000     -0.2407000     0.5043000 
1 1 1 18 20 15 o 9.683000  0.2284000     10.07000  0.3095000     9.296000  0.3359000     0.7744000      0.4568000 
1 1 1 18 20 16 o 6.762000  0.2659000     6.744000  0.3572000     6.780000  0.3941000     -0.3575000E-01 0.5318000 
1 1 1 18 20 17 o 2.394000  0.5364000     2.835000  0.7524000     1.953000  0.7647000     0.8823000      1.073000  
1 1 1 18 20 18 o 2.025000  0.5482000     1.938000  0.7484000     2.113000  0.8012000     -0.1757000     1.096000  
1 1 1 18 20 19 o 3.170000  0.4566000     3.463000  0.5864000     2.878000  0.7001000     0.5855000      0.9132000 
1 1 1 18 20 20 o 1.443000  0.4499000     1.261000  0.5864000     1.626000  0.6826000     -0.3654000     0.8999000 
1 1 1 18 20 21 f 2.498000  0.4761000     2.895000  0.6375000     2.101000  0.7074000     0.7939000      0.9522000 
1 1 1 18 20 22 o 1.168000  0.3888000     1.238000  0.5706000     1.097000  0.5283000     0.1404000      0.7776000 
1 1 1 18 20 23 o 1.571000  0.4602000     1.808000  0.6816000     1.333000  0.6184000     0.4753000      0.9204000 
1 1 1 18 21 0  o 3.800000  0.2483000     3.800000  0.2483000     3.800000  0.2483000     -0.000000      0.000000  
1 1 1 18 21 1  o 11.26000  0.1304000     11.13000  0.1841000     11.39000  0.1846000     -0.2557000     0.2607000 
1 1 1 18 21 2  o 16.48000  0.1553000     16.57000  0.2198000     16.40000  0.2194000     0.1690000      0.3106000 
1 1 1 18 21 3  o 7.407000  0.1306000     7.439000  0.1844000     7.376000  0.1850000     0.6296000E-01  0.2612000 
1 1 1 18 21 4  o 11.36000  0.1500000     11.27000  0.2300000     11.45000  0.1926000     -0.1818000     0.3000000 
1 1 1 18 21 5  o 19.76000  0.2272000     19.88000  0.2912000     19.65000  0.3489000     0.2293000      0.4545000 
1 1 1 18 21 6  o 7.228000  0.1580000     7.173000  0.2086000     7.282000  0.2373000     -0.1090000     0.3159000 
1 1 1 18 21 7  o 11.74000  0.1913000     11.81000  0.2921000     11.67000  0.2471000     0.1462000      0.3826000 
1 1 1 18 21 8  o 8.128000  0.1519000     8.166000  0.2125000     8.090000  0.2173000     0.7631000E-01  0.3039000 
1 1 1 18 21 9  o 8.746000  0.1682000     8.766000  0.2165000     8.727000  0.2575000     0.3920000E-01  0.3364000 
1 1 1 18 21 10 o 1.708000  0.4168000     1.978000  0.5973000     1.438000  0.5815000     0.5394000      0.8336000 
1 1 1 18 21 11 o 7.501000  0.2002000     7.630000  0.3148000     7.372000  0.2475000     0.2585000      0.4004000 
1 1 1 18 21 12 o 3.045000  0.5814000     3.262000  0.6352000     2.827000  0.9741000     0.4350000      1.163000  
1 1 1 18 21 13 o 3.681000  0.4037000     3.460000  0.5728000     3.901000  0.5691000     -0.4401000     0.8074000 
1 1 1 18 21 14 o 4.567000  0.6677000     3.785000  1.249000      5.349000  0.4718000     -1.564000      1.335000  
1 1 1 18 21 15 o 4.606000  0.3703000     4.686000  0.4932000     4.526000  0.5524000     0.1601000      0.7405000 
1 1 1 18 21 16 o 3.403000  0.4721000     3.167000  0.6760000     3.640000  0.6592000     -0.4729000     0.9442000 
1 1 1 18 21 17 o 4.507000  0.3620000     4.304000  0.5285000     4.710000  0.4949000     -0.4058000     0.7240000 
1 1 1 18 21 18 o 5.862000  0.2795000     5.854000  0.3810000     5.871000  0.4090000     -0.1635000E-01 0.5590000 
1 1 1 18 21 19 o 4.506000  0.4058000     4.353000  0.4985000     4.658000  0.6405000     -0.3050000     0.8116000 
1 1 1 18 21 20 o 1.364000  0.4318000     1.582000  0.6642000     1.147000  0.5521000     0.4348000      0.8636000 
1 1 1 18 21 21 o 1.141000  0.3827000     1.274000  0.5826000     1.009000  0.4963000     0.2652000      0.7653000 
1 1 1 18 21 22 o 1.964000  0.4808000     2.258000  0.6769000     1.670000  0.6830000     0.5874000      0.9616000 
1 1 1 18 21 23 o 1.217000  0.4018000     1.283000  0.5848000     1.151000  0.5511000     0.1315000      0.8036000 
1 1 1 18 22 0  o 5.498000  0.2061000     5.498000  0.2061000     5.498000  0.2061000     -0.000000      0.000000  
1 1 1 18 22 1  o 7.073000  0.1324000     6.894000  0.1882000     7.252000  0.1862000     -0.3577000     0.2647000 
1 1 1 18 22 2  o 8.553000  0.1302000     8.465000  0.1836000     8.640000  0.1847000     -0.1751000     0.2604000 
1 1 1 18 22 3  o 4.227000  0.1781000     4.222000  0.2568000     4.231000  0.2468000     -0.9537000E-02 0.3561000 
1 1 1 18 22 4  o 26.73000  0.2905000     26.63000  0.4494000     26.84000  0.3682000     -0.2059000     0.5810000 
1 1 1 18 22 5  o 19.33000  0.1918000     19.28000  0.2500000     19.38000  0.2910000     -0.9347000E-01 0.3836000 
1 1 1 18 22 6  o 16.08000  0.1879000     16.01000  0.2589000     16.16000  0.2723000     -0.1552000     0.3757000 
1 1 1 18 22 7  o 14.37000  0.1567000     14.58000  0.2234000     14.16000  0.2198000     0.4145000      0.3134000 
1 1 1 18 22 8  o 21.35000  0.1947000     21.47000  0.2764000     21.22000  0.2744000     0.2504000      0.3894000 
1 1 1 18 22 9  o 13.06000  0.1593000     13.02000  0.2247000     13.11000  0.2258000     -0.8721000E-01 0.3185000 
1 1 1 18 22 10 o 8.428000  0.1642000     8.569000  0.2300000     8.286000  0.2345000     0.2831000      0.3284000 
1 1 1 18 22 11 o 5.636000  0.2425000     5.638000  0.3802000     5.634000  0.3011000     0.3507000E-02  0.4851000 
1 1 1 18 22 12 o 4.426000  0.2898000     4.711000  0.4285000     4.141000  0.3903000     0.5697000      0.5796000 
1 1 1 18 22 13 f 6.271000  0.2907000     6.437000  0.3611000     6.105000  0.4556000     0.3320000      0.5814000 
1 1 1 18 22 14 o 2.734000  0.5443000     2.923000  0.7404000     2.544000  0.7981000     0.3795000      1.089000  
1 1 1 18 22 15 o 2.630000  0.5653000     2.381000  0.8323000     2.878000  0.7653000     -0.4977000     1.131000  
1 1 1 18 22 16 o 2.780000  0.5224000     3.368000  0.6821000     2.191000  0.7913000     1.177000       1.045000  
1 1 1 18 22 17 o 2.168000  0.5493000     1.827000  0.7270000     2.510000  0.8236000     -0.6830000     1.099000  
1 1 1 18 22 18 o 2.165000  0.5271000     1.967000  0.7367000     2.363000  0.7541000     -0.3956000     1.054000  
1 1 1 18 22 19 o 1.594000  0.5001000     1.487000  0.6869000     1.701000  0.7272000     -0.2145000     1.000000  
1 1 1 18 22 20 o 1.434000  0.4500000     1.504000  0.6533000     1.364000  0.6189000     0.1406000      0.8999000 
1 1 1 18 22 21 f 1.511000  0.4553000     1.392000  0.6123000     1.629000  0.6741000     -0.2373000     0.9106000 
1 1 1 18 22 22 o 1.216000  0.4031000     1.279000  0.5883000     1.152000  0.5511000     0.1267000      0.8061000 
1 1 1 18 22 23 o 1.417000  0.4413000     1.529000  0.6471000     1.305000  0.6003000     0.2239000      0.8827000 
1 1 1 18 23 0  o 6.320000  0.1995000     6.320000  0.1995000     6.320000  0.1995000     0.000000       0.000000  
1 1 1 18 23 1  o 9.566000  0.1308000     9.655000  0.1846000     9.478000  0.1853000     0.1769000      0.2616000 
1 1 1 18 23 2  o 8.982000  0.1453000     8.925000  0.2218000     9.039000  0.1878000     -0.1143000     0.2906000 
1 1 1 18 23 3  o 6.422000  0.1877000     6.495000  0.2955000     6.349000  0.2315000     0.1465000      0.3754000 
1 1 1 18 23 4  o 15.99000  0.1909000     16.07000  0.2245000     15.92000  0.3089000     0.1482000      0.3819000 
1 1 1 18 23 5  o 5.144000  0.2306000     5.197000  0.2620000     5.092000  0.3796000     0.1045000      0.4612000 
1 1 1 18 23 6  o 8.135000  0.1609000     8.306000  0.2448000     7.964000  0.2088000     0.3420000      0.3217000 
1 1 1 18 23 7  o 8.744000  0.1496000     8.829000  0.2091000     8.659000  0.2140000     0.1702000      0.2992000 
1 1 1 18 23 8  o 16.79000  0.1711000     16.76000  0.2412000     16.82000  0.2427000     -0.6260000E-01 0.3422000 
1 1 1 18 23 9  o 1.653000  0.4018000     1.995000  0.5808000     1.311000  0.5556000     0.6846000      0.8037000 
1 1 1 18 23 10 o 3.425000  0.3140000     3.626000  0.4034000     3.224000  0.4812000     0.4017000      0.6279000 
1 1 1 18 23 11 o 8.723000  0.2340000     8.504000  0.3601000     8.943000  0.2989000     -0.4385000     0.4681000 
1 1 1 18 23 12 o 7.953000  0.2166000     7.978000  0.3421000     7.929000  0.2659000     0.4823000E-01  0.4333000 
1 1 1 18 23 13 o 7.850000  0.2753000     7.769000  0.3850000     7.930000  0.3936000     -0.1606000     0.5506000 
1 1 1 18 23 14 o 5.214000  0.3351000     4.616000  0.5079000     5.811000  0.4374000     -1.195000      0.6703000 
1 1 1 18 23 15 o 2.046000  0.5320000     1.617000  0.7042000     2.475000  0.7978000     -0.8576000     1.064000  
1 1 1 18 23 16 o 6.486000  0.2744000     6.308000  0.3833000     6.665000  0.3928000     -0.3567000     0.5488000 
1 1 1 18 23 17 o 5.105000  0.6076000     5.473000  0.4162000     4.738000  1.142000      0.7345000      1.215000  
1 1 1 18 23 18 o 3.206000  0.4538000     2.573000  0.7121000     3.840000  0.5628000     -1.268000      0.9076000 
1 1 1 18 23 19 o 1.774000  0.5494000     1.715000  0.8284000     1.833000  0.7218000     -0.1176000     1.099000  
1 1 1 18 23 20 o 2.413000  0.4953000     2.037000  0.7153000     2.790000  0.6854000     -0.7532000     0.9906000 
1 1 1 18 23 21 o 1.407000  0.4322000     1.642000  0.6617000     1.173000  0.5561000     0.4689000      0.8644000 
1 1 1 18 23 22 o 2.151000  0.5074000     2.473000  0.6982000     1.828000  0.7365000     0.6452000      1.015000  
1 1 1 18 23 23 o 1.267000  0.4089000     1.490000  0.6392000     1.045000  0.5101000     0.4448000      0.8178000 
1 1 1 18 24 0  o 1.142000  0.6401000     1.142000  0.6401000     1.142000  0.6401000     0.000000       0.000000  
1 1 1 18 24 1  o 14.09000  0.1709000     14.17000  0.2431000     14.00000  0.2401000     0.1640000      0.3417000 
1 1 1 18 24 2  o 4.756000  0.2455000     4.818000  0.3448000     4.695000  0.3494000     0.1228000      0.4909000 
1 1 1 18 24 3  o 5.008000  0.2022000     5.047000  0.2328000     4.969000  0.3306000     0.7825000E-01  0.4043000 
1 1 1 18 24 4  o 17.95000  0.1969000     17.88000  0.2730000     18.02000  0.2839000     -0.1394000     0.3939000 
1 1 1 18 24 5  o 17.44000  0.1832000     17.38000  0.2780000     17.50000  0.2388000     -0.1141000     0.3664000 
1 1 1 18 24 6  o 14.96000  0.1577000     15.06000  0.2234000     14.86000  0.2227000     0.1991000      0.3155000 
1 1 1 18 24 7  f 10.26000  0.1495000     10.14000  0.2109000     10.37000  0.2120000     -0.2241000     0.2991000 
1 1 1 18 24 8  o 22.21000  0.2018000     22.13000  0.2848000     22.30000  0.2859000     -0.1756000     0.4036000 
1 1 1 18 24 9  o 4.701000  0.2194000     4.607000  0.3145000     4.795000  0.3059000     -0.1882000     0.4387000 
1 1 1 18 24 10 o 13.42000  0.1690000     13.40000  0.2383000     13.44000  0.2396000     -0.4618000E-01 0.3380000 
1 1 1 18 24 11 o 1.869000  0.4532000     2.305000  0.6315000     1.434000  0.6501000     0.8707000      0.9063000 
1 1 1 18 24 12 o 6.987000  0.2059000     7.446000  0.2742000     6.528000  0.3073000     0.9187000      0.4119000 
1 1 1 18 24 13 o 10.42000  0.3707000     10.25000  0.6772000     10.60000  0.3019000     -0.3503000     0.7414000 
1 1 1 18 24 14 o 2.727000  0.4998000     1.895000  0.7393000     3.558000  0.6728000     -1.663000      0.9996000 
1 1 1 18 24 15 o 2.849000  0.5362000     3.071000  0.7221000     2.627000  0.7930000     0.4433000      1.072000  
1 1 1 18 24 16 o 1.989000  0.5319000     1.888000  0.7293000     2.089000  0.7745000     -0.2007000     1.064000  
1 1 1 18 24 17 o 2.628000  0.5736000     2.856000  0.6865000     2.400000  0.9191000     0.4564000      1.147000  
1 1 1 18 24 18 o 1.262000  0.4174000     1.150000  0.5515000     1.373000  0.6268000     -0.2228000     0.8349000 
1 1 1 18 24 19 o 1.579000  0.5120000     2.028000  0.8658000     1.130000  0.5467000     0.8975000      1.024000  
1 1 1 18 24 20 o 1.430000  0.4443000     1.211000  0.5680000     1.649000  0.6834000     -0.4379000     0.8887000 
1 1 1 18 24 21 o 1.684000  0.4843000     1.677000  0.6839000     1.690000  0.6860000     -0.1242000E-01 0.9686000 
1 1 1 18 24 22 o 1.484000  0.5182000     0.9863000 0.4893000     1.981000  0.9136000     -0.9951000     1.036000  
1 1 1 18 24 23 o 1.276000  0.4467000     1.220000  0.6066000     1.331000  0.6559000     -0.1113000     0.8934000 
1 1 1 18 25 0  o 9.266000  0.2731000     9.266000  0.2731000     9.266000  0.2731000     -0.000000      0.000000  
1 1 1 18 25 1  o 6.923000  0.2739000     6.923000  0.2739000     ?         ?             ?              ?         
1 1 1 18 25 2  o 4.770000  0.2224000     4.783000  0.2700000     4.756000  0.3535000     0.2721000E-01  0.4449000 
1 1 1 18 25 3  o 3.637000  0.2814000     3.841000  0.4017000     3.433000  0.3941000     0.4080000      0.5627000 
1 1 1 18 25 4  o 9.991000  0.1541000     9.903000  0.2333000     10.08000  0.2013000     -0.1743000     0.3081000 
1 1 1 18 25 5  o 11.08000  0.1460000     11.08000  0.2050000     11.08000  0.2080000     -0.6530000E-02 0.2920000 
1 1 1 18 25 6  o 16.31000  0.1654000     16.34000  0.2332000     16.28000  0.2347000     0.5595000E-01  0.3309000 
1 1 1 18 25 7  o 4.145000  0.2229000     4.345000  0.3013000     3.945000  0.3286000     0.4006000      0.4458000 
1 1 1 18 25 8  o 10.49000  0.1556000     10.33000  0.2238000     10.65000  0.2162000     -0.3199000     0.3112000 
1 1 1 18 25 9  o 13.47000  0.1641000     13.30000  0.2313000     13.64000  0.2327000     -0.3350000     0.3281000 
1 1 1 18 25 10 o 5.754000  0.2371000     5.477000  0.3738000     6.032000  0.2916000     -0.5550000     0.4741000 
1 1 1 18 25 11 o 7.755000  0.1955000     7.717000  0.2612000     7.794000  0.2910000     -0.7748000E-01 0.3910000 
1 1 1 18 25 12 o 1.764000  0.4784000     1.762000  0.6486000     1.767000  0.7035000     -0.5582000E-02 0.9568000 
1 1 1 18 25 13 o 2.493000  0.5923000     2.436000  0.9711000     2.551000  0.6784000     -0.1144000     1.185000  
1 1 1 18 25 14 o 4.512000  0.3772000     4.790000  0.5072000     4.234000  0.5584000     0.5560000      0.7544000 
1 1 1 18 25 15 o 5.261000  0.3065000     5.249000  0.4201000     5.273000  0.4465000     -0.2398000E-01 0.6130000 
1 1 1 18 25 16 o 2.465000  0.5173000     2.839000  0.7128000     2.091000  0.7498000     0.7480000      1.035000  
1 1 1 18 25 17 o 2.923000  0.4897000     2.982000  0.6802000     2.865000  0.7047000     0.1168000      0.9794000 
1 1 1 18 25 18 f 1.834000  0.5091000     1.414000  0.6390000     2.253000  0.7928000     -0.8399000     1.018000  
1 1 1 18 25 19 o 1.093000  0.3752000     1.083000  0.5259000     1.103000  0.5353000     -0.2007000E-01 0.7504000 
1 1 1 18 25 20 o 1.136000  0.3846000     0.9984000 0.4906000     1.275000  0.5924000     -0.2761000     0.7692000 
1 1 1 18 25 21 o 1.543000  0.4569000     1.702000  0.6726000     1.384000  0.6185000     0.3180000      0.9138000 
1 1 1 18 25 22 o 1.456000  0.4738000     1.422000  0.6268000     1.489000  0.7105000     -0.6635000E-01 0.9475000 
1 1 1 18 26 0  o 8.740000  0.2292000     8.740000  0.2292000     8.740000  0.2292000     -0.000000      0.000000  
1 1 1 18 26 1  o 16.46000  0.1741000     16.45000  0.2631000     16.46000  0.2279000     -0.1027000E-01 0.3481000 
1 1 1 18 26 2  o 5.743000  0.1746000     5.870000  0.2635000     5.617000  0.2291000     0.2529000      0.3492000 
1 1 1 18 26 3  o 14.60000  0.1539000     14.72000  0.2182000     14.47000  0.2170000     0.2435000      0.3077000 
1 1 1 18 26 4  f 13.69000  0.1519000     13.57000  0.2133000     13.81000  0.2162000     -0.2428000     0.3037000 
1 1 1 18 26 5  o 14.79000  0.1585000     14.71000  0.2226000     14.86000  0.2257000     -0.1512000     0.3170000 
1 1 1 18 26 6  o 13.44000  0.1549000     13.47000  0.2181000     13.41000  0.2201000     0.5745000E-01  0.3099000 
1 1 1 18 26 7  o 10.11000  0.1528000     10.10000  0.2187000     10.12000  0.2136000     -0.2380000E-01 0.3056000 
1 1 1 18 26 8  o 6.076000  0.1855000     6.084000  0.2636000     6.068000  0.2611000     0.1677000E-01  0.3711000 
1 1 1 18 26 9  o 3.220000  0.3177000     2.960000  0.4770000     3.481000  0.4197000     -0.5206000     0.6353000 
1 1 1 18 26 10 o 6.062000  0.2706000     6.276000  0.3906000     5.848000  0.3747000     0.4282000      0.5413000 
1 1 1 18 26 11 o 4.956000  0.2512000     4.904000  0.3489000     5.007000  0.3616000     -0.1024000     0.5025000 
1 1 1 18 26 12 o 4.835000  0.3739000     5.108000  0.3874000     4.561000  0.6397000     0.5463000      0.7478000 
1 1 1 18 26 13 o 5.076000  0.2738000     4.388000  0.4234000     5.764000  0.3474000     -1.375000      0.5477000 
1 1 1 18 26 14 o 1.274000  0.4245000     1.348000  0.6351000     1.199000  0.5634000     0.1489000      0.8490000 
1 1 1 18 26 15 o 5.469000  0.3035000     5.411000  0.4186000     5.527000  0.4396000     -0.1157000     0.6071000 
1 1 1 18 26 16 o 3.335000  0.5107000     3.864000  0.6501000     2.807000  0.7878000     1.057000       1.021000  
1 1 1 18 26 17 o 2.622000  0.5062000     2.733000  0.6933000     2.512000  0.7376000     0.2205000      1.012000  
1 1 1 18 26 18 o 1.416000  0.4579000     1.349000  0.6242000     1.483000  0.6701000     -0.1341000     0.9157000 
1 1 1 18 26 19 f 1.532000  0.4610000     1.498000  0.6428000     1.565000  0.6611000     -0.6666000E-01 0.9221000 
1 1 1 18 26 20 o 2.019000  0.5008000     2.107000  0.7001000     1.931000  0.7164000     0.1764000      1.002000  
1 1 1 18 26 21 f 1.688000  0.4827000     1.664000  0.6679000     1.712000  0.6971000     -0.4815000E-01 0.9654000 
1 1 1 18 26 22 o 1.047000  0.3614000     1.178000  0.5564000     0.9160000 0.4614000     0.2622000      0.7228000 
1 1 1 18 27 0  o 9.543000  0.1985000     9.543000  0.1985000     9.543000  0.1985000     -0.000000      0.000000  
1 1 1 18 27 1  o 16.31000  0.1618000     16.16000  0.2282000     16.46000  0.2295000     -0.3054000     0.3236000 
1 1 1 18 27 2  o 9.801000  0.1428000     9.735000  0.2022000     9.866000  0.2016000     -0.1310000     0.2855000 
1 1 1 18 27 3  o 13.86000  0.1526000     13.99000  0.2162000     13.74000  0.2154000     0.2500000      0.3052000 
1 1 1 18 27 4  o 19.26000  0.1801000     19.22000  0.2535000     19.31000  0.2558000     -0.8455000E-01 0.3602000 
1 1 1 18 27 5  o 22.13000  0.1982000     22.07000  0.2791000     22.19000  0.2815000     -0.1223000     0.3964000 
1 1 1 18 27 6  o 14.03000  0.1582000     13.94000  0.2235000     14.13000  0.2238000     -0.1887000     0.3163000 
1 1 1 18 27 7  o 8.448000  0.1563000     8.545000  0.2202000     8.351000  0.2219000     0.1938000      0.3126000 
1 1 1 18 27 8  o 9.806000  0.1616000     9.757000  0.2298000     9.855000  0.2272000     -0.9847000E-01 0.3231000 
1 1 1 18 27 9  o 8.222000  0.1735000     8.234000  0.2432000     8.211000  0.2474000     0.2316000E-01  0.3469000 
1 1 1 18 27 10 o 7.288000  0.2294000     7.164000  0.2721000     7.413000  0.3695000     -0.2494000     0.4589000 
1 1 1 18 27 11 o 5.007000  0.2730000     4.956000  0.3561000     5.058000  0.4139000     -0.1023000     0.5460000 
1 1 1 18 27 12 o 1.350000  0.4380000     1.537000  0.6838000     1.163000  0.5475000     0.3739000      0.8759000 
1 1 1 18 27 13 o 1.131000  0.3805000     1.170000  0.5509000     1.093000  0.5251000     0.7674000E-01  0.7611000 
1 1 1 18 27 14 o 3.909000  0.3918000     3.691000  0.6440000     4.127000  0.4465000     -0.4356000     0.7836000 
1 1 1 18 27 15 o 1.839000  0.4986000     2.249000  0.7553000     1.429000  0.6511000     0.8207000      0.9972000 
1 1 1 18 27 16 o 4.852000  0.5972000     5.489000  0.4680000     4.215000  1.099000      1.274000       1.194000  
1 1 1 18 27 17 o 1.279000  0.4212000     1.388000  0.6302000     1.170000  0.5592000     0.2183000      0.8425000 
1 1 1 18 27 18 o 1.860000  0.5665000     1.809000  0.8716000     1.910000  0.7240000     -0.1010000     1.133000  
1 1 1 18 27 19 o 1.658000  0.4669000     1.928000  0.6954000     1.388000  0.6232000     0.5401000      0.9338000 
1 1 1 18 27 20 f 1.645000  0.4711000     1.863000  0.6969000     1.427000  0.6340000     0.4363000      0.9422000 
1 1 1 18 27 21 o 1.263000  0.4154000     1.292000  0.5935000     1.235000  0.5812000     0.5654000E-01  0.8307000 
1 1 1 18 27 22 o 1.945000  0.4706000     1.339000  0.6073000     2.552000  0.7189000     -1.213000      0.9411000 
1 1 1 18 28 0  o 5.673000  0.2364000     5.673000  0.2364000     5.673000  0.2364000     -0.000000      0.000000  
1 1 1 18 28 1  o 22.94000  0.2018000     23.18000  0.2877000     22.70000  0.2831000     0.4837000      0.4037000 
1 1 1 18 28 2  o 5.595000  0.1701000     5.783000  0.2335000     5.407000  0.2475000     0.3759000      0.3402000 
1 1 1 18 28 3  o 10.82000  0.1462000     10.94000  0.2062000     10.70000  0.2073000     0.2397000      0.2924000 
1 1 1 18 28 4  o 11.23000  0.1483000     11.35000  0.2089000     11.12000  0.2105000     0.2284000      0.2966000 
1 1 1 18 28 5  o 9.502000  0.1505000     9.761000  0.2120000     9.244000  0.2137000     0.5162000      0.3010000 
1 1 1 18 28 6  o 3.912000  0.2398000     3.404000  0.3722000     4.419000  0.3026000     -1.016000      0.4796000 
1 1 1 18 28 7  o 8.587000  0.1622000     8.500000  0.2324000     8.674000  0.2263000     -0.1735000     0.3244000 
1 1 1 18 28 8  o 13.13000  0.1652000     13.30000  0.2332000     12.96000  0.2340000     0.3350000      0.3303000 
1 1 1 18 28 9  o 7.654000  0.2399000     7.788000  0.3677000     7.521000  0.3084000     0.2670000      0.4799000 
1 1 1 18 28 10 o 3.620000  0.3225000     3.390000  0.4744000     3.850000  0.4370000     -0.4603000     0.6450000 
1 1 1 18 28 11 o 13.58000  0.2343000     14.11000  0.2793000     13.05000  0.3761000     1.058000       0.4685000 
1 1 1 18 28 12 o 8.413000  0.1957000     8.481000  0.2724000     8.346000  0.2812000     0.1354000      0.3915000 
1 1 1 18 28 13 o 2.707000  0.4421000     3.167000  0.5369000     2.248000  0.7026000     0.9191000      0.8842000 
1 1 1 18 28 14 o 2.381000  0.4630000     1.708000  0.6832000     3.054000  0.6251000     -1.346000      0.9260000 
1 1 1 18 28 15 o 6.431000  0.2634000     6.370000  0.4243000     6.493000  0.3121000     -0.1229000     0.5267000 
1 1 1 18 28 16 o 3.687000  0.5449000     3.066000  0.6835000     4.308000  0.8489000     -1.242000      1.090000  
1 1 1 18 28 17 o 1.287000  0.4193000     1.132000  0.5434000     1.441000  0.6386000     -0.3095000     0.8385000 
1 1 1 18 28 18 o 2.240000  0.5117000     3.080000  0.8051000     1.401000  0.6320000     1.679000       1.023000  
1 1 1 18 28 19 f 1.279000  0.4124000     1.064000  0.5128000     1.495000  0.6460000     -0.4308000     0.8248000 
1 1 1 18 28 20 o 1.372000  0.4311000     1.522000  0.6444000     1.223000  0.5727000     0.2992000      0.8622000 
1 1 1 18 28 21 o 1.278000  0.4247000     1.249000  0.5888000     1.306000  0.6122000     -0.5751000E-01 0.8493000 
1 1 1 18 28 22 o 1.578000  0.4711000     1.426000  0.6310000     1.730000  0.6998000     -0.3045000     0.9423000 
1 1 1 18 29 0  o 2.740000  0.4473000     2.740000  0.4473000     2.740000  0.4473000     -0.000000      0.000000  
1 1 1 18 29 1  o 3.870000  0.2214000     4.118000  0.2994000     3.623000  0.3261000     0.4947000      0.4427000 
1 1 1 18 29 2  o 19.34000  0.1810000     19.28000  0.2551000     19.40000  0.2569000     -0.1156000     0.3621000 
1 1 1 18 29 3  o 7.656000  0.1540000     7.487000  0.2181000     7.826000  0.2175000     -0.3397000     0.3080000 
1 1 1 18 29 4  o 3.059000  0.2835000     2.930000  0.4048000     3.188000  0.3969000     -0.2581000     0.5669000 
1 1 1 18 29 5  f 7.967000  0.1575000     7.988000  0.2236000     7.947000  0.2217000     0.4179000E-01  0.3149000 
1 1 1 18 29 6  o 19.61000  0.2026000     19.71000  0.2655000     19.51000  0.3060000     0.2052000      0.4051000 
1 1 1 18 29 7  o 3.722000  0.2699000     3.629000  0.3845000     3.814000  0.3789000     -0.1855000     0.5398000 
1 1 1 18 29 8  o 3.514000  0.2996000     3.849000  0.3849000     3.180000  0.4591000     0.6689000      0.5991000 
1 1 1 18 29 9  o 5.117000  0.2673000     4.666000  0.3545000     5.567000  0.4001000     -0.9011000     0.5345000 
1 1 1 18 29 10 o 11.66000  0.1866000     11.59000  0.2442000     11.73000  0.2823000     -0.1414000     0.3733000 
1 1 1 18 29 11 o 15.17000  0.2243000     15.31000  0.3643000     15.02000  0.2617000     0.2948000      0.4486000 
1 1 1 18 29 12 o 6.752000  0.2187000     7.076000  0.2934000     6.428000  0.3245000     0.6474000      0.4375000 
1 1 1 18 29 13 o 11.60000  0.1856000     11.57000  0.2614000     11.62000  0.2634000     -0.5186000E-01 0.3711000 
1 1 1 18 29 14 o 5.837000  0.2454000     6.000000  0.3335000     5.675000  0.3601000     0.3247000      0.4908000 
1 1 1 18 29 15 o 3.360000  0.4602000     2.940000  0.7541000     3.780000  0.5275000     -0.8396000     0.9203000 
1 1 1 18 29 16 o 2.281000  0.4887000     2.836000  0.6758000     1.727000  0.7060000     1.108000       0.9773000 
1 1 1 18 29 17 o 2.523000  0.5128000     2.812000  0.6637000     2.235000  0.7820000     0.5766000      1.026000  
1 1 1 18 29 18 o 2.583000  0.5016000     2.802000  0.6841000     2.364000  0.7337000     0.4377000      1.003000  
1 1 1 18 29 19 o 1.112000  0.3768000     0.9943000 0.4861000     1.229000  0.5759000     -0.2348000     0.7537000 
1 1 1 18 29 20 o 2.526000  0.4890000     2.949000  0.6501000     2.104000  0.7307000     0.8455000      0.9780000 
1 1 1 18 29 21 o 1.540000  0.5175000     1.401000  0.6383000     1.680000  0.8147000     -0.2795000     1.035000  
1 1 1 18 29 22 o 1.042000  0.3793000     1.045000  0.5371000     1.040000  0.5356000     0.4457000E-02  0.7585000 
1 1 1 18 30 0  o 7.330000  0.2636000     7.330000  0.2636000     7.330000  0.2636000     0.000000       0.000000  
1 1 1 18 30 1  o 10.24000  0.1467000     10.17000  0.2083000     10.31000  0.2067000     -0.1426000     0.2935000 
1 1 1 18 30 2  o 7.886000  0.1556000     7.667000  0.2231000     8.104000  0.2170000     -0.4370000     0.3112000 
1 1 1 18 30 3  o 13.42000  0.1557000     13.59000  0.2209000     13.26000  0.2195000     0.3249000      0.3114000 
1 1 1 18 30 4  o 2.658000  0.3378000     2.910000  0.4359000     2.407000  0.5162000     0.5028000      0.6756000 
1 1 1 18 30 5  o 10.77000  0.1671000     10.77000  0.2202000     10.77000  0.2514000     -0.2874000E-02 0.3342000 
1 1 1 18 30 6  f 2.810000  0.3485000     3.075000  0.4338000     2.545000  0.5456000     0.5298000      0.6971000 
1 1 1 18 30 7  o 8.832000  0.1686000     8.798000  0.2375000     8.865000  0.2395000     -0.6624000E-01 0.3373000 
1 1 1 18 30 8  o 13.18000  0.2212000     12.97000  0.3426000     13.38000  0.2797000     -0.4130000     0.4423000 
1 1 1 18 30 9  o 15.42000  0.1792000     15.43000  0.2531000     15.40000  0.2538000     0.3113000E-01  0.3584000 
1 1 1 18 30 10 o 8.768000  0.2441000     8.760000  0.2874000     8.777000  0.3948000     -0.1685000E-01 0.4883000 
1 1 1 18 30 11 o 2.907000  0.4261000     3.473000  0.5016000     2.340000  0.6890000     1.132000       0.8523000 
1 1 1 18 30 12 o 3.130000  0.4166000     2.918000  0.6082000     3.342000  0.5693000     -0.4244000     0.8331000 
1 1 1 18 30 13 o 3.188000  0.4163000     2.748000  0.6474000     3.628000  0.5235000     -0.8798000     0.8326000 
1 1 1 18 30 14 o 2.152000  0.4745000     2.613000  0.6604000     1.691000  0.6816000     0.9217000      0.9490000 
1 1 1 18 30 15 o 3.914000  0.4566000     3.400000  0.7473000     4.429000  0.5250000     -1.029000      0.9133000 
1 1 1 18 30 16 o 3.608000  0.3983000     4.160000  0.5546000     3.055000  0.5718000     1.105000       0.7966000 
1 1 1 18 30 17 o 4.709000  0.4220000     4.895000  0.5715000     4.523000  0.6210000     0.3720000      0.8440000 
1 1 1 18 30 18 o 1.408000  0.4321000     1.675000  0.6701000     1.141000  0.5457000     0.5341000      0.8642000 
1 1 1 18 30 19 o 2.492000  0.4758000     2.138000  0.7126000     2.846000  0.6308000     -0.7083000     0.9517000 
1 1 1 18 30 20 o 1.403000  0.4323000     1.726000  0.6898000     1.080000  0.5214000     0.6467000      0.8647000 
1 1 1 18 30 21 o 1.478000  0.4840000     1.268000  0.5901000     1.688000  0.7674000     -0.4199000     0.9681000 
1 1 1 18 31 0  o 5.823000  0.2491000     5.823000  0.2491000     5.823000  0.2491000     -0.000000      0.000000  
1 1 1 18 31 1  o 7.266000  0.1593000     7.233000  0.2276000     7.299000  0.2228000     -0.6655000E-01 0.3185000 
1 1 1 18 31 2  o 4.326000  0.2089000     4.172000  0.3048000     4.481000  0.2858000     -0.3089000     0.4178000 
1 1 1 18 31 3  o 2.971000  0.3047000     3.081000  0.4220000     2.862000  0.4397000     0.2185000      0.6094000 
1 1 1 18 31 4  f 15.00000  0.1639000     15.12000  0.2324000     14.89000  0.2311000     0.2233000      0.3277000 
1 1 1 18 31 5  o 2.441000  0.3841000     2.538000  0.5220000     2.344000  0.5636000     0.1934000      0.7682000 
1 1 1 18 31 6  o 18.68000  0.1853000     18.82000  0.2620000     18.55000  0.2622000     0.2768000      0.3707000 
1 1 1 18 31 7  o 7.702000  0.1954000     7.827000  0.2958000     7.578000  0.2555000     0.2496000      0.3909000 
1 1 1 18 31 8  o 6.971000  0.2272000     6.959000  0.2745000     6.984000  0.3622000     -0.2539000E-01 0.4545000 
1 1 1 18 31 9  o 8.497000  0.2017000     8.468000  0.2648000     8.526000  0.3042000     -0.5758000E-01 0.4033000 
1 1 1 18 31 10 o 6.118000  0.2626000     5.887000  0.4177000     6.348000  0.3184000     -0.4610000     0.5252000 
1 1 1 18 31 11 o 7.753000  0.2028000     7.342000  0.2914000     8.165000  0.2822000     -0.8235000     0.4057000 
1 1 1 18 31 12 o 4.613000  0.2987000     4.787000  0.3857000     4.438000  0.4563000     0.3497000      0.5975000 
1 1 1 18 31 13 o 1.675000  0.4765000     1.582000  0.6633000     1.768000  0.6844000     -0.1856000     0.9531000 
1 1 1 18 31 14 f 2.494000  0.4904000     2.530000  0.6746000     2.457000  0.7121000     0.7317000E-01  0.9809000 
1 1 1 18 31 15 o 3.238000  0.4792000     3.164000  0.5680000     3.312000  0.7718000     -0.1478000     0.9583000 
1 1 1 18 31 16 o 4.680000  0.3205000     4.899000  0.5012000     4.461000  0.3996000     0.4376000      0.6410000 
1 1 1 18 31 17 o 1.607000  0.5110000     1.706000  0.7831000     1.508000  0.6567000     0.1979000      1.022000  
1 1 1 18 31 18 o 1.620000  0.4700000     1.511000  0.6442000     1.729000  0.6846000     -0.2183000     0.9401000 
1 1 1 18 31 19 o 1.634000  0.4688000     1.464000  0.6242000     1.804000  0.6996000     -0.3393000     0.9376000 
1 1 1 18 31 20 o 1.678000  0.4810000     1.732000  0.6859000     1.623000  0.6745000     0.1088000      0.9619000 
1 1 1 18 31 21 o 1.480000  0.4559000     1.347000  0.6143000     1.613000  0.6737000     -0.2661000     0.9117000 
1 1 1 18 32 0  o 7.813000  0.2264000     7.813000  0.2264000     7.813000  0.2264000     -0.000000      0.000000  
1 1 1 18 32 1  o 11.60000  0.1537000     11.79000  0.2192000     11.41000  0.2156000     0.3856000      0.3074000 
1 1 1 18 32 2  o 11.57000  0.1543000     11.30000  0.2178000     11.84000  0.2187000     -0.5387000     0.3087000 
1 1 1 18 32 3  o 10.16000  0.1552000     10.13000  0.2187000     10.18000  0.2204000     -0.5556000E-01 0.3105000 
1 1 1 18 32 4  o 8.260000  0.1645000     8.255000  0.2302000     8.266000  0.2349000     -0.1117000E-01 0.3289000 
1 1 1 18 32 5  o 5.690000  0.1973000     5.887000  0.2693000     5.494000  0.2885000     0.3937000      0.3947000 
1 1 1 18 32 6  o 6.115000  0.1981000     6.190000  0.2798000     6.040000  0.2804000     0.1499000      0.3961000 
1 1 1 18 32 7  o 13.64000  0.2144000     13.91000  0.2738000     13.37000  0.3301000     0.5411000      0.4289000 
1 1 1 18 32 8  o 5.808000  0.2388000     5.678000  0.3139000     5.939000  0.3599000     -0.2604000     0.4776000 
1 1 1 18 32 9  o 5.899000  0.2965000     6.073000  0.4429000     5.724000  0.3944000     0.3487000      0.5930000 
1 1 1 18 32 10 o 12.19000  0.1805000     12.39000  0.2553000     12.00000  0.2551000     0.3972000      0.3609000 
1 1 1 18 32 11 o 3.983000  0.3230000     4.097000  0.4323000     3.870000  0.4801000     0.2275000      0.6461000 
1 1 1 18 32 12 o 7.551000  0.2101000     7.511000  0.2948000     7.590000  0.2994000     -0.7869000E-01 0.4201000 
1 1 1 18 32 13 o 1.400000  0.4344000     1.176000  0.5526000     1.624000  0.6704000     -0.4488000     0.8688000 
1 1 1 18 32 14 o 2.344000  0.5220000     2.594000  0.7651000     2.094000  0.7103000     0.5000000      1.044000  
1 1 1 18 32 15 o 6.223000  0.2395000     6.415000  0.3297000     6.031000  0.3474000     0.3839000      0.4789000 
1 1 1 18 32 16 o 2.181000  0.4603000     2.777000  0.6290000     1.585000  0.6721000     1.191000       0.9205000 
1 1 1 18 32 17 o 1.370000  0.4247000     1.232000  0.5874000     1.509000  0.6137000     -0.2770000     0.8495000 
1 1 1 18 32 18 o 2.816000  0.4498000     2.391000  0.6883000     3.240000  0.5791000     -0.8493000     0.8995000 
1 1 1 18 32 19 f 1.763000  0.4839000     1.528000  0.6441000     1.999000  0.7223000     -0.4705000     0.9678000 
1 1 1 18 32 20 o 1.309000  0.4313000     1.245000  0.5873000     1.372000  0.6316000     -0.1272000     0.8625000 
1 1 1 18 32 21 o 1.417000  0.4431000     1.661000  0.6868000     1.173000  0.5600000     0.4882000      0.8862000 
1 1 1 18 33 0  o 25.28000  0.3136000     25.28000  0.3136000     25.28000  0.3136000     0.000000       0.000000  
1 1 1 18 33 1  o 10.88000  0.1565000     10.78000  0.2217000     10.98000  0.2208000     -0.1987000     0.3129000 
1 1 1 18 33 2  o 6.617000  0.1764000     6.609000  0.2473000     6.624000  0.2517000     -0.1428000E-01 0.3528000 
1 1 1 18 33 3  f 2.925000  0.3396000     2.467000  0.5460000     3.383000  0.4040000     -0.9163000     0.6792000 
1 1 1 18 33 4  o 7.655000  0.1726000     7.555000  0.2419000     7.755000  0.2461000     -0.1997000     0.3451000 
1 1 1 18 33 5  o 3.953000  0.2627000     3.520000  0.4027000     4.386000  0.3374000     -0.8661000     0.5254000 
1 1 1 18 33 6  o 10.14000  0.2210000     10.29000  0.3443000     9.984000  0.2772000     0.3093000      0.4420000 
1 1 1 18 33 7  o 10.23000  0.1832000     10.22000  0.2412000     10.24000  0.2758000     -0.2196000E-01 0.3664000 
1 1 1 18 33 8  o 5.824000  0.3027000     6.109000  0.3341000     5.539000  0.5049000     0.5700000      0.6054000 
1 1 1 18 33 9  o 8.945000  0.2050000     8.836000  0.3184000     9.055000  0.2584000     -0.2194000     0.4101000 
1 1 1 18 33 10 o 9.225000  0.1934000     9.140000  0.2716000     9.310000  0.2753000     -0.1699000     0.3868000 
1 1 1 18 33 11 o 9.065000  0.1936000     9.021000  0.2732000     9.109000  0.2743000     -0.8815000E-01 0.3872000 
1 1 1 18 33 12 o 7.331000  0.2167000     7.124000  0.3110000     7.538000  0.3019000     -0.4144000     0.4334000 
1 1 1 18 33 13 o 1.769000  0.4872000     1.895000  0.7000000     1.643000  0.6779000     0.2512000      0.9744000 
1 1 1 18 33 14 o 5.226000  0.3886000     4.851000  0.6217000     5.601000  0.4663000     -0.7499000     0.7771000 
1 1 1 18 33 15 o 4.592000  0.2999000     4.718000  0.4078000     4.467000  0.4399000     0.2511000      0.5998000 
1 1 1 18 33 16 o 1.646000  0.4811000     1.821000  0.6848000     1.472000  0.6761000     0.3481000      0.9623000 
1 1 1 18 33 17 o 4.244000  0.3487000     4.191000  0.5798000     4.297000  0.3877000     -0.1063000     0.6975000 
1 1 1 18 33 18 o 1.489000  0.4450000     1.225000  0.5643000     1.753000  0.6881000     -0.5275000     0.8899000 
1 1 1 18 33 19 o 1.522000  0.4553000     1.292000  0.5874000     1.752000  0.6958000     -0.4597000     0.9106000 
1 1 1 18 33 20 o 1.526000  0.5136000     1.344000  0.6143000     1.708000  0.8233000     -0.3641000     1.027000  
1 1 1 18 33 21 o 1.111000  0.4024000     1.055000  0.5421000     1.167000  0.5948000     -0.1122000     0.8048000 
1 1 1 18 34 0  o 1.131000  0.6670000     1.131000  0.6670000     1.131000  0.6670000     0.000000       0.000000  
1 1 1 18 34 1  o 10.55000  0.1598000     10.45000  0.2272000     10.65000  0.2248000     -0.1934000     0.3196000 
1 1 1 18 34 2  o 14.09000  0.1649000     14.16000  0.2332000     14.03000  0.2331000     0.1334000      0.3297000 
1 1 1 18 34 3  o 4.652000  0.2237000     4.560000  0.3231000     4.744000  0.3097000     -0.1832000     0.4475000 
1 1 1 18 34 4  o 3.148000  0.3337000     3.417000  0.4235000     2.879000  0.5158000     0.5374000      0.6673000 
1 1 1 18 34 5  o 6.450000  0.2570000     6.342000  0.4069000     6.558000  0.3141000     -0.2165000     0.5140000 
1 1 1 18 34 6  o 4.963000  0.2544000     4.977000  0.3300000     4.949000  0.3873000     0.2891000E-01  0.5088000 
1 1 1 18 34 7  o 3.959000  0.4061000     4.038000  0.4514000     3.880000  0.6753000     0.1580000      0.8123000 
1 1 1 18 34 8  o 4.413000  0.3028000     4.427000  0.4709000     4.399000  0.3809000     0.2780000E-01  0.6057000 
1 1 1 18 34 9  o 8.339000  0.1920000     8.663000  0.2652000     8.015000  0.2777000     0.6485000      0.3840000 
1 1 1 18 34 10 o 6.977000  0.2161000     6.818000  0.3078000     7.136000  0.3033000     -0.3176000     0.4321000 
1 1 1 18 34 11 o 5.135000  0.2689000     4.647000  0.3991000     5.623000  0.3605000     -0.9761000     0.5378000 
1 1 1 18 34 12 o 5.694000  0.2511000     5.827000  0.3562000     5.562000  0.3539000     0.2646000      0.5021000 
1 1 1 18 34 13 o 1.376000  0.4370000     1.352000  0.6128000     1.399000  0.6232000     -0.4692000E-01 0.8740000 
1 1 1 18 34 14 o 4.749000  0.3630000     4.660000  0.4271000     4.839000  0.5872000     -0.1789000     0.7261000 
1 1 1 18 34 15 o 2.312000  0.4949000     2.478000  0.6636000     2.146000  0.7343000     0.3324000      0.9897000 
1 1 1 18 34 16 o 1.510000  0.4557000     1.670000  0.6883000     1.350000  0.5973000     0.3204000      0.9113000 
1 1 1 18 34 17 o 1.605000  0.4615000     1.545000  0.6774000     1.665000  0.6269000     -0.1193000     0.9230000 
1 1 1 18 34 18 o 1.888000  0.4845000     2.187000  0.7005000     1.588000  0.6696000     0.5988000      0.9691000 
1 1 1 18 34 19 o 2.179000  0.5001000     2.289000  0.6955000     2.068000  0.7187000     0.2214000      1.000000  
1 1 1 18 34 20 o 1.777000  0.4699000     2.290000  0.7049000     1.264000  0.6217000     1.025000       0.9399000 
1 1 1 18 35 0  o 17.42000  0.2542000     17.42000  0.2542000     17.42000  0.2542000     0.000000       0.000000  
1 1 1 18 35 1  o 3.430000  0.3170000     2.731000  0.5261000     4.130000  0.3537000     -1.398000      0.6340000 
1 1 1 18 35 2  o 3.575000  0.2954000     4.044000  0.3581000     3.106000  0.4698000     0.9376000      0.5908000 
1 1 1 18 35 3  o 7.171000  0.1977000     7.397000  0.3019000     6.945000  0.2552000     0.4528000      0.3954000 
1 1 1 18 35 4  o 1.596000  0.4709000     1.766000  0.7122000     1.426000  0.6162000     0.3397000      0.9418000 
1 1 1 18 35 5  o 13.64000  0.2062000     13.47000  0.2392000     13.81000  0.3360000     -0.3384000     0.4124000 
1 1 1 18 35 6  o 1.731000  0.4963000     1.588000  0.6398000     1.874000  0.7589000     -0.2865000     0.9926000 
1 1 1 18 35 7  o 1.681000  0.4687000     2.020000  0.7294000     1.343000  0.5889000     0.6767000      0.9375000 
1 1 1 18 35 8  o 14.15000  0.1787000     14.14000  0.2528000     14.16000  0.2527000     -0.2053000E-01 0.3575000 
1 1 1 18 35 9  o 4.339000  0.2935000     4.196000  0.4259000     4.482000  0.4041000     -0.2858000     0.5871000 
1 1 1 18 35 10 o 1.572000  0.4207000     2.130000  0.6800000     1.015000  0.4953000     1.116000       0.8413000 
1 1 1 18 35 11 o 3.330000  0.4015000     2.916000  0.6321000     3.745000  0.4950000     -0.8291000     0.8029000 
1 1 1 18 35 12 o 5.021000  0.2784000     5.212000  0.3734000     4.830000  0.4130000     0.3815000      0.5568000 
1 1 1 18 35 13 o 5.164000  0.3372000     5.728000  0.5133000     4.599000  0.4374000     1.129000       0.6744000 
1 1 1 18 35 14 o 1.921000  0.4907000     2.141000  0.7100000     1.701000  0.6776000     0.4399000      0.9814000 
1 1 1 18 35 15 o 1.480000  0.4711000     1.404000  0.6142000     1.557000  0.7145000     -0.1536000     0.9422000 
1 1 1 18 35 16 o 1.405000  0.4298000     1.520000  0.6342000     1.290000  0.5802000     0.2301000      0.8595000 
1 1 1 18 35 17 o 2.753000  0.4274000     2.891000  0.5930000     2.615000  0.6155000     0.2764000      0.8547000 
1 1 1 18 35 18 o 1.995000  0.4757000     1.877000  0.7302000     2.113000  0.6098000     -0.2359000     0.9514000 
1 1 1 18 35 19 o 1.478000  0.4546000     1.312000  0.6001000     1.644000  0.6830000     -0.3320000     0.9092000 
1 1 1 18 35 20 o 1.316000  0.4206000     1.072000  0.5198000     1.560000  0.6613000     -0.4876000     0.8412000 
1 1 1 18 36 0  o 3.126000  0.5010000     3.126000  0.5010000     3.126000  0.5010000     0.000000       0.000000  
1 1 1 18 36 1  o 9.688000  0.1820000     9.739000  0.2787000     9.637000  0.2343000     0.1018000      0.3640000 
1 1 1 18 36 2  o 9.211000  0.2114000     9.184000  0.3455000     9.237000  0.2438000     -0.5270000E-01 0.4228000 
1 1 1 18 36 3  o 4.368000  0.3242000     3.992000  0.4358000     4.744000  0.4803000     -0.7518000     0.6485000 
1 1 1 18 36 4  o 9.731000  0.2784000     9.340000  0.2472000     10.12000  0.4989000     -0.7832000     0.5568000 
1 1 1 18 36 5  o 11.10000  0.1988000     11.37000  0.2714000     10.83000  0.2906000     0.5395000      0.3976000 
1 1 1 18 36 6  o 6.281000  0.2365000     6.303000  0.3632000     6.258000  0.3029000     0.4476000E-01  0.4730000 
1 1 1 18 36 7  o 7.348000  0.1986000     7.479000  0.2774000     7.217000  0.2843000     0.2615000      0.3972000 
1 1 1 18 36 8  o 1.802000  0.4694000     1.787000  0.6644000     1.817000  0.6632000     -0.2959000E-01 0.9388000 
1 1 1 18 36 9  o 5.164000  0.2588000     5.398000  0.3516000     4.931000  0.3799000     0.4662000      0.5176000 
1 1 1 18 36 10 o 4.452000  0.3015000     4.815000  0.3993000     4.088000  0.4518000     0.7269000      0.6029000 
1 1 1 18 36 11 f 8.623000  0.1989000     8.776000  0.2788000     8.470000  0.2838000     0.3055000      0.3978000 
1 1 1 18 36 12 o 3.795000  0.3766000     4.705000  0.4024000     2.885000  0.6368000     1.819000       0.7533000 
1 1 1 18 36 13 o 4.192000  0.4260000     4.779000  0.4509000     3.605000  0.7228000     1.173000       0.8519000 
1 1 1 18 36 14 o 5.230000  0.2714000     5.154000  0.3845000     5.306000  0.3831000     -0.1512000     0.5428000 
1 1 1 18 36 15 o 1.572000  0.4680000     1.320000  0.6219000     1.823000  0.6995000     -0.5031000     0.9360000 
1 1 1 18 36 16 o 2.350000  0.4594000     2.670000  0.6124000     2.030000  0.6850000     0.6403000      0.9188000 
1 1 1 18 36 17 o 1.659000  0.4487000     1.925000  0.6691000     1.393000  0.5978000     0.5318000      0.8973000 
1 1 1 18 36 18 o 1.764000  0.4731000     1.688000  0.7041000     1.841000  0.6322000     -0.1532000     0.9462000 
1 1 1 18 36 19 o 2.030000  0.4908000     2.686000  0.7164000     1.375000  0.6712000     1.311000       0.9817000 
1 1 1 18 36 20 o 1.550000  0.4663000     1.404000  0.6197000     1.696000  0.6970000     -0.2911000     0.9327000 
1 1 1 18 37 0  o 20.57000  0.5699000     20.57000  0.5699000     20.57000  0.5699000     -0.000000      0.000000  
1 1 1 18 37 1  o 4.385000  0.4972000     4.385000  0.4972000     ?         ?             ?              ?         
1 1 1 18 37 2  o 9.749000  0.2745000     9.749000  0.2745000     ?         ?             ?              ?         
1 1 1 18 37 3  o 8.816000  0.2460000     9.116000  0.3368000     8.516000  0.3587000     0.6000000      0.4920000 
1 1 1 18 37 4  o 5.834000  0.2627000     6.124000  0.4090000     5.545000  0.3299000     0.5789000      0.5255000 
1 1 1 18 37 5  o 5.094000  0.2649000     4.863000  0.4170000     5.325000  0.3270000     -0.4628000     0.5299000 
1 1 1 18 37 6  o 6.376000  0.2173000     6.083000  0.3193000     6.670000  0.2947000     -0.5871000     0.4345000 
1 1 1 18 37 7  o 5.959000  0.2306000     5.827000  0.3288000     6.092000  0.3234000     -0.2647000     0.4612000 
1 1 1 18 37 8  o 1.698000  0.4680000     1.713000  0.6567000     1.683000  0.6669000     0.2976000E-01  0.9360000 
1 1 1 18 37 9  o 2.568000  0.4545000     2.335000  0.6710000     2.801000  0.6133000     -0.4663000     0.9090000 
1 1 1 18 37 10 o 7.707000  0.2067000     7.785000  0.2942000     7.629000  0.2903000     0.1560000      0.4133000 
1 1 1 18 37 11 o 2.243000  0.4893000     2.004000  0.7083000     2.482000  0.6752000     -0.4778000     0.9785000 
1 1 1 18 37 12 o 3.727000  0.4565000     3.495000  0.7674000     3.958000  0.4946000     -0.4632000     0.9129000 
1 1 1 18 37 13 o 3.630000  0.3700000     3.869000  0.4923000     3.391000  0.5525000     0.4782000      0.7400000 
1 1 1 18 37 14 o 2.169000  0.5439000     2.267000  0.7142000     2.070000  0.8206000     0.1961000      1.088000  
1 1 1 18 37 15 f 1.439000  0.4376000     1.465000  0.6232000     1.412000  0.6146000     0.5346000E-01  0.8752000 
1 1 1 18 37 16 o 1.891000  0.4749000     1.992000  0.6722000     1.789000  0.6710000     0.2025000      0.9498000 
1 1 1 18 37 17 o 2.580000  0.4367000     3.089000  0.5852000     2.071000  0.6483000     1.018000       0.8733000 
1 1 1 18 37 18 o 2.756000  0.4240000     3.049000  0.5671000     2.464000  0.6303000     0.5850000      0.8479000 
1 1 1 18 37 19 o 1.072000  0.3713000     1.179000  0.5689000     0.9649000 0.4773000     0.2138000      0.7426000 
1 1 1 18 38 0  o 5.887000  0.3459000     5.887000  0.3459000     5.887000  0.3459000     0.000000       0.000000  
1 1 1 18 38 1  o 3.374000  0.3875000     3.915000  0.4762000     2.833000  0.6114000     1.081000       0.7750000 
1 1 1 18 38 2  o 10.79000  0.1842000     10.50000  0.2802000     11.09000  0.2393000     -0.5971000     0.3685000 
1 1 1 18 38 3  o 4.363000  0.2877000     4.604000  0.4272000     4.122000  0.3855000     0.4813000      0.5755000 
1 1 1 18 38 4  o 4.107000  0.2924000     4.408000  0.3780000     3.806000  0.4463000     0.6022000      0.5849000 
1 1 1 18 38 5  o 7.994000  0.1903000     8.094000  0.2662000     7.894000  0.2722000     0.1998000      0.3807000 
1 1 1 18 38 6  o 8.909000  0.1874000     8.980000  0.2613000     8.838000  0.2685000     0.1419000      0.3747000 
1 1 1 18 38 7  o 3.741000  0.3314000     3.842000  0.4418000     3.641000  0.4941000     0.2015000      0.6628000 
1 1 1 18 38 8  o 2.431000  0.4618000     2.551000  0.6225000     2.311000  0.6822000     0.2397000      0.9235000 
1 1 1 18 38 9  o 4.285000  0.3044000     4.267000  0.4332000     4.304000  0.4279000     -0.3749000E-01 0.6089000 
1 1 1 18 38 10 o 4.851000  0.2822000     4.623000  0.4188000     5.079000  0.3784000     -0.4561000     0.5644000 
1 1 1 18 38 11 o 4.610000  0.3065000     4.011000  0.4868000     5.210000  0.3727000     -1.199000      0.6131000 
1 1 1 18 38 12 o 6.537000  0.2823000     6.312000  0.3679000     6.762000  0.4283000     -0.4505000     0.5646000 
1 1 1 18 38 13 f 1.341000  0.4222000     1.092000  0.5248000     1.589000  0.6616000     -0.4976000     0.8445000 
1 1 1 18 38 14 o 2.129000  0.5624000     2.212000  0.8081000     2.046000  0.7824000     0.1660000      1.125000  
1 1 1 18 38 15 o 1.662000  0.4581000     2.003000  0.6963000     1.321000  0.5954000     0.6818000      0.9162000 
1 1 1 18 38 16 o 1.665000  0.4597000     1.503000  0.6257000     1.828000  0.6736000     -0.3247000     0.9194000 
1 1 1 18 38 17 o 1.623000  0.4527000     1.681000  0.6513000     1.564000  0.6290000     0.1171000      0.9055000 
1 1 1 18 38 18 o 1.426000  0.4484000     1.586000  0.6887000     1.266000  0.5745000     0.3198000      0.8969000 
1 1 1 18 38 19 o 1.677000  0.4817000     1.799000  0.7342000     1.556000  0.6237000     0.2430000      0.9634000 
1 1 1 18 39 0  o 5.199000  0.3385000     5.199000  0.3385000     5.199000  0.3385000     -0.000000      0.000000  
1 1 1 18 39 1  o 2.235000  0.4520000     2.182000  0.6483000     2.287000  0.6301000     -0.1051000     0.9040000 
1 1 1 18 39 2  o 3.060000  0.3690000     3.108000  0.5152000     3.011000  0.5283000     0.9704000E-01  0.7379000 
1 1 1 18 39 3  o 9.402000  0.1798000     9.444000  0.2515000     9.359000  0.2570000     0.8525000E-01  0.3596000 
1 1 1 18 39 4  o 6.203000  0.2192000     5.960000  0.3114000     6.445000  0.3087000     -0.4847000     0.4385000 
1 1 1 18 39 5  o 5.619000  0.2365000     5.963000  0.3160000     5.276000  0.3519000     0.6868000      0.4729000 
1 1 1 18 39 6  f 10.83000  0.1799000     10.91000  0.2533000     10.76000  0.2554000     0.1426000      0.3597000 
1 1 1 18 39 7  o 3.252000  0.3827000     3.023000  0.5654000     3.482000  0.5161000     -0.4586000     0.7655000 
1 1 1 18 39 8  o 5.569000  0.2494000     5.921000  0.3328000     5.217000  0.3716000     0.7039000      0.4989000 
1 1 1 18 39 9  o 4.051000  0.3353000     3.340000  0.5455000     4.762000  0.3901000     -1.422000      0.6706000 
1 1 1 18 39 10 o 6.115000  0.2422000     6.477000  0.3291000     5.752000  0.3554000     0.7255000      0.4844000 
1 1 1 18 39 11 o 3.156000  0.4878000     2.565000  0.8443000     3.747000  0.4889000     -1.182000      0.9756000 
1 1 1 18 39 12 o 3.311000  0.4012000     3.479000  0.5270000     3.142000  0.6052000     0.3369000      0.8025000 
1 1 1 18 39 13 o 4.266000  0.4524000     4.769000  0.4518000     3.764000  0.7839000     1.005000       0.9048000 
1 1 1 18 39 14 o 1.557000  0.4531000     1.252000  0.5786000     1.861000  0.6975000     -0.6091000     0.9062000 
1 1 1 18 39 15 o 4.137000  0.3190000     4.055000  0.4553000     4.220000  0.4470000     -0.1658000     0.6380000 
1 1 1 18 39 16 o 1.645000  0.4100000     1.052000  0.5033000     2.237000  0.6474000     -1.184000      0.8200000 
1 1 1 18 39 17 o 1.473000  0.4271000     1.185000  0.5513000     1.761000  0.6526000     -0.5760000     0.8542000 
1 1 1 18 39 18 o 1.546000  0.4832000     1.516000  0.6946000     1.577000  0.6720000     -0.6118000E-01 0.9665000 
1 1 1 18 39 19 f 1.517000  0.4605000     1.835000  0.7397000     1.199000  0.5486000     0.6361000      0.9209000 
1 1 1 18 40 0  o 12.93000  0.2473000     12.93000  0.2473000     12.93000  0.2473000     -0.000000      0.000000  
1 1 1 18 40 1  o 11.92000  0.1739000     12.05000  0.2458000     11.78000  0.2461000     0.2710000      0.3478000 
1 1 1 18 40 2  f 3.889000  0.3070000     3.981000  0.4277000     3.796000  0.4405000     0.1848000      0.6140000 
1 1 1 18 40 3  o 3.009000  0.3939000     3.111000  0.5318000     2.908000  0.5813000     0.2036000      0.7879000 
1 1 1 18 40 4  o 4.956000  0.2571000     5.198000  0.3442000     4.715000  0.3819000     0.4826000      0.5141000 
1 1 1 18 40 5  o 10.36000  0.1820000     10.45000  0.2549000     10.26000  0.2600000     0.1918000      0.3641000 
1 1 1 18 40 6  o 6.230000  0.2274000     6.253000  0.3175000     6.206000  0.3256000     0.4686000E-01  0.4548000 
1 1 1 18 40 7  o 11.19000  0.1834000     10.75000  0.2594000     11.63000  0.2592000     -0.8796000     0.3667000 
1 1 1 18 40 8  o 5.244000  0.2615000     5.392000  0.3594000     5.095000  0.3799000     0.2975000      0.5230000 
1 1 1 18 40 9  o 4.596000  0.2929000     4.445000  0.4212000     4.748000  0.4072000     -0.3024000     0.5858000 
1 1 1 18 40 10 o 2.116000  0.5024000     2.083000  0.7098000     2.148000  0.7112000     -0.6460000E-01 1.005000  
1 1 1 18 40 11 o 4.718000  0.3501000     4.396000  0.4585000     5.041000  0.5292000     -0.6442000     0.7002000 
1 1 1 18 40 12 o 7.529000  0.2342000     7.493000  0.3058000     7.566000  0.3547000     -0.7320000E-01 0.4683000 
1 1 1 18 40 13 o 2.517000  0.5401000     2.440000  0.8312000     2.595000  0.6899000     -0.1546000     1.080000  
1 1 1 18 40 14 o 2.496000  0.4668000     2.135000  0.6840000     2.857000  0.6356000     -0.7220000     0.9337000 
1 1 1 18 40 15 o 2.145000  0.4474000     1.595000  0.6470000     2.696000  0.6182000     -1.101000      0.8948000 
1 1 1 18 40 16 o 1.678000  0.4612000     1.602000  0.6489000     1.755000  0.6556000     -0.1528000     0.9224000 
1 1 1 18 40 17 o 1.687000  0.4598000     1.572000  0.6388000     1.801000  0.6616000     -0.2289000     0.9197000 
1 1 1 18 40 18 o 1.492000  0.4539000     1.680000  0.6673000     1.304000  0.6154000     0.3761000      0.9078000 
1 1 1 18 41 0  o 5.745000  0.3330000     5.745000  0.3330000     5.745000  0.3330000     -0.000000      0.000000  
1 1 1 18 41 1  o 2.503000  0.4200000     3.246000  0.5160000     1.760000  0.6629000     1.486000       0.8400000 
1 1 1 18 41 2  o 10.29000  0.1799000     10.21000  0.2524000     10.38000  0.2565000     -0.1634000     0.3598000 
1 1 1 18 41 3  o 4.301000  0.2893000     3.959000  0.4304000     4.644000  0.3868000     -0.6856000     0.5787000 
1 1 1 18 41 4  o 3.000000  0.3932000     3.038000  0.5421000     2.963000  0.5697000     0.7554000E-01  0.7864000 
1 1 1 18 41 5  o 6.533000  0.2198000     6.905000  0.2971000     6.161000  0.3241000     0.7434000      0.4397000 
1 1 1 18 41 6  o 5.094000  0.2643000     4.850000  0.3940000     5.338000  0.3524000     -0.4881000     0.5285000 
1 1 1 18 41 7  o 3.405000  0.3884000     3.158000  0.5879000     3.652000  0.5077000     -0.4944000     0.7768000 
1 1 1 18 41 8  o 3.520000  0.3864000     4.061000  0.4647000     2.979000  0.6175000     1.083000       0.7728000 
1 1 1 18 41 9  f 5.059000  0.2790000     5.261000  0.3840000     4.856000  0.4048000     0.4049000      0.5580000 
1 1 1 18 41 10 o 4.014000  0.4615000     4.206000  0.6877000     3.822000  0.6155000     0.3839000      0.9230000 
1 1 1 18 41 11 o 5.370000  0.2777000     5.669000  0.3659000     5.071000  0.4177000     0.5974000      0.5553000 
1 1 1 18 41 12 o 1.420000  0.4647000     1.378000  0.6200000     1.462000  0.6924000     -0.8414000E-01 0.9294000 
1 1 1 18 41 13 o 3.146000  0.4247000     3.101000  0.5903000     3.192000  0.6107000     -0.9133000E-01 0.8494000 
1 1 1 18 41 14 o 1.196000  0.3904000     1.340000  0.5933000     1.051000  0.5077000     0.2884000      0.7809000 
1 1 1 18 41 15 o 1.169000  0.3855000     1.187000  0.5497000     1.152000  0.5405000     0.3517000E-01  0.7709000 
1 1 1 18 41 16 o 1.380000  0.4277000     1.353000  0.6030000     1.407000  0.6069000     -0.5387000E-01 0.8555000 
1 1 1 18 41 17 o 1.581000  0.4843000     2.127000  0.8277000     1.034000  0.5029000     1.093000       0.9685000 
1 1 1 18 41 18 o 1.289000  0.4127000     1.414000  0.6167000     1.165000  0.5486000     0.2487000      0.8254000 
1 1 1 18 42 0  o 10.22000  0.2544000     10.22000  0.2544000     10.22000  0.2544000     0.000000       0.000000  
1 1 1 18 42 1  o 6.488000  0.2184000     6.702000  0.3036000     6.275000  0.3142000     0.4275000      0.4369000 
1 1 1 18 42 2  o 1.839000  0.4729000     1.845000  0.6630000     1.833000  0.6745000     0.1108000E-01  0.9458000 
1 1 1 18 42 3  o 1.693000  0.4658000     1.690000  0.6619000     1.696000  0.6554000     -0.5955000E-02 0.9315000 
1 1 1 18 42 4  o 2.750000  0.4098000     1.853000  0.6635000     3.647000  0.4810000     -1.795000      0.8196000 
1 1 1 18 42 5  o 6.043000  0.2327000     6.222000  0.3189000     5.864000  0.3389000     0.3579000      0.4653000 
1 1 1 18 42 6  o 6.593000  0.2240000     6.549000  0.3176000     6.638000  0.3161000     -0.8911000E-01 0.4481000 
1 1 1 18 42 7  o 2.054000  0.4891000     1.888000  0.6940000     2.221000  0.6892000     -0.3327000     0.9781000 
1 1 1 18 42 8  o 3.470000  0.4063000     4.495000  0.4276000     2.445000  0.6909000     2.050000       0.8125000 
1 1 1 18 42 9  o 5.917000  0.3188000     5.692000  0.5380000     6.141000  0.3421000     -0.4484000     0.6376000 
1 1 1 18 42 10 o 4.062000  0.3572000     4.432000  0.4194000     3.692000  0.5785000     0.7406000      0.7145000 
1 1 1 18 42 11 o 1.781000  0.5151000     1.851000  0.6905000     1.711000  0.7646000     0.1405000      1.030000  
1 1 1 18 42 12 o 2.596000  0.5001000     2.275000  0.7811000     2.917000  0.6246000     -0.6427000     1.000000  
1 1 1 18 42 13 o 2.125000  0.4911000     1.938000  0.6963000     2.312000  0.6928000     -0.3740000     0.9822000 
1 1 1 18 42 14 o 2.690000  0.4390000     3.087000  0.5692000     2.293000  0.6685000     0.7933000      0.8780000 
1 1 1 18 42 15 o 3.077000  0.4098000     3.216000  0.5580000     2.937000  0.6002000     0.2791000      0.8195000 
1 1 1 18 42 16 o 1.953000  0.4782000     1.689000  0.6713000     2.218000  0.6813000     -0.5292000     0.9565000 
1 1 1 18 42 17 o 1.877000  0.4900000     1.156000  0.5492000     2.598000  0.8117000     -1.442000      0.9800000 
1 1 1 18 42 18 o 1.723000  0.5660000     1.515000  0.7256000     1.931000  0.8689000     -0.4168000     1.132000  
1 1 1 18 43 0  o 1.289000  0.7545000     1.289000  0.7545000     1.289000  0.7545000     0.000000       0.000000  
1 1 1 18 43 1  o 11.58000  0.1802000     11.45000  0.2546000     11.72000  0.2552000     -0.2662000     0.3605000 
1 1 1 18 43 2  o 3.442000  0.3657000     3.376000  0.5086000     3.508000  0.5257000     -0.1319000     0.7315000 
1 1 1 18 43 3  o 5.510000  0.2428000     5.647000  0.3385000     5.372000  0.3483000     0.2751000      0.4857000 
1 1 1 18 43 4  o 1.444000  0.4342000     1.323000  0.5877000     1.565000  0.6394000     -0.2428000     0.8685000 
1 1 1 18 43 5  o 9.608000  0.1889000     9.744000  0.2641000     9.471000  0.2703000     0.2726000      0.3779000 
1 1 1 18 43 6  o 6.932000  0.2353000     6.955000  0.3521000     6.910000  0.3121000     0.4523000E-01  0.4705000 
1 1 1 18 43 7  o 2.553000  0.4653000     2.185000  0.7137000     2.921000  0.5973000     -0.7355000     0.9306000 
1 1 1 18 43 8  o 5.306000  0.3017000     5.766000  0.4384000     4.845000  0.4145000     0.9215000      0.6033000 
1 1 1 18 43 9  o 4.248000  0.3982000     4.365000  0.4963000     4.130000  0.6228000     0.2346000      0.7963000 
1 1 1 18 43 10 o 1.839000  0.4538000     2.436000  0.6923000     1.243000  0.5868000     1.193000       0.9075000 
1 1 1 18 43 11 o 7.313000  0.2934000     7.527000  0.4289000     7.098000  0.4006000     0.4296000      0.5869000 
1 1 1 18 43 12 o 1.497000  0.4543000     1.548000  0.6498000     1.445000  0.6350000     0.1023000      0.9085000 
1 1 1 18 43 13 o 2.949000  0.4069000     4.028000  0.4642000     1.869000  0.6684000     2.159000       0.8138000 
1 1 1 18 43 14 o 1.582000  0.4568000     1.594000  0.6474000     1.570000  0.6445000     0.2369000E-01  0.9135000 
1 1 1 18 43 15 o 2.074000  0.4515000     2.597000  0.6452000     1.551000  0.6317000     1.046000       0.9029000 
1 1 1 18 43 16 o 1.475000  0.4568000     1.828000  0.7391000     1.122000  0.5370000     0.7068000      0.9136000 
1 1 1 18 43 17 o 1.612000  0.4565000     1.936000  0.6887000     1.289000  0.5993000     0.6477000      0.9130000 
1 1 1 18 44 0  o 1.916000  0.8251000     1.916000  0.8251000     1.916000  0.8251000     -0.000000      0.000000  
1 1 1 18 44 1  o 5.072000  0.2664000     5.272000  0.3614000     4.872000  0.3917000     0.3994000      0.5329000 
1 1 1 18 44 2  o 3.294000  0.3901000     3.210000  0.5548000     3.379000  0.5486000     -0.1687000     0.7802000 
1 1 1 18 44 3  o 4.097000  0.3129000     3.982000  0.4423000     4.213000  0.4426000     -0.2307000     0.6257000 
1 1 1 18 44 4  o 6.364000  0.2277000     6.495000  0.3162000     6.233000  0.3279000     0.2621000      0.4555000 
1 1 1 18 44 5  o 9.153000  0.1972000     9.506000  0.2737000     8.801000  0.2841000     0.7051000      0.3945000 
1 1 1 18 44 6  f 6.250000  0.2364000     6.340000  0.3232000     6.160000  0.3451000     0.1797000      0.4728000 
1 1 1 18 44 7  o 7.417000  0.2423000     7.739000  0.3645000     7.095000  0.3193000     0.6442000      0.4846000 
1 1 1 18 44 8  o 2.839000  0.5215000     3.124000  0.6573000     2.553000  0.8098000     0.5706000      1.043000  
1 1 1 18 44 9  o 5.918000  0.2709000     5.813000  0.3562000     6.023000  0.4082000     -0.2104000     0.5418000 
1 1 1 18 44 10 o 7.013000  0.2972000     7.060000  0.4406000     6.965000  0.3990000     0.9550000E-01  0.5944000 
1 1 1 18 44 11 o 1.553000  0.4582000     1.784000  0.6924000     1.323000  0.6003000     0.4604000      0.9164000 
1 1 1 18 44 12 o 2.410000  0.4712000     2.243000  0.6756000     2.577000  0.6570000     -0.3345000     0.9424000 
1 1 1 18 44 13 o 1.849000  0.4574000     1.601000  0.6457000     2.097000  0.6481000     -0.4966000     0.9149000 
1 1 1 18 44 14 o 3.380000  0.3791000     3.770000  0.5082000     2.991000  0.5626000     0.7792000      0.7581000 
1 1 1 18 44 15 o 1.288000  0.4080000     1.465000  0.6235000     1.111000  0.5265000     0.3538000      0.8160000 
1 1 1 18 44 16 o 1.504000  0.4780000     1.865000  0.7799000     1.143000  0.5528000     0.7220000      0.9559000 
1 1 1 18 44 17 o 1.298000  0.4075000     1.569000  0.6452000     1.027000  0.4981000     0.5423000      0.8151000 
1 1 1 18 45 0  o 2.551000  0.7665000     2.551000  0.7665000     2.551000  0.7665000     0.000000       0.000000  
1 1 1 18 45 1  o 2.018000  0.4793000     2.228000  0.6777000     1.808000  0.6781000     0.4202000      0.9587000 
1 1 1 18 45 2  o 2.189000  0.4873000     2.050000  0.6872000     2.329000  0.6910000     -0.2797000     0.9745000 
1 1 1 18 45 3  o 5.631000  0.2477000     5.587000  0.3526000     5.675000  0.3479000     -0.8815000E-01 0.4954000 
1 1 1 18 45 4  o 11.43000  0.1891000     11.34000  0.2682000     11.51000  0.2667000     -0.1685000     0.3782000 
1 1 1 18 45 5  o 5.743000  0.2549000     5.617000  0.3624000     5.870000  0.3586000     -0.2532000     0.5098000 
1 1 1 18 45 6  o 2.208000  0.5073000     2.601000  0.7412000     1.815000  0.6929000     0.7866000      1.015000  
1 1 1 18 45 7  o 1.783000  0.5096000     1.763000  0.7090000     1.802000  0.7321000     -0.3903000E-01 1.019000  
1 1 1 18 45 8  o 9.569000  0.2392000     9.575000  0.2875000     9.563000  0.3825000     0.1173000E-01  0.4785000 
1 1 1 18 45 9  o 3.917000  0.4196000     4.393000  0.4889000     3.442000  0.6820000     0.9511000      0.8392000 
1 1 1 18 45 10 o 2.763000  0.4966000     2.609000  0.7680000     2.918000  0.6298000     -0.3088000     0.9932000 
1 1 1 18 45 11 o 6.562000  0.2382000     6.956000  0.3242000     6.168000  0.3491000     0.7880000      0.4764000 
1 1 1 18 45 12 o 3.640000  0.3502000     3.692000  0.4981000     3.587000  0.4924000     0.1057000      0.7004000 
1 1 1 18 45 13 o 1.598000  0.4437000     1.192000  0.5559000     2.003000  0.6919000     -0.8109000     0.8875000 
1 1 1 18 45 14 o 1.314000  0.4082000     1.563000  0.6364000     1.065000  0.5113000     0.4979000      0.8164000 
1 1 1 18 45 15 o 1.404000  0.4315000     1.410000  0.6110000     1.397000  0.6096000     0.1263000E-01  0.8631000 
1 1 1 18 45 16 o 1.131000  0.3849000     1.156000  0.5461000     1.106000  0.5426000     0.5009000E-01  0.7698000 
1 1 1 18 46 0  o 1.925000  0.8418000     1.925000  0.8418000     1.925000  0.8418000     0.000000       0.000000  
1 1 1 18 46 1  o 6.213000  0.2388000     5.791000  0.3448000     6.635000  0.3305000     -0.8441000     0.4777000 
1 1 1 18 46 2  o 2.395000  0.4866000     2.136000  0.7071000     2.654000  0.6686000     -0.5183000     0.9731000 
1 1 1 18 46 3  o 2.699000  0.4561000     2.826000  0.6229000     2.572000  0.6665000     0.2539000      0.9123000 
1 1 1 18 46 4  o 2.030000  0.4867000     2.285000  0.6951000     1.775000  0.6814000     0.5105000      0.9734000 
1 1 1 18 46 5  o 2.998000  0.4616000     2.615000  0.7327000     3.381000  0.5617000     -0.7659000     0.9232000 
1 1 1 18 46 6  o 1.553000  0.4775000     1.388000  0.6320000     1.718000  0.7161000     -0.3300000     0.9551000 
1 1 1 18 46 7  o 2.743000  0.5091000     3.258000  0.5988000     2.227000  0.8236000     1.031000       1.018000  
1 1 1 18 46 8  f 4.649000  0.3541000     4.724000  0.4623000     4.574000  0.5365000     0.1495000      0.7082000 
1 1 1 18 46 9  o 5.313000  0.3025000     5.146000  0.4769000     5.479000  0.3722000     -0.3332000     0.6049000 
1 1 1 18 46 10 o 4.403000  0.3208000     3.885000  0.4998000     4.921000  0.4023000     -1.036000      0.6416000 
1 1 1 18 46 11 o 3.177000  0.4028000     3.071000  0.5745000     3.283000  0.5648000     -0.2120000     0.8056000 
1 1 1 18 46 12 o 3.481000  0.3701000     3.819000  0.4736000     3.143000  0.5688000     0.6757000      0.7402000 
1 1 1 18 46 13 o 1.425000  0.4326000     1.578000  0.6448000     1.271000  0.5769000     0.3067000      0.8653000 
1 1 1 18 46 14 o 2.817000  0.4444000     2.268000  0.6866000     3.366000  0.5644000     -1.098000      0.8888000 
1 1 1 18 46 15 o 1.763000  0.5252000     1.937000  0.7917000     1.589000  0.6901000     0.3478000      1.050000  
1 1 1 18 46 16 o 1.367000  0.4304000     1.377000  0.6112000     1.357000  0.6060000     0.1991000E-01  0.8607000 
1 1 1 18 47 0  o 1.613000  0.8311000     1.613000  0.8311000     1.613000  0.8311000     0.000000       0.000000  
1 1 1 18 47 1  o 4.192000  0.3182000     3.945000  0.4682000     4.439000  0.4310000     -0.4949000     0.6363000 
1 1 1 18 47 2  o 4.620000  0.2913000     4.622000  0.4123000     4.617000  0.4116000     0.5195000E-02  0.5825000 
1 1 1 18 47 3  o 3.412000  0.4362000     3.043000  0.7175000     3.781000  0.4963000     -0.7384000     0.8724000 
1 1 1 18 47 4  o 2.948000  0.5007000     2.355000  0.8436000     3.540000  0.5398000     -1.186000      1.001000  
1 1 1 18 47 5  o 1.910000  0.5676000     1.736000  0.7075000     2.085000  0.8878000     -0.3487000     1.135000  
1 1 1 18 47 6  o 2.759000  0.5981000     3.019000  0.6793000     2.499000  0.9846000     0.5197000      1.196000  
1 1 1 18 47 7  o 3.025000  0.5439000     2.740000  0.8339000     3.310000  0.6984000     -0.5698000     1.088000  
1 1 1 18 47 8  o 3.857000  0.4122000     3.265000  0.6998000     4.449000  0.4359000     -1.184000      0.8244000 
1 1 1 18 47 9  o 3.193000  0.4191000     3.636000  0.5252000     2.751000  0.6533000     0.8849000      0.8382000 
1 1 1 18 47 10 o 3.782000  0.3439000     3.618000  0.5011000     3.946000  0.4712000     -0.3277000     0.6878000 
1 1 1 18 47 11 o 1.281000  0.3993000     1.578000  0.6370000     0.9838000 0.4816000     0.5945000      0.7986000 
1 1 1 18 47 12 o 2.925000  0.4181000     3.064000  0.5709000     2.787000  0.6111000     0.2777000      0.8363000 
1 1 1 18 47 13 o 0.9212000 0.3234000     0.9798000 0.4811000     0.8627000 0.4324000     0.1170000      0.6469000 
1 1 1 18 47 14 o 1.816000  0.4850000     1.962000  0.7003000     1.669000  0.6713000     0.2939000      0.9701000 
1 1 1 18 47 15 o 3.847000  0.4581000     4.983000  0.4172000     2.712000  0.8158000     2.271000       0.9163000 
1 1 1 18 48 0  o 3.618000  0.6544000     3.618000  0.6544000     3.618000  0.6544000     -0.000000      0.000000  
1 1 1 18 48 1  o 5.100000  0.3356000     4.745000  0.4995000     5.455000  0.4482000     -0.7109000     0.6712000 
1 1 1 18 48 2  o 5.386000  0.3928000     5.117000  0.5920000     5.654000  0.5163000     -0.5367000     0.7855000 
1 1 1 18 48 3  o 2.114000  0.5607000     2.235000  0.7602000     1.993000  0.8245000     0.2421000      1.121000  
1 1 1 18 48 4  f 1.890000  0.7343000     1.890000  0.7343000     ?         ?             ?              ?         
1 1 1 18 48 5  o 2.506000  0.5392000     2.569000  0.7324000     2.444000  0.7916000     0.1252000      1.078000  
1 1 1 18 48 6  o 2.963000  0.4849000     3.180000  0.7015000     2.747000  0.6696000     0.4330000      0.9698000 
1 1 1 18 48 7  o 1.156000  0.3865000     1.107000  0.5308000     1.205000  0.5620000     -0.9800000E-01 0.7730000 
1 1 1 18 48 8  o 1.699000  0.4835000     1.650000  0.6805000     1.748000  0.6871000     -0.9807000E-01 0.9670000 
1 1 1 18 48 9  o 1.303000  0.4177000     1.403000  0.6177000     1.202000  0.5625000     0.2014000      0.8354000 
1 1 1 18 48 10 o 1.918000  0.4886000     1.896000  0.6881000     1.940000  0.6939000     -0.4457000E-01 0.9773000 
1 1 1 18 48 11 o 1.844000  0.4759000     2.117000  0.7011000     1.571000  0.6437000     0.5454000      0.9518000 
1 1 1 18 48 12 f 1.077000  0.3649000     1.073000  0.5162000     1.081000  0.5160000     -0.7811000E-02 0.7299000 
1 1 1 18 48 13 o 1.741000  0.4722000     1.436000  0.6212000     2.046000  0.7113000     -0.6101000     0.9444000 
1 1 1 18 48 14 o 2.350000  0.5804000     2.480000  0.8855000     2.221000  0.7505000     0.2595000      1.161000  
1 1 1 18 48 15 o 1.847000  0.4864000     1.979000  0.6967000     1.715000  0.6788000     0.2643000      0.9727000 
1 1 1 18 49 0  o 1.415000  0.9405000     1.415000  0.9405000     1.415000  0.9405000     -0.000000      0.000000  
1 1 1 18 49 1  o 1.722000  0.5253000     2.086000  0.8105000     1.358000  0.6683000     0.7278000      1.051000  
1 1 1 18 49 2  o 2.936000  0.5806000     3.331000  0.7773000     2.541000  0.8627000     0.7906000      1.161000  
1 1 1 18 49 3  f 3.467000  0.5197000     2.547000  0.8074000     4.388000  0.6545000     -1.841000      1.039000  
1 1 1 18 49 4  o 2.315000  0.4923000     1.848000  0.7365000     2.781000  0.6534000     -0.9323000     0.9846000 
1 1 1 18 49 5  o 2.418000  0.5111000     2.369000  0.7545000     2.466000  0.6898000     -0.9659000E-01 1.022000  
1 1 1 18 49 6  o 1.223000  0.3973000     1.014000  0.4932000     1.432000  0.6231000     -0.4180000     0.7947000 
1 1 1 18 49 7  o 2.628000  0.4621000     2.058000  0.7117000     3.198000  0.5896000     -1.141000      0.9242000 
1 1 1 18 49 8  o 3.755000  0.3630000     4.277000  0.4448000     3.232000  0.5737000     1.045000       0.7259000 
1 1 1 18 49 9  o 2.501000  0.4824000     2.454000  0.6930000     2.549000  0.6711000     -0.9524000E-01 0.9647000 
1 1 1 18 49 10 o 4.084000  0.3262000     4.025000  0.4736000     4.144000  0.4488000     -0.1187000     0.6524000 
1 1 1 18 49 11 o 1.759000  0.4469000     1.280000  0.5873000     2.238000  0.6738000     -0.9574000     0.8938000 
1 1 1 18 49 12 o 2.407000  0.4796000     2.688000  0.6612000     2.125000  0.6948000     0.5631000      0.9592000 
1 1 1 18 49 13 o 2.863000  0.4870000     2.358000  0.8047000     3.367000  0.5486000     -1.009000      0.9739000 
1 1 1 18 49 14 o 1.625000  0.4760000     1.801000  0.6942000     1.448000  0.6515000     0.3528000      0.9520000 
1 1 1 18 50 0  f 3.915000  0.5199000     3.915000  0.5199000     3.915000  0.5199000     -0.000000      0.000000  
1 1 1 18 50 1  o 3.757000  0.3829000     3.858000  0.5677000     3.656000  0.5141000     0.2018000      0.7659000 
1 1 1 18 50 2  o 1.923000  0.4872000     1.737000  0.6783000     2.110000  0.6996000     -0.3724000     0.9744000 
1 1 1 18 50 3  o 5.094000  0.2790000     5.175000  0.3895000     5.012000  0.3995000     0.1633000      0.5579000 
1 1 1 18 50 4  o 5.950000  0.2508000     5.915000  0.3491000     5.985000  0.3602000     -0.6991000E-01 0.5016000 
1 1 1 18 50 5  o 1.975000  0.4877000     1.803000  0.6836000     2.147000  0.6958000     -0.3433000     0.9754000 
1 1 1 18 50 6  o 2.168000  0.4844000     1.853000  0.6840000     2.483000  0.6862000     -0.6299000     0.9689000 
1 1 1 18 50 7  o 1.873000  0.4928000     1.760000  0.6887000     1.985000  0.7050000     -0.2249000     0.9856000 
1 1 1 18 50 8  o 1.950000  0.4778000     1.704000  0.6757000     2.196000  0.6758000     -0.4921000     0.9556000 
1 1 1 18 50 9  o 4.223000  0.3203000     3.808000  0.4866000     4.638000  0.4165000     -0.8294000     0.6405000 
1 1 1 18 50 10 o 1.909000  0.4604000     1.449000  0.6300000     2.370000  0.6715000     -0.9218000     0.9207000 
1 1 1 18 50 11 o 1.407000  0.4346000     1.527000  0.6410000     1.288000  0.5872000     0.2388000      0.8693000 
1 1 1 18 50 12 o 2.250000  0.4901000     2.178000  0.6949000     2.323000  0.6913000     -0.1449000     0.9802000 
1 1 1 18 50 13 o 2.378000  0.5398000     2.639000  0.7341000     2.117000  0.7917000     0.5227000      1.080000  
1 1 1 18 50 14 o 2.751000  0.5692000     3.317000  0.7219000     2.186000  0.8803000     1.131000       1.138000  
1 1 1 18 51 0  o 2.736000  0.7734000     2.736000  0.7734000     2.736000  0.7734000     0.000000       0.000000  
1 1 1 18 51 1  o 1.998000  0.4591000     1.390000  0.6172000     2.606000  0.6800000     -1.215000      0.9183000 
1 1 1 18 51 2  o 1.186000  0.3950000     1.110000  0.5312000     1.263000  0.5849000     -0.1527000     0.7901000 
1 1 1 18 51 3  f 2.426000  0.4674000     2.921000  0.6233000     1.930000  0.6968000     0.9904000      0.9349000 
1 1 1 18 51 4  o 2.320000  0.4642000     1.696000  0.6761000     2.944000  0.6364000     -1.248000      0.9285000 
1 1 1 18 51 5  o 1.680000  0.4537000     2.099000  0.6994000     1.261000  0.5781000     0.8380000      0.9074000 
1 1 1 18 51 6  o 2.212000  0.4702000     1.676000  0.6706000     2.747000  0.6592000     -1.072000      0.9403000 
1 1 1 18 51 7  o 1.890000  0.4864000     1.971000  0.6863000     1.810000  0.6893000     0.1606000      0.9727000 
1 1 1 18 51 8  o 1.195000  0.3946000     1.170000  0.5506000     1.220000  0.5655000     -0.5042000E-01 0.7893000 
1 1 1 18 51 9  o 1.314000  0.4195000     1.452000  0.6320000     1.176000  0.5518000     0.2762000      0.8390000 
1 1 1 18 51 10 o 2.421000  0.4681000     1.900000  0.6870000     2.941000  0.6360000     -1.041000      0.9361000 
1 1 1 18 51 11 o 2.102000  0.4902000     2.330000  0.6838000     1.874000  0.7026000     0.4563000      0.9804000 
1 1 1 18 51 12 o 1.606000  0.4915000     1.530000  0.7078000     1.682000  0.6820000     -0.1518000     0.9829000 
1 1 1 18 51 13 o 1.370000  0.4256000     0.9430000 0.4663000     1.798000  0.7120000     -0.8548000     0.8511000 
1 1 1 18 52 0  o 5.410000  0.3861000     5.410000  0.3861000     5.410000  0.3861000     -0.000000      0.000000  
1 1 1 18 52 1  o 2.973000  0.4562000     2.990000  0.6420000     2.956000  0.6484000     0.3470000E-01  0.9125000 
1 1 1 18 52 2  f 4.905000  0.2901000     4.882000  0.4126000     4.929000  0.4078000     -0.4726000E-01 0.5802000 
1 1 1 18 52 3  o 4.455000  0.3098000     4.348000  0.4502000     4.561000  0.4258000     -0.2132000     0.6197000 
1 1 1 18 52 4  o 3.714000  0.3670000     3.566000  0.5380000     3.863000  0.4995000     -0.2974000     0.7341000 
1 1 1 18 52 5  o 2.675000  0.4633000     2.565000  0.6816000     2.785000  0.6277000     -0.2205000     0.9266000 
1 1 1 18 52 6  o 4.234000  0.3379000     4.833000  0.4149000     3.636000  0.5335000     1.197000       0.6759000 
1 1 1 18 52 7  f 1.249000  0.4071000     1.105000  0.5306000     1.393000  0.6176000     -0.2877000     0.8142000 
1 1 1 18 52 8  o 2.390000  0.4935000     2.246000  0.7174000     2.534000  0.6779000     -0.2880000     0.9870000 
1 1 1 18 52 9  o 1.526000  0.4549000     1.459000  0.6274000     1.593000  0.6590000     -0.1343000     0.9099000 
1 1 1 18 52 10 o 2.448000  0.4955000     2.534000  0.6898000     2.362000  0.7116000     0.1721000      0.9910000 
1 1 1 18 52 11 o 2.443000  0.4964000     3.168000  0.7271000     1.718000  0.6758000     1.450000       0.9927000 
1 1 1 18 52 12 o 1.628000  0.4927000     1.278000  0.5890000     1.977000  0.7899000     -0.6987000     0.9854000 
1 1 1 18 53 0  o 3.054000  0.6843000     3.054000  0.6843000     3.054000  0.6843000     0.000000       0.000000  
1 1 1 18 53 1  o 2.932000  0.4569000     2.644000  0.6867000     3.220000  0.6029000     -0.5754000     0.9138000 
1 1 1 18 53 2  o 3.622000  0.3857000     3.595000  0.5358000     3.649000  0.5549000     -0.5311000E-01 0.7714000 
1 1 1 18 53 3  f 3.391000  0.4002000     3.429000  0.5478000     3.354000  0.5835000     0.7495000E-01  0.8004000 
1 1 1 18 53 4  o 1.508000  0.4533000     1.481000  0.6332000     1.535000  0.6487000     -0.5341000E-01 0.9065000 
1 1 1 18 53 5  o 1.867000  0.4867000     1.934000  0.6941000     1.799000  0.6824000     0.1344000      0.9734000 
1 1 1 18 53 6  o 3.007000  0.4369000     3.377000  0.5513000     2.637000  0.6780000     0.7403000      0.8739000 
1 1 1 18 53 7  o 7.941000  0.2242000     7.701000  0.3240000     8.181000  0.3099000     -0.4797000     0.4483000 
1 1 1 18 53 8  o 4.564000  0.3131000     4.439000  0.4513000     4.688000  0.4343000     -0.2498000     0.6263000 
1 1 1 18 53 9  o 2.058000  0.4984000     1.819000  0.6951000     2.297000  0.7144000     -0.4777000     0.9967000 
1 1 1 18 53 10 o 1.208000  0.4068000     1.285000  0.6070000     1.132000  0.5416000     0.1522000      0.8136000 
1 1 1 18 53 11 o 1.467000  0.4708000     1.550000  0.6758000     1.384000  0.6557000     0.1655000      0.9416000 
1 1 1 18 53 12 o 1.462000  0.5120000     1.378000  0.6903000     1.547000  0.7564000     -0.1687000     1.024000  
1 1 1 18 54 0  o 3.933000  0.5246000     3.933000  0.5246000     3.933000  0.5246000     -0.000000      0.000000  
1 1 1 18 54 1  o 3.713000  0.3906000     4.420000  0.4447000     3.005000  0.6421000     1.415000       0.7811000 
1 1 1 18 54 2  o 3.434000  0.4052000     3.649000  0.5344000     3.219000  0.6093000     0.4300000      0.8105000 
1 1 1 18 54 3  o 3.855000  0.3716000     4.334000  0.4528000     3.377000  0.5893000     0.9566000      0.7432000 
1 1 1 18 54 4  f 2.394000  0.5035000     2.296000  0.7147000     2.492000  0.7093000     -0.1959000     1.007000  
1 1 1 18 54 5  o 3.401000  0.4082000     3.852000  0.5139000     2.950000  0.6344000     0.9025000      0.8164000 
1 1 1 18 54 6  o 1.686000  0.4593000     1.273000  0.5854000     2.098000  0.7080000     -0.8248000     0.9187000 
1 1 1 18 54 7  o 4.038000  0.3517000     4.278000  0.4573000     3.799000  0.5344000     0.4792000      0.7034000 
1 1 1 18 54 8  o 1.218000  0.4024000     1.338000  0.6053000     1.097000  0.5306000     0.2412000      0.8049000 
1 1 1 18 54 9  o 2.211000  0.5062000     2.032000  0.7132000     2.390000  0.7185000     -0.3580000     1.012000  
1 1 1 18 54 10 o 2.832000  0.5806000     3.164000  0.8672000     2.500000  0.7722000     0.6648000      1.161000  
1 1 1 18 54 11 o 3.396000  0.4515000     3.558000  0.5578000     3.233000  0.7102000     0.3246000      0.9031000 
1 1 1 18 55 0  o 2.256000  0.8733000     2.256000  0.8733000     2.256000  0.8733000     0.000000       0.000000  
1 1 1 18 55 1  o 4.120000  0.3483000     4.140000  0.4862000     4.101000  0.4988000     0.3964000E-01  0.6965000 
1 1 1 18 55 2  o 1.989000  0.4957000     1.757000  0.6892000     2.221000  0.7126000     -0.4635000     0.9913000 
1 1 1 18 55 3  o 2.217000  0.5033000     2.403000  0.7027000     2.030000  0.7209000     0.3738000      1.007000  
1 1 1 18 55 4  o 1.921000  0.4908000     1.678000  0.6727000     2.164000  0.7149000     -0.4852000     0.9817000 
1 1 1 18 55 5  o 5.094000  0.3125000     5.211000  0.4013000     4.976000  0.4792000     0.2355000      0.6250000 
1 1 1 18 55 6  o 6.148000  0.2585000     5.981000  0.3700000     6.314000  0.3612000     -0.3337000     0.5171000 
1 1 1 18 55 7  o 6.848000  0.2485000     6.929000  0.3493000     6.767000  0.3535000     0.1615000      0.4970000 
1 1 1 18 55 8  o 1.534000  0.4655000     1.575000  0.6686000     1.493000  0.6480000     0.8218000E-01  0.9310000 
1 1 1 18 55 9  o 2.001000  0.5454000     1.677000  0.7652000     2.325000  0.7773000     -0.6485000     1.091000  
1 1 1 18 55 10 o 1.678000  0.5099000     1.416000  0.6341000     1.940000  0.7987000     -0.5234000     1.020000  
1 1 1 18 56 0  o 2.288000  0.8543000     2.288000  0.8543000     2.288000  0.8543000     -0.000000      0.000000  
1 1 1 18 56 1  o 3.947000  0.3668000     4.396000  0.4590000     3.499000  0.5723000     0.8973000      0.7336000 
1 1 1 18 56 2  o 1.114000  0.3778000     1.158000  0.5478000     1.069000  0.5205000     0.8877000E-01  0.7557000 
1 1 1 18 56 3  o 2.152000  0.5101000     2.221000  0.7174000     2.084000  0.7252000     0.1366000      1.020000  
1 1 1 18 56 4  o 4.567000  0.3148000     4.761000  0.4195000     4.373000  0.4695000     0.3881000      0.6296000 
1 1 1 18 56 5  o 3.232000  0.4250000     3.564000  0.5336000     2.900000  0.6618000     0.6647000      0.8501000 
1 1 1 18 56 6  o 1.979000  0.5050000     2.512000  0.7856000     1.445000  0.6347000     1.067000       1.010000  
1 1 1 18 56 7  o 1.361000  0.4410000     1.310000  0.6135000     1.411000  0.6338000     -0.1008000     0.8821000 
1 1 1 18 56 8  o 1.663000  0.5176000     1.579000  0.7344000     1.748000  0.7296000     -0.1692000     1.035000  
1 1 1 18 56 9  f 1.885000  0.5257000     2.024000  0.7267000     1.746000  0.7599000     0.2776000      1.051000  
1 1 1 18 57 0  o 6.059000  0.3778000     6.059000  0.3778000     6.059000  0.3778000     -0.000000      0.000000  
1 1 1 18 57 1  o 5.123000  0.2953000     4.983000  0.4304000     5.264000  0.4043000     -0.2808000     0.5905000 
1 1 1 18 57 2  o 1.779000  0.4919000     1.793000  0.6989000     1.766000  0.6924000     0.2716000E-01  0.9838000 
1 1 1 18 57 3  o 1.392000  0.4392000     1.480000  0.6446000     1.305000  0.5967000     0.1757000      0.8784000 
1 1 1 18 57 4  o 1.781000  0.4560000     1.152000  0.5453000     2.411000  0.7309000     -1.259000      0.9119000 
1 1 1 18 57 5  o 1.451000  0.4493000     1.307000  0.5963000     1.595000  0.6722000     -0.2882000     0.8986000 
1 1 1 18 57 6  o 3.623000  0.4461000     3.460000  0.7081000     3.786000  0.5428000     -0.3264000     0.8922000 
1 1 1 18 57 7  o 1.969000  0.5323000     2.303000  0.7896000     1.636000  0.7142000     0.6673000      1.065000  
1 1 1 18 57 8  o 3.250000  0.5392000     3.372000  0.6333000     3.128000  0.8729000     0.2437000      1.078000  
1 1 1 18 58 0  f 5.938000  0.3800000     5.938000  0.3800000     5.938000  0.3800000     0.000000       0.000000  
1 1 1 18 58 1  o 2.624000  0.4897000     3.021000  0.6566000     2.227000  0.7266000     0.7939000      0.9793000 
1 1 1 18 58 2  o 1.699000  0.4834000     1.764000  0.6924000     1.633000  0.6748000     0.1311000      0.9668000 
1 1 1 18 58 3  o 2.508000  0.4715000     1.812000  0.6996000     3.204000  0.6323000     -1.392000      0.9430000 
1 1 1 18 58 4  o 4.828000  0.3392000     5.106000  0.4986000     4.551000  0.4601000     0.5554000      0.6784000 
1 1 1 18 58 5  o 3.386000  0.5406000     3.263000  0.8854000     3.508000  0.6206000     -0.2447000     1.081000  
1 1 1 18 58 6  o 1.350000  0.4633000     1.232000  0.5885000     1.468000  0.7158000     -0.2362000     0.9266000 
1 1 1 18 59 0  o 6.811000  0.3699000     6.811000  0.3699000     6.811000  0.3699000     -0.000000      0.000000  
1 1 1 18 59 1  o 4.176000  0.4160000     3.674000  0.6958000     4.677000  0.4562000     -1.002000      0.8320000 
1 1 1 18 59 2  o 1.481000  0.4701000     1.611000  0.7075000     1.351000  0.6191000     0.2593000      0.9401000 
1 1 1 18 59 3  o 1.803000  0.5504000     1.580000  0.7244000     2.026000  0.8287000     -0.4466000     1.101000  
1 1 1 18 59 4  o 1.347000  0.4434000     1.566000  0.6861000     1.128000  0.5618000     0.4377000      0.8868000 
1 1 1 18 59 5  o 1.647000  0.5595000     1.121000  0.5482000     2.174000  0.9756000     -1.054000      1.119000  
1 1 1 18 60 0  o 1.930000  1.140000      1.930000  1.140000      1.930000  1.140000      -0.000000      0.000000  
1 1 1 18 60 1  o 1.381000  0.4781000     1.296000  0.6287000     1.467000  0.7205000     -0.1715000     0.9563000 
1 1 1 18 60 2  o 1.881000  0.5967000     1.712000  0.7537000     2.050000  0.9252000     -0.3385000     1.193000  
1 1 1 18 60 3  o 1.003000  0.3659000     0.9972000 0.5126000     1.009000  0.5223000     -0.1185000E-01 0.7318000 
1 1 1 19 0  2  o 8.115000  0.1992000     8.115000  0.1992000     8.115000  0.1992000     -0.000000      0.000000  
1 1 1 19 0  3  o 15.06000  0.1824000     15.06000  0.1824000     15.06000  0.1824000     -0.000000      0.000000  
1 1 1 19 0  4  o 9.099000  0.1721000     9.099000  0.1721000     9.099000  0.1721000     0.000000       0.000000  
1 1 1 19 0  5  o 10.40000  0.1776000     10.40000  0.1776000     10.40000  0.1776000     0.000000       0.000000  
1 1 1 19 0  6  o 15.76000  0.2178000     15.76000  0.2178000     15.76000  0.2178000     0.000000       0.000000  
1 1 1 19 0  7  o 7.306000  0.2288000     7.306000  0.2288000     7.306000  0.2288000     0.000000       0.000000  
1 1 1 19 0  8  o 22.55000  0.2862000     22.55000  0.2862000     22.55000  0.2862000     0.000000       0.000000  
1 1 1 19 0  9  o 8.327000  0.2598000     8.327000  0.2598000     8.327000  0.2598000     0.000000       0.000000  
1 1 1 19 0  10 o 6.986000  0.3071000     6.986000  0.3071000     6.986000  0.3071000     0.000000       0.000000  
1 1 1 19 0  11 o 1.254000  0.7806000     1.254000  0.7806000     1.254000  0.7806000     0.000000       0.000000  
1 1 1 19 0  12 o 11.68000  0.2814000     11.68000  0.2814000     11.68000  0.2814000     0.000000       0.000000  
1 1 1 19 0  13 o 7.348000  0.3732000     7.348000  0.3732000     7.348000  0.3732000     0.000000       0.000000  
1 1 1 19 0  14 o 7.285000  0.4002000     7.285000  0.4002000     7.285000  0.4002000     0.000000       0.000000  
1 1 1 19 0  15 o 6.433000  0.4786000     6.433000  0.4786000     6.433000  0.4786000     0.000000       0.000000  
1 1 1 19 0  16 o 2.234000  1.085000      2.234000  1.085000      2.234000  1.085000      0.000000       0.000000  
1 1 1 19 0  17 o 1.481000  0.9257000     1.481000  0.9257000     1.481000  0.9257000     -0.000000      0.000000  
1 1 1 19 0  18 o 1.120000  0.7651000     1.120000  0.7651000     1.120000  0.7651000     0.000000       0.000000  
1 1 1 19 0  19 o 1.507000  0.9264000     1.507000  0.9264000     1.507000  0.9264000     0.000000       0.000000  
1 1 1 19 0  20 o 2.162000  0.9596000     2.162000  0.9596000     2.162000  0.9596000     0.000000       0.000000  
1 1 1 19 0  21 o 3.125000  0.8033000     3.125000  0.8033000     3.125000  0.8033000     0.000000       0.000000  
1 1 1 19 0  22 o 1.537000  0.8478000     1.537000  0.8478000     1.537000  0.8478000     0.000000       0.000000  
1 1 1 19 0  23 o 0.7501000 0.5396000     0.7501000 0.5396000     0.7501000 0.5396000     0.000000       0.000000  
1 1 1 19 0  24 o 0.7852000 0.5730000     0.7852000 0.5730000     0.7852000 0.5730000     0.000000       0.000000  
1 1 1 19 1  1  o 10.78000  0.1357000     10.97000  0.1889000     10.60000  0.1950000     0.3763000      0.2714000 
1 1 1 19 1  2  o 9.353000  0.1796000     9.175000  0.2899000     9.532000  0.2122000     -0.3569000     0.3593000 
1 1 1 19 1  3  o 5.541000  0.9624000E-01 5.494000  0.1069000     5.589000  0.1600000     -0.9490000E-01 0.1925000 
1 1 1 19 1  4  o 11.66000  0.1415000     11.46000  0.1541000     11.86000  0.2374000     -0.4057000     0.2831000 
1 1 1 19 1  5  o 12.14000  0.1314000     11.88000  0.1867000     12.39000  0.1849000     -0.5122000     0.2627000 
1 1 1 19 1  6  o 13.80000  0.1455000     13.88000  0.2068000     13.73000  0.2048000     0.1486000      0.2910000 
1 1 1 19 1  7  o 6.624000  0.1701000     6.281000  0.2502000     6.966000  0.2306000     -0.6845000     0.3402000 
1 1 1 19 1  8  o 3.552000  0.3184000     3.096000  0.5062000     4.007000  0.3865000     -0.9108000     0.6369000 
1 1 1 19 1  9  o 5.607000  0.2341000     5.744000  0.3171000     5.471000  0.3444000     0.2729000      0.4682000 
1 1 1 19 1  10 o 11.97000  0.1778000     12.06000  0.2495000     11.88000  0.2534000     0.1772000      0.3556000 
1 1 1 19 1  11 o 8.017000  0.2204000     8.195000  0.3042000     7.840000  0.3191000     0.3546000      0.4409000 
1 1 1 19 1  12 o 12.75000  0.1961000     12.99000  0.2749000     12.51000  0.2796000     0.4838000      0.3921000 
1 1 1 19 1  13 o 6.506000  0.2885000     6.726000  0.3910000     6.286000  0.4244000     0.4398000      0.5771000 
1 1 1 19 1  14 o 3.342000  0.5586000     3.392000  0.7764000     3.292000  0.8033000     0.1004000      1.117000  
1 1 1 19 1  15 o 2.504000  0.6068000     2.868000  0.8644000     2.139000  0.8518000     0.7290000      1.214000  
1 1 1 19 1  16 o 2.321000  0.6252000     2.464000  0.8902000     2.179000  0.8781000     0.2855000      1.250000  
1 1 1 19 1  17 o 4.991000  0.4738000     4.041000  0.7694000     5.941000  0.5532000     -1.900000      0.9477000 
1 1 1 19 1  18 o 3.917000  0.5342000     4.256000  0.6967000     3.579000  0.8099000     0.6762000      1.068000  
1 1 1 19 1  19 o 1.881000  0.5597000     2.030000  0.8176000     1.733000  0.7645000     0.2972000      1.119000  
1 1 1 19 1  20 o 2.698000  0.4951000     1.843000  0.7407000     3.553000  0.6571000     -1.710000      0.9902000 
1 1 1 19 1  21 o 1.496000  0.4696000     1.253000  0.5944000     1.738000  0.7272000     -0.4855000     0.9392000 
1 1 1 19 1  22 o 1.416000  0.4513000     1.252000  0.5915000     1.580000  0.6817000     -0.3277000     0.9025000 
1 1 1 19 1  23 o 1.280000  0.4226000     1.423000  0.6409000     1.137000  0.5511000     0.2857000      0.8452000 
1 1 1 19 1  24 o 1.885000  0.5744000     1.742000  0.7785000     2.028000  0.8448000     -0.2861000     1.149000  
1 1 1 19 2  1  o 5.677000  0.1278000     5.700000  0.2200000     5.655000  0.1303000     0.4502000E-01  0.2557000 
1 1 1 19 2  2  o 5.786000  0.1660000     5.820000  0.2930000     5.752000  0.1559000     0.6789000E-01  0.3319000 
1 1 1 19 2  3  o 13.74000  0.1206000     13.73000  0.1672000     13.76000  0.1737000     -0.2850000E-01 0.2411000 
1 1 1 19 2  4  o 5.228000  0.1356000     5.290000  0.1408000     5.165000  0.2318000     0.1245000      0.2712000 
1 1 1 19 2  5  o 23.82000  0.2052000     23.73000  0.2472000     23.91000  0.3277000     -0.1874000     0.4105000 
1 1 1 19 2  6  o 7.068000  0.1607000     6.959000  0.2118000     7.177000  0.2418000     -0.2180000     0.3214000 
1 1 1 19 2  7  o 3.374000  0.2829000     3.206000  0.4232000     3.542000  0.3755000     -0.3355000     0.5657000 
1 1 1 19 2  8  o 4.023000  0.2739000     4.174000  0.3723000     3.872000  0.4018000     0.3025000      0.5477000 
1 1 1 19 2  9  o 15.25000  0.1727000     15.14000  0.2432000     15.37000  0.2452000     -0.2337000     0.3454000 
1 1 1 19 2  10 o 4.388000  0.3037000     4.468000  0.4290000     4.309000  0.4300000     0.1584000      0.6074000 
1 1 1 19 2  11 o 6.778000  0.2415000     6.841000  0.3367000     6.715000  0.3462000     0.1261000      0.4830000 
1 1 1 19 2  12 o 11.11000  0.2012000     11.18000  0.2856000     11.05000  0.2836000     0.1215000      0.4025000 
1 1 1 19 2  13 o 1.692000  0.5025000     1.199000  0.5861000     2.185000  0.8165000     -0.9861000     1.005000  
1 1 1 19 2  14 o 10.94000  0.2281000     10.95000  0.3249000     10.94000  0.3203000     0.1248000E-01  0.4562000 
1 1 1 19 2  15 o 10.82000  0.2464000     10.78000  0.3518000     10.85000  0.3451000     -0.7003000E-01 0.4928000 
1 1 1 19 2  16 o 5.518000  0.4229000     4.627000  0.6760000     6.409000  0.5084000     -1.782000      0.8458000 
1 1 1 19 2  17 o 2.419000  0.6245000     2.760000  0.9107000     2.079000  0.8549000     0.6813000      1.249000  
1 1 1 19 2  18 o 2.702000  0.6088000     3.207000  0.8647000     2.197000  0.8572000     1.010000       1.218000  
1 1 1 19 2  19 o 2.439000  0.6115000     2.236000  0.8476000     2.642000  0.8817000     -0.4067000     1.223000  
1 1 1 19 2  20 o 3.360000  0.4816000     3.144000  0.7195000     3.577000  0.6405000     -0.4331000     0.9633000 
1 1 1 19 2  21 o 1.786000  0.5150000     2.022000  0.7694000     1.550000  0.6847000     0.4724000      1.030000  
1 1 1 19 2  22 o 1.466000  0.4517000     1.815000  0.7206000     1.117000  0.5450000     0.6976000      0.9035000 
1 1 1 19 2  23 o 1.486000  0.4621000     1.253000  0.5915000     1.719000  0.7101000     -0.4658000     0.9241000 
1 1 1 19 2  24 o 1.796000  0.5562000     2.075000  0.8521000     1.517000  0.7152000     0.5576000      1.112000  
1 1 1 19 3  0  o 6.324000  0.2049000     6.324000  0.2049000     6.324000  0.2049000     0.000000       0.000000  
1 1 1 19 3  1  o 8.408000  0.1532000     8.467000  0.2421000     8.350000  0.1879000     0.1173000      0.3065000 
1 1 1 19 3  2  o 3.378000  0.8908000E-01 3.335000  0.1241000     3.420000  0.1278000     -0.8498000E-01 0.1782000 
1 1 1 19 3  3  o 2.933000  0.1200000     2.989000  0.1543000     2.876000  0.1839000     0.1137000      0.2401000 
1 1 1 19 3  4  o 2.353000  0.1924000     2.308000  0.2429000     2.398000  0.2985000     -0.8988000E-01 0.3848000 
1 1 1 19 3  5  o 11.55000  0.1327000     11.48000  0.1552000     11.62000  0.2152000     -0.1411000     0.2653000 
1 1 1 19 3  6  o 11.02000  0.1867000     10.61000  0.2283000     11.43000  0.2955000     -0.8192000     0.3734000 
1 1 1 19 3  7  o 13.84000  0.1522000     14.24000  0.2173000     13.43000  0.2131000     0.8099000      0.3044000 
1 1 1 19 3  8  o 5.889000  0.2006000     6.103000  0.2737000     5.675000  0.2934000     0.4281000      0.4013000 
1 1 1 19 3  9  o 6.522000  0.2278000     6.409000  0.3300000     6.635000  0.3140000     -0.2264000     0.4556000 
1 1 1 19 3  10 f 4.283000  0.3133000     3.941000  0.4740000     4.624000  0.4099000     -0.6827000     0.6267000 
1 1 1 19 3  11 o 3.332000  0.4408000     3.274000  0.6403000     3.391000  0.6061000     -0.1167000     0.8817000 
1 1 1 19 3  12 o 9.623000  0.2097000     9.846000  0.2978000     9.401000  0.2952000     0.4455000      0.4193000 
1 1 1 19 3  13 o 7.404000  0.2646000     7.259000  0.3800000     7.550000  0.3684000     -0.2901000     0.5292000 
1 1 1 19 3  14 o 11.23000  0.2278000     10.99000  0.3214000     11.48000  0.3228000     -0.4912000     0.4555000 
1 1 1 19 3  15 o 2.211000  0.6094000     1.965000  0.8250000     2.456000  0.8970000     -0.4913000     1.219000  
1 1 1 19 3  16 o 6.914000  0.3386000     6.575000  0.4969000     7.254000  0.4599000     -0.6800000     0.6771000 
1 1 1 19 3  17 o 5.372000  0.4210000     5.448000  0.5833000     5.296000  0.6072000     0.1523000      0.8419000 
1 1 1 19 3  18 o 4.492000  0.4777000     3.798000  0.7632000     5.187000  0.5746000     -1.390000      0.9553000 
1 1 1 19 3  19 o 1.788000  0.5568000     1.758000  0.7768000     1.817000  0.7979000     -0.5915000E-01 1.114000  
1 1 1 19 3  20 o 1.670000  0.5022000     1.867000  0.7496000     1.473000  0.6684000     0.3940000      1.004000  
1 1 1 19 3  21 o 1.661000  0.5102000     1.511000  0.6808000     1.811000  0.7601000     -0.3004000     1.020000  
1 1 1 19 3  22 o 1.671000  0.4923000     1.432000  0.6489000     1.909000  0.7404000     -0.4772000     0.9845000 
1 1 1 19 3  23 f 1.257000  0.4162000     1.460000  0.6514000     1.054000  0.5183000     0.4064000      0.8324000 
1 1 1 19 3  24 o 2.061000  0.5990000     1.887000  0.8063000     2.236000  0.8861000     -0.3488000     1.198000  
1 1 1 19 4  0  o 4.344000  0.1110000     4.344000  0.1110000     4.344000  0.1110000     0.000000       0.000000  
1 1 1 19 4  1  o 0.9185000 0.2192000     0.7342000 0.3280000     1.103000  0.2908000     -0.3685000     0.4384000 
1 1 1 19 4  2  o 8.282000  0.8798000E-01 8.192000  0.1192000     8.372000  0.1295000     -0.1806000     0.1760000 
1 1 1 19 4  3  o 15.77000  0.1353000     15.59000  0.1873000     15.96000  0.1954000     -0.3697000     0.2707000 
1 1 1 19 4  4  o 9.728000  0.1643000     9.436000  0.1643000     10.02000  0.2847000     -0.5842000     0.3286000 
1 1 1 19 4  5  o 6.441000  0.1196000     6.348000  0.1625000     6.533000  0.1755000     -0.1849000     0.2392000 
1 1 1 19 4  6  o 8.052000  0.1815000     8.001000  0.1797000     8.102000  0.3153000     -0.1007000     0.3630000 
1 1 1 19 4  7  o 13.01000  0.1540000     12.97000  0.1802000     13.06000  0.2499000     -0.9089000E-01 0.3081000 
1 1 1 19 4  8  o 9.163000  0.1642000     8.947000  0.2359000     9.380000  0.2285000     -0.4333000     0.3285000 
1 1 1 19 4  9  o 11.30000  0.1886000     11.48000  0.2700000     11.12000  0.2634000     0.3570000      0.3772000 
1 1 1 19 4  10 o 15.10000  0.1810000     14.95000  0.2556000     15.25000  0.2564000     -0.2972000     0.3620000 
1 1 1 19 4  11 o 2.232000  0.5192000     1.519000  0.6695000     2.944000  0.7938000     -1.425000      1.038000  
1 1 1 19 4  12 o 6.442000  0.2687000     6.075000  0.3999000     6.810000  0.3590000     -0.7355000     0.5374000 
1 1 1 19 4  13 o 5.006000  0.3661000     4.856000  0.5321000     5.157000  0.5030000     -0.3009000     0.7323000 
1 1 1 19 4  14 o 7.642000  0.2811000     7.920000  0.3899000     7.363000  0.4049000     0.5573000      0.5621000 
1 1 1 19 4  15 o 9.822000  0.2554000     9.924000  0.3655000     9.720000  0.3568000     0.2041000      0.5108000 
1 1 1 19 4  16 o 9.247000  0.2742000     8.970000  0.3993000     9.525000  0.3760000     -0.5547000     0.5484000 
1 1 1 19 4  17 o 4.143000  0.5375000     3.711000  0.8222000     4.575000  0.6925000     -0.8636000     1.075000  
1 1 1 19 4  18 o 4.679000  0.4641000     5.290000  0.5685000     4.068000  0.7336000     1.222000       0.9281000 
1 1 1 19 4  19 o 2.151000  0.5428000     2.956000  0.8691000     1.346000  0.6505000     1.610000       1.086000  
1 1 1 19 4  20 o 1.306000  0.4349000     1.289000  0.6083000     1.324000  0.6217000     -0.3494000E-01 0.8699000 
1 1 1 19 4  21 o 1.853000  0.5391000     1.965000  0.7864000     1.740000  0.7378000     0.2248000      1.078000  
1 1 1 19 4  22 o 2.317000  0.5337000     2.190000  0.7574000     2.444000  0.7521000     -0.2538000     1.067000  
1 1 1 19 4  23 o 1.648000  0.4854000     1.861000  0.7233000     1.435000  0.6476000     0.4261000      0.9709000 
1 1 1 19 4  24 o 1.612000  0.5246000     1.684000  0.7585000     1.540000  0.7248000     0.1444000      1.049000  
1 1 1 19 5  0  o 2.639000  0.1361000     2.639000  0.1361000     2.639000  0.1361000     0.000000       0.000000  
1 1 1 19 5  1  o 4.180000  0.8419000E-01 4.225000  0.1342000     4.136000  0.1017000     0.8855000E-01  0.1684000 
1 1 1 19 5  2  o 10.92000  0.1109000     10.80000  0.1631000     11.05000  0.1503000     -0.2453000     0.2218000 
1 1 1 19 5  3  o 10.35000  0.1062000     10.21000  0.1457000     10.49000  0.1547000     -0.2808000     0.2125000 
1 1 1 19 5  4  f 12.80000  0.1607000     12.70000  0.1935000     12.91000  0.2568000     -0.2118000     0.3215000 
1 1 1 19 5  5  o 10.16000  0.1212000     10.10000  0.1676000     10.23000  0.1752000     -0.1215000     0.2424000 
1 1 1 19 5  6  o 6.624000  0.3038000     6.792000  0.4942000     6.456000  0.3534000     0.3356000      0.6076000 
1 1 1 19 5  7  o 13.34000  0.1556000     13.53000  0.1833000     13.15000  0.2516000     0.3837000      0.3113000 
1 1 1 19 5  8  o 8.747000  0.1686000     9.074000  0.1836000     8.419000  0.2828000     0.6553000      0.3372000 
1 1 1 19 5  9  o 7.704000  0.2112000     7.541000  0.3052000     7.866000  0.2920000     -0.3248000     0.4224000 
1 1 1 19 5  10 o 17.59000  0.1893000     17.32000  0.2673000     17.86000  0.2682000     -0.5442000     0.3786000 
1 1 1 19 5  11 o 14.66000  0.2212000     14.95000  0.3108000     14.38000  0.3148000     0.5686000      0.4424000 
1 1 1 19 5  12 o 2.533000  0.5118000     3.115000  0.6974000     1.951000  0.7494000     1.165000       1.024000  
1 1 1 19 5  13 o 10.85000  0.2168000     10.89000  0.3050000     10.80000  0.3082000     0.8847000E-01  0.4336000 
1 1 1 19 5  14 o 3.226000  0.6169000     3.448000  0.8531000     3.004000  0.8914000     0.4444000      1.234000  
1 1 1 19 5  15 o 7.519000  0.3009000     7.441000  0.4307000     7.596000  0.4204000     -0.1555000     0.6018000 
1 1 1 19 5  16 o 1.562000  0.5187000     1.758000  0.7886000     1.367000  0.6740000     0.3913000      1.037000  
1 1 1 19 5  17 o 2.745000  0.6450000     2.732000  0.9126000     2.757000  0.9118000     -0.2458000E-01 1.290000  
1 1 1 19 5  18 o 2.403000  0.6114000     2.335000  0.8626000     2.472000  0.8668000     -0.1371000     1.223000  
1 1 1 19 5  19 o 2.196000  0.5721000     2.744000  0.8752000     1.647000  0.7371000     1.096000       1.144000  
1 1 1 19 5  20 o 2.170000  0.5392000     2.456000  0.7798000     1.884000  0.7449000     0.5721000      1.078000  
1 1 1 19 5  21 o 1.876000  0.5232000     1.442000  0.6730000     2.311000  0.8013000     -0.8693000     1.046000  
1 1 1 19 5  22 o 1.504000  0.4699000     1.464000  0.6561000     1.545000  0.6729000     -0.8073000E-01 0.9398000 
1 1 1 19 5  23 o 1.682000  0.4966000     1.649000  0.6972000     1.715000  0.7075000     -0.6572000E-01 0.9932000 
1 1 1 19 5  24 o 1.496000  0.4937000     1.367000  0.6505000     1.624000  0.7428000     -0.2573000     0.9874000 
1 1 1 19 6  0  o 7.817000  0.1293000     7.817000  0.1293000     7.817000  0.1293000     0.000000       0.000000  
1 1 1 19 6  1  f 8.782000  0.8644000E-01 8.675000  0.1217000     8.889000  0.1228000     -0.2139000     0.1729000 
1 1 1 19 6  2  o 6.622000  0.1067000     6.657000  0.1414000     6.587000  0.1597000     0.7008000E-01  0.2133000 
1 1 1 19 6  3  o 11.49000  0.1125000     11.42000  0.1549000     11.56000  0.1632000     -0.1347000     0.2250000 
1 1 1 19 6  4  f 3.673000  0.1815000     3.577000  0.1917000     3.769000  0.3082000     -0.1922000     0.3629000 
1 1 1 19 6  5  o 4.925000  0.1367000     4.943000  0.1800000     4.907000  0.2058000     0.3651000E-01  0.2734000 
1 1 1 19 6  6  o 9.319000  0.1756000     9.487000  0.2986000     9.152000  0.1848000     0.3351000      0.3511000 
1 1 1 19 6  7  o 11.63000  0.1587000     11.85000  0.2462000     11.40000  0.2003000     0.4534000      0.3174000 
1 1 1 19 6  8  o 11.87000  0.1618000     12.09000  0.1876000     11.64000  0.2638000     0.4457000      0.3237000 
1 1 1 19 6  9  f 24.78000  0.2675000     25.31000  0.3102000     24.25000  0.4358000     1.056000       0.5349000 
1 1 1 19 6  10 f 15.87000  0.1842000     15.92000  0.2608000     15.83000  0.2601000     0.9273000E-01  0.3684000 
1 1 1 19 6  11 o 15.50000  0.2218000     15.43000  0.3132000     15.58000  0.3141000     -0.1543000     0.4436000 
1 1 1 19 6  12 o 4.313000  0.3779000     3.945000  0.5819000     4.682000  0.4824000     -0.7374000     0.7558000 
1 1 1 19 6  13 o 8.102000  0.2527000     7.862000  0.3629000     8.341000  0.3519000     -0.4793000     0.5055000 
1 1 1 19 6  14 o 3.844000  0.5532000     3.719000  0.8079000     3.968000  0.7560000     -0.2498000     1.106000  
1 1 1 19 6  15 o 4.805000  0.4254000     4.810000  0.5966000     4.801000  0.6064000     0.8550000E-02  0.8507000 
1 1 1 19 6  16 o 2.582000  0.6613000     2.233000  0.8804000     2.931000  0.9871000     -0.6979000     1.323000  
1 1 1 19 6  17 o 2.394000  0.6321000     2.484000  0.8997000     2.304000  0.8881000     0.1793000      1.264000  
1 1 1 19 6  18 o 3.830000  0.5421000     3.656000  0.7899000     4.004000  0.7428000     -0.3483000     1.084000  
1 1 1 19 6  19 o 2.733000  0.5792000     3.379000  0.8170000     2.088000  0.8211000     1.291000       1.158000  
1 1 1 19 6  20 o 2.351000  0.4798000     3.239000  0.6979000     1.464000  0.6585000     1.776000       0.9595000 
1 1 1 19 6  21 o 1.424000  0.4692000     1.418000  0.6646000     1.430000  0.6626000     -0.1165000E-01 0.9385000 
1 1 1 19 6  22 o 1.383000  0.4452000     1.390000  0.6310000     1.377000  0.6282000     0.1314000E-01  0.8904000 
1 1 1 19 6  23 o 1.441000  0.4504000     1.214000  0.5757000     1.667000  0.6928000     -0.4526000     0.9008000 
1 1 1 19 6  24 o 1.363000  0.4527000     1.132000  0.5603000     1.595000  0.7112000     -0.4631000     0.9054000 
1 1 1 19 7  0  o 14.12000  0.1689000     14.12000  0.1689000     14.12000  0.1689000     0.000000       0.000000  
1 1 1 19 7  1  o 11.44000  0.1033000     11.44000  0.1455000     11.44000  0.1466000     -0.2009000E-02 0.2065000 
1 1 1 19 7  2  o 8.001000  0.8668000E-01 7.946000  0.1275000     8.055000  0.1175000     -0.1095000     0.1734000 
1 1 1 19 7  3  o 8.437000  0.1051000     8.517000  0.1623000     8.357000  0.1334000     0.1596000      0.2101000 
1 1 1 19 7  4  o 7.179000  0.1116000     7.233000  0.1513000     7.124000  0.1642000     0.1084000      0.2233000 
1 1 1 19 7  5  o 6.587000  0.1262000     6.533000  0.1728000     6.641000  0.1839000     -0.1085000     0.2523000 
1 1 1 19 7  6  o 6.646000  0.1665000     6.624000  0.2675000     6.669000  0.1983000     -0.4481000E-01 0.3330000 
1 1 1 19 7  7  o 22.90000  0.1983000     22.95000  0.2797000     22.85000  0.2812000     0.9680000E-01  0.3966000 
1 1 1 19 7  8  o 8.245000  0.1773000     8.448000  0.2077000     8.042000  0.2873000     0.4060000      0.3545000 
1 1 1 19 7  9  o 15.75000  0.2710000     15.88000  0.2600000     15.61000  0.4756000     0.2697000      0.5420000 
1 1 1 19 7  10 f 8.663000  0.1936000     8.586000  0.2177000     8.739000  0.3203000     -0.1523000     0.3873000 
1 1 1 19 7  11 o 17.67000  0.2831000     17.41000  0.3944000     17.93000  0.4063000     -0.5257000     0.5662000 
1 1 1 19 7  12 o 3.778000  0.4488000     4.649000  0.5100000     2.906000  0.7386000     1.743000       0.8975000 
1 1 1 19 7  13 o 7.818000  0.2589000     7.951000  0.3567000     7.685000  0.3755000     0.2658000      0.5179000 
1 1 1 19 7  14 o 11.89000  0.2507000     12.01000  0.3596000     11.77000  0.3495000     0.2469000      0.5014000 
1 1 1 19 7  15 f 6.625000  0.3255000     6.624000  0.4561000     6.626000  0.4645000     -0.2644000E-02 0.6510000 
1 1 1 19 7  16 o 4.088000  0.6018000     3.649000  0.9094000     4.528000  0.7884000     -0.8782000     1.204000  
1 1 1 19 7  17 o 2.352000  0.6237000     2.149000  0.8636000     2.555000  0.9001000     -0.4053000     1.247000  
1 1 1 19 7  18 o 3.012000  0.5857000     3.505000  0.7800000     2.518000  0.8740000     0.9864000      1.171000  
1 1 1 19 7  19 o 2.623000  0.6035000     2.491000  0.8542000     2.754000  0.8527000     -0.2634000     1.207000  
1 1 1 19 7  20 o 1.774000  0.5140000     1.752000  0.7197000     1.796000  0.7341000     -0.4412000E-01 1.028000  
1 1 1 19 7  21 o 1.403000  0.4586000     1.710000  0.7394000     1.096000  0.5427000     0.6141000      0.9172000 
1 1 1 19 7  22 o 1.520000  0.4617000     1.220000  0.5792000     1.820000  0.7191000     -0.5991000     0.9234000 
1 1 1 19 7  23 o 1.733000  0.4942000     1.518000  0.6631000     1.948000  0.7331000     -0.4295000     0.9885000 
1 1 1 19 7  24 o 1.190000  0.4105000     1.243000  0.6025000     1.136000  0.5577000     0.1063000      0.8210000 
1 1 1 19 8  0  o 17.13000  0.1997000     17.13000  0.1997000     17.13000  0.1997000     -0.000000      0.000000  
1 1 1 19 8  1  o 4.961000  0.8972000E-01 4.868000  0.1294000     5.055000  0.1243000     -0.1873000     0.1794000 
1 1 1 19 8  2  o 10.28000  0.1014000     10.30000  0.1433000     10.26000  0.1436000     0.3603000E-01  0.2028000 
1 1 1 19 8  3  o 22.06000  0.2319000     22.02000  0.3583000     22.11000  0.2944000     -0.9420000E-01 0.4638000 
1 1 1 19 8  4  o 3.852000  0.1412000     3.550000  0.2295000     4.155000  0.1647000     -0.6050000     0.2825000 
1 1 1 19 8  5  o 8.722000  0.1470000     8.326000  0.1932000     9.118000  0.2215000     -0.7918000     0.2939000 
1 1 1 19 8  6  o 8.469000  0.1323000     8.614000  0.1817000     8.324000  0.1923000     0.2903000      0.2645000 
1 1 1 19 8  7  o 13.37000  0.1469000     13.50000  0.2062000     13.24000  0.2092000     0.2629000      0.2937000 
1 1 1 19 8  8  o 11.55000  0.1490000     11.45000  0.2090000     11.65000  0.2124000     -0.2037000     0.2980000 
1 1 1 19 8  9  o 17.48000  0.2228000     17.06000  0.2437000     17.91000  0.3730000     -0.8499000     0.4456000 
1 1 1 19 8  10 o 15.20000  0.1861000     15.22000  0.2180000     15.18000  0.3018000     0.3632000E-01  0.3723000 
1 1 1 19 8  11 o 15.41000  0.2768000     15.58000  0.3851000     15.25000  0.3978000     0.3314000      0.5537000 
1 1 1 19 8  12 o 6.780000  0.2591000     7.350000  0.2602000     6.209000  0.4482000     1.141000       0.5183000 
1 1 1 19 8  13 o 4.067000  0.4550000     4.573000  0.5764000     3.560000  0.7041000     1.013000       0.9100000 
1 1 1 19 8  14 o 7.399000  0.3285000     7.226000  0.4858000     7.573000  0.4422000     -0.3472000     0.6570000 
1 1 1 19 8  15 o 3.442000  0.5728000     3.530000  0.8084000     3.354000  0.8118000     0.1760000      1.146000  
1 1 1 19 8  16 o 4.534000  0.5746000     5.053000  0.7280000     4.015000  0.8892000     1.039000       1.149000  
1 1 1 19 8  17 o 3.336000  0.5949000     3.381000  0.8465000     3.290000  0.8360000     0.9037000E-01  1.190000  
1 1 1 19 8  18 o 1.964000  0.5549000     2.372000  0.8504000     1.557000  0.7130000     0.8144000      1.110000  
1 1 1 19 8  19 o 4.176000  0.5629000     4.416000  0.8697000     3.935000  0.7148000     0.4809000      1.126000  
1 1 1 19 8  20 o 1.318000  0.4359000     1.326000  0.6204000     1.310000  0.6123000     0.1600000E-01  0.8717000 
1 1 1 19 8  21 o 2.281000  0.5546000     1.816000  0.7545000     2.747000  0.8130000     -0.9317000     1.109000  
1 1 1 19 8  22 o 1.540000  0.4597000     1.946000  0.7354000     1.135000  0.5519000     0.8111000      0.9194000 
1 1 1 19 8  23 o 1.562000  0.4735000     1.403000  0.6306000     1.722000  0.7064000     -0.3191000     0.9470000 
1 1 1 19 8  24 o 1.285000  0.4332000     1.092000  0.5421000     1.478000  0.6757000     -0.3859000     0.8663000 
1 1 1 19 9  0  o 3.373000  0.1618000     3.373000  0.1618000     3.373000  0.1618000     -0.000000      0.000000  
1 1 1 19 9  1  o 7.088000  0.9113000E-01 7.190000  0.1280000     6.987000  0.1297000     0.2029000      0.1823000 
1 1 1 19 9  2  o 8.926000  0.9821000E-01 8.896000  0.1391000     8.955000  0.1386000     -0.5883000E-01 0.1964000 
1 1 1 19 9  3  o 2.945000  0.1714000     3.043000  0.2225000     2.847000  0.2607000     0.1960000      0.3427000 
1 1 1 19 9  4  o 10.91000  0.1221000     10.83000  0.1926000     11.00000  0.1500000     -0.1686000     0.2441000 
1 1 1 19 9  5  o 7.180000  0.2279000     7.008000  0.4158000     7.352000  0.1866000     -0.3439000     0.4558000 
1 1 1 19 9  6  o 11.11000  0.1351000     11.11000  0.1874000     11.12000  0.1947000     -0.1933000E-02 0.2703000 
1 1 1 19 9  7  o 8.958000  0.1417000     8.936000  0.1936000     8.980000  0.2069000     -0.4450000E-01 0.2833000 
1 1 1 19 9  8  o 16.45000  0.1664000     16.39000  0.2334000     16.51000  0.2371000     -0.1195000     0.3327000 
1 1 1 19 9  9  o 9.718000  0.2100000     9.864000  0.2241000     9.572000  0.3551000     0.2922000      0.4199000 
1 1 1 19 9  10 o 3.454000  0.3078000     3.608000  0.4122000     3.299000  0.4573000     0.3096000      0.6157000 
1 1 1 19 9  11 o 5.516000  0.2933000     5.518000  0.4884000     5.515000  0.3251000     0.2873000E-02  0.5867000 
1 1 1 19 9  12 o 4.285000  0.4034000     4.788000  0.3494000     3.782000  0.7272000     1.006000       0.8068000 
1 1 1 19 9  13 o 4.405000  0.3824000     4.301000  0.3949000     4.510000  0.6549000     -0.2090000     0.7647000 
1 1 1 19 9  14 o 8.425000  0.3586000     9.119000  0.4901000     7.730000  0.5235000     1.389000       0.7171000 
1 1 1 19 9  15 o 2.710000  0.6320000     2.671000  0.9057000     2.749000  0.8818000     -0.7747000E-01 1.264000  
1 1 1 19 9  16 o 1.939000  0.6239000     2.035000  0.9270000     1.843000  0.8354000     0.1919000      1.248000  
1 1 1 19 9  17 o 4.497000  0.4626000     5.135000  0.5605000     3.859000  0.7362000     1.276000       0.9253000 
1 1 1 19 9  18 o 2.961000  0.5793000     3.428000  0.7820000     2.494000  0.8550000     0.9342000      1.159000  
1 1 1 19 9  19 o 2.268000  0.6520000     2.459000  0.9745000     2.076000  0.8666000     0.3826000      1.304000  
1 1 1 19 9  20 o 2.433000  0.5074000     1.842000  0.7377000     3.024000  0.6967000     -1.181000      1.015000  
1 1 1 19 9  21 o 2.591000  0.5239000     1.766000  0.7850000     3.417000  0.6941000     -1.651000      1.048000  
1 1 1 19 9  22 o 1.488000  0.4615000     1.668000  0.6953000     1.308000  0.6071000     0.3600000      0.9230000 
1 1 1 19 9  23 o 1.599000  0.4805000     1.806000  0.7226000     1.392000  0.6334000     0.4147000      0.9609000 
1 1 1 19 9  24 o 1.332000  0.4470000     1.326000  0.6326000     1.337000  0.6317000     -0.1116000E-01 0.8940000 
1 1 1 19 10 0  o 8.742000  0.1362000     8.742000  0.1362000     8.742000  0.1362000     0.000000       0.000000  
1 1 1 19 10 1  o 15.82000  0.1358000     15.75000  0.1909000     15.90000  0.1931000     -0.1430000     0.2716000 
1 1 1 19 10 2  o 10.00000  0.1285000     9.791000  0.2086000     10.21000  0.1503000     -0.4206000     0.2571000 
1 1 1 19 10 3  o 6.107000  0.1045000     6.030000  0.1489000     6.184000  0.1467000     -0.1541000     0.2090000 
1 1 1 19 10 4  o 7.641000  0.1180000     7.572000  0.1549000     7.711000  0.1781000     -0.1393000     0.2360000 
1 1 1 19 10 5  o 14.29000  0.1724000     14.03000  0.2946000     14.56000  0.1791000     -0.5280000     0.3448000 
1 1 1 19 10 6  o 15.30000  0.1518000     15.21000  0.2120000     15.38000  0.2174000     -0.1705000     0.3036000 
1 1 1 19 10 7  o 10.23000  0.1436000     10.07000  0.2006000     10.38000  0.2054000     -0.3107000     0.2871000 
1 1 1 19 10 8  o 3.182000  0.2789000     3.215000  0.3518000     3.149000  0.4329000     0.6598000E-01  0.5578000 
1 1 1 19 10 9  f 4.297000  0.2382000     4.534000  0.2973000     4.059000  0.3722000     0.4759000      0.4763000 
1 1 1 19 10 10 o 10.80000  0.1645000     10.80000  0.2305000     10.81000  0.2347000     -0.1417000E-01 0.3290000 
1 1 1 19 10 11 o 11.78000  0.2029000     11.72000  0.3228000     11.84000  0.2461000     -0.1209000     0.4059000 
1 1 1 19 10 12 o 7.935000  0.1999000     7.450000  0.2840000     8.420000  0.2815000     -0.9698000     0.3999000 
1 1 1 19 10 13 o 10.84000  0.2212000     10.83000  0.2466000     10.85000  0.3673000     -0.2059000E-01 0.4424000 
1 1 1 19 10 14 o 9.037000  0.2988000     9.119000  0.2895000     8.955000  0.5228000     0.1641000      0.5976000 
1 1 1 19 10 15 o 3.782000  0.5945000     4.104000  0.7364000     3.460000  0.9336000     0.6445000      1.189000  
1 1 1 19 10 16 o 6.920000  0.4492000     7.509000  0.6550000     6.332000  0.6149000     1.177000       0.8984000 
1 1 1 19 10 17 o 2.101000  0.5926000     2.095000  0.8420000     2.108000  0.8341000     -0.1274000E-01 1.185000  
1 1 1 19 10 18 o 1.550000  0.5018000     1.737000  0.7613000     1.363000  0.6538000     0.3741000      1.004000  
1 1 1 19 10 19 o 2.089000  0.5977000     1.929000  0.8276000     2.250000  0.8626000     -0.3208000     1.195000  
1 1 1 19 10 20 o 1.890000  0.5254000     1.940000  0.7476000     1.840000  0.7384000     0.9929000E-01  1.051000  
1 1 1 19 10 21 o 3.447000  0.6289000     3.372000  0.8569000     3.522000  0.9207000     -0.1505000     1.258000  
1 1 1 19 10 22 o 1.211000  0.4068000     1.182000  0.5665000     1.240000  0.5840000     -0.5754000E-01 0.8136000 
1 1 1 19 10 23 o 1.762000  0.4994000     1.675000  0.6907000     1.849000  0.7216000     -0.1741000     0.9989000 
1 1 1 19 10 24 o 1.541000  0.4899000     1.441000  0.6721000     1.641000  0.7131000     -0.2000000     0.9799000 
1 1 1 19 11 0  o 6.339000  0.1383000     6.339000  0.1383000     6.339000  0.1383000     -0.000000      0.000000  
1 1 1 19 11 1  o 15.82000  0.1484000     15.69000  0.2233000     15.96000  0.1956000     -0.2692000     0.2968000 
1 1 1 19 11 2  f 4.065000  0.1431000     4.078000  0.1911000     4.052000  0.2131000     0.2592000E-01  0.2862000 
1 1 1 19 11 3  o 11.71000  0.1276000     11.76000  0.1668000     11.65000  0.1930000     0.1172000      0.2551000 
1 1 1 19 11 4  o 14.32000  0.1758000     14.32000  0.2702000     14.32000  0.2250000     0.1776000E-02  0.3516000 
1 1 1 19 11 5  o 9.810000  0.1270000     9.861000  0.2011000     9.760000  0.1552000     0.1010000      0.2540000 
1 1 1 19 11 6  o 10.41000  0.1346000     10.40000  0.2131000     10.42000  0.1646000     -0.2068000E-01 0.2693000 
1 1 1 19 11 7  o 5.332000  0.1718000     5.580000  0.2228000     5.084000  0.2617000     0.4963000      0.3436000 
1 1 1 19 11 8  o 10.51000  0.1603000     10.53000  0.2104000     10.49000  0.2418000     0.3569000E-01  0.3206000 
1 1 1 19 11 9  o 7.732000  0.1701000     7.642000  0.2364000     7.822000  0.2445000     -0.1796000     0.3401000 
1 1 1 19 11 10 o 6.847000  0.2060000     6.667000  0.2712000     7.027000  0.3101000     -0.3602000     0.4120000 
1 1 1 19 11 11 o 21.94000  0.2094000     22.03000  0.2962000     21.84000  0.2960000     0.1994000      0.4187000 
1 1 1 19 11 12 o 12.41000  0.1805000     12.34000  0.2541000     12.49000  0.2564000     -0.1525000     0.3610000 
1 1 1 19 11 13 o 5.085000  0.2827000     5.063000  0.3838000     5.107000  0.4151000     -0.4346000E-01 0.5654000 
1 1 1 19 11 14 o 6.416000  0.3657000     6.104000  0.3615000     6.729000  0.6358000     -0.6248000     0.7314000 
1 1 1 19 11 15 o 2.929000  0.5933000     2.910000  0.6770000     2.947000  0.9744000     -0.3767000E-01 1.187000  
1 1 1 19 11 16 o 2.377000  0.6564000     2.144000  0.9058000     2.609000  0.9502000     -0.4654000     1.313000  
1 1 1 19 11 17 o 1.939000  0.5658000     2.144000  0.8393000     1.733000  0.7591000     0.4107000      1.132000  
1 1 1 19 11 18 o 1.378000  0.4654000     1.321000  0.6390000     1.435000  0.6770000     -0.1138000     0.9309000 
1 1 1 19 11 19 o 2.000000  0.5685000     1.724000  0.7719000     2.276000  0.8347000     -0.5514000     1.137000  
1 1 1 19 11 20 o 1.189000  0.4028000     1.123000  0.5469000     1.255000  0.5916000     -0.1317000     0.8056000 
1 1 1 19 11 21 o 1.403000  0.4636000     1.220000  0.5900000     1.586000  0.7151000     -0.3659000     0.9271000 
1 1 1 19 11 22 o 2.943000  0.4818000     2.565000  0.7365000     3.321000  0.6212000     -0.7560000     0.9635000 
1 1 1 19 11 23 o 1.428000  0.4491000     1.604000  0.6782000     1.253000  0.5888000     0.3510000      0.8982000 
1 1 1 19 11 24 o 1.112000  0.3831000     1.047000  0.5174000     1.177000  0.5650000     -0.1292000     0.7661000 
1 1 1 19 12 0  o 1.524000  0.5117000     1.524000  0.5117000     1.524000  0.5117000     0.000000       0.000000  
1 1 1 19 12 1  o 14.46000  0.2082000     14.74000  0.2139000     14.18000  0.3572000     0.5617000      0.4163000 
1 1 1 19 12 2  o 17.41000  0.1629000     17.43000  0.2119000     17.40000  0.2475000     0.2899000E-01  0.3258000 
1 1 1 19 12 3  o 6.586000  0.1302000     6.723000  0.1721000     6.449000  0.1954000     0.2739000      0.2603000 
1 1 1 19 12 4  o 10.04000  0.1278000     10.10000  0.1968000     9.982000  0.1630000     0.1148000      0.2556000 
1 1 1 19 12 5  o 9.153000  0.1181000     9.203000  0.1681000     9.102000  0.1659000     0.1016000      0.2362000 
1 1 1 19 12 6  o 4.606000  0.1658000     4.570000  0.2611000     4.642000  0.2045000     -0.7193000E-01 0.3316000 
1 1 1 19 12 7  o 8.953000  0.1458000     9.004000  0.2014000     8.903000  0.2110000     0.1013000      0.2917000 
1 1 1 19 12 8  o 8.463000  0.2067000     8.764000  0.2363000     8.162000  0.3391000     0.6023000      0.4133000 
1 1 1 19 12 9  o 6.041000  0.1897000     5.905000  0.2610000     6.177000  0.2754000     -0.2723000     0.3794000 
1 1 1 19 12 10 o 14.60000  0.1978000     14.49000  0.2721000     14.70000  0.2871000     -0.2062000     0.3955000 
1 1 1 19 12 11 o 4.036000  0.3139000     4.720000  0.3682000     3.352000  0.5084000     1.368000       0.6277000 
1 1 1 19 12 12 o 3.328000  0.3970000     4.082000  0.4512000     2.575000  0.6534000     1.507000       0.7941000 
1 1 1 19 12 13 o 4.761000  0.2964000     4.307000  0.4451000     5.215000  0.3917000     -0.9089000     0.5929000 
1 1 1 19 12 14 o 2.103000  0.5115000     2.497000  0.7260000     1.710000  0.7208000     0.7863000      1.023000  
1 1 1 19 12 15 o 3.304000  0.4704000     3.262000  0.6285000     3.345000  0.7002000     -0.8317000E-01 0.9408000 
1 1 1 19 12 16 o 3.828000  0.6236000     3.004000  0.9873000     4.653000  0.7619000     -1.650000      1.247000  
1 1 1 19 12 17 o 1.808000  0.5231000     1.955000  0.7084000     1.661000  0.7699000     0.2941000      1.046000  
1 1 1 19 12 18 o 2.231000  0.5838000     1.822000  0.7008000     2.639000  0.9339000     -0.8170000     1.168000  
1 1 1 19 12 19 o 2.395000  0.6017000     2.330000  0.8579000     2.460000  0.8438000     -0.1302000     1.203000  
1 1 1 19 12 20 o 2.508000  0.5197000     2.106000  0.7556000     2.911000  0.7137000     -0.8051000     1.039000  
1 1 1 19 12 21 o 1.620000  0.5089000     1.572000  0.7015000     1.667000  0.7375000     -0.9550000E-01 1.018000  
1 1 1 19 12 22 o 1.609000  0.4827000     1.715000  0.7068000     1.504000  0.6576000     0.2106000      0.9654000 
1 1 1 19 12 23 o 1.460000  0.4564000     1.594000  0.6786000     1.327000  0.6105000     0.2664000      0.9128000 
1 1 1 19 12 24 o 1.162000  0.3961000     1.311000  0.6128000     1.014000  0.5020000     0.2968000      0.7922000 
1 1 1 19 13 0  o 25.65000  0.5838000     25.65000  0.5838000     25.65000  0.5838000     0.000000       0.000000  
1 1 1 19 13 1  o 0.9764000 0.3045000     1.010000  0.4376000     0.9432000 0.4236000     0.6636000E-01  0.6090000 
1 1 1 19 13 2  o 4.633000  0.1611000     4.758000  0.2384000     4.508000  0.2166000     0.2503000      0.3221000 
1 1 1 19 13 3  o 12.57000  0.1361000     12.56000  0.2064000     12.57000  0.1775000     -0.7468000E-02 0.2723000 
1 1 1 19 13 4  o 11.65000  0.1237000     11.59000  0.1752000     11.71000  0.1745000     -0.1153000     0.2473000 
1 1 1 19 13 5  o 17.99000  0.1608000     17.87000  0.2268000     18.12000  0.2280000     -0.2443000     0.3216000 
1 1 1 19 13 6  o 6.126000  0.1295000     6.186000  0.1862000     6.065000  0.1800000     0.1207000      0.2589000 
1 1 1 19 13 7  o 7.306000  0.1459000     7.422000  0.2281000     7.191000  0.1820000     0.2310000      0.2918000 
1 1 1 19 13 8  o 9.922000  0.2061000     10.18000  0.2353000     9.668000  0.3384000     0.5067000      0.4121000 
1 1 1 19 13 9  o 5.919000  0.1943000     5.891000  0.2636000     5.947000  0.2855000     -0.5608000E-01 0.3886000 
1 1 1 19 13 10 o 5.284000  0.4913000     4.901000  0.9071000     5.667000  0.3776000     -0.7651000     0.9826000 
1 1 1 19 13 11 o 8.679000  0.1865000     8.730000  0.2559000     8.628000  0.2713000     0.1024000      0.3730000 
1 1 1 19 13 12 o 3.821000  0.3623000     3.986000  0.4881000     3.657000  0.5356000     0.3291000      0.7247000 
1 1 1 19 13 13 o 2.080000  0.4967000     1.647000  0.6803000     2.513000  0.7238000     -0.8663000     0.9933000 
1 1 1 19 13 14 o 1.349000  0.4403000     1.390000  0.6301000     1.309000  0.6153000     0.8087000E-01  0.8807000 
1 1 1 19 13 15 o 2.646000  0.5209000     2.995000  0.7059000     2.298000  0.7662000     0.6974000      1.042000  
1 1 1 19 13 16 o 4.424000  0.3841000     3.822000  0.5868000     5.026000  0.4956000     -1.204000      0.7681000 
1 1 1 19 13 17 o 2.914000  0.4791000     3.334000  0.5808000     2.494000  0.7620000     0.8402000      0.9581000 
1 1 1 19 13 18 o 2.212000  0.4802000     2.941000  0.6503000     1.482000  0.7069000     1.458000       0.9605000 
1 1 1 19 13 19 o 2.021000  0.5272000     2.133000  0.6722000     1.910000  0.8124000     0.2230000      1.054000  
1 1 1 19 13 20 o 2.941000  0.5179000     2.958000  0.5656000     2.923000  0.8676000     0.3468000E-01  1.036000  
1 1 1 19 13 21 o 3.308000  0.5016000     3.639000  0.5893000     2.977000  0.8119000     0.6621000      1.003000  
1 1 1 19 13 22 o 1.643000  0.4817000     1.505000  0.6548000     1.781000  0.7067000     -0.2763000     0.9634000 
1 1 1 19 13 23 o 1.187000  0.3994000     1.342000  0.6165000     1.031000  0.5078000     0.3107000      0.7987000 
1 1 1 19 13 24 o 1.323000  0.4333000     1.167000  0.5625000     1.478000  0.6591000     -0.3110000     0.8665000 
1 1 1 19 14 0  o 13.67000  0.1814000     13.67000  0.1814000     13.67000  0.1814000     0.000000       0.000000  
1 1 1 19 14 1  o 4.398000  0.1379000     4.388000  0.2060000     4.409000  0.1833000     -0.2066000E-01 0.2757000 
1 1 1 19 14 2  o 4.658000  0.1243000     4.692000  0.1717000     4.624000  0.1797000     0.6761000E-01  0.2486000 
1 1 1 19 14 3  o 16.61000  0.1492000     16.65000  0.2103000     16.57000  0.2118000     0.7924000E-01  0.2984000 
1 1 1 19 14 4  o 7.446000  0.1189000     7.574000  0.1684000     7.318000  0.1678000     0.2553000      0.2377000 
1 1 1 19 14 5  o 25.53000  0.2265000     25.55000  0.2992000     25.51000  0.3402000     0.3219000E-01  0.4530000 
1 1 1 19 14 6  o 11.67000  0.1331000     11.78000  0.1877000     11.55000  0.1888000     0.2259000      0.2663000 
1 1 1 19 14 7  o 11.77000  0.1487000     11.82000  0.2370000     11.71000  0.1797000     0.1037000      0.2974000 
1 1 1 19 14 8  o 13.03000  0.1788000     13.14000  0.2533000     12.91000  0.2526000     0.2322000      0.3577000 
1 1 1 19 14 9  o 20.62000  0.1962000     20.92000  0.2785000     20.31000  0.2766000     0.6066000      0.3925000 
1 1 1 19 14 10 o 7.555000  0.2611000     7.897000  0.4456000     7.212000  0.2723000     0.6843000      0.5222000 
1 1 1 19 14 11 o 9.230000  0.1846000     9.421000  0.2524000     9.039000  0.2694000     0.3822000      0.3692000 
1 1 1 19 14 12 f 10.43000  0.1907000     10.63000  0.2613000     10.23000  0.2779000     0.3979000      0.3815000 
1 1 1 19 14 13 o 2.477000  0.5098000     2.814000  0.6742000     2.140000  0.7648000     0.6738000      1.020000  
1 1 1 19 14 14 o 3.149000  0.4757000     2.504000  0.7434000     3.793000  0.5937000     -1.289000      0.9513000 
1 1 1 19 14 15 o 5.065000  0.3330000     4.816000  0.4422000     5.314000  0.4980000     -0.4971000     0.6660000 
1 1 1 19 14 16 o 3.243000  0.4799000     3.901000  0.5666000     2.586000  0.7747000     1.315000       0.9598000 
1 1 1 19 14 17 o 2.077000  0.5235000     1.705000  0.7071000     2.449000  0.7720000     -0.7432000     1.047000  
1 1 1 19 14 18 o 2.789000  0.5226000     2.957000  0.6936000     2.622000  0.7820000     0.3345000      1.045000  
1 1 1 19 14 19 o 1.445000  0.4431000     1.653000  0.6448000     1.237000  0.6079000     0.4169000      0.8862000 
1 1 1 19 14 20 o 1.371000  0.4499000     1.209000  0.5549000     1.532000  0.7084000     -0.3229000     0.8998000 
1 1 1 19 14 21 o 1.666000  0.4723000     1.858000  0.6546000     1.474000  0.6810000     0.3847000      0.9446000 
1 1 1 19 14 22 o 1.465000  0.4603000     1.355000  0.5919000     1.575000  0.7051000     -0.2196000     0.9207000 
1 1 1 19 14 23 o 2.075000  0.4991000     2.820000  0.7583000     1.330000  0.6491000     1.490000       0.9982000 
1 1 1 19 14 24 o 1.233000  0.4199000     1.173000  0.5724000     1.293000  0.6146000     -0.1201000     0.8399000 
1 1 1 19 15 0  o 15.18000  0.1956000     15.18000  0.1956000     15.18000  0.1956000     -0.000000      0.000000  
1 1 1 19 15 1  o 3.559000  0.1538000     3.664000  0.2022000     3.455000  0.2318000     0.2086000      0.3076000 
1 1 1 19 15 2  o 14.11000  0.1337000     14.05000  0.1880000     14.17000  0.1902000     -0.1237000     0.2674000 
1 1 1 19 15 3  o 14.77000  0.1393000     14.85000  0.1971000     14.70000  0.1968000     0.1554000      0.2786000 
1 1 1 19 15 4  o 9.048000  0.1197000     9.084000  0.1696000     9.011000  0.1691000     0.7296000E-01  0.2394000 
1 1 1 19 15 5  o 7.256000  0.1256000     7.363000  0.1807000     7.148000  0.1745000     0.2156000      0.2512000 
1 1 1 19 15 6  o 8.624000  0.1276000     8.752000  0.1808000     8.497000  0.1801000     0.2542000      0.2552000 
1 1 1 19 15 7  o 3.258000  0.2565000     3.524000  0.3798000     2.993000  0.3449000     0.5308000      0.5131000 
1 1 1 19 15 8  o 5.971000  0.1707000     6.151000  0.2645000     5.791000  0.2160000     0.3592000      0.3415000 
1 1 1 19 15 9  o 9.084000  0.1835000     8.946000  0.2318000     9.223000  0.2846000     -0.2767000     0.3670000 
1 1 1 19 15 10 o 5.583000  0.2233000     5.270000  0.3219000     5.896000  0.3097000     -0.6264000     0.4467000 
1 1 1 19 15 11 o 9.936000  0.1842000     9.820000  0.2534000     10.05000  0.2674000     -0.2318000     0.3684000 
1 1 1 19 15 12 o 4.572000  0.3062000     4.445000  0.4244000     4.699000  0.4415000     -0.2535000     0.6124000 
1 1 1 19 15 13 o 4.607000  0.4895000     4.950000  0.4544000     4.264000  0.8672000     0.6864000      0.9790000 
1 1 1 19 15 14 o 2.153000  0.5292000     2.219000  0.7333000     2.087000  0.7632000     0.1321000      1.058000  
1 1 1 19 15 15 o 3.991000  0.4517000     3.811000  0.6533000     4.171000  0.6239000     -0.3595000     0.9033000 
1 1 1 19 15 16 o 3.533000  0.4604000     4.157000  0.5188000     2.909000  0.7608000     1.248000       0.9209000 
1 1 1 19 15 17 o 1.876000  0.5030000     2.176000  0.7326000     1.577000  0.6894000     0.5983000      1.006000  
1 1 1 19 15 18 o 4.106000  0.4075000     4.638000  0.4690000     3.575000  0.6666000     1.062000       0.8150000 
1 1 1 19 15 19 o 2.165000  0.5148000     2.204000  0.7202000     2.126000  0.7359000     0.7836000E-01  1.030000  
1 1 1 19 15 20 o 2.755000  0.4866000     2.759000  0.6640000     2.751000  0.7114000     0.7942000E-02  0.9731000 
1 1 1 19 15 21 f 1.736000  0.4519000     1.315000  0.5770000     2.158000  0.6955000     -0.8431000     0.9037000 
1 1 1 19 15 22 o 1.576000  0.4583000     1.783000  0.6523000     1.368000  0.6441000     0.4154000      0.9167000 
1 1 1 19 15 23 o 1.521000  0.4371000     1.930000  0.6728000     1.111000  0.5582000     0.8183000      0.8742000 
1 1 1 19 16 0  o 12.12000  0.1750000     12.12000  0.1750000     12.12000  0.1750000     0.000000       0.000000  
1 1 1 19 16 1  o 14.15000  0.1346000     14.19000  0.1904000     14.10000  0.1903000     0.8774000E-01  0.2692000 
1 1 1 19 16 2  o 11.10000  0.1208000     11.11000  0.1702000     11.09000  0.1714000     0.1195000E-01  0.2416000 
1 1 1 19 16 3  o 4.610000  0.1384000     4.695000  0.1956000     4.525000  0.1958000     0.1701000      0.2768000 
1 1 1 19 16 4  o 27.07000  0.2218000     26.73000  0.3099000     27.41000  0.3173000     -0.6789000     0.4435000 
1 1 1 19 16 5  o 12.34000  0.1343000     12.37000  0.1893000     12.32000  0.1905000     0.4807000E-01  0.2685000 
1 1 1 19 16 6  o 1.640000  0.3508000     1.691000  0.4948000     1.589000  0.4975000     0.1014000      0.7016000 
1 1 1 19 16 7  o 11.17000  0.1908000     11.20000  0.2758000     11.15000  0.2637000     0.5311000E-01  0.3816000 
1 1 1 19 16 8  o 9.308000  0.1568000     9.277000  0.2491000     9.338000  0.1906000     -0.6089000E-01 0.3137000 
1 1 1 19 16 9  o 5.760000  0.2432000     5.704000  0.3383000     5.817000  0.3495000     -0.1133000     0.4864000 
1 1 1 19 16 10 o 10.96000  0.1726000     11.06000  0.2401000     10.86000  0.2480000     0.1972000      0.3452000 
1 1 1 19 16 11 o 9.629000  0.1869000     9.484000  0.2629000     9.773000  0.2658000     -0.2893000     0.3738000 
1 1 1 19 16 12 o 4.282000  0.3291000     4.612000  0.4152000     3.953000  0.5106000     0.6589000      0.6582000 
1 1 1 19 16 13 o 3.981000  0.6150000     4.424000  0.4927000     3.538000  1.127000      0.8861000      1.230000  
1 1 1 19 16 14 o 5.264000  0.3082000     5.471000  0.4057000     5.058000  0.4641000     0.4133000      0.6164000 
1 1 1 19 16 15 o 4.898000  0.6965000     4.919000  1.266000      4.876000  0.5810000     0.4297000E-01  1.393000  
1 1 1 19 16 16 o 4.182000  0.3880000     4.600000  0.4762000     3.764000  0.6128000     0.8362000      0.7761000 
1 1 1 19 16 17 o 2.875000  0.5011000     2.669000  0.7190000     3.081000  0.6981000     -0.4122000     1.002000  
1 1 1 19 16 18 o 1.674000  0.5012000     1.512000  0.6624000     1.836000  0.7523000     -0.3237000     1.002000  
1 1 1 19 16 19 o 2.497000  0.5080000     2.611000  0.6914000     2.384000  0.7444000     0.2271000      1.016000  
1 1 1 19 16 20 o 1.936000  0.5276000     1.991000  0.7556000     1.880000  0.7367000     0.1104000      1.055000  
1 1 1 19 16 21 o 1.523000  0.4566000     1.587000  0.6552000     1.460000  0.6360000     0.1274000      0.9131000 
1 1 1 19 16 22 o 1.560000  0.4534000     1.323000  0.5916000     1.797000  0.6873000     -0.4739000     0.9069000 
1 1 1 19 16 23 o 1.844000  0.5441000     1.166000  0.5588000     2.523000  0.9338000     -1.356000      1.088000  
1 1 1 19 17 0  o 3.709000  0.2210000     3.709000  0.2210000     3.709000  0.2210000     0.000000       0.000000  
1 1 1 19 17 1  o 10.37000  0.1196000     10.31000  0.1680000     10.43000  0.1704000     -0.1218000     0.2393000 
1 1 1 19 17 2  o 19.97000  0.1718000     20.01000  0.2434000     19.93000  0.2425000     0.7812000E-01  0.3436000 
1 1 1 19 17 3  o 17.35000  0.1561000     17.41000  0.2211000     17.28000  0.2203000     0.1292000      0.3121000 
1 1 1 19 17 4  o 18.18000  0.1632000     18.06000  0.2294000     18.30000  0.2323000     -0.2353000     0.3265000 
1 1 1 19 17 5  o 12.18000  0.1350000     12.23000  0.1914000     12.14000  0.1905000     0.9193000E-01  0.2700000 
1 1 1 19 17 6  o 4.888000  0.1634000     5.096000  0.2269000     4.680000  0.2352000     0.4166000      0.3268000 
1 1 1 19 17 7  o 7.272000  0.1705000     7.281000  0.2029000     7.262000  0.2740000     0.1922000E-01  0.3409000 
1 1 1 19 17 8  o 4.900000  0.1848000     4.820000  0.2591000     4.981000  0.2634000     -0.1610000     0.3695000 
1 1 1 19 17 9  o 14.83000  0.2789000     14.56000  0.5150000     15.10000  0.2143000     -0.5428000     0.5578000 
1 1 1 19 17 10 o 3.425000  0.4570000     2.599000  0.8194000     4.251000  0.4052000     -1.652000      0.9141000 
1 1 1 19 17 11 o 5.336000  0.2556000     5.466000  0.3533000     5.205000  0.3695000     0.2600000      0.5112000 
1 1 1 19 17 12 o 4.622000  0.2927000     4.490000  0.3987000     4.754000  0.4287000     -0.2643000     0.5855000 
1 1 1 19 17 13 o 3.036000  0.6079000     2.428000  0.7090000     3.644000  0.9877000     -1.216000      1.216000  
1 1 1 19 17 14 o 2.807000  0.5241000     2.914000  0.7090000     2.699000  0.7721000     0.2146000      1.048000  
1 1 1 19 17 15 o 3.201000  0.7207000     3.265000  1.228000      3.137000  0.7557000     0.1278000      1.441000  
1 1 1 19 17 16 f 1.752000  0.5160000     1.849000  0.7372000     1.656000  0.7223000     0.1929000      1.032000  
1 1 1 19 17 17 o 3.606000  0.4344000     3.674000  0.5737000     3.538000  0.6525000     0.1361000      0.8689000 
1 1 1 19 17 18 o 1.914000  0.5973000     2.003000  0.8607000     1.825000  0.8283000     0.1781000      1.195000  
1 1 1 19 17 19 o 1.559000  0.4558000     1.875000  0.7015000     1.242000  0.5823000     0.6325000      0.9117000 
1 1 1 19 17 20 o 1.536000  0.4806000     1.461000  0.6690000     1.611000  0.6902000     -0.1507000     0.9612000 
1 1 1 19 17 21 o 3.311000  0.4089000     2.708000  0.6569000     3.914000  0.4871000     -1.206000      0.8178000 
1 1 1 19 17 22 o 1.367000  0.4296000     1.336000  0.5972000     1.398000  0.6178000     -0.6208000E-01 0.8592000 
1 1 1 19 17 23 o 1.543000  0.5239000     1.315000  0.6073000     1.772000  0.8537000     -0.4564000     1.048000  
1 1 1 19 18 0  o 0.5572000 0.3851000     0.5572000 0.3851000     0.5572000 0.3851000     -0.000000      0.000000  
1 1 1 19 18 1  o 1.783000  0.2983000     1.867000  0.4045000     1.699000  0.4386000     0.1688000      0.5966000 
1 1 1 19 18 2  o 7.952000  0.1195000     8.127000  0.1691000     7.778000  0.1690000     0.3491000      0.2391000 
1 1 1 19 18 3  o 12.18000  0.1310000     12.15000  0.1846000     12.22000  0.1859000     -0.7301000E-01 0.2620000 
1 1 1 19 18 4  o 8.435000  0.1258000     8.343000  0.1771000     8.527000  0.1787000     -0.1848000     0.2517000 
1 1 1 19 18 5  o 13.82000  0.1438000     13.74000  0.2030000     13.91000  0.2037000     -0.1664000     0.2876000 
1 1 1 19 18 6  o 8.190000  0.1765000     8.146000  0.2729000     8.233000  0.2238000     -0.8659000E-01 0.3529000 
1 1 1 19 18 7  o 10.50000  0.1413000     10.46000  0.2005000     10.53000  0.1990000     -0.6569000E-01 0.2825000 
1 1 1 19 18 8  o 5.547000  0.2308000     5.946000  0.2350000     5.149000  0.3974000     0.7969000      0.4617000 
1 1 1 19 18 9  o 7.844000  0.1563000     8.095000  0.2197000     7.594000  0.2223000     0.5013000      0.3125000 
1 1 1 19 18 10 o 2.168000  0.4368000     2.185000  0.6603000     2.151000  0.5718000     0.3382000E-01  0.8735000 
1 1 1 19 18 11 o 8.439000  0.1997000     8.537000  0.2765000     8.340000  0.2883000     0.1969000      0.3994000 
1 1 1 19 18 12 o 4.870000  0.2923000     4.802000  0.4015000     4.938000  0.4249000     -0.1355000     0.5846000 
1 1 1 19 18 13 o 7.333000  0.2411000     7.560000  0.3250000     7.106000  0.3561000     0.4541000      0.4821000 
1 1 1 19 18 14 o 7.579000  0.2507000     7.982000  0.3305000     7.177000  0.3770000     0.8044000      0.5013000 
1 1 1 19 18 15 o 8.706000  0.2974000     8.442000  0.4886000     8.969000  0.3392000     -0.5269000     0.5948000 
1 1 1 19 18 16 o 3.460000  0.4540000     3.706000  0.5695000     3.214000  0.7072000     0.4914000      0.9080000 
1 1 1 19 18 17 o 4.523000  0.3605000     4.928000  0.4405000     4.117000  0.5707000     0.8104000      0.7209000 
1 1 1 19 18 18 o 1.999000  0.5714000     1.920000  0.7175000     2.078000  0.8895000     -0.1578000     1.143000  
1 1 1 19 18 19 o 2.357000  0.5216000     2.196000  0.7173000     2.518000  0.7575000     -0.3215000     1.043000  
1 1 1 19 18 20 o 1.750000  0.5625000     1.898000  0.9058000     1.602000  0.6673000     0.2953000      1.125000  
1 1 1 19 18 21 o 1.232000  0.3996000     1.051000  0.5088000     1.413000  0.6162000     -0.3623000     0.7991000 
1 1 1 19 18 22 o 2.518000  0.4818000     2.513000  0.6765000     2.523000  0.6863000     -0.9993000E-02 0.9636000 
1 1 1 19 18 23 o 1.561000  0.5028000     1.328000  0.5960000     1.795000  0.8100000     -0.4671000     1.006000  
1 1 1 19 19 0  f 11.93000  0.1809000     11.93000  0.1809000     11.93000  0.1809000     0.000000       0.000000  
1 1 1 19 19 1  o 15.01000  0.1431000     15.13000  0.2035000     14.89000  0.2012000     0.2413000      0.2862000 
1 1 1 19 19 2  o 9.570000  0.1232000     9.607000  0.1739000     9.533000  0.1745000     0.7406000E-01  0.2464000 
1 1 1 19 19 3  o 17.04000  0.1570000     17.03000  0.2212000     17.06000  0.2229000     -0.3519000E-01 0.3140000 
1 1 1 19 19 4  o 8.563000  0.1293000     8.661000  0.1818000     8.465000  0.1839000     0.1962000      0.2586000 
1 1 1 19 19 5  o 11.90000  0.1376000     11.99000  0.1950000     11.81000  0.1942000     0.1868000      0.2752000 
1 1 1 19 19 6  o 11.31000  0.1717000     11.34000  0.2240000     11.27000  0.2602000     0.7024000E-01  0.3434000 
1 1 1 19 19 7  o 22.96000  0.2018000     22.91000  0.2853000     23.01000  0.2854000     -0.1011000     0.4035000 
1 1 1 19 19 8  o 13.48000  0.2030000     13.38000  0.3097000     13.57000  0.2625000     -0.1944000     0.4059000 
1 1 1 19 19 9  o 3.417000  0.2653000     3.174000  0.3966000     3.660000  0.3526000     -0.4858000     0.5307000 
1 1 1 19 19 10 o 11.17000  0.1805000     11.24000  0.2717000     11.10000  0.2377000     0.1415000      0.3610000 
1 1 1 19 19 11 o 7.221000  0.2108000     7.256000  0.2859000     7.187000  0.3099000     0.6889000E-01  0.4216000 
1 1 1 19 19 12 o 2.276000  0.5004000     2.646000  0.6714000     1.907000  0.7422000     0.7389000      1.001000  
1 1 1 19 19 13 f 8.865000  0.2215000     8.970000  0.3038000     8.761000  0.3223000     0.2094000      0.4429000 
1 1 1 19 19 14 o 4.498000  0.4085000     4.442000  0.5087000     4.553000  0.6393000     -0.1111000     0.8170000 
1 1 1 19 19 15 o 2.570000  0.5450000     2.252000  0.7687000     2.888000  0.7729000     -0.6360000     1.090000  
1 1 1 19 19 16 o 2.269000  0.5478000     2.063000  0.7572000     2.475000  0.7917000     -0.4119000     1.096000  
1 1 1 19 19 17 o 2.437000  0.5306000     2.077000  0.7354000     2.797000  0.7651000     -0.7205000     1.061000  
1 1 1 19 19 18 o 2.524000  0.5619000     2.853000  0.6711000     2.195000  0.9015000     0.6582000      1.124000  
1 1 1 19 19 19 o 1.926000  0.4841000     2.379000  0.7161000     1.474000  0.6515000     0.9043000      0.9681000 
1 1 1 19 19 20 o 2.769000  0.5906000     2.795000  0.9668000     2.742000  0.6785000     0.5307000E-01  1.181000  
1 1 1 19 19 21 o 1.166000  0.3897000     1.089000  0.5247000     1.242000  0.5764000     -0.1534000     0.7794000 
1 1 1 19 19 22 o 2.417000  0.4895000     2.278000  0.6881000     2.555000  0.6964000     -0.2769000     0.9790000 
1 1 1 19 19 23 o 1.925000  0.4789000     2.499000  0.6937000     1.351000  0.6605000     1.148000       0.9579000 
1 1 1 19 20 0  o 11.57000  0.1825000     11.57000  0.1825000     11.57000  0.1825000     -0.000000      0.000000  
1 1 1 19 20 1  o 21.07000  0.1812000     21.20000  0.2574000     20.95000  0.2551000     0.2546000      0.3624000 
1 1 1 19 20 2  o 25.18000  0.2098000     25.37000  0.2982000     24.99000  0.2951000     0.3878000      0.4195000 
1 1 1 19 20 3  o 12.23000  0.1347000     12.26000  0.1894000     12.19000  0.1917000     0.6897000E-01  0.2695000 
1 1 1 19 20 4  o 17.04000  0.1603000     16.93000  0.2256000     17.15000  0.2278000     -0.2257000     0.3206000 
1 1 1 19 20 5  o 15.58000  0.2011000     16.03000  0.3148000     15.13000  0.2502000     0.9047000      0.4021000 
1 1 1 19 20 6  o 16.73000  0.1633000     16.79000  0.2311000     16.67000  0.2308000     0.1139000      0.3266000 
1 1 1 19 20 7  o 24.63000  0.2659000     24.57000  0.3011000     24.68000  0.4383000     -0.1087000     0.5318000 
1 1 1 19 20 8  o 10.36000  0.1657000     10.57000  0.2538000     10.15000  0.2129000     0.4189000      0.3313000 
1 1 1 19 20 9  o 13.91000  0.1606000     13.63000  0.2247000     14.20000  0.2296000     -0.5672000     0.3212000 
1 1 1 19 20 10 o 7.049000  0.1750000     7.175000  0.2475000     6.922000  0.2476000     0.2534000      0.3501000 
1 1 1 19 20 11 o 5.075000  0.2452000     5.285000  0.3733000     4.866000  0.3179000     0.4191000      0.4903000 
1 1 1 19 20 12 o 8.440000  0.3332000     8.310000  0.3145000     8.569000  0.5876000     -0.2595000     0.6665000 
1 1 1 19 20 13 o 9.185000  0.2200000     9.408000  0.2990000     8.962000  0.3228000     0.4461000      0.4400000 
1 1 1 19 20 14 o 5.717000  0.3711000     6.154000  0.4864000     5.280000  0.5606000     0.8744000      0.7422000 
1 1 1 19 20 15 o 3.572000  0.4883000     3.868000  0.6222000     3.276000  0.7527000     0.5917000      0.9766000 
1 1 1 19 20 16 o 6.433000  0.2785000     6.880000  0.3497000     5.986000  0.4335000     0.8939000      0.5570000 
1 1 1 19 20 17 o 5.129000  0.3001000     4.774000  0.4150000     5.484000  0.4337000     -0.7095000     0.6003000 
1 1 1 19 20 18 o 1.477000  0.4579000     1.547000  0.6559000     1.408000  0.6392000     0.1389000      0.9159000 
1 1 1 19 20 19 o 2.274000  0.5182000     2.167000  0.7292000     2.381000  0.7366000     -0.2146000     1.036000  
1 1 1 19 20 20 o 1.350000  0.4303000     1.201000  0.5694000     1.499000  0.6452000     -0.2975000     0.8605000 
1 1 1 19 20 21 o 2.066000  0.4825000     1.665000  0.6650000     2.467000  0.6993000     -0.8021000     0.9650000 
1 1 1 19 20 22 o 1.989000  0.4907000     1.930000  0.6887000     2.049000  0.6992000     -0.1197000     0.9814000 
1 1 1 19 20 23 o 1.714000  0.4771000     1.944000  0.7021000     1.484000  0.6462000     0.4603000      0.9542000 
1 1 1 19 21 0  o 2.804000  0.3219000     2.804000  0.3219000     2.804000  0.3219000     0.000000       0.000000  
1 1 1 19 21 1  o 17.95000  0.1626000     18.10000  0.2311000     17.79000  0.2288000     0.3158000      0.3252000 
1 1 1 19 21 2  o 19.17000  0.1713000     19.20000  0.2423000     19.14000  0.2423000     0.5407000E-01  0.3427000 
1 1 1 19 21 3  o 4.797000  0.1595000     4.648000  0.2292000     4.946000  0.2218000     -0.2986000     0.3189000 
1 1 1 19 21 4  o 14.76000  0.1637000     14.71000  0.2494000     14.81000  0.2120000     -0.1028000     0.3273000 
1 1 1 19 21 5  o 6.319000  0.1793000     6.395000  0.2336000     6.243000  0.2721000     0.1516000      0.3586000 
1 1 1 19 21 6  o 9.672000  0.1521000     9.758000  0.1998000     9.586000  0.2294000     0.1726000      0.3042000 
1 1 1 19 21 7  o 18.67000  0.2314000     18.76000  0.3550000     18.57000  0.2969000     0.1919000      0.4628000 
1 1 1 19 21 8  o 11.43000  0.1512000     11.33000  0.2130000     11.52000  0.2145000     -0.1881000     0.3023000 
1 1 1 19 21 9  o 9.400000  0.1576000     9.501000  0.2211000     9.298000  0.2247000     0.2034000      0.3152000 
1 1 1 19 21 10 o 4.662000  0.2452000     4.846000  0.3016000     4.477000  0.3867000     0.3688000      0.4904000 
1 1 1 19 21 11 o 8.793000  0.1876000     8.879000  0.2943000     8.707000  0.2328000     0.1721000      0.3753000 
1 1 1 19 21 12 o 8.737000  0.2876000     8.467000  0.2925000     9.007000  0.4952000     -0.5394000     0.5752000 
1 1 1 19 21 13 o 4.065000  0.3852000     3.980000  0.5092000     4.149000  0.5781000     -0.1690000     0.7704000 
1 1 1 19 21 14 o 5.634000  0.6280000     4.444000  1.193000      6.824000  0.3919000     -2.380000      1.256000  
1 1 1 19 21 15 o 8.848000  0.2315000     8.495000  0.3218000     9.202000  0.3330000     -0.7067000     0.4631000 
1 1 1 19 21 16 o 3.315000  0.4750000     3.338000  0.6193000     3.292000  0.7205000     0.4594000E-01  0.9501000 
1 1 1 19 21 17 o 1.814000  0.4790000     2.319000  0.7259000     1.309000  0.6252000     1.010000       0.9580000 
1 1 1 19 21 18 o 1.393000  0.4449000     1.268000  0.5893000     1.519000  0.6666000     -0.2506000     0.8897000 
1 1 1 19 21 19 o 1.876000  0.4964000     2.193000  0.7171000     1.560000  0.6866000     0.6328000      0.9928000 
1 1 1 19 21 20 o 2.099000  0.5081000     1.972000  0.7058000     2.225000  0.7310000     -0.2538000     1.016000  
1 1 1 19 21 21 o 1.587000  0.4372000     2.033000  0.6832000     1.141000  0.5458000     0.8914000      0.8744000 
1 1 1 19 21 22 o 1.305000  0.4188000     1.387000  0.6133000     1.223000  0.5706000     0.1641000      0.8377000 
1 1 1 19 21 23 o 1.163000  0.3884000     1.292000  0.5895000     1.035000  0.5058000     0.2565000      0.7767000 
1 1 1 19 22 0  o 6.389000  0.1951000     6.389000  0.1951000     6.389000  0.1951000     -0.000000      0.000000  
1 1 1 19 22 1  o 3.621000  0.1869000     3.842000  0.2499000     3.400000  0.2781000     0.4421000      0.3739000 
1 1 1 19 22 2  o 7.970000  0.1326000     7.924000  0.1870000     8.017000  0.1880000     -0.9343000E-01 0.2651000 
1 1 1 19 22 3  o 10.60000  0.1458000     10.51000  0.2217000     10.68000  0.1895000     -0.1658000     0.2917000 
1 1 1 19 22 4  o 10.72000  0.1588000     10.96000  0.2237000     10.48000  0.2253000     0.4777000      0.3175000 
1 1 1 19 22 5  o 8.114000  0.1426000     8.083000  0.2008000     8.145000  0.2027000     -0.6210000E-01 0.2853000 
1 1 1 19 22 6  o 13.75000  0.2018000     13.99000  0.2446000     13.51000  0.3211000     0.4853000      0.4037000 
1 1 1 19 22 7  o 12.35000  0.1515000     12.62000  0.2163000     12.08000  0.2122000     0.5381000      0.3030000 
1 1 1 19 22 8  o 15.41000  0.1648000     15.54000  0.2334000     15.29000  0.2326000     0.2431000      0.3295000 
1 1 1 19 22 9  o 4.834000  0.2146000     5.063000  0.2932000     4.604000  0.3136000     0.4591000      0.4293000 
1 1 1 19 22 10 f 5.357000  0.2106000     5.290000  0.3012000     5.424000  0.2945000     -0.1341000     0.4213000 
1 1 1 19 22 11 o 5.411000  0.2597000     5.270000  0.4158000     5.552000  0.3111000     -0.2813000     0.5193000 
1 1 1 19 22 12 o 12.18000  0.1925000     12.17000  0.3053000     12.20000  0.2345000     -0.2670000E-01 0.3850000 
1 1 1 19 22 13 o 5.297000  0.3402000     5.317000  0.4162000     5.277000  0.5383000     0.3982000E-01  0.6805000 
1 1 1 19 22 14 o 3.038000  0.6111000     3.678000  0.9247000     2.398000  0.7991000     1.281000       1.222000  
1 1 1 19 22 15 o 4.715000  0.3496000     4.462000  0.4875000     4.968000  0.5012000     -0.5066000     0.6991000 
1 1 1 19 22 16 o 2.134000  0.5357000     1.860000  0.7085000     2.409000  0.8038000     -0.5495000     1.071000  
1 1 1 19 22 17 o 1.704000  0.5003000     2.074000  0.7490000     1.334000  0.6636000     0.7399000      1.001000  
1 1 1 19 22 18 o 2.888000  0.4950000     2.636000  0.7332000     3.141000  0.6651000     -0.5057000     0.9899000 
1 1 1 19 22 19 o 2.902000  0.4944000     3.703000  0.6061000     2.100000  0.7813000     1.603000       0.9889000 
1 1 1 19 22 20 o 1.006000  0.3495000     1.137000  0.5426000     0.8751000 0.4407000     0.2621000      0.6991000 
1 1 1 19 22 21 o 1.855000  0.4580000     2.361000  0.6875000     1.348000  0.6052000     1.013000       0.9159000 
1 1 1 19 22 22 o 1.817000  0.5089000     1.788000  0.6990000     1.847000  0.7397000     -0.5909000E-01 1.018000  
1 1 1 19 23 0  o 10.42000  0.1881000     10.42000  0.1881000     10.42000  0.1881000     -0.000000      0.000000  
1 1 1 19 23 1  o 9.308000  0.1311000     9.140000  0.1860000     9.475000  0.1847000     -0.3345000     0.2621000 
1 1 1 19 23 2  f 14.73000  0.1621000     14.52000  0.2448000     14.94000  0.2126000     -0.4131000     0.3243000 
1 1 1 19 23 3  o 6.111000  0.1919000     6.405000  0.2943000     5.817000  0.2464000     0.5874000      0.3838000 
1 1 1 19 23 4  o 5.025000  0.2016000     5.110000  0.2371000     4.940000  0.3262000     0.1700000      0.4032000 
1 1 1 19 23 5  o 8.309000  0.1924000     8.308000  0.2244000     8.310000  0.3125000     -0.2036000E-02 0.3847000 
1 1 1 19 23 6  o 9.978000  0.1616000     9.979000  0.2487000     9.978000  0.2064000     0.4110000E-03  0.3232000 
1 1 1 19 23 7  o 24.28000  0.2127000     24.26000  0.3001000     24.30000  0.3016000     -0.3777000E-01 0.4254000 
1 1 1 19 23 8  o 5.728000  0.1846000     5.677000  0.2571000     5.780000  0.2649000     -0.1032000     0.3691000 
1 1 1 19 23 9  o 9.921000  0.1618000     9.982000  0.2299000     9.860000  0.2279000     0.1221000      0.3237000 
1 1 1 19 23 10 o 6.943000  0.1872000     7.087000  0.2547000     6.798000  0.2745000     0.2888000      0.3745000 
1 1 1 19 23 11 o 11.00000  0.2214000     11.24000  0.3357000     10.76000  0.2888000     0.4736000      0.4429000 
1 1 1 19 23 12 f 10.15000  0.1982000     9.769000  0.3143000     10.53000  0.2416000     -0.7580000     0.3964000 
1 1 1 19 23 13 o 6.980000  0.2977000     6.773000  0.4205000     7.186000  0.4215000     -0.4125000     0.5954000 
1 1 1 19 23 14 o 8.412000  0.2418000     8.294000  0.3420000     8.531000  0.3418000     -0.2363000     0.4835000 
1 1 1 19 23 15 o 4.614000  0.3593000     5.033000  0.4299000     4.194000  0.5758000     0.8394000      0.7186000 
1 1 1 19 23 16 o 1.973000  0.5094000     2.094000  0.7144000     1.852000  0.7264000     0.2417000      1.019000  
1 1 1 19 23 17 o 1.841000  0.5294000     2.190000  0.7599000     1.492000  0.7374000     0.6978000      1.059000  
1 1 1 19 23 18 o 2.415000  0.5195000     2.575000  0.7113000     2.255000  0.7574000     0.3195000      1.039000  
1 1 1 19 23 19 o 1.885000  0.5772000     1.912000  0.9002000     1.859000  0.7227000     0.5316000E-01  1.154000  
1 1 1 19 23 20 o 1.384000  0.4347000     1.211000  0.5662000     1.558000  0.6597000     -0.3470000     0.8694000 
1 1 1 19 23 21 o 1.213000  0.4003000     1.083000  0.5212000     1.344000  0.6078000     -0.2610000     0.8007000 
1 1 1 19 23 22 o 1.482000  0.4855000     1.330000  0.6056000     1.634000  0.7590000     -0.3037000     0.9710000 
1 1 1 19 24 0  o 11.36000  0.2280000     11.36000  0.2280000     11.36000  0.2280000     0.000000       0.000000  
1 1 1 19 24 1  o 4.910000  0.1977000     5.108000  0.2742000     4.713000  0.2848000     0.3952000      0.3953000 
1 1 1 19 24 2  o 18.00000  0.2174000     18.25000  0.2768000     17.76000  0.3354000     0.4901000      0.4348000 
1 1 1 19 24 3  o 1.351000  0.3795000     0.9679000 0.4417000     1.734000  0.6172000     -0.7658000     0.7590000 
1 1 1 19 24 4  o 7.095000  0.2005000     7.390000  0.2270000     6.800000  0.3305000     0.5898000      0.4010000 
1 1 1 19 24 5  o 5.914000  0.1825000     6.120000  0.2781000     5.709000  0.2365000     0.4108000      0.3651000 
1 1 1 19 24 6  o 17.21000  0.1702000     17.16000  0.2403000     17.25000  0.2410000     -0.8780000E-01 0.3404000 
1 1 1 19 24 7  o 14.85000  0.1611000     14.85000  0.2266000     14.86000  0.2291000     -0.1842000E-01 0.3223000 
1 1 1 19 24 8  o 11.34000  0.1570000     11.38000  0.2217000     11.31000  0.2223000     0.6523000E-01  0.3140000 
1 1 1 19 24 9  o 1.366000  0.4079000     1.297000  0.5587000     1.435000  0.5944000     -0.1373000     0.8158000 
1 1 1 19 24 10 o 3.407000  0.3321000     3.652000  0.4314000     3.162000  0.5052000     0.4899000      0.6643000 
1 1 1 19 24 11 o 6.814000  0.2379000     6.198000  0.2966000     7.430000  0.3721000     -1.231000      0.4759000 
1 1 1 19 24 12 o 5.562000  0.2372000     5.698000  0.3231000     5.426000  0.3475000     0.2719000      0.4745000 
1 1 1 19 24 13 o 5.009000  0.6537000     3.904000  1.241000      6.114000  0.4122000     -2.210000      1.307000  
1 1 1 19 24 14 o 1.967000  0.5569000     1.720000  0.7849000     2.214000  0.7904000     -0.4947000     1.114000  
1 1 1 19 24 15 o 4.004000  0.3913000     3.647000  0.5690000     4.362000  0.5372000     -0.7155000     0.7825000 
1 1 1 19 24 16 o 4.551000  0.3274000     4.346000  0.4795000     4.757000  0.4460000     -0.4105000     0.6549000 
1 1 1 19 24 17 o 1.671000  0.5094000     1.726000  0.6863000     1.615000  0.7531000     0.1113000      1.019000  
1 1 1 19 24 18 o 2.687000  0.5097000     2.873000  0.6970000     2.501000  0.7440000     0.3717000      1.019000  
1 1 1 19 24 19 o 2.532000  0.5864000     3.207000  0.9305000     1.857000  0.7138000     1.350000       1.173000  
1 1 1 19 24 20 o 1.440000  0.4358000     1.684000  0.6673000     1.196000  0.5606000     0.4879000      0.8715000 
1 1 1 19 24 21 o 1.545000  0.4570000     1.799000  0.6956000     1.292000  0.5929000     0.5070000      0.9140000 
1 1 1 19 24 22 o 1.565000  0.5112000     1.537000  0.6621000     1.593000  0.7792000     -0.5619000E-01 1.022000  
1 1 1 19 25 0  o 27.00000  0.4519000     27.00000  0.4519000     27.00000  0.4519000     -0.000000      0.000000  
1 1 1 19 25 1  o 19.21000  0.3480000     19.21000  0.3480000     ?         ?             ?              ?         
1 1 1 19 25 2  o 9.961000  0.1774000     10.02000  0.2208000     9.900000  0.2777000     0.1207000      0.3548000 
1 1 1 19 25 3  o 8.940000  0.1819000     9.175000  0.2750000     8.706000  0.2382000     0.4689000      0.3638000 
1 1 1 19 25 4  o 6.132000  0.1752000     6.004000  0.2674000     6.260000  0.2265000     -0.2561000     0.3505000 
1 1 1 19 25 5  o 18.46000  0.1757000     18.68000  0.2495000     18.25000  0.2474000     0.4283000      0.3514000 
1 1 1 19 25 6  o 7.026000  0.1594000     7.085000  0.2222000     6.967000  0.2287000     0.1175000      0.3189000 
1 1 1 19 25 7  o 11.03000  0.1529000     10.90000  0.2159000     11.15000  0.2167000     -0.2567000     0.3059000 
1 1 1 19 25 8  o 14.71000  0.1665000     14.54000  0.2362000     14.88000  0.2347000     -0.3444000     0.3330000 
1 1 1 19 25 9  o 6.877000  0.1832000     7.012000  0.2534000     6.743000  0.2647000     0.2690000      0.3664000 
1 1 1 19 25 10 o 10.26000  0.1926000     9.908000  0.3015000     10.61000  0.2397000     -0.7005000     0.3852000 
1 1 1 19 25 11 o 6.250000  0.2143000     6.134000  0.3032000     6.366000  0.3029000     -0.2320000     0.4285000 
1 1 1 19 25 12 o 8.739000  0.1983000     8.828000  0.2605000     8.651000  0.2991000     0.1771000      0.3966000 
1 1 1 19 25 13 o 3.136000  0.5813000     2.996000  1.017000      3.276000  0.5636000     -0.2793000     1.163000  
1 1 1 19 25 14 o 4.593000  0.3554000     4.328000  0.5123000     4.857000  0.4928000     -0.5289000     0.7108000 
1 1 1 19 25 15 f 2.937000  0.4752000     3.766000  0.5572000     2.109000  0.7699000     1.657000       0.9504000 
1 1 1 19 25 16 o 1.524000  0.4721000     1.518000  0.6645000     1.530000  0.6709000     -0.1169000E-01 0.9442000 
1 1 1 19 25 17 o 1.784000  0.4960000     1.724000  0.6921000     1.844000  0.7108000     -0.1196000     0.9921000 
1 1 1 19 25 18 o 1.264000  0.4187000     1.223000  0.5741000     1.306000  0.6096000     -0.8277000E-01 0.8374000 
1 1 1 19 25 19 o 1.956000  0.4675000     1.298000  0.5947000     2.614000  0.7216000     -1.316000      0.9350000 
1 1 1 19 25 20 o 1.296000  0.4182000     1.254000  0.5766000     1.338000  0.6059000     -0.8420000E-01 0.8364000 
1 1 1 19 25 21 o 1.732000  0.4458000     2.276000  0.6961000     1.187000  0.5572000     1.089000       0.8916000 
1 1 1 19 25 22 o 1.316000  0.4366000     1.399000  0.6242000     1.232000  0.6106000     0.1666000      0.8731000 
1 1 1 19 26 0  o 27.96000  0.3810000     27.96000  0.3810000     27.96000  0.3810000     0.000000       0.000000  
1 1 1 19 26 1  o 10.94000  0.1512000     11.02000  0.2281000     10.86000  0.1985000     0.1595000      0.3024000 
1 1 1 19 26 2  o 16.19000  0.1736000     16.30000  0.2639000     16.08000  0.2256000     0.2191000      0.3472000 
1 1 1 19 26 3  o 12.34000  0.1468000     12.22000  0.2074000     12.46000  0.2079000     -0.2372000     0.2936000 
1 1 1 19 26 4  o 9.165000  0.1445000     9.187000  0.2034000     9.142000  0.2054000     0.4524000E-01  0.2890000 
1 1 1 19 26 5  o 10.87000  0.1610000     10.90000  0.2098000     10.85000  0.2444000     0.4932000E-01  0.3221000 
1 1 1 19 26 6  o 5.425000  0.1833000     5.335000  0.2590000     5.515000  0.2593000     -0.1804000     0.3665000 
1 1 1 19 26 7  o 9.289000  0.1555000     9.224000  0.2216000     9.354000  0.2181000     -0.1296000     0.3109000 
1 1 1 19 26 8  o 14.08000  0.1658000     14.04000  0.2341000     14.13000  0.2349000     -0.8780000E-01 0.3317000 
1 1 1 19 26 9  f 11.84000  0.1655000     11.97000  0.2316000     11.70000  0.2364000     0.2668000      0.3309000 
1 1 1 19 26 10 o 15.88000  0.2361000     16.05000  0.3621000     15.70000  0.3031000     0.3492000      0.4721000 
1 1 1 19 26 11 o 7.727000  0.1913000     7.846000  0.2644000     7.609000  0.2766000     0.2369000      0.3826000 
1 1 1 19 26 12 o 3.293000  0.4887000     3.285000  0.5484000     3.301000  0.8090000     -0.1581000E-01 0.9774000 
1 1 1 19 26 13 o 4.847000  0.2715000     4.915000  0.3694000     4.780000  0.3979000     0.1349000      0.5429000 
1 1 1 19 26 14 o 2.085000  0.4746000     1.595000  0.6934000     2.576000  0.6480000     -0.9802000     0.9491000 
1 1 1 19 26 15 f 3.105000  0.4769000     2.885000  0.6983000     3.324000  0.6498000     -0.4385000     0.9539000 
1 1 1 19 26 16 o 1.388000  0.4484000     1.524000  0.6671000     1.251000  0.5994000     0.2725000      0.8968000 
1 1 1 19 26 17 o 1.921000  0.5106000     1.970000  0.7189000     1.873000  0.7251000     0.9696000E-01  1.021000  
1 1 1 19 26 18 o 2.402000  0.5343000     2.191000  0.7437000     2.613000  0.7673000     -0.4218000     1.069000  
1 1 1 19 26 19 f 1.725000  0.4718000     1.381000  0.6089000     2.069000  0.7207000     -0.6881000     0.9435000 
1 1 1 19 26 20 o 1.478000  0.4500000     1.317000  0.5967000     1.640000  0.6737000     -0.3233000     0.9000000 
1 1 1 19 26 21 o 1.567000  0.4634000     1.459000  0.6284000     1.676000  0.6813000     -0.2171000     0.9268000 
1 1 1 19 26 22 o 1.505000  0.4216000     0.8467000 0.4270000     2.164000  0.7270000     -1.317000      0.8431000 
1 1 1 19 27 0  o 10.66000  0.2022000     10.66000  0.2022000     10.66000  0.2022000     0.000000       0.000000  
1 1 1 19 27 1  o 14.67000  0.1541000     14.89000  0.2193000     14.46000  0.2166000     0.4340000      0.3083000 
1 1 1 19 27 2  o 12.28000  0.1462000     12.04000  0.2056000     12.51000  0.2079000     -0.4709000     0.2924000 
1 1 1 19 27 3  o 7.769000  0.1500000     7.834000  0.2111000     7.704000  0.2132000     0.1303000      0.3000000 
1 1 1 19 27 4  o 3.821000  0.2238000     3.838000  0.3134000     3.804000  0.3195000     0.3377000E-01  0.4476000 
1 1 1 19 27 5  o 17.56000  0.1733000     17.63000  0.2441000     17.49000  0.2460000     0.1395000      0.3466000 
1 1 1 19 27 6  o 5.737000  0.1843000     5.921000  0.2532000     5.553000  0.2679000     0.3679000      0.3686000 
1 1 1 19 27 7  o 2.480000  0.3720000     2.933000  0.4593000     2.028000  0.5853000     0.9046000      0.7439000 
1 1 1 19 27 8  o 6.800000  0.1846000     6.925000  0.2590000     6.675000  0.2630000     0.2498000      0.3692000 
1 1 1 19 27 9  o 8.745000  0.1944000     8.962000  0.2977000     8.527000  0.2501000     0.4350000      0.3888000 
1 1 1 19 27 10 o 6.058000  0.2257000     5.713000  0.3139000     6.404000  0.3244000     -0.6911000     0.4514000 
1 1 1 19 27 11 o 9.925000  0.1833000     10.06000  0.2550000     9.789000  0.2634000     0.2733000      0.3667000 
1 1 1 19 27 12 o 4.261000  0.3696000     4.453000  0.5676000     4.068000  0.4734000     0.3851000      0.7391000 
1 1 1 19 27 13 o 1.781000  0.4750000     2.003000  0.6880000     1.559000  0.6552000     0.4446000      0.9500000 
1 1 1 19 27 14 o 5.434000  0.2832000     5.663000  0.4360000     5.206000  0.3617000     0.4568000      0.5665000 
1 1 1 19 27 15 o 2.540000  0.5097000     2.761000  0.6865000     2.320000  0.7535000     0.4411000      1.019000  
1 1 1 19 27 16 f 1.585000  0.5331000     1.240000  0.5844000     1.930000  0.8918000     -0.6895000     1.066000  
1 1 1 19 27 17 o 2.716000  0.4964000     2.782000  0.6834000     2.651000  0.7202000     0.1312000      0.9928000 
1 1 1 19 27 18 o 1.860000  0.6007000     2.182000  0.9984000     1.537000  0.6683000     0.6452000      1.201000  
1 1 1 19 27 19 o 2.737000  0.4650000     2.882000  0.6089000     2.591000  0.7029000     0.2907000      0.9300000 
1 1 1 19 27 20 o 1.844000  0.4935000     1.656000  0.6717000     2.031000  0.7231000     -0.3743000     0.9869000 
1 1 1 19 27 21 o 1.228000  0.4054000     1.467000  0.6439000     0.9892000 0.4926000     0.4775000      0.8107000 
1 1 1 19 27 22 o 2.055000  0.6329000     1.580000  0.7132000     2.530000  1.046000      -0.9501000     1.266000  
1 1 1 19 28 0  o 9.406000  0.2039000     9.406000  0.2039000     9.406000  0.2039000     0.000000       0.000000  
1 1 1 19 28 1  o 3.898000  0.2257000     3.226000  0.3602000     4.571000  0.2720000     -1.345000      0.4513000 
1 1 1 19 28 2  o 9.339000  0.1454000     9.060000  0.2053000     9.618000  0.2058000     -0.5575000     0.2907000 
1 1 1 19 28 3  o 1.766000  0.3773000     2.149000  0.5206000     1.383000  0.5462000     0.7658000      0.7546000 
1 1 1 19 28 4  o 11.04000  0.1488000     11.10000  0.2091000     10.97000  0.2118000     0.1224000      0.2976000 
1 1 1 19 28 5  o 5.629000  0.1868000     5.968000  0.2509000     5.291000  0.2769000     0.6766000      0.3736000 
1 1 1 19 28 6  o 12.05000  0.1559000     12.26000  0.2209000     11.85000  0.2200000     0.4123000      0.3117000 
1 1 1 19 28 7  o 7.775000  0.1687000     7.893000  0.2364000     7.656000  0.2408000     0.2370000      0.3374000 
1 1 1 19 28 8  o 13.11000  0.1661000     13.14000  0.2355000     13.08000  0.2342000     0.5906000E-01  0.3322000 
1 1 1 19 28 9  o 2.343000  0.5179000     2.531000  0.7513000     2.154000  0.7130000     0.3771000      1.036000  
1 1 1 19 28 10 o 2.671000  0.4258000     2.717000  0.5899000     2.626000  0.6141000     0.9108000E-01  0.8516000 
1 1 1 19 28 11 o 15.02000  0.2384000     14.77000  0.2848000     15.28000  0.3823000     -0.5097000     0.4768000 
1 1 1 19 28 12 o 1.278000  0.4078000     1.415000  0.6063000     1.141000  0.5456000     0.2736000      0.8157000 
1 1 1 19 28 13 o 5.913000  0.2392000     6.160000  0.3137000     5.666000  0.3612000     0.4944000      0.4784000 
1 1 1 19 28 14 o 1.692000  0.4683000     1.682000  0.6627000     1.701000  0.6620000     -0.1919000E-01 0.9367000 
1 1 1 19 28 15 o 3.122000  0.4470000     2.919000  0.7239000     3.326000  0.5246000     -0.4072000     0.8940000 
1 1 1 19 28 16 o 1.457000  0.4635000     1.388000  0.6230000     1.525000  0.6865000     -0.1367000     0.9271000 
1 1 1 19 28 17 o 2.354000  0.5001000     2.024000  0.7149000     2.685000  0.6996000     -0.6607000     1.000000  
1 1 1 19 28 18 o 1.438000  0.4687000     1.391000  0.6788000     1.485000  0.6466000     -0.9458000E-01 0.9374000 
1 1 1 19 28 19 o 1.380000  0.4245000     1.048000  0.5094000     1.712000  0.6791000     -0.6631000     0.8489000 
1 1 1 19 28 20 o 2.289000  0.4709000     1.742000  0.6750000     2.836000  0.6569000     -1.095000      0.9419000 
1 1 1 19 28 21 o 1.444000  0.4736000     1.449000  0.6445000     1.439000  0.6942000     0.9487000E-02  0.9472000 
1 1 1 19 29 0  o 10.31000  0.2072000     10.31000  0.2072000     10.31000  0.2072000     -0.000000      0.000000  
1 1 1 19 29 1  o 1.395000  0.3714000     1.652000  0.5510000     1.139000  0.4981000     0.5136000      0.7427000 
1 1 1 19 29 2  o 11.92000  0.1490000     11.87000  0.2095000     11.97000  0.2120000     -0.9250000E-01 0.2981000 
1 1 1 19 29 3  o 6.734000  0.1639000     6.756000  0.2302000     6.712000  0.2332000     0.4395000E-01  0.3277000 
1 1 1 19 29 4  o 21.13000  0.2104000     21.06000  0.3188000     21.20000  0.2746000     -0.1345000     0.4208000 
1 1 1 19 29 5  o 4.131000  0.2329000     3.749000  0.3536000     4.513000  0.3032000     -0.7633000     0.4658000 
1 1 1 19 29 6  f 12.81000  0.1605000     13.01000  0.2276000     12.61000  0.2264000     0.4008000      0.3210000 
1 1 1 19 29 7  o 12.83000  0.1637000     12.97000  0.2307000     12.68000  0.2324000     0.2929000      0.3275000 
1 1 1 19 29 8  o 4.760000  0.2639000     4.650000  0.4060000     4.870000  0.3373000     -0.2197000     0.5279000 
1 1 1 19 29 9  o 2.650000  0.4737000     2.387000  0.6421000     2.913000  0.6966000     -0.5261000     0.9474000 
1 1 1 19 29 10 o 5.005000  0.2702000     4.816000  0.3689000     5.194000  0.3948000     -0.3780000     0.5404000 
1 1 1 19 29 11 o 13.07000  0.2366000     12.69000  0.3563000     13.44000  0.3115000     -0.7559000     0.4733000 
1 1 1 19 29 12 o 1.858000  0.4851000     1.654000  0.6591000     2.061000  0.7120000     -0.4066000     0.9703000 
1 1 1 19 29 13 o 2.209000  0.4800000     1.878000  0.6698000     2.540000  0.6878000     -0.6617000     0.9601000 
1 1 1 19 29 14 o 2.343000  0.4839000     2.198000  0.6942000     2.489000  0.6743000     -0.2912000     0.9678000 
1 1 1 19 29 15 o 1.990000  0.5248000     1.912000  0.7760000     2.068000  0.7067000     -0.1553000     1.050000  
1 1 1 19 29 16 f 3.356000  0.4263000     3.343000  0.5839000     3.370000  0.6213000     -0.2681000E-01 0.8526000 
1 1 1 19 29 17 o 2.022000  0.5195000     1.415000  0.6621000     2.628000  0.8008000     -1.213000      1.039000  
1 1 1 19 29 18 o 2.758000  0.4649000     2.213000  0.7211000     3.303000  0.5869000     -1.090000      0.9297000 
1 1 1 19 29 19 o 1.744000  0.4846000     1.612000  0.6685000     1.876000  0.7017000     -0.2638000     0.9692000 
1 1 1 19 29 20 o 1.187000  0.3930000     1.037000  0.5045000     1.337000  0.6028000     -0.3007000     0.7860000 
1 1 1 19 29 21 o 1.486000  0.4824000     1.583000  0.6905000     1.388000  0.6739000     0.1945000      0.9648000 
1 1 1 19 30 0  f 4.648000  0.2908000     4.648000  0.2908000     4.648000  0.2908000     0.000000       0.000000  
1 1 1 19 30 1  o 7.924000  0.1534000     8.081000  0.2163000     7.766000  0.2176000     0.3150000      0.3069000 
1 1 1 19 30 2  o 8.541000  0.1519000     8.458000  0.2141000     8.624000  0.2155000     -0.1664000     0.3038000 
1 1 1 19 30 3  o 2.754000  0.3235000     2.715000  0.4643000     2.793000  0.4506000     -0.7814000E-01 0.6471000 
1 1 1 19 30 4  o 9.744000  0.1548000     9.919000  0.2184000     9.569000  0.2193000     0.3499000      0.3095000 
1 1 1 19 30 5  f 13.43000  0.1614000     13.25000  0.2288000     13.61000  0.2278000     -0.3636000     0.3229000 
1 1 1 19 30 6  o 16.34000  0.1741000     16.82000  0.2491000     15.87000  0.2434000     0.9496000      0.3483000 
1 1 1 19 30 7  o 14.65000  0.1697000     14.44000  0.2373000     14.87000  0.2427000     -0.4294000     0.3394000 
1 1 1 19 30 8  o 8.512000  0.2288000     8.337000  0.3523000     8.686000  0.2921000     -0.3486000     0.4576000 
1 1 1 19 30 9  o 7.479000  0.1949000     7.546000  0.2757000     7.413000  0.2757000     0.1335000      0.3899000 
1 1 1 19 30 10 o 9.013000  0.2460000     9.137000  0.2829000     8.889000  0.4026000     0.2475000      0.4921000 
1 1 1 19 30 11 o 5.499000  0.2434000     5.481000  0.3397000     5.517000  0.3486000     -0.3626000E-01 0.4868000 
1 1 1 19 30 12 o 5.998000  0.2335000     5.991000  0.3266000     6.006000  0.3338000     -0.1415000E-01 0.4669000 
1 1 1 19 30 13 o 4.926000  0.2726000     4.762000  0.3832000     5.091000  0.3878000     -0.3288000     0.5452000 
1 1 1 19 30 14 o 6.138000  0.2420000     6.192000  0.3423000     6.084000  0.3421000     0.1073000      0.4839000 
1 1 1 19 30 15 o 1.917000  0.5407000     1.817000  0.7558000     2.016000  0.7735000     -0.1989000     1.081000  
1 1 1 19 30 16 o 4.157000  0.3604000     3.955000  0.6009000     4.360000  0.3981000     -0.4055000     0.7208000 
1 1 1 19 30 17 o 2.000000  0.5265000     2.586000  0.8333000     1.413000  0.6439000     1.173000       1.053000  
1 1 1 19 30 18 o 1.385000  0.4264000     1.095000  0.5255000     1.675000  0.6717000     -0.5796000     0.8528000 
1 1 1 19 30 19 o 2.160000  0.4994000     1.824000  0.7035000     2.496000  0.7091000     -0.6720000     0.9989000 
1 1 1 19 30 20 o 1.406000  0.4353000     1.113000  0.5320000     1.700000  0.6893000     -0.5872000     0.8707000 
1 1 1 19 30 21 o 1.247000  0.4107000     1.390000  0.6198000     1.105000  0.5389000     0.2850000      0.8213000 
1 1 1 19 31 0  o 23.57000  0.2944000     23.57000  0.2944000     23.57000  0.2944000     -0.000000      0.000000  
1 1 1 19 31 1  o 9.784000  0.1514000     9.728000  0.2153000     9.840000  0.2130000     -0.1120000     0.3028000 
1 1 1 19 31 2  o 9.212000  0.1668000     9.420000  0.2518000     9.004000  0.2189000     0.4166000      0.3337000 
1 1 1 19 31 3  f 7.830000  0.1610000     7.802000  0.2279000     7.859000  0.2274000     -0.5698000E-01 0.3219000 
1 1 1 19 31 4  o 3.135000  0.3036000     3.357000  0.3947000     2.913000  0.4614000     0.4443000      0.6072000 
1 1 1 19 31 5  o 4.965000  0.2144000     4.764000  0.3120000     5.167000  0.2941000     -0.4036000     0.4288000 
1 1 1 19 31 6  o 8.553000  0.1696000     8.568000  0.2374000     8.537000  0.2422000     0.3031000E-01  0.3391000 
1 1 1 19 31 7  o 5.370000  0.2452000     5.260000  0.3825000     5.480000  0.3067000     -0.2201000     0.4903000 
1 1 1 19 31 8  o 5.317000  0.2406000     4.948000  0.3433000     5.686000  0.3372000     -0.7377000     0.4812000 
1 1 1 19 31 9  o 6.725000  0.2219000     6.783000  0.2903000     6.667000  0.3358000     0.1161000      0.4439000 
1 1 1 19 31 10 o 5.886000  0.2736000     6.060000  0.4264000     5.712000  0.3431000     0.3474000      0.5472000 
1 1 1 19 31 11 o 3.596000  0.3549000     3.813000  0.4644000     3.379000  0.5369000     0.4342000      0.7098000 
1 1 1 19 31 12 o 6.345000  0.2297000     6.345000  0.3182000     6.345000  0.3314000     -0.5102000E-03 0.4595000 
1 1 1 19 31 13 o 4.081000  0.3220000     3.952000  0.4479000     4.211000  0.4627000     -0.2594000     0.6440000 
1 1 1 19 31 14 o 5.754000  0.2536000     5.442000  0.3682000     6.066000  0.3488000     -0.6241000     0.5072000 
1 1 1 19 31 15 o 3.295000  0.4780000     3.550000  0.5352000     3.039000  0.7921000     0.5108000      0.9559000 
1 1 1 19 31 16 o 1.975000  0.4828000     2.660000  0.7772000     1.289000  0.5731000     1.370000       0.9656000 
1 1 1 19 31 17 o 1.960000  0.5937000     2.123000  0.9617000     1.796000  0.6964000     0.3267000      1.187000  
1 1 1 19 31 18 o 1.797000  0.4891000     1.867000  0.6932000     1.727000  0.6903000     0.1400000      0.9783000 
1 1 1 19 31 19 o 1.687000  0.4588000     1.304000  0.5880000     2.069000  0.7044000     -0.7646000     0.9176000 
1 1 1 19 31 20 o 1.170000  0.3926000     1.133000  0.5411000     1.207000  0.5690000     -0.7413000E-01 0.7852000 
1 1 1 19 31 21 o 1.383000  0.4412000     1.565000  0.6772000     1.200000  0.5658000     0.3649000      0.8825000 
1 1 1 19 32 0  o 12.53000  0.2206000     12.53000  0.2206000     12.53000  0.2206000     0.000000       0.000000  
1 1 1 19 32 1  o 25.66000  0.2233000     25.84000  0.3177000     25.47000  0.3137000     0.3735000      0.4465000 
1 1 1 19 32 2  o 3.342000  0.2824000     3.232000  0.4157000     3.452000  0.3823000     -0.2206000     0.5648000 
1 1 1 19 32 3  o 5.215000  0.2018000     5.000000  0.2905000     5.430000  0.2802000     -0.4300000     0.4037000 
1 1 1 19 32 4  o 3.752000  0.2635000     4.042000  0.3441000     3.462000  0.3992000     0.5800000      0.5270000 
1 1 1 19 32 5  f 8.884000  0.1665000     8.938000  0.2344000     8.829000  0.2366000     0.1089000      0.3331000 
1 1 1 19 32 6  o 11.29000  0.1826000     11.17000  0.2777000     11.40000  0.2372000     -0.2312000     0.3652000 
1 1 1 19 32 7  o 10.51000  0.2113000     9.902000  0.2735000     11.12000  0.3222000     -1.217000      0.4226000 
1 1 1 19 32 8  o 5.948000  0.2322000     5.785000  0.3058000     6.112000  0.3494000     -0.3266000     0.4644000 
1 1 1 19 32 9  o 5.273000  0.3269000     5.097000  0.4957000     5.449000  0.4263000     -0.3520000     0.6538000 
1 1 1 19 32 10 o 4.491000  0.2944000     5.058000  0.3705000     3.924000  0.4577000     1.135000       0.5888000 
1 1 1 19 32 11 o 5.855000  0.2375000     5.727000  0.3396000     5.984000  0.3321000     -0.2567000     0.4750000 
1 1 1 19 32 12 o 4.700000  0.2847000     4.702000  0.3995000     4.698000  0.4056000     0.3901000E-02  0.5693000 
1 1 1 19 32 13 o 1.752000  0.4852000     1.635000  0.6645000     1.869000  0.7072000     -0.2343000     0.9705000 
1 1 1 19 32 14 o 1.821000  0.5031000     1.608000  0.7049000     2.033000  0.7182000     -0.4250000     1.006000  
1 1 1 19 32 15 o 1.632000  0.4465000     1.206000  0.5636000     2.058000  0.6927000     -0.8519000     0.8930000 
1 1 1 19 32 16 o 1.957000  0.5174000     2.000000  0.7749000     1.914000  0.6859000     0.8683000E-01  1.035000  
1 1 1 19 32 17 o 1.833000  0.4246000     1.023000  0.5010000     2.642000  0.6857000     -1.620000      0.8492000 
1 1 1 19 32 18 o 1.737000  0.4431000     2.287000  0.6880000     1.186000  0.5585000     1.101000       0.8862000 
1 1 1 19 32 19 o 1.505000  0.4375000     1.865000  0.6831000     1.144000  0.5468000     0.7212000      0.8750000 
1 1 1 19 32 20 o 1.672000  0.4833000     2.038000  0.7469000     1.306000  0.6135000     0.7324000      0.9665000 
1 1 1 19 33 0  o 8.251000  0.2345000     8.251000  0.2345000     8.251000  0.2345000     0.000000       0.000000  
1 1 1 19 33 1  o 13.31000  0.1608000     13.30000  0.2274000     13.32000  0.2274000     -0.2494000E-01 0.3216000 
1 1 1 19 33 2  o 7.510000  0.1702000     7.444000  0.2393000     7.575000  0.2420000     -0.1309000     0.3403000 
1 1 1 19 33 3  o 3.209000  0.3145000     3.572000  0.3908000     2.846000  0.4929000     0.7255000      0.6291000 
1 1 1 19 33 4  o 7.714000  0.1742000     7.788000  0.2453000     7.640000  0.2474000     0.1486000      0.3484000 
1 1 1 19 33 5  o 8.973000  0.1692000     8.917000  0.2388000     9.029000  0.2398000     -0.1120000     0.3384000 
1 1 1 19 33 6  o 5.116000  0.2997000     5.668000  0.4270000     4.563000  0.4206000     1.105000       0.5994000 
1 1 1 19 33 7  o 6.145000  0.2219000     6.394000  0.2878000     5.897000  0.3378000     0.4973000      0.4437000 
1 1 1 19 33 8  o 14.47000  0.2351000     14.26000  0.2790000     14.68000  0.3786000     -0.4162000     0.4703000 
1 1 1 19 33 9  o 2.957000  0.4584000     3.386000  0.6424000     2.529000  0.6541000     0.8570000      0.9168000 
1 1 1 19 33 10 o 5.917000  0.2404000     5.754000  0.3532000     6.081000  0.3261000     -0.3266000     0.4807000 
1 1 1 19 33 11 f 4.685000  0.2878000     5.191000  0.3605000     4.179000  0.4487000     1.013000       0.5756000 
1 1 1 19 33 12 o 6.698000  0.2230000     7.037000  0.3072000     6.360000  0.3233000     0.6772000      0.4460000 
1 1 1 19 33 13 o 4.826000  0.2820000     4.548000  0.4175000     5.103000  0.3791000     -0.5544000     0.5640000 
1 1 1 19 33 14 o 2.726000  0.5447000     2.602000  0.7040000     2.850000  0.8313000     -0.2474000     1.089000  
1 1 1 19 33 15 o 1.566000  0.4523000     1.670000  0.6525000     1.461000  0.6265000     0.2087000      0.9046000 
1 1 1 19 33 16 f 2.240000  0.4875000     1.323000  0.5939000     3.158000  0.7733000     -1.835000      0.9750000 
1 1 1 19 33 17 o 1.895000  0.4941000     1.935000  0.7482000     1.855000  0.6455000     0.8012000E-01  0.9882000 
1 1 1 19 33 18 o 2.437000  0.4948000     2.161000  0.7147000     2.712000  0.6845000     -0.5511000     0.9896000 
1 1 1 19 33 19 o 2.357000  0.4763000     1.809000  0.6897000     2.905000  0.6571000     -1.096000      0.9526000 
1 1 1 19 33 20 o 1.523000  0.5085000     1.403000  0.6329000     1.643000  0.7960000     -0.2402000     1.017000  
1 1 1 19 34 0  o 18.94000  0.2623000     18.94000  0.2623000     18.94000  0.2623000     0.000000       0.000000  
1 1 1 19 34 1  o 19.28000  0.1875000     19.26000  0.2648000     19.30000  0.2656000     -0.3847000E-01 0.3750000 
1 1 1 19 34 2  o 5.100000  0.2146000     5.319000  0.2922000     4.880000  0.3144000     0.4392000      0.4292000 
1 1 1 19 34 3  o 3.692000  0.2790000     3.591000  0.4051000     3.794000  0.3837000     -0.2033000     0.5580000 
1 1 1 19 34 4  o 7.512000  0.1811000     7.330000  0.2582000     7.694000  0.2540000     -0.3635000     0.3623000 
1 1 1 19 34 5  o 6.932000  0.2456000     6.845000  0.3820000     7.018000  0.3088000     -0.1734000     0.4912000 
1 1 1 19 34 6  o 10.58000  0.1821000     10.62000  0.2409000     10.53000  0.2732000     0.9190000E-01  0.3642000 
1 1 1 19 34 7  o 9.128000  0.2367000     9.002000  0.2803000     9.255000  0.3814000     -0.2529000     0.4733000 
1 1 1 19 34 8  o 8.087000  0.2129000     8.279000  0.3239000     7.895000  0.2765000     0.3836000      0.4258000 
1 1 1 19 34 9  o 6.177000  0.2262000     5.967000  0.3286000     6.387000  0.3108000     -0.4201000     0.4524000 
1 1 1 19 34 10 o 4.008000  0.3201000     4.073000  0.4310000     3.944000  0.4733000     0.1286000      0.6402000 
1 1 1 19 34 11 o 4.235000  0.3089000     4.387000  0.4200000     4.083000  0.4530000     0.3045000      0.6178000 
1 1 1 19 34 12 o 4.131000  0.3228000     4.285000  0.4456000     3.976000  0.4672000     0.3091000      0.6456000 
1 1 1 19 34 13 o 5.016000  0.2760000     5.094000  0.3848000     4.938000  0.3958000     0.1563000      0.5520000 
1 1 1 19 34 14 o 1.692000  0.4721000     1.967000  0.6943000     1.416000  0.6399000     0.5512000      0.9442000 
1 1 1 19 34 15 o 2.607000  0.4394000     3.131000  0.5386000     2.084000  0.6944000     1.047000       0.8788000 
1 1 1 19 34 16 o 3.260000  0.4138000     3.424000  0.6066000     3.096000  0.5631000     0.3285000      0.8277000 
1 1 1 19 34 17 o 1.135000  0.3850000     1.248000  0.5953000     1.022000  0.4883000     0.2264000      0.7700000 
1 1 1 19 34 18 o 1.428000  0.4257000     1.869000  0.6980000     0.9871000 0.4877000     0.8814000      0.8515000 
1 1 1 19 34 19 o 1.335000  0.4265000     1.284000  0.5853000     1.386000  0.6207000     -0.1020000     0.8531000 
1 1 1 19 34 20 o 1.767000  0.4993000     1.737000  0.6900000     1.797000  0.7220000     -0.6011000E-01 0.9986000 
1 1 1 19 35 0  o 14.37000  0.2387000     14.37000  0.2387000     14.37000  0.2387000     0.000000       0.000000  
1 1 1 19 35 1  o 9.668000  0.1660000     9.767000  0.2335000     9.568000  0.2360000     0.1993000      0.3320000 
1 1 1 19 35 2  o 18.31000  0.1848000     18.14000  0.2599000     18.49000  0.2629000     -0.3456000     0.3696000 
1 1 1 19 35 3  o 2.329000  0.4375000     2.035000  0.6808000     2.622000  0.5498000     -0.5868000     0.8751000 
1 1 1 19 35 4  o 6.634000  0.2508000     6.439000  0.3953000     6.830000  0.3089000     -0.3902000     0.5017000 
1 1 1 19 35 5  o 7.487000  0.2206000     7.337000  0.2595000     7.638000  0.3568000     -0.3007000     0.4412000 
1 1 1 19 35 6  o 7.603000  0.2511000     7.476000  0.2982000     7.729000  0.4040000     -0.2538000     0.5022000 
1 1 1 19 35 7  o 7.039000  0.2224000     7.184000  0.3342000     6.894000  0.2936000     0.2900000      0.4448000 
1 1 1 19 35 8  o 4.878000  0.2593000     5.226000  0.3369000     4.531000  0.3941000     0.6954000      0.5185000 
1 1 1 19 35 9  o 6.792000  0.2118000     6.375000  0.3048000     7.210000  0.2941000     -0.8346000     0.4235000 
1 1 1 19 35 10 o 5.494000  0.2498000     5.519000  0.3530000     5.470000  0.3534000     0.4909000E-01  0.4996000 
1 1 1 19 35 11 o 3.153000  0.4049000     1.961000  0.6861000     4.344000  0.4302000     -2.383000      0.8098000 
1 1 1 19 35 12 o 4.868000  0.2773000     4.898000  0.3878000     4.838000  0.3966000     0.5967000E-01  0.5547000 
1 1 1 19 35 13 o 1.938000  0.5198000     2.549000  0.8342000     1.328000  0.6203000     1.221000       1.040000  
1 1 1 19 35 14 o 1.614000  0.4610000     1.352000  0.6009000     1.876000  0.6992000     -0.5241000     0.9219000 
1 1 1 19 35 15 o 2.666000  0.5253000     2.995000  0.6055000     2.337000  0.8585000     0.6578000      1.051000  
1 1 1 19 35 16 o 2.522000  0.4415000     2.194000  0.6594000     2.850000  0.5873000     -0.6560000     0.8831000 
1 1 1 19 35 17 o 1.756000  0.4629000     1.788000  0.6625000     1.724000  0.6468000     0.6388000E-01  0.9259000 
1 1 1 19 35 18 o 1.335000  0.4246000     1.354000  0.6304000     1.316000  0.5689000     0.3811000E-01  0.8491000 
1 1 1 19 35 19 o 1.318000  0.4367000     1.327000  0.6185000     1.308000  0.6166000     0.1989000E-01  0.8734000 
1 1 1 19 35 20 o 0.9736000 0.3551000     0.9184000 0.4737000     1.029000  0.5291000     -0.1103000     0.7101000 
1 1 1 19 36 0  o 19.70000  0.2760000     19.70000  0.2760000     19.70000  0.2760000     0.000000       0.000000  
1 1 1 19 36 1  o 12.75000  0.1808000     12.88000  0.2756000     12.62000  0.2342000     0.2563000      0.3617000 
1 1 1 19 36 2  o 4.050000  0.3564000     4.370000  0.5264000     3.731000  0.4807000     0.6393000      0.7128000 
1 1 1 19 36 3  o 10.75000  0.2615000     10.95000  0.2699000     10.56000  0.4481000     0.3813000      0.5231000 
1 1 1 19 36 4  o 6.249000  0.3608000     7.066000  0.2774000     5.433000  0.6662000     1.633000       0.7216000 
1 1 1 19 36 5  o 5.979000  0.2496000     6.133000  0.3305000     5.826000  0.3742000     0.3072000      0.4993000 
1 1 1 19 36 6  o 6.713000  0.2283000     6.685000  0.3514000     6.741000  0.2916000     -0.5614000E-01 0.4566000 
1 1 1 19 36 7  o 1.519000  0.4268000     1.872000  0.6560000     1.167000  0.5462000     0.7046000      0.8536000 
1 1 1 19 36 8  o 1.526000  0.4435000     1.647000  0.6490000     1.404000  0.6047000     0.2434000      0.8871000 
1 1 1 19 36 9  o 8.604000  0.1955000     8.821000  0.2761000     8.388000  0.2768000     0.4332000      0.3910000 
1 1 1 19 36 10 o 8.139000  0.2011000     7.937000  0.2854000     8.341000  0.2833000     -0.4040000     0.4021000 
1 1 1 19 36 11 o 1.910000  0.4807000     1.711000  0.6721000     2.109000  0.6875000     -0.3984000     0.9614000 
1 1 1 19 36 12 o 3.018000  0.4306000     2.840000  0.6314000     3.196000  0.5856000     -0.3558000     0.8611000 
1 1 1 19 36 13 o 1.932000  0.5211000     1.915000  0.7027000     1.949000  0.7696000     -0.3358000E-01 1.042000  
1 1 1 19 36 14 o 4.213000  0.3336000     3.512000  0.5279000     4.915000  0.4079000     -1.403000      0.6671000 
1 1 1 19 36 15 o 2.152000  0.5476000     2.171000  0.7738000     2.134000  0.7749000     0.3725000E-01  1.095000  
1 1 1 19 36 16 o 1.764000  0.4624000     1.686000  0.6452000     1.842000  0.6624000     -0.1557000     0.9247000 
1 1 1 19 36 17 o 1.437000  0.4085000     1.817000  0.6440000     1.058000  0.5028000     0.7598000      0.8170000 
1 1 1 19 36 18 o 2.850000  0.4565000     2.665000  0.7523000     3.035000  0.5174000     -0.3705000     0.9131000 
1 1 1 19 36 19 o 1.729000  0.5542000     1.465000  0.6525000     1.992000  0.8960000     -0.5274000     1.108000  
1 1 1 19 37 0  o 2.866000  1.120000      2.866000  1.120000      2.866000  1.120000      0.000000       0.000000  
1 1 1 19 37 1  o 12.31000  0.3270000     12.31000  0.3270000     ?         ?             ?              ?         
1 1 1 19 37 2  o 2.473000  0.6554000     2.473000  0.6554000     ?         ?             ?              ?         
1 1 1 19 37 3  o 4.230000  0.3588000     4.413000  0.4222000     4.047000  0.5803000     0.3654000      0.7176000 
1 1 1 19 37 4  o 5.300000  0.3062000     5.028000  0.4705000     5.573000  0.3921000     -0.5446000     0.6125000 
1 1 1 19 37 5  o 2.626000  0.4566000     2.400000  0.7209000     2.853000  0.5608000     -0.4534000     0.9133000 
1 1 1 19 37 6  o 6.797000  0.2071000     6.681000  0.2938000     6.913000  0.2920000     -0.2313000     0.4142000 
1 1 1 19 37 7  o 6.557000  0.2286000     6.562000  0.3411000     6.553000  0.3043000     0.9677000E-02  0.4571000 
1 1 1 19 37 8  o 2.412000  0.4754000     2.410000  0.6671000     2.415000  0.6776000     -0.5540000E-02 0.9509000 
1 1 1 19 37 9  o 3.668000  0.3462000     3.422000  0.5118000     3.914000  0.4664000     -0.4914000     0.6925000 
1 1 1 19 37 10 o 1.942000  0.4869000     1.761000  0.6804000     2.122000  0.6968000     -0.3616000     0.9739000 
1 1 1 19 37 11 o 4.108000  0.3270000     3.919000  0.4758000     4.298000  0.4488000     -0.3787000     0.6540000 
1 1 1 19 37 12 o 3.350000  0.4680000     2.564000  0.8178000     4.136000  0.4551000     -1.572000      0.9359000 
1 1 1 19 37 13 o 2.144000  0.4936000     2.222000  0.6882000     2.066000  0.7077000     0.1568000      0.9872000 
1 1 1 19 37 14 o 1.901000  0.5313000     1.798000  0.6857000     2.003000  0.8118000     -0.2044000     1.063000  
1 1 1 19 37 15 o 1.529000  0.4501000     1.317000  0.5926000     1.741000  0.6775000     -0.4236000     0.9001000 
1 1 1 19 37 16 o 1.541000  0.4341000     1.172000  0.5439000     1.909000  0.6766000     -0.7372000     0.8681000 
1 1 1 19 37 17 o 1.564000  0.4414000     1.311000  0.5827000     1.817000  0.6631000     -0.5056000     0.8827000 
1 1 1 19 37 18 o 1.780000  0.4858000     2.124000  0.7654000     1.435000  0.5987000     0.6889000      0.9717000 
1 1 1 19 37 19 o 1.386000  0.4593000     1.516000  0.6798000     1.256000  0.6177000     0.2595000      0.9185000 
1 1 1 19 38 0  o 1.591000  0.8207000     1.591000  0.8207000     1.591000  0.8207000     -0.000000      0.000000  
1 1 1 19 38 1  o 3.145000  0.3971000     2.658000  0.6628000     3.632000  0.4375000     -0.9746000     0.7942000 
1 1 1 19 38 2  o 9.103000  0.1911000     8.965000  0.2906000     9.240000  0.2481000     -0.2749000     0.3821000 
1 1 1 19 38 3  o 8.774000  0.1961000     8.902000  0.2964000     8.647000  0.2568000     0.2550000      0.3921000 
1 1 1 19 38 4  o 4.143000  0.2849000     3.953000  0.4139000     4.332000  0.3917000     -0.3791000     0.5699000 
1 1 1 19 38 5  o 6.816000  0.2078000     7.089000  0.2834000     6.542000  0.3039000     0.5463000      0.4156000 
1 1 1 19 38 6  o 9.731000  0.1805000     9.593000  0.2555000     9.870000  0.2550000     -0.2772000     0.3610000 
1 1 1 19 38 7  o 3.923000  0.3191000     4.016000  0.4484000     3.830000  0.4541000     0.1868000      0.6382000 
1 1 1 19 38 8  o 1.362000  0.4245000     1.349000  0.5939000     1.375000  0.6068000     -0.2611000E-01 0.8490000 
1 1 1 19 38 9  o 3.064000  0.4232000     2.746000  0.6499000     3.382000  0.5422000     -0.6355000     0.8464000 
1 1 1 19 38 10 o 2.068000  0.4918000     2.344000  0.7026000     1.791000  0.6884000     0.5526000      0.9836000 
1 1 1 19 38 11 o 3.293000  0.4109000     3.799000  0.4885000     2.786000  0.6609000     1.013000       0.8218000 
1 1 1 19 38 12 o 3.712000  0.4503000     3.995000  0.4997000     3.429000  0.7493000     0.5664000      0.9007000 
1 1 1 19 38 13 o 1.617000  0.4583000     1.883000  0.6894000     1.351000  0.6041000     0.5323000      0.9166000 
1 1 1 19 38 14 o 2.290000  0.5617000     2.264000  0.8144000     2.317000  0.7738000     -0.5245000E-01 1.123000  
1 1 1 19 38 15 o 1.471000  0.4423000     1.412000  0.6113000     1.531000  0.6394000     -0.1198000     0.8846000 
1 1 1 19 38 16 f 1.432000  0.4285000     1.268000  0.5670000     1.595000  0.6426000     -0.3275000     0.8570000 
1 1 1 19 38 17 f 1.535000  0.4282000     1.189000  0.5484000     1.880000  0.6577000     -0.6911000     0.8563000 
1 1 1 19 38 18 o 1.556000  0.4694000     1.413000  0.6605000     1.699000  0.6671000     -0.2862000     0.9387000 
1 1 1 19 38 19 o 1.450000  0.4962000     1.633000  0.7604000     1.267000  0.6378000     0.3658000      0.9925000 
1 1 1 19 39 0  o 0.9654000 0.6303000     0.9654000 0.6303000     0.9654000 0.6303000     0.000000       0.000000  
1 1 1 19 39 1  o 7.978000  0.1864000     8.149000  0.2586000     7.807000  0.2684000     0.3421000      0.3728000 
1 1 1 19 39 2  o 9.509000  0.1760000     9.488000  0.2496000     9.530000  0.2484000     -0.4128000E-01 0.3521000 
1 1 1 19 39 3  o 6.077000  0.2176000     5.909000  0.3103000     6.245000  0.3052000     -0.3369000     0.4352000 
1 1 1 19 39 4  o 2.848000  0.4057000     3.075000  0.5392000     2.622000  0.6062000     0.4527000      0.8113000 
1 1 1 19 39 5  o 1.987000  0.4674000     1.671000  0.6508000     2.304000  0.6711000     -0.6330000     0.9348000 
1 1 1 19 39 6  o 4.391000  0.2910000     4.423000  0.4064000     4.358000  0.4167000     0.6514000E-01  0.5820000 
1 1 1 19 39 7  o 2.388000  0.4720000     2.337000  0.6624000     2.440000  0.6725000     -0.1026000     0.9439000 
1 1 1 19 39 8  o 2.560000  0.4647000     2.457000  0.6689000     2.663000  0.6453000     -0.2064000     0.9294000 
1 1 1 19 39 9  o 4.436000  0.3024000     4.331000  0.4314000     4.542000  0.4239000     -0.2111000     0.6048000 
1 1 1 19 39 10 o 1.280000  0.4151000     1.146000  0.5445000     1.415000  0.6268000     -0.2690000     0.8303000 
1 1 1 19 39 11 o 3.814000  0.4666000     3.483000  0.7586000     4.144000  0.5434000     -0.6611000     0.9331000 
1 1 1 19 39 12 f 2.546000  0.4697000     2.112000  0.7033000     2.979000  0.6227000     -0.8665000     0.9393000 
1 1 1 19 39 13 o 1.461000  0.4724000     1.401000  0.6306000     1.521000  0.7037000     -0.1194000     0.9449000 
1 1 1 19 39 14 o 2.556000  0.4911000     2.346000  0.7519000     2.766000  0.6319000     -0.4199000     0.9822000 
1 1 1 19 39 15 o 1.883000  0.4601000     1.453000  0.6182000     2.313000  0.6817000     -0.8600000     0.9203000 
1 1 1 19 39 16 o 2.680000  0.4421000     2.439000  0.6592000     2.921000  0.5893000     -0.4820000     0.8842000 
1 1 1 19 39 17 f 1.441000  0.4333000     1.526000  0.6284000     1.356000  0.5967000     0.1700000      0.8665000 
1 1 1 19 39 18 o 1.484000  0.4719000     1.558000  0.7012000     1.410000  0.6317000     0.1481000      0.9438000 
1 1 1 19 40 0  o 4.667000  0.3800000     4.667000  0.3800000     4.667000  0.3800000     -0.000000      0.000000  
1 1 1 19 40 1  o 4.427000  0.2718000     4.158000  0.4026000     4.695000  0.3653000     -0.5365000     0.5436000 
1 1 1 19 40 2  o 10.45000  0.1767000     10.78000  0.2491000     10.13000  0.2508000     0.6474000      0.3535000 
1 1 1 19 40 3  o 2.530000  0.4376000     2.716000  0.5906000     2.344000  0.6460000     0.3713000      0.8753000 
1 1 1 19 40 4  o 7.375000  0.1999000     7.207000  0.2847000     7.543000  0.2807000     -0.3363000     0.3998000 
1 1 1 19 40 5  f 8.406000  0.1915000     8.406000  0.2691000     8.406000  0.2726000     -0.1678000E-03 0.3830000 
1 1 1 19 40 6  o 13.93000  0.1827000     13.73000  0.2590000     14.13000  0.2577000     -0.3955000     0.3654000 
1 1 1 19 40 7  o 8.749000  0.1960000     8.549000  0.2807000     8.948000  0.2735000     -0.3994000     0.3919000 
1 1 1 19 40 8  o 5.292000  0.2636000     5.493000  0.3596000     5.091000  0.3856000     0.4028000      0.5273000 
1 1 1 19 40 9  o 2.482000  0.4633000     2.091000  0.6803000     2.874000  0.6291000     -0.7831000     0.9266000 
1 1 1 19 40 10 o 1.941000  0.5090000     2.176000  0.7589000     1.706000  0.6787000     0.4692000      1.018000  
1 1 1 19 40 11 o 1.400000  0.4511000     1.219000  0.5672000     1.582000  0.7016000     -0.3630000     0.9022000 
1 1 1 19 40 12 o 2.665000  0.4835000     2.657000  0.6456000     2.673000  0.7200000     -0.1527000E-01 0.9670000 
1 1 1 19 40 13 o 2.144000  0.5514000     1.927000  0.7716000     2.361000  0.7881000     -0.4343000     1.103000  
1 1 1 19 40 14 o 1.650000  0.4543000     1.886000  0.6717000     1.414000  0.6118000     0.4720000      0.9086000 
1 1 1 19 40 15 o 1.311000  0.4124000     1.367000  0.5979000     1.256000  0.5683000     0.1115000      0.8249000 
1 1 1 19 40 16 o 1.632000  0.4540000     1.834000  0.6770000     1.430000  0.6051000     0.4045000      0.9080000 
1 1 1 19 40 17 o 1.430000  0.4322000     1.464000  0.6161000     1.396000  0.6064000     0.6778000E-01  0.8644000 
1 1 1 19 40 18 o 1.537000  0.4691000     1.460000  0.6218000     1.614000  0.7025000     -0.1541000     0.9382000 
1 1 1 19 41 0  o 0.8792000 0.5921000     0.8792000 0.5921000     0.8792000 0.5921000     -0.000000      0.000000  
1 1 1 19 41 1  o 3.557000  0.3428000     3.790000  0.4389000     3.324000  0.5268000     0.4657000      0.6857000 
1 1 1 19 41 2  o 7.238000  0.2008000     7.275000  0.2825000     7.201000  0.2854000     0.7362000E-01  0.4015000 
1 1 1 19 41 3  o 5.344000  0.2411000     5.423000  0.3365000     5.265000  0.3453000     0.1579000      0.4822000 
1 1 1 19 41 4  f 3.570000  0.3445000     3.269000  0.5171000     3.872000  0.4553000     -0.6030000     0.6890000 
1 1 1 19 41 5  f 4.061000  0.3082000     3.742000  0.4597000     4.380000  0.4107000     -0.6381000     0.6165000 
1 1 1 19 41 6  o 4.291000  0.2987000     4.643000  0.3950000     3.939000  0.4482000     0.7035000      0.5974000 
1 1 1 19 41 7  o 1.900000  0.4859000     1.913000  0.6922000     1.886000  0.6819000     0.2673000E-01  0.9717000 
1 1 1 19 41 8  f 2.180000  0.4661000     2.626000  0.6520000     1.734000  0.6664000     0.8915000      0.9323000 
1 1 1 19 41 9  o 2.169000  0.4433000     2.869000  0.6210000     1.469000  0.6329000     1.400000       0.8867000 
1 1 1 19 41 10 o 5.545000  0.3401000     5.551000  0.5298000     5.538000  0.4268000     0.1220000E-01  0.6803000 
1 1 1 19 41 11 o 2.704000  0.4586000     3.019000  0.5958000     2.389000  0.6972000     0.6307000      0.9171000 
1 1 1 19 41 12 o 1.755000  0.5293000     1.510000  0.6513000     2.000000  0.8344000     -0.4902000     1.059000  
1 1 1 19 41 13 o 3.796000  0.3430000     3.875000  0.4786000     3.717000  0.4916000     0.1585000      0.6861000 
1 1 1 19 41 14 o 2.321000  0.4724000     2.613000  0.6447000     2.029000  0.6906000     0.5844000      0.9447000 
1 1 1 19 41 15 o 2.202000  0.4275000     1.578000  0.6327000     2.826000  0.5751000     -1.247000      0.8550000 
1 1 1 19 41 16 o 2.146000  0.4777000     1.908000  0.6713000     2.384000  0.6797000     -0.4765000     0.9554000 
1 1 1 19 41 17 o 1.147000  0.3952000     1.259000  0.6109000     1.035000  0.5014000     0.2233000      0.7903000 
1 1 1 19 42 0  o 5.667000  0.3372000     5.667000  0.3372000     5.667000  0.3372000     -0.000000      0.000000  
1 1 1 19 42 1  o 1.516000  0.4268000     1.099000  0.5217000     1.933000  0.6757000     -0.8333000     0.8537000 
1 1 1 19 42 2  o 1.103000  0.3702000     1.058000  0.5071000     1.148000  0.5395000     -0.9061000E-01 0.7404000 
1 1 1 19 42 3  o 3.069000  0.3965000     3.011000  0.5677000     3.127000  0.5538000     -0.1153000     0.7931000 
1 1 1 19 42 4  o 2.040000  0.4667000     1.803000  0.6571000     2.278000  0.6631000     -0.4746000     0.9335000 
1 1 1 19 42 5  o 3.836000  0.3227000     3.781000  0.4656000     3.890000  0.4471000     -0.1090000     0.6455000 
1 1 1 19 42 6  o 2.895000  0.4271000     3.189000  0.5562000     2.600000  0.6484000     0.5890000      0.8543000 
1 1 1 19 42 7  o 1.689000  0.4659000     1.948000  0.6974000     1.429000  0.6181000     0.5195000      0.9319000 
1 1 1 19 42 8  o 4.408000  0.3046000     4.155000  0.4559000     4.661000  0.4041000     -0.5054000     0.6092000 
1 1 1 19 42 9  o 3.468000  0.4643000     4.171000  0.6590000     2.765000  0.6542000     1.406000       0.9286000 
1 1 1 19 42 10 f 2.925000  0.4371000     1.940000  0.6980000     3.911000  0.5263000     -1.971000      0.8741000 
1 1 1 19 42 11 o 1.491000  0.4669000     1.571000  0.6450000     1.410000  0.6753000     0.1617000      0.9338000 
1 1 1 19 42 12 o 1.983000  0.5067000     2.397000  0.7678000     1.570000  0.6615000     0.8268000      1.013000  
1 1 1 19 42 13 f 3.402000  0.3684000     3.377000  0.5361000     3.427000  0.5055000     -0.4983000E-01 0.7368000 
1 1 1 19 42 14 o 2.329000  0.4205000     3.150000  0.5448000     1.509000  0.6408000     1.642000       0.8411000 
1 1 1 19 42 15 o 2.673000  0.4304000     2.885000  0.5840000     2.461000  0.6323000     0.4235000      0.8607000 
1 1 1 19 42 16 o 1.202000  0.3948000     1.147000  0.5397000     1.258000  0.5765000     -0.1113000     0.7896000 
1 1 1 19 42 17 o 1.647000  0.4663000     2.074000  0.7267000     1.221000  0.5847000     0.8530000      0.9327000 
1 1 1 19 43 0  o 3.466000  0.5234000     3.466000  0.5234000     3.466000  0.5234000     -0.000000      0.000000  
1 1 1 19 43 1  o 8.210000  0.1936000     8.540000  0.2673000     7.879000  0.2802000     0.6601000      0.3872000 
1 1 1 19 43 2  o 1.613000  0.4547000     1.716000  0.6552000     1.510000  0.6306000     0.2063000      0.9094000 
1 1 1 19 43 3  o 3.563000  0.3394000     3.881000  0.4401000     3.245000  0.5169000     0.6360000      0.6789000 
1 1 1 19 43 4  o 4.624000  0.2760000     4.612000  0.3900000     4.635000  0.3908000     -0.2292000E-01 0.5521000 
1 1 1 19 43 5  o 5.928000  0.2405000     5.863000  0.3401000     5.993000  0.3402000     -0.1300000     0.4810000 
1 1 1 19 43 6  o 1.340000  0.4223000     1.384000  0.6068000     1.297000  0.5876000     0.8784000E-01  0.8447000 
1 1 1 19 43 7  o 8.268000  0.2062000     8.323000  0.2944000     8.214000  0.2889000     0.1095000      0.4125000 
1 1 1 19 43 8  o 4.968000  0.3397000     4.239000  0.5753000     5.697000  0.3613000     -1.458000      0.6794000 
1 1 1 19 43 9  o 1.611000  0.4956000     1.487000  0.6541000     1.734000  0.7448000     -0.2465000     0.9913000 
1 1 1 19 43 10 o 1.880000  0.4778000     1.361000  0.6076000     2.398000  0.7377000     -1.037000      0.9557000 
1 1 1 19 43 11 o 2.032000  0.4972000     2.869000  0.8088000     1.194000  0.5786000     1.675000       0.9945000 
1 1 1 19 43 12 o 2.504000  0.4649000     2.744000  0.6376000     2.263000  0.6766000     0.4807000      0.9297000 
1 1 1 19 43 13 o 3.443000  0.3741000     3.817000  0.4862000     3.070000  0.5686000     0.7469000      0.7482000 
1 1 1 19 43 14 o 1.491000  0.4335000     1.777000  0.6683000     1.206000  0.5523000     0.5709000      0.8670000 
1 1 1 19 43 15 o 1.259000  0.3990000     1.108000  0.5218000     1.411000  0.6037000     -0.3026000     0.7980000 
1 1 1 19 43 16 o 1.294000  0.4242000     1.291000  0.6114000     1.297000  0.5883000     -0.5743000E-02 0.8485000 
1 1 1 19 43 17 o 1.086000  0.3753000     1.219000  0.5811000     0.9535000 0.4753000     0.2659000      0.7507000 
1 1 1 19 44 0  o 3.569000  0.5081000     3.569000  0.5081000     3.569000  0.5081000     0.000000       0.000000  
1 1 1 19 44 1  o 5.820000  0.2362000     6.145000  0.3163000     5.495000  0.3507000     0.6501000      0.4723000 
1 1 1 19 44 2  o 2.686000  0.4415000     2.406000  0.6571000     2.967000  0.5900000     -0.5611000     0.8831000 
1 1 1 19 44 3  o 4.895000  0.2689000     4.961000  0.3751000     4.829000  0.3853000     0.1317000      0.5377000 
1 1 1 19 44 4  o 4.619000  0.2887000     4.891000  0.3857000     4.348000  0.4296000     0.5430000      0.5773000 
1 1 1 19 44 5  o 3.216000  0.4006000     3.249000  0.5604000     3.182000  0.5726000     0.6711000E-01  0.8012000 
1 1 1 19 44 6  o 5.522000  0.2539000     5.606000  0.3560000     5.437000  0.3620000     0.1696000      0.5077000 
1 1 1 19 44 7  o 2.383000  0.5017000     3.016000  0.7388000     1.749000  0.6791000     1.267000       1.003000  
1 1 1 19 44 8  o 4.307000  0.3892000     3.965000  0.5499000     4.650000  0.5509000     -0.6854000     0.7784000 
1 1 1 19 44 9  o 1.899000  0.4676000     1.284000  0.5833000     2.514000  0.7311000     -1.230000      0.9353000 
1 1 1 19 44 10 o 3.794000  0.4279000     3.300000  0.6494000     4.289000  0.5575000     -0.9894000     0.8559000 
1 1 1 19 44 11 o 3.641000  0.3702000     3.017000  0.6000000     4.265000  0.4337000     -1.248000      0.7403000 
1 1 1 19 44 12 o 2.291000  0.4722000     2.419000  0.6555000     2.162000  0.6799000     0.2566000      0.9444000 
1 1 1 19 44 13 o 1.505000  0.4445000     1.544000  0.6361000     1.466000  0.6212000     0.7836000E-01  0.8891000 
1 1 1 19 44 14 o 2.678000  0.4397000     2.791000  0.6129000     2.565000  0.6305000     0.2264000      0.8793000 
1 1 1 19 44 15 o 2.378000  0.5236000     2.488000  0.7896000     2.268000  0.6879000     0.2196000      1.047000  
1 1 1 19 44 16 o 1.613000  0.4702000     1.191000  0.5860000     2.035000  0.7356000     -0.8446000     0.9405000 
1 1 1 19 45 0  o 2.525000  0.7591000     2.525000  0.7591000     2.525000  0.7591000     -0.000000      0.000000  
1 1 1 19 45 1  o 2.297000  0.4718000     2.693000  0.6461000     1.901000  0.6878000     0.7925000      0.9436000 
1 1 1 19 45 2  o 4.427000  0.3006000     4.561000  0.4104000     4.294000  0.4395000     0.2665000      0.6013000 
1 1 1 19 45 3  o 5.129000  0.2645000     5.111000  0.3785000     5.147000  0.3694000     -0.3545000E-01 0.5289000 
1 1 1 19 45 4  o 4.698000  0.2873000     4.353000  0.4306000     5.043000  0.3803000     -0.6902000     0.5745000 
1 1 1 19 45 5  o 2.049000  0.4822000     1.768000  0.6777000     2.330000  0.6861000     -0.5617000     0.9644000 
1 1 1 19 45 6  o 1.695000  0.4900000     1.638000  0.7015000     1.753000  0.6844000     -0.1147000     0.9801000 
1 1 1 19 45 7  o 3.946000  0.4203000     3.814000  0.5738000     4.078000  0.6142000     -0.2640000     0.8405000 
1 1 1 19 45 8  o 2.615000  0.4780000     3.184000  0.5843000     2.045000  0.7568000     1.139000       0.9561000 
1 1 1 19 45 9  o 3.270000  0.4715000     3.752000  0.5590000     2.787000  0.7594000     0.9651000      0.9429000 
1 1 1 19 45 10 o 1.653000  0.4804000     1.736000  0.7082000     1.570000  0.6493000     0.1668000      0.9608000 
1 1 1 19 45 11 o 1.246000  0.4036000     1.207000  0.5580000     1.284000  0.5833000     -0.7747000E-01 0.8072000 
1 1 1 19 45 12 o 1.435000  0.4344000     1.634000  0.6600000     1.236000  0.5650000     0.3983000      0.8688000 
1 1 1 19 45 13 o 3.133000  0.4015000     3.497000  0.5168000     2.769000  0.6145000     0.7284000      0.8029000 
1 1 1 19 45 14 o 1.565000  0.4548000     1.534000  0.6402000     1.597000  0.6462000     -0.6303000E-01 0.9096000 
1 1 1 19 45 15 o 1.447000  0.4455000     1.939000  0.7566000     0.9555000 0.4707000     0.9836000      0.8910000 
1 1 1 19 45 16 o 1.233000  0.4035000     1.045000  0.5025000     1.420000  0.6315000     -0.3750000     0.8071000 
1 1 1 19 46 0  o 2.012000  0.8472000     2.012000  0.8472000     2.012000  0.8472000     -0.000000      0.000000  
1 1 1 19 46 1  o 3.558000  0.3624000     3.505000  0.5149000     3.610000  0.5101000     -0.1046000     0.7248000 
1 1 1 19 46 2  o 8.059000  0.2062000     8.163000  0.2908000     7.955000  0.2924000     0.2088000      0.4124000 
1 1 1 19 46 3  o 6.044000  0.2437000     6.239000  0.3346000     5.848000  0.3543000     0.3905000      0.4873000 
1 1 1 19 46 4  o 2.285000  0.4890000     2.516000  0.6848000     2.055000  0.6983000     0.4614000      0.9781000 
1 1 1 19 46 5  o 1.581000  0.4701000     1.435000  0.6488000     1.728000  0.6804000     -0.2931000     0.9402000 
1 1 1 19 46 6  o 1.569000  0.4564000     2.126000  0.7589000     1.012000  0.5073000     1.113000       0.9128000 
1 1 1 19 46 7  o 2.984000  0.5002000     3.109000  0.6023000     2.860000  0.7989000     0.2484000      1.000000  
1 1 1 19 46 8  o 1.266000  0.4190000     1.409000  0.6316000     1.123000  0.5508000     0.2853000      0.8380000 
1 1 1 19 46 9  o 2.693000  0.5061000     2.755000  0.7571000     2.631000  0.6717000     0.1241000      1.012000  
1 1 1 19 46 10 o 1.841000  0.4891000     1.813000  0.6875000     1.869000  0.6959000     -0.5551000E-01 0.9782000 
1 1 1 19 46 11 o 1.621000  0.4592000     1.691000  0.6540000     1.551000  0.6447000     0.1409000      0.9184000 
1 1 1 19 46 12 o 2.451000  0.4682000     2.198000  0.6807000     2.704000  0.6430000     -0.5056000     0.9364000 
1 1 1 19 46 13 o 1.717000  0.4701000     1.890000  0.6910000     1.544000  0.6377000     0.3463000      0.9403000 
1 1 1 19 46 14 o 1.303000  0.4142000     1.237000  0.5638000     1.369000  0.6070000     -0.1328000     0.8285000 
1 1 1 19 46 15 o 1.653000  0.4716000     1.178000  0.5813000     2.127000  0.7427000     -0.9485000     0.9431000 
1 1 1 19 47 0  f 5.097000  0.3809000     5.097000  0.3809000     5.097000  0.3809000     0.000000       0.000000  
1 1 1 19 47 1  o 3.012000  0.4362000     2.915000  0.6308000     3.108000  0.6025000     -0.1930000     0.8723000 
1 1 1 19 47 2  o 4.766000  0.2848000     4.739000  0.4068000     4.793000  0.3987000     -0.5348000E-01 0.5696000 
1 1 1 19 47 3  o 4.707000  0.3233000     4.882000  0.4899000     4.532000  0.4218000     0.3499000      0.6465000 
1 1 1 19 47 4  o 4.858000  0.3846000     4.564000  0.6315000     5.152000  0.4392000     -0.5880000     0.7692000 
1 1 1 19 47 5  o 2.487000  0.5869000     2.576000  0.7334000     2.399000  0.9164000     0.1770000      1.174000  
1 1 1 19 47 6  f 2.144000  0.5908000     2.176000  0.7441000     2.112000  0.9179000     0.6419000E-01  1.182000  
1 1 1 19 47 7  o 4.483000  0.4094000     4.595000  0.5963000     4.372000  0.5613000     0.2228000      0.8189000 
1 1 1 19 47 8  o 5.620000  0.2885000     5.788000  0.4371000     5.453000  0.3768000     0.3353000      0.5771000 
1 1 1 19 47 9  o 5.517000  0.2674000     5.699000  0.3644000     5.336000  0.3916000     0.3631000      0.5349000 
1 1 1 19 47 10 o 3.418000  0.3845000     3.343000  0.5578000     3.492000  0.5293000     -0.1487000     0.7689000 
1 1 1 19 47 11 o 1.934000  0.4623000     1.484000  0.6374000     2.385000  0.6699000     -0.9005000     0.9247000 
1 1 1 19 47 12 o 1.864000  0.4733000     2.005000  0.6847000     1.723000  0.6538000     0.2824000      0.9467000 
1 1 1 19 47 13 o 1.486000  0.4452000     1.647000  0.6634000     1.326000  0.5939000     0.3210000      0.8904000 
1 1 1 19 47 14 o 1.864000  0.5111000     2.113000  0.7790000     1.616000  0.6618000     0.4972000      1.022000  
1 1 1 19 47 15 o 1.764000  0.4828000     1.961000  0.6950000     1.567000  0.6702000     0.3942000      0.9655000 
1 1 1 19 48 0  o 1.328000  0.8035000     1.328000  0.8035000     1.328000  0.8035000     0.000000       0.000000  
1 1 1 19 48 1  o 3.787000  0.4301000     4.233000  0.5472000     3.341000  0.6638000     0.8914000      0.8603000 
1 1 1 19 48 2  o 1.787000  0.5413000     1.836000  0.7794000     1.737000  0.7515000     0.9917000E-01  1.083000  
1 1 1 19 48 3  o 3.511000  0.5030000     4.245000  0.5037000     2.778000  0.8708000     1.467000       1.006000  
1 1 1 19 48 4  o 2.569000  0.5613000     3.076000  0.6495000     2.062000  0.9156000     1.014000       1.123000  
1 1 1 19 48 5  o 3.692000  0.4156000     3.486000  0.5862000     3.898000  0.5894000     -0.4121000     0.8312000 
1 1 1 19 48 6  f 1.694000  0.4871000     2.016000  0.7571000     1.372000  0.6132000     0.6438000      0.9743000 
1 1 1 19 48 7  o 2.344000  0.4843000     2.337000  0.6890000     2.352000  0.6809000     -0.1463000E-01 0.9687000 
1 1 1 19 48 8  o 3.322000  0.4131000     3.063000  0.6269000     3.580000  0.5382000     -0.5173000     0.8262000 
1 1 1 19 48 9  o 1.897000  0.4869000     1.723000  0.6777000     2.072000  0.6993000     -0.3496000     0.9738000 
1 1 1 19 48 10 o 1.416000  0.4137000     1.876000  0.6802000     0.9570000 0.4713000     0.9189000      0.8275000 
1 1 1 19 48 11 o 2.072000  0.4729000     1.820000  0.6762000     2.325000  0.6613000     -0.5045000     0.9459000 
1 1 1 19 48 12 o 1.390000  0.4282000     1.183000  0.5566000     1.597000  0.6508000     -0.4136000     0.8563000 
1 1 1 19 48 13 o 3.003000  0.4306000     3.401000  0.5328000     2.605000  0.6766000     0.7966000      0.8612000 
1 1 1 19 48 14 o 1.306000  0.4433000     1.532000  0.7128000     1.080000  0.5272000     0.4513000      0.8866000 
1 1 1 19 49 0  o 1.353000  0.8941000     1.353000  0.8941000     1.353000  0.8941000     -0.000000      0.000000  
1 1 1 19 49 1  o 1.736000  0.5464000     1.778000  0.7608000     1.693000  0.7843000     0.8513000E-01  1.093000  
1 1 1 19 49 2  o 3.697000  0.5130000     3.772000  0.6812000     3.623000  0.7673000     0.1482000      1.026000  
1 1 1 19 49 3  o 4.445000  0.4321000     3.944000  0.6421000     4.946000  0.5786000     -1.002000      0.8643000 
1 1 1 19 49 4  o 2.590000  0.4880000     2.225000  0.7695000     2.956000  0.6006000     -0.7309000     0.9761000 
1 1 1 19 49 5  o 2.673000  0.4942000     2.654000  0.7316000     2.693000  0.6647000     -0.3851000E-01 0.9884000 
1 1 1 19 49 6  o 1.766000  0.4772000     1.641000  0.6611000     1.892000  0.6883000     -0.2510000     0.9544000 
1 1 1 19 49 7  o 3.604000  0.3805000     3.784000  0.5080000     3.424000  0.5668000     0.3597000      0.7611000 
1 1 1 19 49 8  o 3.166000  0.4201000     3.482000  0.5436000     2.849000  0.6407000     0.6334000      0.8402000 
1 1 1 19 49 9  o 1.618000  0.4561000     1.344000  0.6019000     1.892000  0.6854000     -0.5483000     0.9121000 
1 1 1 19 49 10 o 1.119000  0.3762000     1.111000  0.5300000     1.128000  0.5339000     -0.1749000E-01 0.7523000 
1 1 1 19 49 11 o 1.745000  0.4692000     1.565000  0.6477000     1.926000  0.6789000     -0.3607000     0.9383000 
1 1 1 19 49 12 o 1.315000  0.4086000     1.637000  0.6581000     0.9936000 0.4846000     0.6434000      0.8172000 
1 1 1 19 49 13 o 2.962000  0.5063000     2.647000  0.8232000     3.278000  0.5896000     -0.6312000     1.013000  
1 1 1 19 49 14 o 1.876000  0.5962000     2.216000  0.9295000     1.536000  0.7470000     0.6806000      1.192000  
1 1 1 19 50 0  o 4.294000  0.4633000     4.294000  0.4633000     4.294000  0.4633000     0.000000       0.000000  
1 1 1 19 50 1  o 2.048000  0.5124000     2.021000  0.7349000     2.075000  0.7142000     -0.5479000E-01 1.025000  
1 1 1 19 50 2  f 1.498000  0.4231000     2.006000  0.6928000     0.9902000 0.4858000     1.016000       0.8462000 
1 1 1 19 50 3  o 1.719000  0.4767000     1.646000  0.6592000     1.792000  0.6887000     -0.1459000     0.9534000 
1 1 1 19 50 4  o 1.825000  0.4797000     1.569000  0.6497000     2.080000  0.7058000     -0.5103000     0.9593000 
1 1 1 19 50 5  o 4.957000  0.2884000     5.397000  0.3739000     4.516000  0.4392000     0.8819000      0.5768000 
1 1 1 19 50 6  o 4.123000  0.3308000     4.060000  0.4660000     4.187000  0.4695000     -0.1274000     0.6615000 
1 1 1 19 50 7  o 1.749000  0.4809000     1.688000  0.6747000     1.810000  0.6855000     -0.1221000     0.9619000 
1 1 1 19 50 8  o 1.421000  0.4221000     1.097000  0.5265000     1.745000  0.6600000     -0.6478000     0.8443000 
1 1 1 19 50 9  o 1.354000  0.4264000     1.393000  0.6120000     1.315000  0.5939000     0.7817000E-01  0.8528000 
1 1 1 19 50 10 f 1.709000  0.4705000     1.614000  0.6599000     1.803000  0.6708000     -0.1896000     0.9410000 
1 1 1 19 50 11 o 4.319000  0.3231000     4.134000  0.4811000     4.503000  0.4315000     -0.3695000     0.6462000 
1 1 1 19 50 12 o 1.747000  0.4788000     1.564000  0.6475000     1.930000  0.7054000     -0.3659000     0.9576000 
1 1 1 19 50 13 o 1.231000  0.4180000     1.184000  0.5679000     1.278000  0.6134000     -0.9415000E-01 0.8359000 
1 1 1 19 51 0  o 2.660000  0.7687000     2.660000  0.7687000     2.660000  0.7687000     -0.000000      0.000000  
1 1 1 19 51 1  o 5.417000  0.2730000     5.670000  0.3657000     5.163000  0.4053000     0.5062000      0.5459000 
1 1 1 19 51 2  o 3.383000  0.4111000     2.749000  0.6616000     4.017000  0.4880000     -1.267000      0.8221000 
1 1 1 19 51 3  o 2.551000  0.4322000     1.745000  0.6743000     3.357000  0.5409000     -1.612000      0.8644000 
1 1 1 19 51 4  f 3.272000  0.3992000     3.363000  0.5524000     3.181000  0.5765000     0.1819000      0.7984000 
1 1 1 19 51 5  o 1.349000  0.4202000     1.616000  0.6599000     1.083000  0.5204000     0.5324000      0.8404000 
1 1 1 19 51 6  o 1.405000  0.4340000     1.541000  0.6468000     1.269000  0.5790000     0.2723000      0.8681000 
1 1 1 19 51 7  o 1.675000  0.4648000     1.966000  0.7036000     1.384000  0.6075000     0.5821000      0.9296000 
1 1 1 19 51 8  o 1.298000  0.4159000     1.245000  0.5765000     1.351000  0.5996000     -0.1057000     0.8318000 
1 1 1 19 51 9  o 1.951000  0.4527000     1.379000  0.6140000     2.524000  0.6655000     -1.145000      0.9054000 
1 1 1 19 51 10 o 2.663000  0.4530000     3.230000  0.5621000     2.096000  0.7106000     1.134000       0.9061000 
1 1 1 19 51 11 o 1.209000  0.3962000     1.385000  0.6110000     1.034000  0.5046000     0.3508000      0.7924000 
1 1 1 19 51 12 o 1.199000  0.4082000     1.034000  0.5208000     1.365000  0.6287000     -0.3308000     0.8164000 
1 1 1 19 52 0  o 1.063000  0.6831000     1.063000  0.6831000     1.063000  0.6831000     -0.000000      0.000000  
1 1 1 19 52 1  o 1.773000  0.4797000     1.993000  0.6961000     1.553000  0.6602000     0.4394000      0.9594000 
1 1 1 19 52 2  o 2.527000  0.4734000     2.141000  0.7004000     2.913000  0.6372000     -0.7717000     0.9469000 
1 1 1 19 52 3  o 1.768000  0.4817000     1.839000  0.6889000     1.698000  0.6736000     0.1416000      0.9635000 
1 1 1 19 52 4  o 1.761000  0.4697000     2.034000  0.6942000     1.488000  0.6328000     0.5460000      0.9393000 
1 1 1 19 52 5  o 4.272000  0.3180000     3.988000  0.4859000     4.555000  0.4105000     -0.5665000     0.6361000 
1 1 1 19 52 6  o 3.719000  0.3647000     4.278000  0.4535000     3.160000  0.5712000     1.118000       0.7294000 
1 1 1 19 52 7  o 4.246000  0.3271000     4.383000  0.4624000     4.109000  0.4627000     0.2734000      0.6541000 
1 1 1 19 52 8  o 2.019000  0.4928000     2.253000  0.7107000     1.785000  0.6827000     0.4674000      0.9855000 
1 1 1 19 52 9  o 3.477000  0.3865000     3.915000  0.4999000     3.039000  0.5894000     0.8760000      0.7729000 
1 1 1 19 52 10 o 2.253000  0.4961000     2.256000  0.6946000     2.249000  0.7087000     0.6757000E-02  0.9923000 
1 1 1 19 52 11 o 1.385000  0.4443000     1.358000  0.6343000     1.413000  0.6222000     -0.5426000E-01 0.8885000 
1 1 1 19 52 12 o 1.797000  0.8214000     1.797000  0.8214000     ?         ?             ?              ?         
1 1 1 19 53 0  o 1.514000  0.8114000     1.514000  0.8114000     1.514000  0.8114000     -0.000000      0.000000  
1 1 1 19 53 1  o 7.439000  0.2256000     7.653000  0.3107000     7.226000  0.3271000     0.4270000      0.4511000 
1 1 1 19 53 2  o 3.791000  0.3561000     3.875000  0.4819000     3.708000  0.5244000     0.1671000      0.7122000 
1 1 1 19 53 3  o 5.513000  0.2586000     5.680000  0.3633000     5.346000  0.3682000     0.3346000      0.5173000 
1 1 1 19 53 4  o 3.889000  0.3420000     4.123000  0.4660000     3.655000  0.5008000     0.4678000      0.6841000 
1 1 1 19 53 5  f 2.321000  0.4844000     2.066000  0.7097000     2.576000  0.6595000     -0.5097000     0.9688000 
1 1 1 19 53 6  o 2.814000  0.4329000     3.698000  0.5138000     1.929000  0.6969000     1.770000       0.8658000 
1 1 1 19 53 7  o 2.976000  0.4405000     3.238000  0.5983000     2.713000  0.6467000     0.5245000      0.8810000 
1 1 1 19 53 8  o 3.152000  0.4350000     2.464000  0.7066000     3.840000  0.5074000     -1.375000      0.8699000 
1 1 1 19 53 9  o 1.705000  0.4710000     2.038000  0.7121000     1.372000  0.6168000     0.6658000      0.9421000 
1 1 1 19 53 10 o 3.374000  0.4969000     2.760000  0.7962000     3.988000  0.5949000     -1.227000      0.9939000 
1 1 1 19 53 11 o 1.510000  0.4794000     1.449000  0.6466000     1.571000  0.7080000     -0.1214000     0.9588000 
1 1 1 19 54 0  o 10.77000  0.2826000     10.77000  0.2826000     10.77000  0.2826000     0.000000       0.000000  
1 1 1 19 54 1  o 5.818000  0.2582000     5.660000  0.3652000     5.976000  0.3650000     -0.3166000     0.5163000 
1 1 1 19 54 2  o 5.671000  0.2618000     5.549000  0.3743000     5.793000  0.3662000     -0.2441000     0.5236000 
1 1 1 19 54 3  f 1.348000  0.4267000     1.316000  0.5950000     1.381000  0.6118000     -0.6500000E-01 0.8534000 
1 1 1 19 54 4  o 4.752000  0.2985000     4.589000  0.4357000     4.915000  0.4080000     -0.3262000     0.5969000 
1 1 1 19 54 5  o 3.717000  0.3685000     3.530000  0.5483000     3.904000  0.4924000     -0.3735000     0.7370000 
1 1 1 19 54 6  f 2.442000  0.4765000     1.890000  0.7042000     2.993000  0.6421000     -1.103000      0.9530000 
1 1 1 19 54 7  o 1.953000  0.4920000     1.703000  0.6764000     2.202000  0.7147000     -0.4987000     0.9840000 
1 1 1 19 54 8  o 1.126000  0.3810000     1.180000  0.5551000     1.072000  0.5220000     0.1078000      0.7620000 
1 1 1 19 54 9  o 1.423000  0.4516000     1.399000  0.6458000     1.446000  0.6313000     -0.4648000E-01 0.9031000 
1 1 1 19 54 10 o 1.625000  0.4810000     1.934000  0.7405000     1.316000  0.6141000     0.6189000      0.9620000 
1 1 1 19 55 0  o 1.729000  0.8513000     1.729000  0.8513000     1.729000  0.8513000     0.000000       0.000000  
1 1 1 19 55 1  o 1.792000  0.4885000     1.838000  0.6919000     1.745000  0.6898000     0.9289000E-01  0.9770000 
1 1 1 19 55 2  o 1.550000  0.4497000     1.867000  0.6937000     1.234000  0.5722000     0.6329000      0.8993000 
1 1 1 19 55 3  o 3.925000  0.3599000     4.101000  0.4725000     3.748000  0.5429000     0.3535000      0.7197000 
1 1 1 19 55 4  o 4.968000  0.2935000     5.189000  0.3961000     4.746000  0.4331000     0.4432000      0.5869000 
1 1 1 19 55 5  o 3.665000  0.3824000     3.464000  0.5550000     3.866000  0.5262000     -0.4017000     0.7648000 
1 1 1 19 55 6  o 7.832000  0.2289000     7.677000  0.3251000     7.987000  0.3225000     -0.3098000     0.4579000 
1 1 1 19 55 7  o 2.451000  0.4997000     2.322000  0.7109000     2.579000  0.7026000     -0.2578000     0.9995000 
1 1 1 19 55 8  o 2.676000  0.5400000     2.656000  0.8149000     2.697000  0.7089000     -0.4123000E-01 1.080000  
1 1 1 19 55 9  o 1.494000  0.4751000     1.279000  0.6242000     1.710000  0.7163000     -0.4317000     0.9501000 
1 1 1 19 56 0  o 3.380000  0.6310000     3.380000  0.6310000     3.380000  0.6310000     0.000000       0.000000  
1 1 1 19 56 1  o 1.847000  0.4852000     1.528000  0.6472000     2.165000  0.7230000     -0.6372000     0.9704000 
1 1 1 19 56 2  o 1.945000  0.4626000     1.356000  0.6109000     2.534000  0.6949000     -1.178000      0.9253000 
1 1 1 19 56 3  o 3.198000  0.4414000     3.900000  0.5116000     2.497000  0.7193000     1.403000       0.8827000 
1 1 1 19 56 4  o 1.095000  0.3724000     1.033000  0.5033000     1.156000  0.5489000     -0.1225000     0.7447000 
1 1 1 19 56 5  o 1.763000  0.4761000     1.466000  0.6361000     2.060000  0.7086000     -0.5938000     0.9522000 
1 1 1 19 56 6  o 2.318000  0.5040000     2.432000  0.7046000     2.204000  0.7207000     0.2277000      1.008000  
1 1 1 19 56 7  o 3.177000  0.4983000     3.265000  0.7489000     3.089000  0.6577000     0.1762000      0.9967000 
1 1 1 19 56 8  f 1.260000  0.4264000     1.101000  0.5524000     1.419000  0.6496000     -0.3181000     0.8527000 
1 1 1 19 57 0  o 1.030000  0.6808000     1.030000  0.6808000     1.030000  0.6808000     0.000000       0.000000  
1 1 1 19 57 1  o 3.293000  0.4331000     2.765000  0.6881000     3.821000  0.5262000     -1.056000      0.8662000 
1 1 1 19 57 2  o 4.293000  0.3377000     4.473000  0.4553000     4.113000  0.4990000     0.3603000      0.6755000 
1 1 1 19 57 3  o 3.613000  0.3945000     3.610000  0.5542000     3.617000  0.5615000     -0.6400000E-02 0.7889000 
1 1 1 19 57 4  o 3.877000  0.3877000     4.583000  0.4618000     3.171000  0.6230000     1.411000       0.7755000 
1 1 1 19 57 5  o 2.292000  0.4962000     1.911000  0.7098000     2.673000  0.6935000     -0.7615000     0.9924000 
1 1 1 19 57 6  o 4.950000  0.3427000     4.649000  0.5445000     5.252000  0.4164000     -0.6026000     0.6855000 
1 1 1 19 57 7  o 5.034000  0.4718000     5.523000  0.4822000     4.545000  0.8111000     0.9777000      0.9436000 
1 1 1 19 58 0  o 2.522000  0.8228000     2.522000  0.8228000     2.522000  0.8228000     -0.000000      0.000000  
1 1 1 19 58 1  o 2.028000  0.5159000     2.038000  0.7332000     2.018000  0.7260000     0.1945000E-01  1.032000  
1 1 1 19 58 2  f 1.915000  0.4884000     2.295000  0.7234000     1.534000  0.6563000     0.7610000      0.9767000 
1 1 1 19 58 3  o 1.483000  0.4527000     1.628000  0.6706000     1.337000  0.6084000     0.2902000      0.9054000 
1 1 1 19 58 4  o 1.566000  0.4773000     1.669000  0.7107000     1.463000  0.6372000     0.2055000      0.9545000 
1 1 1 19 58 5  o 1.802000  0.5347000     2.276000  0.8664000     1.329000  0.6269000     0.9465000      1.069000  
1 1 1 19 59 0  o 2.659000  0.8442000     2.659000  0.8442000     2.659000  0.8442000     -0.000000      0.000000  
1 1 1 19 59 1  o 2.692000  0.4941000     2.035000  0.7715000     3.348000  0.6174000     -1.312000      0.9881000 
1 1 1 19 59 2  o 1.425000  0.4637000     1.394000  0.6446000     1.457000  0.6668000     -0.6283000E-01 0.9275000 
1 1 1 19 59 3  o 1.696000  0.5525000     1.714000  0.7646000     1.679000  0.7978000     0.3495000E-01  1.105000  
1 1 1 20 0  1  o 5.553000  0.1388000     5.553000  0.1388000     5.553000  0.1388000     -0.000000      0.000000  
1 1 1 20 0  2  o 14.35000  0.2448000     14.35000  0.2448000     14.35000  0.2448000     0.000000       0.000000  
1 1 1 20 0  3  o 2.189000  0.1704000     2.189000  0.1704000     2.189000  0.1704000     0.000000       0.000000  
1 1 1 20 0  4  o 0.7406000 0.4912000     0.7406000 0.4912000     0.7406000 0.4912000     0.000000       0.000000  
1 1 1 20 0  5  o 12.34000  0.1868000     12.34000  0.1868000     12.34000  0.1868000     0.000000       0.000000  
1 1 1 20 0  6  o 3.159000  0.3743000     3.159000  0.3743000     3.159000  0.3743000     -0.000000      0.000000  
1 1 1 20 0  7  o 2.565000  0.5955000     2.565000  0.5955000     2.565000  0.5955000     -0.000000      0.000000  
1 1 1 20 0  8  o 10.79000  0.2277000     10.79000  0.2277000     10.79000  0.2277000     -0.000000      0.000000  
1 1 1 20 0  9  o 4.728000  0.3922000     4.728000  0.3922000     4.728000  0.3922000     -0.000000      0.000000  
1 1 1 20 0  10 o 12.42000  0.2570000     12.42000  0.2570000     12.42000  0.2570000     0.000000       0.000000  
1 1 1 20 0  11 o 18.29000  0.2825000     18.29000  0.2825000     18.29000  0.2825000     0.000000       0.000000  
1 1 1 20 0  12 o 1.434000  0.8644000     1.434000  0.8644000     1.434000  0.8644000     0.000000       0.000000  
1 1 1 20 0  13 o 1.289000  0.8271000     1.289000  0.8271000     1.289000  0.8271000     0.000000       0.000000  
1 1 1 20 0  14 o 4.221000  0.7303000     4.221000  0.7303000     4.221000  0.7303000     -0.000000      0.000000  
1 1 1 20 0  15 o 1.198000  0.8047000     1.198000  0.8047000     1.198000  0.8047000     0.000000       0.000000  
1 1 1 20 0  16 o 2.963000  1.203000      2.963000  1.203000      2.963000  1.203000      0.000000       0.000000  
1 1 1 20 0  17 o 3.175000  0.9790000     3.175000  0.9790000     3.175000  0.9790000     0.000000       0.000000  
1 1 1 20 0  18 o 2.301000  1.033000      2.301000  1.033000      2.301000  1.033000      0.000000       0.000000  
1 1 1 20 0  19 o 1.725000  0.9584000     1.725000  0.9584000     1.725000  0.9584000     0.000000       0.000000  
1 1 1 20 0  20 o 1.287000  0.7975000     1.287000  0.7975000     1.287000  0.7975000     0.000000       0.000000  
1 1 1 20 0  21 o 2.045000  0.9360000     2.045000  0.9360000     2.045000  0.9360000     0.000000       0.000000  
1 1 1 20 0  22 o 1.300000  0.8291000     1.300000  0.8291000     1.300000  0.8291000     0.000000       0.000000  
1 1 1 20 0  23 o 0.7423000 0.5417000     0.7423000 0.5417000     0.7423000 0.5417000     0.000000       0.000000  
1 1 1 20 0  24 o 0.8177000 0.5954000     0.8177000 0.5954000     0.8177000 0.5954000     0.000000       0.000000  
1 1 1 20 1  1  o 6.196000  0.1003000     6.110000  0.1376000     6.282000  0.1459000     -0.1714000     0.2005000 
1 1 1 20 1  2  o 7.976000  0.1771000     8.130000  0.2868000     7.823000  0.2078000     0.3077000      0.3542000 
1 1 1 20 1  3  o 6.459000  0.8671000E-01 6.443000  0.1167000     6.476000  0.1282000     -0.3285000E-01 0.1734000 
1 1 1 20 1  4  o 4.774000  0.1393000     4.726000  0.1405000     4.821000  0.2405000     -0.9474000E-01 0.2785000 
1 1 1 20 1  5  o 17.95000  0.1747000     17.90000  0.2272000     18.00000  0.2653000     -0.1043000     0.3493000 
1 1 1 20 1  6  f 6.080000  0.1639000     6.098000  0.2383000     6.061000  0.2251000     0.3706000E-01  0.3278000 
1 1 1 20 1  7  o 1.064000  0.3501000     1.082000  0.5014000     1.046000  0.4886000     0.3583000E-01  0.7001000 
1 1 1 20 1  8  o 5.358000  0.2153000     5.460000  0.3026000     5.257000  0.3064000     0.2028000      0.4306000 
1 1 1 20 1  9  o 9.798000  0.1870000     9.910000  0.2497000     9.686000  0.2785000     0.2235000      0.3740000 
1 1 1 20 1  10 o 8.165000  0.2048000     8.068000  0.2875000     8.262000  0.2917000     -0.1934000     0.4096000 
1 1 1 20 1  11 o 4.039000  0.3906000     4.283000  0.5001000     3.795000  0.6001000     0.4876000      0.7812000 
1 1 1 20 1  12 o 9.968000  0.2138000     9.926000  0.3011000     10.01000  0.3035000     -0.8322000E-01 0.4276000 
1 1 1 20 1  13 o 5.493000  0.3436000     5.760000  0.4572000     5.226000  0.5131000     0.5334000      0.6872000 
1 1 1 20 1  14 o 8.637000  0.2665000     8.586000  0.3656000     8.688000  0.3879000     -0.1028000     0.5331000 
1 1 1 20 1  15 o 2.728000  0.6314000     2.674000  0.8699000     2.782000  0.9153000     -0.1076000     1.263000  
1 1 1 20 1  16 o 6.110000  0.3670000     6.098000  0.5079000     6.122000  0.5299000     -0.2428000E-01 0.7340000 
1 1 1 20 1  17 o 2.419000  0.6155000     2.640000  0.8771000     2.198000  0.8638000     0.4417000      1.231000  
1 1 1 20 1  18 o 1.477000  0.4848000     1.333000  0.6394000     1.621000  0.7289000     -0.2878000     0.9696000 
1 1 1 20 1  19 o 1.646000  0.5165000     1.453000  0.6737000     1.839000  0.7830000     -0.3863000     1.033000  
1 1 1 20 1  20 o 1.407000  0.4545000     1.334000  0.6199000     1.481000  0.6649000     -0.1462000     0.9090000 
1 1 1 20 1  21 o 2.682000  0.5306000     2.808000  0.7324000     2.556000  0.7679000     0.2514000      1.061000  
1 1 1 20 1  22 o 1.839000  0.5425000     1.706000  0.7399000     1.972000  0.7936000     -0.2662000     1.085000  
1 1 1 20 1  23 o 1.623000  0.5106000     1.468000  0.6814000     1.778000  0.7605000     -0.3098000     1.021000  
1 1 1 20 1  24 o 1.096000  0.3897000     1.069000  0.5393000     1.123000  0.5627000     -0.5471000E-01 0.7794000 
1 1 1 20 2  1  o 3.318000  0.1630000     3.239000  0.2857000     3.397000  0.1569000     -0.1577000     0.3260000 
1 1 1 20 2  2  o 4.574000  0.1858000     4.457000  0.3335000     4.692000  0.1640000     -0.2345000     0.3716000 
1 1 1 20 2  3  o 8.026000  0.9143000E-01 7.971000  0.1237000     8.080000  0.1347000     -0.1093000     0.1829000 
1 1 1 20 2  4  o 12.12000  0.1454000     12.18000  0.1629000     12.06000  0.2409000     0.1154000      0.2908000 
1 1 1 20 2  5  o 19.93000  0.1786000     19.99000  0.2155000     19.87000  0.2847000     0.1132000      0.3571000 
1 1 1 20 2  6  o 11.75000  0.1392000     11.62000  0.1964000     11.88000  0.1973000     -0.2611000     0.2784000 
1 1 1 20 2  7  o 9.596000  0.1498000     9.639000  0.2145000     9.553000  0.2091000     0.8623000E-01  0.2995000 
1 1 1 20 2  8  o 4.690000  0.2432000     4.875000  0.3328000     4.506000  0.3547000     0.3690000      0.4864000 
1 1 1 20 2  9  o 13.91000  0.1924000     14.06000  0.2717000     13.75000  0.2723000     0.3151000      0.3847000 
1 1 1 20 2  10 o 4.384000  0.3123000     4.175000  0.4657000     4.593000  0.4163000     -0.4177000     0.6247000 
1 1 1 20 2  11 f 7.998000  0.2257000     8.125000  0.3168000     7.871000  0.3214000     0.2532000      0.4513000 
1 1 1 20 2  12 o 6.828000  0.2710000     6.976000  0.3793000     6.680000  0.3872000     0.2957000      0.5421000 
1 1 1 20 2  13 o 4.976000  0.3731000     5.035000  0.5171000     4.918000  0.5379000     0.1169000      0.7461000 
1 1 1 20 2  14 o 8.240000  0.2761000     8.135000  0.3858000     8.344000  0.3951000     -0.2090000     0.5522000 
1 1 1 20 2  15 o 3.158000  0.6263000     3.165000  0.8843000     3.152000  0.8871000     0.1231000E-01  1.253000  
1 1 1 20 2  16 o 2.568000  0.6137000     1.900000  0.8238000     3.237000  0.9099000     -1.337000      1.227000  
1 1 1 20 2  17 o 3.054000  0.6097000     3.325000  0.8461000     2.784000  0.8782000     0.5411000      1.219000  
1 1 1 20 2  18 o 3.640000  0.5064000     4.957000  0.5467000     2.323000  0.8526000     2.633000       1.013000  
1 1 1 20 2  19 o 3.190000  0.5441000     2.816000  0.8180000     3.563000  0.7178000     -0.7470000     1.088000  
1 1 1 20 2  20 o 1.711000  0.4982000     1.395000  0.6410000     2.027000  0.7628000     -0.6323000     0.9963000 
1 1 1 20 2  21 o 2.161000  0.5461000     2.303000  0.7776000     2.020000  0.7670000     0.2832000      1.092000  
1 1 1 20 2  22 o 1.989000  0.5619000     2.016000  0.7932000     1.962000  0.7960000     0.5304000E-01  1.124000  
1 1 1 20 2  23 o 1.248000  0.4274000     1.180000  0.5796000     1.316000  0.6282000     -0.1360000     0.8547000 
1 1 1 20 2  24 o 1.777000  0.5285000     2.095000  0.8101000     1.458000  0.6791000     0.6369000      1.057000  
1 1 1 20 3  0  o 1.736000  0.4984000     1.736000  0.4984000     1.736000  0.4984000     -0.000000      0.000000  
1 1 1 20 3  1  o 2.350000  0.2110000     2.485000  0.3501000     2.214000  0.2356000     0.2710000      0.4220000 
1 1 1 20 3  2  o 11.08000  0.1705000     11.27000  0.3099000     10.88000  0.1425000     0.3860000      0.3411000 
1 1 1 20 3  3  o 16.45000  0.1387000     16.27000  0.1918000     16.63000  0.2005000     -0.3688000     0.2775000 
1 1 1 20 3  4  o 2.185000  0.2089000     1.895000  0.2982000     2.476000  0.2925000     -0.5810000     0.4177000 
1 1 1 20 3  5  o 4.016000  0.1724000     3.812000  0.1905000     4.219000  0.2874000     -0.4070000     0.3448000 
1 1 1 20 3  6  o 6.855000  0.1897000     6.869000  0.1583000     6.840000  0.3447000     0.2922000E-01  0.3793000 
1 1 1 20 3  7  o 9.307000  0.1510000     9.086000  0.2138000     9.529000  0.2134000     -0.4427000     0.3021000 
1 1 1 20 3  8  o 8.260000  0.1695000     8.094000  0.2427000     8.427000  0.2367000     -0.3332000     0.3390000 
1 1 1 20 3  9  o 12.82000  0.1913000     12.97000  0.2720000     12.66000  0.2692000     0.3115000      0.3827000 
1 1 1 20 3  10 o 10.97000  0.1841000     10.90000  0.2634000     11.05000  0.2573000     -0.1490000     0.3682000 
1 1 1 20 3  11 o 10.80000  0.1970000     10.70000  0.2790000     10.89000  0.2782000     -0.1879000     0.3940000 
1 1 1 20 3  12 o 9.047000  0.2263000     8.724000  0.3297000     9.370000  0.3101000     -0.6465000     0.4527000 
1 1 1 20 3  13 o 19.39000  0.2162000     19.56000  0.3073000     19.21000  0.3043000     0.3453000      0.4325000 
1 1 1 20 3  14 o 3.056000  0.6032000     2.256000  0.8876000     3.855000  0.8172000     -1.599000      1.206000  
1 1 1 20 3  15 o 2.014000  0.5887000     1.874000  0.8047000     2.154000  0.8594000     -0.2801000     1.177000  
1 1 1 20 3  16 o 7.355000  0.3158000     7.477000  0.4430000     7.232000  0.4502000     0.2450000      0.6316000 
1 1 1 20 3  17 o 2.782000  0.6115000     2.352000  0.8702000     3.211000  0.8593000     -0.8583000     1.223000  
1 1 1 20 3  18 o 2.212000  0.5920000     2.340000  0.8480000     2.084000  0.8262000     0.2566000      1.184000  
1 1 1 20 3  19 o 1.708000  0.5226000     1.969000  0.7972000     1.447000  0.6759000     0.5215000      1.045000  
1 1 1 20 3  20 o 2.026000  0.5286000     2.337000  0.7681000     1.715000  0.7266000     0.6221000      1.057000  
1 1 1 20 3  21 o 1.614000  0.4828000     1.316000  0.6155000     1.912000  0.7441000     -0.5959000     0.9657000 
1 1 1 20 3  22 o 2.011000  0.5160000     2.760000  0.8308000     1.261000  0.6121000     1.499000       1.032000  
1 1 1 20 3  23 o 1.769000  0.5212000     1.398000  0.6555000     2.140000  0.8104000     -0.7423000     1.042000  
1 1 1 20 3  24 o 1.300000  0.4410000     1.285000  0.6172000     1.315000  0.6301000     -0.2923000E-01 0.8820000 
1 1 1 20 4  0  o 6.148000  0.1062000     6.148000  0.1062000     6.148000  0.1062000     0.000000       0.000000  
1 1 1 20 4  1  o 1.775000  0.1735000     1.852000  0.2844000     1.698000  0.1988000     0.1541000      0.3470000 
1 1 1 20 4  2  o 2.173000  0.1343000     2.043000  0.1924000     2.302000  0.1873000     -0.2591000     0.2685000 
1 1 1 20 4  3  o 14.75000  0.1292000     14.67000  0.1789000     14.84000  0.1863000     -0.1784000     0.2583000 
1 1 1 20 4  4  o 21.73000  0.2875000     21.68000  0.2864000     21.78000  0.4985000     -0.9519000E-01 0.5750000 
1 1 1 20 4  5  o 10.58000  0.1196000     10.62000  0.1658000     10.53000  0.1723000     0.9341000E-01  0.2392000 
1 1 1 20 4  6  f 11.29000  0.1750000     11.36000  0.1822000     11.22000  0.2988000     0.1411000      0.3499000 
1 1 1 20 4  7  o 10.75000  0.1531000     10.77000  0.1730000     10.74000  0.2527000     0.3677000E-01  0.3062000 
1 1 1 20 4  8  o 17.14000  0.1900000     17.40000  0.2481000     16.87000  0.2879000     0.5272000      0.3800000 
1 1 1 20 4  9  o 18.06000  0.2097000     18.10000  0.2980000     18.03000  0.2952000     0.6751000E-01  0.4194000 
1 1 1 20 4  10 o 4.186000  0.3474000     3.613000  0.5540000     4.759000  0.4194000     -1.147000      0.6949000 
1 1 1 20 4  11 o 14.23000  0.1899000     14.40000  0.2698000     14.06000  0.2672000     0.3410000      0.3797000 
1 1 1 20 4  12 f 9.394000  0.2193000     9.589000  0.3071000     9.200000  0.3130000     0.3891000      0.4385000 
1 1 1 20 4  13 o 6.644000  0.2919000     6.550000  0.4203000     6.738000  0.4051000     -0.1882000     0.5837000 
1 1 1 20 4  14 o 7.032000  0.3500000     6.579000  0.5196000     7.485000  0.4691000     -0.9057000     0.7001000 
1 1 1 20 4  15 o 2.543000  0.6364000     2.493000  0.9045000     2.593000  0.8954000     -0.1000000     1.273000  
1 1 1 20 4  16 o 2.787000  0.6260000     2.333000  0.8969000     3.242000  0.8734000     -0.9085000     1.252000  
1 1 1 20 4  17 o 5.452000  0.3791000     5.464000  0.5345000     5.440000  0.5378000     0.2435000E-01  0.7582000 
1 1 1 20 4  18 o 2.834000  0.5691000     3.348000  0.7822000     2.320000  0.8269000     1.029000       1.138000  
1 1 1 20 4  19 o 4.004000  0.4675000     3.830000  0.6984000     4.179000  0.6216000     -0.3484000     0.9350000 
1 1 1 20 4  20 o 1.396000  0.4507000     1.575000  0.6862000     1.216000  0.5843000     0.3591000      0.9013000 
1 1 1 20 4  21 o 1.745000  0.5063000     1.394000  0.6390000     2.096000  0.7855000     -0.7019000     1.013000  
1 1 1 20 4  22 o 1.386000  0.4606000     1.420000  0.6609000     1.352000  0.6416000     0.6821000E-01  0.9211000 
1 1 1 20 4  23 o 2.486000  0.5945000     2.511000  0.8340000     2.462000  0.8475000     0.4911000E-01  1.189000  
1 1 1 20 4  24 o 1.126000  0.3950000     1.326000  0.6345000     0.9258000 0.4706000     0.4000000      0.7899000 
1 1 1 20 5  0  o 6.899000  0.1044000     6.899000  0.1044000     6.899000  0.1044000     -0.000000      0.000000  
1 1 1 20 5  1  o 3.711000  0.8938000E-01 3.727000  0.1448000     3.694000  0.1048000     0.3332000E-01  0.1788000 
1 1 1 20 5  2  o 20.05000  0.1625000     20.17000  0.2291000     19.94000  0.2305000     0.2312000      0.3250000 
1 1 1 20 5  3  o 17.79000  0.1496000     17.71000  0.2085000     17.87000  0.2146000     -0.1673000     0.2992000 
1 1 1 20 5  4  o 20.40000  0.2202000     20.44000  0.2739000     20.36000  0.3449000     0.7214000E-01  0.4404000 
1 1 1 20 5  5  o 9.575000  0.1191000     9.519000  0.1642000     9.631000  0.1726000     -0.1127000     0.2382000 
1 1 1 20 5  6  o 2.858000  0.2769000     2.846000  0.3663000     2.869000  0.4153000     -0.2323000E-01 0.5537000 
1 1 1 20 5  7  o 8.440000  0.1551000     8.412000  0.1731000     8.467000  0.2574000     -0.5503000E-01 0.3102000 
1 1 1 20 5  8  o 4.589000  0.2369000     4.429000  0.2559000     4.749000  0.3987000     -0.3194000     0.4737000 
1 1 1 20 5  9  o 10.18000  0.2218000     10.32000  0.2820000     10.04000  0.3423000     0.2790000      0.4435000 
1 1 1 20 5  10 o 7.989000  0.2053000     7.996000  0.2933000     7.983000  0.2874000     0.1325000E-01  0.4107000 
1 1 1 20 5  11 o 13.94000  0.2074000     13.85000  0.2698000     14.04000  0.3150000     -0.1918000     0.4147000 
1 1 1 20 5  12 o 3.557000  0.4627000     3.578000  0.6515000     3.535000  0.6571000     0.4278000E-01  0.9253000 
1 1 1 20 5  13 o 7.368000  0.2718000     7.658000  0.3665000     7.078000  0.4016000     0.5796000      0.5437000 
1 1 1 20 5  14 o 3.921000  0.5745000     4.731000  0.6713000     3.110000  0.9326000     1.621000       1.149000  
1 1 1 20 5  15 o 4.769000  0.4583000     4.394000  0.7063000     5.144000  0.5843000     -0.7505000     0.9166000 
1 1 1 20 5  16 o 3.076000  0.6263000     2.671000  0.9076000     3.481000  0.8632000     -0.8102000     1.253000  
1 1 1 20 5  17 o 3.778000  0.5574000     4.232000  0.7087000     3.324000  0.8604000     0.9077000      1.115000  
1 1 1 20 5  18 o 1.920000  0.5561000     2.111000  0.8279000     1.728000  0.7428000     0.3834000      1.112000  
1 1 1 20 5  19 o 2.816000  0.5687000     2.804000  0.8047000     2.828000  0.8037000     -0.2362000E-01 1.137000  
1 1 1 20 5  20 o 1.681000  0.4729000     2.216000  0.7655000     1.147000  0.5557000     1.069000       0.9459000 
1 1 1 20 5  21 o 1.564000  0.4931000     1.809000  0.7620000     1.320000  0.6262000     0.4892000      0.9862000 
1 1 1 20 5  22 o 1.586000  0.5027000     1.691000  0.7401000     1.481000  0.6805000     0.2100000      1.005000  
1 1 1 20 5  23 o 1.818000  0.4913000     1.300000  0.6252000     2.336000  0.7580000     -1.036000      0.9825000 
1 1 1 20 5  24 o 1.731000  0.5229000     1.475000  0.6819000     1.987000  0.7930000     -0.5122000     1.046000  
1 1 1 20 6  0  o 3.632000  0.1570000     3.632000  0.1570000     3.632000  0.1570000     -0.000000      0.000000  
1 1 1 20 6  1  o 10.88000  0.9409000E-01 10.96000  0.1397000     10.80000  0.1260000     0.1648000      0.1882000 
1 1 1 20 6  2  o 14.64000  0.1296000     14.56000  0.2036000     14.73000  0.1606000     -0.1664000     0.2593000 
1 1 1 20 6  3  o 4.139000  0.1164000     4.044000  0.1634000     4.234000  0.1658000     -0.1908000     0.2327000 
1 1 1 20 6  4  o 14.26000  0.1424000     14.35000  0.1863000     14.18000  0.2153000     0.1661000      0.2847000 
1 1 1 20 6  5  o 11.00000  0.1256000     10.92000  0.1746000     11.07000  0.1804000     -0.1456000     0.2511000 
1 1 1 20 6  6  o 12.93000  0.2387000     12.82000  0.4341000     13.05000  0.1986000     -0.2330000     0.4774000 
1 1 1 20 6  7  o 16.20000  0.1587000     16.30000  0.2234000     16.11000  0.2255000     0.1858000      0.3174000 
1 1 1 20 6  8  o 17.73000  0.1823000     17.69000  0.2158000     17.77000  0.2939000     -0.7449000E-01 0.3646000 
1 1 1 20 6  9  o 12.29000  0.2562000     11.98000  0.2339000     12.60000  0.4560000     -0.6212000     0.5125000 
1 1 1 20 6  10 o 10.47000  0.1884000     10.90000  0.2109000     10.03000  0.3122000     0.8630000      0.3767000 
1 1 1 20 6  11 o 6.462000  0.3015000     6.614000  0.4192000     6.310000  0.4335000     0.3036000      0.6030000 
1 1 1 20 6  12 o 3.760000  0.4514000     3.441000  0.6919000     4.079000  0.5800000     -0.6374000     0.9029000 
1 1 1 20 6  13 o 7.790000  0.2596000     7.867000  0.3653000     7.713000  0.3689000     0.1540000      0.5191000 
1 1 1 20 6  14 o 4.499000  0.5675000     5.493000  0.6037000     3.505000  0.9612000     1.989000       1.135000  
1 1 1 20 6  15 o 5.606000  0.3815000     5.730000  0.5249000     5.483000  0.5538000     0.2472000      0.7631000 
1 1 1 20 6  16 o 4.924000  0.4987000     4.851000  0.6477000     4.996000  0.7586000     -0.1454000     0.9975000 
1 1 1 20 6  17 o 3.611000  0.5505000     3.623000  0.7752000     3.599000  0.7818000     0.2360000E-01  1.101000  
1 1 1 20 6  18 o 1.764000  0.5300000     1.710000  0.7412000     1.817000  0.7577000     -0.1075000     1.060000  
1 1 1 20 6  19 o 2.051000  0.5568000     2.273000  0.8062000     1.830000  0.7682000     0.4427000      1.114000  
1 1 1 20 6  20 o 2.340000  0.5390000     2.053000  0.7627000     2.626000  0.7619000     -0.5732000     1.078000  
1 1 1 20 6  21 o 1.856000  0.5301000     2.137000  0.7976000     1.575000  0.6985000     0.5618000      1.060000  
1 1 1 20 6  22 o 1.415000  0.4658000     1.393000  0.6508000     1.437000  0.6665000     -0.4411000E-01 0.9315000 
1 1 1 20 6  23 o 1.160000  0.3977000     1.065000  0.5300000     1.255000  0.5930000     -0.1897000     0.7953000 
1 1 1 20 6  24 f 1.206000  0.4156000     1.214000  0.5934000     1.198000  0.5821000     0.1602000E-01  0.8313000 
1 1 1 20 7  0  o 4.262000  0.1243000     4.262000  0.1243000     4.262000  0.1243000     0.000000       0.000000  
1 1 1 20 7  1  o 13.43000  0.1154000     13.56000  0.1641000     13.30000  0.1623000     0.2613000      0.2308000 
1 1 1 20 7  2  o 14.67000  0.1312000     14.57000  0.2061000     14.77000  0.1626000     -0.2002000     0.2625000 
1 1 1 20 7  3  o 18.90000  0.1697000     18.72000  0.2558000     19.08000  0.2230000     -0.3605000     0.3394000 
1 1 1 20 7  4  o 17.29000  0.1524000     17.14000  0.2117000     17.44000  0.2193000     -0.3040000     0.3048000 
1 1 1 20 7  5  o 10.35000  0.1244000     10.03000  0.1711000     10.68000  0.1806000     -0.6532000     0.2488000 
1 1 1 20 7  6  o 10.45000  0.1532000     10.83000  0.2417000     10.07000  0.1882000     0.7563000      0.3064000 
1 1 1 20 7  7  o 10.59000  0.1392000     10.39000  0.1934000     10.79000  0.2004000     -0.4004000     0.2785000 
1 1 1 20 7  8  o 4.269000  0.2098000     4.374000  0.2802000     4.164000  0.3124000     0.2104000      0.4196000 
1 1 1 20 7  9  o 14.07000  0.2606000     14.16000  0.2492000     13.98000  0.4579000     0.1859000      0.5213000 
1 1 1 20 7  10 o 7.561000  0.2138000     7.971000  0.2222000     7.151000  0.3653000     0.8205000      0.4276000 
1 1 1 20 7  11 f 14.00000  0.2346000     14.06000  0.2483000     13.94000  0.3981000     0.1206000      0.4692000 
1 1 1 20 7  12 o 2.073000  0.5531000     1.979000  0.7788000     2.166000  0.7855000     -0.1868000     1.106000  
1 1 1 20 7  13 o 3.623000  0.5003000     2.927000  0.8097000     4.320000  0.5878000     -1.394000      1.001000  
1 1 1 20 7  14 o 4.357000  0.5413000     3.079000  0.9308000     5.636000  0.5529000     -2.557000      1.083000  
1 1 1 20 7  15 o 2.057000  0.6042000     1.858000  0.8048000     2.257000  0.9013000     -0.3993000     1.208000  
1 1 1 20 7  16 o 6.087000  0.4314000     6.039000  0.6054000     6.135000  0.6147000     -0.9645000E-01 0.8628000 
1 1 1 20 7  17 o 5.821000  0.3534000     6.261000  0.4751000     5.382000  0.5234000     0.8796000      0.7069000 
1 1 1 20 7  18 o 1.339000  0.4502000     1.324000  0.6307000     1.355000  0.6427000     -0.3149000E-01 0.9004000 
1 1 1 20 7  19 o 2.819000  0.5533000     2.106000  0.8594000     3.531000  0.6971000     -1.425000      1.107000  
1 1 1 20 7  20 o 1.785000  0.5019000     2.061000  0.7513000     1.509000  0.6658000     0.5519000      1.004000  
1 1 1 20 7  21 o 1.670000  0.5017000     1.946000  0.7641000     1.394000  0.6505000     0.5519000      1.003000  
1 1 1 20 7  22 o 1.281000  0.4322000     1.394000  0.6482000     1.167000  0.5717000     0.2269000      0.8643000 
1 1 1 20 7  23 o 1.658000  0.5027000     1.844000  0.7596000     1.472000  0.6586000     0.3722000      1.005000  
1 1 1 20 7  24 o 1.474000  0.4803000     1.381000  0.6543000     1.566000  0.7033000     -0.1846000     0.9606000 
1 1 1 20 8  0  o 6.022000  0.1212000     6.022000  0.1212000     6.022000  0.1212000     0.000000       0.000000  
1 1 1 20 8  1  o 6.422000  0.8682000E-01 6.275000  0.1228000     6.569000  0.1228000     -0.2933000     0.1736000 
1 1 1 20 8  2  o 16.36000  0.1380000     16.23000  0.1936000     16.49000  0.1966000     -0.2557000     0.2759000 
1 1 1 20 8  3  o 6.966000  0.1233000     7.043000  0.1918000     6.890000  0.1550000     0.1530000      0.2466000 
1 1 1 20 8  4  o 5.712000  0.1269000     5.673000  0.1841000     5.751000  0.1746000     -0.7842000E-01 0.2537000 
1 1 1 20 8  5  o 4.768000  0.1699000     4.713000  0.1983000     4.822000  0.2760000     -0.1088000     0.3398000 
1 1 1 20 8  6  o 22.59000  0.1934000     22.67000  0.2728000     22.51000  0.2744000     0.1595000      0.3869000 
1 1 1 20 8  7  o 4.968000  0.1818000     4.805000  0.2534000     5.132000  0.2608000     -0.3269000     0.3637000 
1 1 1 20 8  8  o 19.02000  0.1798000     19.03000  0.2524000     19.02000  0.2563000     0.9300000E-02  0.3597000 
1 1 1 20 8  9  o 12.92000  0.2063000     12.67000  0.2184000     13.16000  0.3501000     -0.4818000     0.4127000 
1 1 1 20 8  10 f 2.647000  0.3721000     2.429000  0.5312000     2.865000  0.5212000     -0.4364000     0.7442000 
1 1 1 20 8  11 o 7.741000  0.3443000     7.740000  0.4786000     7.742000  0.4951000     -0.1266000E-02 0.6886000 
1 1 1 20 8  12 o 7.266000  0.2555000     7.465000  0.2736000     7.067000  0.4316000     0.3978000      0.5111000 
1 1 1 20 8  13 o 3.173000  0.5295000     2.421000  0.8363000     3.926000  0.6497000     -1.504000      1.059000  
1 1 1 20 8  14 o 12.77000  0.3073000     13.06000  0.4396000     12.49000  0.4294000     0.5674000      0.6145000 
1 1 1 20 8  15 o 3.190000  0.5926000     2.714000  0.8946000     3.665000  0.7776000     -0.9508000     1.185000  
1 1 1 20 8  16 o 3.875000  0.6142000     2.853000  0.9798000     4.896000  0.7411000     -2.044000      1.228000  
1 1 1 20 8  17 o 1.836000  0.5333000     2.407000  0.8687000     1.264000  0.6187000     1.143000       1.067000  
1 1 1 20 8  18 o 2.568000  0.5889000     2.354000  0.8203000     2.782000  0.8452000     -0.4276000     1.178000  
1 1 1 20 8  19 o 2.305000  0.6228000     2.443000  0.9139000     2.167000  0.8464000     0.2759000      1.246000  
1 1 1 20 8  20 o 2.854000  0.5112000     2.766000  0.7331000     2.943000  0.7127000     -0.1771000     1.022000  
1 1 1 20 8  21 o 1.639000  0.5019000     1.799000  0.7443000     1.479000  0.6736000     0.3207000      1.004000  
1 1 1 20 8  22 o 1.418000  0.4664000     1.301000  0.6183000     1.536000  0.6985000     -0.2345000     0.9328000 
1 1 1 20 8  23 o 2.365000  0.5371000     2.885000  0.7944000     1.845000  0.7231000     1.040000       1.074000  
1 1 1 20 8  24 o 1.784000  0.5307000     1.646000  0.7306000     1.923000  0.7699000     -0.2767000     1.061000  
1 1 1 20 9  0  o 12.94000  0.1635000     12.94000  0.1635000     12.94000  0.1635000     -0.000000      0.000000  
1 1 1 20 9  1  o 10.68000  0.1037000     10.66000  0.1459000     10.71000  0.1475000     -0.5376000E-01 0.2075000 
1 1 1 20 9  2  o 7.621000  0.9528000E-01 7.604000  0.1356000     7.639000  0.1339000     -0.3505000E-01 0.1906000 
1 1 1 20 9  3  o 18.74000  0.2002000     18.48000  0.2525000     19.00000  0.3108000     -0.5248000     0.4004000 
1 1 1 20 9  4  o 2.803000  0.2023000     2.749000  0.2946000     2.857000  0.2775000     -0.1070000     0.4047000 
1 1 1 20 9  5  o 11.58000  0.2185000     11.56000  0.3939000     11.60000  0.1892000     -0.4350000E-01 0.4370000 
1 1 1 20 9  6  o 6.176000  0.1468000     6.321000  0.1987000     6.030000  0.2161000     0.2911000      0.2936000 
1 1 1 20 9  7  f 11.99000  0.1461000     12.02000  0.2022000     11.95000  0.2110000     0.6198000E-01  0.2923000 
1 1 1 20 9  8  o 11.62000  0.1514000     11.86000  0.2123000     11.38000  0.2161000     0.4805000      0.3029000 
1 1 1 20 9  9  o 11.63000  0.1676000     11.68000  0.2185000     11.59000  0.2542000     0.8856000E-01  0.3352000 
1 1 1 20 9  10 o 11.64000  0.1670000     11.47000  0.2321000     11.81000  0.2401000     -0.3391000     0.3340000 
1 1 1 20 9  11 o 10.06000  0.3199000     9.980000  0.5857000     10.14000  0.2576000     -0.1604000     0.6399000 
1 1 1 20 9  12 o 16.49000  0.2078000     16.03000  0.2396000     16.96000  0.3396000     -0.9349000     0.4156000 
1 1 1 20 9  13 o 13.75000  0.2115000     13.66000  0.2406000     13.84000  0.3478000     -0.1798000     0.4229000 
1 1 1 20 9  14 o 4.454000  0.5036000     4.023000  0.5288000     4.884000  0.8573000     -0.8617000     1.007000  
1 1 1 20 9  15 o 3.078000  0.6249000     3.295000  0.8769000     2.861000  0.8906000     0.4339000      1.250000  
1 1 1 20 9  16 o 5.334000  0.5130000     4.857000  0.8100000     5.811000  0.6298000     -0.9536000     1.026000  
1 1 1 20 9  17 o 4.433000  0.4651000     3.760000  0.7525000     5.105000  0.5469000     -1.345000      0.9303000 
1 1 1 20 9  18 o 2.821000  0.5821000     2.480000  0.8419000     3.161000  0.8040000     -0.6811000     1.164000  
1 1 1 20 9  19 o 2.332000  0.6001000     2.152000  0.8749000     2.512000  0.8216000     -0.3603000     1.200000  
1 1 1 20 9  20 o 1.398000  0.4498000     1.234000  0.5867000     1.561000  0.6819000     -0.3279000     0.8996000 
1 1 1 20 9  21 o 2.013000  0.5680000     1.897000  0.8098000     2.128000  0.7966000     -0.2311000     1.136000  
1 1 1 20 9  22 o 1.586000  0.4971000     1.530000  0.6850000     1.641000  0.7205000     -0.1107000     0.9941000 
1 1 1 20 9  23 o 1.253000  0.4225000     1.364000  0.6399000     1.142000  0.5517000     0.2218000      0.8449000 
1 1 1 20 9  24 o 1.390000  0.4743000     1.609000  0.7482000     1.171000  0.5832000     0.4382000      0.9487000 
1 1 1 20 10 0  o 20.65000  0.2380000     20.65000  0.2380000     20.65000  0.2380000     -0.000000      0.000000  
1 1 1 20 10 1  o 22.14000  0.1794000     22.29000  0.2548000     21.98000  0.2526000     0.3124000      0.3588000 
1 1 1 20 10 2  o 24.56000  0.2428000     24.58000  0.3964000     24.54000  0.2806000     0.4287000E-01  0.4856000 
1 1 1 20 10 3  o 3.591000  0.1335000     3.641000  0.1872000     3.542000  0.1903000     0.9897000E-01  0.2670000 
1 1 1 20 10 4  o 3.173000  0.1864000     3.282000  0.2702000     3.064000  0.2569000     0.2182000      0.3729000 
1 1 1 20 10 5  o 6.901000  0.1668000     7.414000  0.2894000     6.389000  0.1659000     1.025000       0.3336000 
1 1 1 20 10 6  o 8.312000  0.1344000     8.369000  0.1861000     8.255000  0.1940000     0.1139000      0.2688000 
1 1 1 20 10 7  o 15.42000  0.1585000     15.38000  0.2209000     15.47000  0.2273000     -0.8582000E-01 0.3170000 
1 1 1 20 10 8  o 2.397000  0.3614000     2.498000  0.4506000     2.296000  0.5651000     0.2024000      0.7228000 
1 1 1 20 10 9  o 16.74000  0.1756000     16.65000  0.2460000     16.84000  0.2507000     -0.1950000     0.3512000 
1 1 1 20 10 10 o 20.14000  0.1959000     19.94000  0.2738000     20.34000  0.2803000     -0.4059000     0.3919000 
1 1 1 20 10 11 o 4.024000  0.4480000     4.196000  0.7824000     3.853000  0.4364000     0.3433000      0.8959000 
1 1 1 20 10 12 o 5.595000  0.2476000     5.792000  0.3354000     5.398000  0.3642000     0.3933000      0.4951000 
1 1 1 20 10 13 o 5.523000  0.4197000     5.980000  0.3203000     5.065000  0.7760000     0.9145000      0.8395000 
1 1 1 20 10 14 o 1.867000  0.5745000     1.582000  0.6728000     2.153000  0.9314000     -0.5704000     1.149000  
1 1 1 20 10 15 o 4.122000  0.4651000     3.720000  0.5416000     4.524000  0.7563000     -0.8038000     0.9303000 
1 1 1 20 10 16 o 2.406000  0.7076000     2.590000  1.030000      2.223000  0.9705000     0.3664000      1.415000  
1 1 1 20 10 17 o 4.083000  0.4919000     4.787000  0.5868000     3.379000  0.7896000     1.408000       0.9838000 
1 1 1 20 10 18 o 3.672000  0.5352000     3.614000  0.7578000     3.731000  0.7561000     -0.1176000     1.070000  
1 1 1 20 10 19 o 1.620000  0.5122000     1.595000  0.7227000     1.645000  0.7260000     -0.5001000E-01 1.024000  
1 1 1 20 10 20 o 1.626000  0.4778000     1.322000  0.6147000     1.930000  0.7316000     -0.6087000     0.9555000 
1 1 1 20 10 21 o 2.190000  0.5776000     1.502000  0.7005000     2.878000  0.9186000     -1.376000      1.155000  
1 1 1 20 10 22 o 2.978000  0.5614000     2.255000  0.8898000     3.700000  0.6846000     -1.445000      1.123000  
1 1 1 20 10 23 o 1.914000  0.5167000     2.350000  0.8015000     1.477000  0.6524000     0.8733000      1.033000  
1 1 1 20 10 24 o 1.143000  0.4053000     1.235000  0.6122000     1.051000  0.5313000     0.1847000      0.8106000 
1 1 1 20 11 0  o 4.925000  0.1518000     4.925000  0.1518000     4.925000  0.1518000     -0.000000      0.000000  
1 1 1 20 11 1  o 11.09000  0.1198000     11.12000  0.1816000     11.07000  0.1563000     0.4278000E-01  0.2396000 
1 1 1 20 11 2  o 8.659000  0.1267000     8.870000  0.1667000     8.449000  0.1908000     0.4207000      0.2533000 
1 1 1 20 11 3  o 13.86000  0.1403000     13.98000  0.1835000     13.75000  0.2124000     0.2259000      0.2807000 
1 1 1 20 11 4  o 10.14000  0.1521000     10.12000  0.2326000     10.17000  0.1962000     -0.4537000E-01 0.3042000 
1 1 1 20 11 5  o 1.929000  0.2924000     2.476000  0.3842000     1.381000  0.4409000     1.095000       0.5848000 
1 1 1 20 11 6  o 11.20000  0.1491000     11.30000  0.2208000     11.11000  0.2006000     0.1826000      0.2983000 
1 1 1 20 11 7  o 13.82000  0.1535000     13.99000  0.2134000     13.65000  0.2206000     0.3380000      0.3069000 
1 1 1 20 11 8  o 11.65000  0.1693000     11.89000  0.2351000     11.41000  0.2435000     0.4812000      0.3385000 
1 1 1 20 11 9  o 15.54000  0.1714000     15.61000  0.2395000     15.47000  0.2452000     0.1390000      0.3428000 
1 1 1 20 11 10 o 8.312000  0.1821000     8.274000  0.2552000     8.351000  0.2599000     -0.7692000E-01 0.3642000 
1 1 1 20 11 11 f 1.489000  0.4352000     1.554000  0.6214000     1.424000  0.6093000     0.1300000      0.8703000 
1 1 1 20 11 12 o 9.976000  0.1874000     9.890000  0.2624000     10.06000  0.2676000     -0.1724000     0.3748000 
1 1 1 20 11 13 o 8.225000  0.2082000     7.875000  0.2888000     8.575000  0.2999000     -0.6995000     0.4164000 
1 1 1 20 11 14 o 3.863000  0.4262000     4.165000  0.4921000     3.560000  0.6959000     0.6051000      0.8523000 
1 1 1 20 11 15 o 7.231000  0.3016000     7.320000  0.3230000     7.143000  0.5096000     0.1771000      0.6033000 
1 1 1 20 11 16 o 1.916000  0.6156000     2.152000  0.9519000     1.679000  0.7809000     0.4728000      1.231000  
1 1 1 20 11 17 o 5.805000  0.3538000     6.130000  0.3406000     5.480000  0.6202000     0.6504000      0.7075000 
1 1 1 20 11 18 o 1.829000  0.5513000     1.725000  0.7571000     1.933000  0.8017000     -0.2076000     1.103000  
1 1 1 20 11 19 o 2.176000  0.5714000     2.265000  0.8323000     2.087000  0.7832000     0.1773000      1.143000  
1 1 1 20 11 20 o 1.579000  0.4624000     2.057000  0.7511000     1.102000  0.5396000     0.9544000      0.9248000 
1 1 1 20 11 21 o 1.269000  0.4361000     1.414000  0.6719000     1.124000  0.5561000     0.2898000      0.8722000 
1 1 1 20 11 22 o 1.634000  0.5084000     1.540000  0.6916000     1.727000  0.7455000     -0.1864000     1.017000  
1 1 1 20 11 23 o 1.491000  0.4658000     1.877000  0.7625000     1.104000  0.5352000     0.7736000      0.9315000 
1 1 1 20 12 0  o 10.93000  0.1833000     10.93000  0.1833000     10.93000  0.1833000     0.000000       0.000000  
1 1 1 20 12 1  o 3.873000  0.1957000     3.708000  0.2021000     4.038000  0.3352000     -0.3300000     0.3914000 
1 1 1 20 12 2  o 7.922000  0.1155000     7.970000  0.1474000     7.875000  0.1779000     0.9535000E-01  0.2311000 
1 1 1 20 12 3  o 1.799000  0.3299000     1.352000  0.4372000     2.246000  0.4941000     -0.8944000     0.6598000 
1 1 1 20 12 4  o 14.65000  0.1502000     14.50000  0.2276000     14.79000  0.1959000     -0.2888000     0.3003000 
1 1 1 20 12 5  f 11.59000  0.1262000     11.46000  0.1787000     11.73000  0.1783000     -0.2744000     0.2524000 
1 1 1 20 12 6  f 4.712000  0.1684000     4.758000  0.2638000     4.667000  0.2095000     0.9135000E-01  0.3369000 
1 1 1 20 12 7  o 17.20000  0.1685000     17.42000  0.2384000     16.98000  0.2383000     0.4390000      0.3370000 
1 1 1 20 12 8  o 23.19000  0.2685000     23.33000  0.3323000     23.05000  0.4218000     0.2788000      0.5370000 
1 1 1 20 12 9  o 9.770000  0.1646000     9.534000  0.2276000     10.01000  0.2379000     -0.4706000     0.3293000 
1 1 1 20 12 10 o 5.634000  0.2489000     5.628000  0.3116000     5.640000  0.3883000     -0.1123000E-01 0.4979000 
1 1 1 20 12 11 o 10.75000  0.1798000     10.61000  0.2532000     10.89000  0.2555000     -0.2824000     0.3597000 
1 1 1 20 12 12 o 12.93000  0.1854000     12.86000  0.2618000     13.00000  0.2626000     -0.1398000     0.3708000 
1 1 1 20 12 13 o 7.553000  0.2192000     7.918000  0.2944000     7.189000  0.3249000     0.7287000      0.4385000 
1 1 1 20 12 14 o 5.714000  0.2721000     5.771000  0.3704000     5.657000  0.3988000     0.1146000      0.5443000 
1 1 1 20 12 15 o 6.363000  0.2669000     6.376000  0.3634000     6.349000  0.3910000     0.2707000E-01  0.5338000 
1 1 1 20 12 16 o 1.695000  0.5539000     1.675000  0.7788000     1.715000  0.7879000     -0.3975000E-01 1.108000  
1 1 1 20 12 17 o 2.184000  0.5695000     2.258000  0.7340000     2.109000  0.8708000     0.1486000      1.139000  
1 1 1 20 12 18 o 2.197000  0.5801000     1.880000  0.7106000     2.514000  0.9171000     -0.6342000     1.160000  
1 1 1 20 12 19 o 1.633000  0.5212000     1.322000  0.5903000     1.945000  0.8592000     -0.6233000     1.042000  
1 1 1 20 12 20 o 1.798000  0.5040000     2.038000  0.7418000     1.558000  0.6826000     0.4798000      1.008000  
1 1 1 20 12 21 o 1.096000  0.3845000     1.015000  0.5084000     1.176000  0.5771000     -0.1611000     0.7691000 
1 1 1 20 12 22 o 2.740000  0.5536000     3.177000  0.7378000     2.304000  0.8256000     0.8732000      1.107000  
1 1 1 20 12 23 o 1.413000  0.4604000     1.255000  0.5984000     1.571000  0.6998000     -0.3163000     0.9207000 
1 1 1 20 13 0  o 6.928000  0.2770000     6.928000  0.2770000     6.928000  0.2770000     0.000000       0.000000  
1 1 1 20 13 1  f 15.55000  0.1781000     15.40000  0.2234000     15.70000  0.2775000     -0.3038000     0.3563000 
1 1 1 20 13 2  o 6.468000  0.1962000     6.720000  0.3254000     6.216000  0.2193000     0.5043000      0.3924000 
1 1 1 20 13 3  o 11.33000  0.1304000     11.35000  0.1984000     11.31000  0.1695000     0.4681000E-01  0.2609000 
1 1 1 20 13 4  o 2.369000  0.2393000     2.778000  0.2836000     1.961000  0.3856000     0.8167000      0.4787000 
1 1 1 20 13 5  o 10.67000  0.1249000     10.66000  0.1774000     10.69000  0.1757000     -0.3304000E-01 0.2497000 
1 1 1 20 13 6  o 3.345000  0.2204000     3.330000  0.3448000     3.360000  0.2746000     -0.2993000E-01 0.4408000 
1 1 1 20 13 7  o 16.20000  0.1656000     16.10000  0.2614000     16.29000  0.2034000     -0.1843000     0.3312000 
1 1 1 20 13 8  o 5.335000  0.2742000     5.473000  0.2837000     5.197000  0.4693000     0.2762000      0.5484000 
1 1 1 20 13 9  o 8.706000  0.1666000     8.563000  0.2269000     8.849000  0.2439000     -0.2861000     0.3331000 
1 1 1 20 13 10 o 2.289000  0.4886000     1.931000  0.6847000     2.647000  0.6973000     -0.7158000     0.9772000 
1 1 1 20 13 11 o 5.950000  0.2300000     5.887000  0.3168000     6.012000  0.3337000     -0.1243000     0.4601000 
1 1 1 20 13 12 o 11.85000  0.1876000     11.84000  0.2624000     11.85000  0.2683000     -0.1155000E-01 0.3753000 
1 1 1 20 13 13 o 2.504000  0.5038000     2.624000  0.6847000     2.383000  0.7393000     0.2408000      1.008000  
1 1 1 20 13 14 f 6.540000  0.2568000     6.614000  0.3455000     6.466000  0.3802000     0.1481000      0.5137000 
1 1 1 20 13 15 o 3.094000  0.4930000     3.147000  0.6744000     3.041000  0.7193000     0.1059000      0.9860000 
1 1 1 20 13 16 o 3.925000  0.4228000     4.068000  0.5946000     3.783000  0.6012000     0.2857000      0.8456000 
1 1 1 20 13 17 o 1.969000  0.5358000     1.823000  0.7259000     2.115000  0.7884000     -0.2925000     1.072000  
1 1 1 20 13 18 o 1.785000  0.5278000     1.747000  0.6843000     1.824000  0.8038000     -0.7680000E-01 1.056000  
1 1 1 20 13 19 o 1.800000  0.5172000     1.650000  0.6436000     1.950000  0.8097000     -0.3002000     1.034000  
1 1 1 20 13 20 o 1.725000  0.4827000     1.883000  0.6528000     1.566000  0.7112000     0.3174000      0.9654000 
1 1 1 20 13 21 o 1.554000  0.4926000     1.334000  0.6267000     1.774000  0.7602000     -0.4400000     0.9852000 
1 1 1 20 13 22 o 1.567000  0.4855000     1.866000  0.7545000     1.267000  0.6111000     0.5989000      0.9710000 
1 1 1 20 13 23 o 1.367000  0.4469000     1.648000  0.7192000     1.086000  0.5307000     0.5619000      0.8938000 
1 1 1 20 14 0  o 12.34000  0.1711000     12.34000  0.1711000     12.34000  0.1711000     -0.000000      0.000000  
1 1 1 20 14 1  o 2.587000  0.2033000     2.625000  0.3004000     2.549000  0.2741000     0.7613000E-01  0.4067000 
1 1 1 20 14 2  o 7.839000  0.1104000     7.914000  0.1545000     7.765000  0.1578000     0.1485000      0.2208000 
1 1 1 20 14 3  o 9.505000  0.1149000     9.445000  0.1616000     9.565000  0.1634000     -0.1198000     0.2298000 
1 1 1 20 14 4  o 22.87000  0.1916000     22.94000  0.2719000     22.80000  0.2700000     0.1423000      0.3832000 
1 1 1 20 14 5  o 4.970000  0.1632000     4.668000  0.2594000     5.272000  0.1982000     -0.6040000     0.3264000 
1 1 1 20 14 6  o 10.15000  0.1289000     10.15000  0.1816000     10.16000  0.1828000     -0.1261000E-01 0.2577000 
1 1 1 20 14 7  o 11.37000  0.1475000     11.65000  0.2338000     11.10000  0.1801000     0.5494000      0.2951000 
1 1 1 20 14 8  o 3.839000  0.2564000     3.753000  0.3338000     3.925000  0.3894000     -0.1721000     0.5129000 
1 1 1 20 14 9  o 7.196000  0.1815000     7.184000  0.2526000     7.209000  0.2607000     -0.2449000E-01 0.3630000 
1 1 1 20 14 10 o 6.887000  0.3668000     6.582000  0.6755000     7.191000  0.2861000     -0.6093000     0.7336000 
1 1 1 20 14 11 o 5.688000  0.3088000     5.216000  0.5203000     6.161000  0.3326000     -0.9447000     0.6175000 
1 1 1 20 14 12 o 2.342000  0.4991000     2.122000  0.6933000     2.563000  0.7182000     -0.4413000     0.9982000 
1 1 1 20 14 13 o 10.37000  0.2221000     10.13000  0.3101000     10.61000  0.3181000     -0.4737000     0.4442000 
1 1 1 20 14 14 o 3.805000  0.4120000     3.425000  0.6197000     4.184000  0.5430000     -0.7597000     0.8239000 
1 1 1 20 14 15 o 7.347000  0.2622000     7.204000  0.3348000     7.491000  0.4035000     -0.2865000     0.5243000 
1 1 1 20 14 16 o 2.131000  0.5397000     2.039000  0.7478000     2.224000  0.7784000     -0.1847000     1.079000  
1 1 1 20 14 17 o 4.182000  0.3954000     4.530000  0.4613000     3.834000  0.6422000     0.6964000      0.7908000 
1 1 1 20 14 18 o 2.362000  0.5073000     2.858000  0.6945000     1.865000  0.7396000     0.9931000      1.015000  
1 1 1 20 14 19 o 1.579000  0.4418000     1.979000  0.6828000     1.178000  0.5610000     0.8005000      0.8837000 
1 1 1 20 14 20 o 1.948000  0.5229000     1.658000  0.6406000     2.239000  0.8266000     -0.5814000     1.046000  
1 1 1 20 14 21 o 1.417000  0.4557000     1.216000  0.5524000     1.618000  0.7248000     -0.4017000     0.9113000 
1 1 1 20 14 22 o 1.636000  0.4889000     1.623000  0.6521000     1.649000  0.7287000     -0.2629000E-01 0.9778000 
1 1 1 20 14 23 o 1.626000  0.5117000     1.259000  0.5858000     1.992000  0.8392000     -0.7329000     1.023000  
1 1 1 20 15 0  o 8.617000  0.1563000     8.617000  0.1563000     8.617000  0.1563000     0.000000       0.000000  
1 1 1 20 15 1  o 9.433000  0.1127000     9.496000  0.1590000     9.369000  0.1599000     0.1273000      0.2255000 
1 1 1 20 15 2  o 2.324000  0.2293000     2.281000  0.3291000     2.367000  0.3195000     -0.8605000E-01 0.4587000 
1 1 1 20 15 3  o 8.716000  0.1169000     8.558000  0.1656000     8.875000  0.1650000     -0.3173000     0.2337000 
1 1 1 20 15 4  o 8.168000  0.1335000     7.940000  0.2064000     8.397000  0.1694000     -0.4569000     0.2670000 
1 1 1 20 15 5  o 13.60000  0.1388000     13.64000  0.1974000     13.55000  0.1951000     0.9169000E-01  0.2776000 
1 1 1 20 15 6  o 4.174000  0.1700000     4.116000  0.2420000     4.233000  0.2388000     -0.1168000     0.3400000 
1 1 1 20 15 7  o 5.615000  0.2052000     5.571000  0.3476000     5.658000  0.2183000     -0.8721000E-01 0.4105000 
1 1 1 20 15 8  o 15.90000  0.1701000     15.80000  0.2681000     15.99000  0.2095000     -0.1889000     0.3402000 
1 1 1 20 15 9  o 13.57000  0.1817000     13.63000  0.2331000     13.52000  0.2788000     0.1064000      0.3635000 
1 1 1 20 15 10 o 8.921000  0.2134000     8.840000  0.3403000     9.002000  0.2576000     -0.1612000     0.4268000 
1 1 1 20 15 11 o 4.309000  0.3000000     4.346000  0.3989000     4.271000  0.4482000     0.7547000E-01  0.6000000 
1 1 1 20 15 12 o 8.387000  0.2256000     8.233000  0.2877000     8.542000  0.3474000     -0.3094000     0.4511000 
1 1 1 20 15 13 o 6.762000  0.3356000     6.357000  0.3869000     7.166000  0.5484000     -0.8086000     0.6711000 
1 1 1 20 15 14 o 6.772000  0.2594000     7.090000  0.3559000     6.454000  0.3775000     0.6362000      0.5188000 
1 1 1 20 15 15 o 3.481000  0.5060000     3.796000  0.6479000     3.166000  0.7774000     0.6306000      1.012000  
1 1 1 20 15 16 o 1.689000  0.4997000     1.782000  0.7207000     1.597000  0.6925000     0.1849000      0.9994000 
1 1 1 20 15 17 o 2.560000  0.5062000     1.970000  0.7264000     3.150000  0.7052000     -1.180000      1.012000  
1 1 1 20 15 18 o 1.956000  0.5089000     1.460000  0.6458000     2.453000  0.7867000     -0.9930000     1.018000  
1 1 1 20 15 19 o 1.818000  0.4864000     2.068000  0.7083000     1.567000  0.6667000     0.5013000      0.9727000 
1 1 1 20 15 20 o 2.082000  0.5026000     2.153000  0.6979000     2.010000  0.7235000     0.1425000      1.005000  
1 1 1 20 15 21 o 2.028000  0.4630000     2.456000  0.6612000     1.601000  0.6483000     0.8549000      0.9260000 
1 1 1 20 15 22 o 1.573000  0.4822000     1.514000  0.6334000     1.633000  0.7273000     -0.1195000     0.9644000 
1 1 1 20 15 23 o 1.211000  0.4176000     1.077000  0.5187000     1.345000  0.6546000     -0.2678000     0.8352000 
1 1 1 20 16 0  o 8.550000  0.1603000     8.550000  0.1603000     8.550000  0.1603000     -0.000000      0.000000  
1 1 1 20 16 1  o 7.726000  0.1154000     7.863000  0.1607000     7.589000  0.1656000     0.2743000      0.2307000 
1 1 1 20 16 2  o 9.540000  0.1322000     9.536000  0.1865000     9.544000  0.1875000     -0.8595000E-02 0.2644000 
1 1 1 20 16 3  o 5.510000  0.1315000     5.489000  0.1840000     5.531000  0.1877000     -0.4142000E-01 0.2629000 
1 1 1 20 16 4  o 5.573000  0.1348000     5.388000  0.1943000     5.758000  0.1868000     -0.3701000     0.2695000 
1 1 1 20 16 5  o 6.400000  0.1340000     6.505000  0.1902000     6.294000  0.1889000     0.2108000      0.2681000 
1 1 1 20 16 6  o 11.38000  0.1349000     11.46000  0.1913000     11.29000  0.1903000     0.1696000      0.2698000 
1 1 1 20 16 7  f 12.22000  0.1761000     12.21000  0.2255000     12.24000  0.2706000     -0.2610000E-01 0.3522000 
1 1 1 20 16 8  o 4.480000  0.2913000     5.186000  0.4983000     3.774000  0.3017000     1.412000       0.5825000 
1 1 1 20 16 9  o 4.772000  0.2801000     4.445000  0.3992000     5.100000  0.3930000     -0.6551000     0.5602000 
1 1 1 20 16 10 o 1.672000  0.4039000     2.269000  0.6233000     1.075000  0.5140000     1.194000       0.8078000 
1 1 1 20 16 11 o 8.420000  0.2086000     8.582000  0.2772000     8.259000  0.3117000     0.3235000      0.4171000 
1 1 1 20 16 12 o 7.160000  0.2301000     7.062000  0.3223000     7.258000  0.3285000     -0.1958000     0.4602000 
1 1 1 20 16 13 o 8.216000  0.3204000     8.292000  0.3184000     8.141000  0.5560000     0.1512000      0.6407000 
1 1 1 20 16 14 o 7.575000  0.2428000     7.404000  0.3370000     7.746000  0.3496000     -0.3416000     0.4856000 
1 1 1 20 16 15 f 2.999000  0.5613000     2.512000  0.8434000     3.486000  0.7407000     -0.9741000     1.123000  
1 1 1 20 16 16 o 5.026000  0.3355000     4.450000  0.5183000     5.602000  0.4262000     -1.152000      0.6711000 
1 1 1 20 16 17 o 2.777000  0.5041000     3.235000  0.6407000     2.318000  0.7783000     0.9173000      1.008000  
1 1 1 20 16 18 o 2.427000  0.5978000     2.080000  0.7177000     2.774000  0.9562000     -0.6934000     1.196000  
1 1 1 20 16 19 o 1.598000  0.4660000     1.799000  0.6949000     1.396000  0.6210000     0.4037000      0.9320000 
1 1 1 20 16 20 o 1.681000  0.4828000     1.759000  0.6837000     1.604000  0.6820000     0.1547000      0.9657000 
1 1 1 20 16 21 o 2.442000  0.4614000     1.927000  0.6819000     2.957000  0.6219000     -1.029000      0.9228000 
1 1 1 20 16 22 o 1.414000  0.4381000     1.259000  0.5829000     1.569000  0.6541000     -0.3097000     0.8761000 
1 1 1 20 16 23 o 1.460000  0.4829000     1.384000  0.6326000     1.537000  0.7297000     -0.1530000     0.9658000 
1 1 1 20 17 0  o 12.18000  0.1779000     12.18000  0.1779000     12.18000  0.1779000     0.000000       0.000000  
1 1 1 20 17 1  o 12.52000  0.1278000     12.47000  0.1796000     12.57000  0.1820000     -0.9447000E-01 0.2557000 
1 1 1 20 17 2  o 15.96000  0.1467000     15.89000  0.2066000     16.03000  0.2084000     -0.1364000     0.2934000 
1 1 1 20 17 3  o 13.63000  0.1355000     13.54000  0.1905000     13.73000  0.1927000     -0.1932000     0.2710000 
1 1 1 20 17 4  o 9.541000  0.1243000     9.606000  0.1755000     9.475000  0.1761000     0.1307000      0.2486000 
1 1 1 20 17 5  o 16.62000  0.1679000     16.58000  0.2514000     16.66000  0.2226000     -0.8493000E-01 0.3357000 
1 1 1 20 17 6  o 8.948000  0.1489000     8.871000  0.2286000     9.025000  0.1907000     -0.1537000     0.2977000 
1 1 1 20 17 7  o 2.188000  0.3432000     2.062000  0.4843000     2.315000  0.4863000     -0.2538000     0.6863000 
1 1 1 20 17 8  o 8.979000  0.1478000     9.210000  0.2055000     8.748000  0.2124000     0.4613000      0.2955000 
1 1 1 20 17 9  f 6.641000  0.3536000     6.525000  0.6499000     6.758000  0.2788000     -0.2327000     0.7072000 
1 1 1 20 17 10 o 12.01000  0.1762000     12.02000  0.2463000     12.01000  0.2521000     0.7664000E-02  0.3524000 
1 1 1 20 17 11 o 4.584000  0.2872000     4.367000  0.4096000     4.800000  0.4027000     -0.4330000     0.5745000 
1 1 1 20 17 12 o 12.37000  0.1911000     12.25000  0.2671000     12.48000  0.2735000     -0.2243000     0.3822000 
1 1 1 20 17 13 o 2.353000  0.5246000     2.730000  0.6996000     1.975000  0.7820000     0.7550000      1.049000  
1 1 1 20 17 14 o 4.036000  0.3950000     4.263000  0.4982000     3.809000  0.6132000     0.4539000      0.7901000 
1 1 1 20 17 15 o 5.536000  0.6166000     5.423000  1.156000      5.649000  0.4307000     -0.2260000     1.233000  
1 1 1 20 17 16 o 2.092000  0.5338000     1.983000  0.7311000     2.201000  0.7780000     -0.2178000     1.068000  
1 1 1 20 17 17 o 2.757000  0.5130000     2.509000  0.7218000     3.005000  0.7293000     -0.4959000     1.026000  
1 1 1 20 17 18 o 2.734000  0.6594000     2.323000  0.7105000     3.146000  1.111000      -0.8232000     1.319000  
1 1 1 20 17 19 o 1.393000  0.4418000     1.343000  0.6126000     1.442000  0.6369000     -0.9870000E-01 0.8837000 
1 1 1 20 17 20 o 1.553000  0.4716000     1.448000  0.6525000     1.657000  0.6812000     -0.2098000     0.9433000 
1 1 1 20 17 21 o 1.592000  0.4649000     1.424000  0.6227000     1.761000  0.6904000     -0.3375000     0.9297000 
1 1 1 20 17 22 o 1.362000  0.4311000     1.322000  0.6032000     1.402000  0.6161000     -0.8004000E-01 0.8623000 
1 1 1 20 17 23 o 1.553000  0.5061000     1.551000  0.6557000     1.554000  0.7712000     -0.3442000E-02 1.012000  
1 1 1 20 18 0  f 4.948000  0.1941000     4.948000  0.1941000     4.948000  0.1941000     -0.000000      0.000000  
1 1 1 20 18 1  o 9.151000  0.1197000     8.961000  0.1686000     9.341000  0.1699000     -0.3798000     0.2393000 
1 1 1 20 18 2  o 6.629000  0.1250000     6.725000  0.1746000     6.532000  0.1789000     0.1926000      0.2499000 
1 1 1 20 18 3  o 12.46000  0.1321000     12.51000  0.1863000     12.42000  0.1873000     0.9505000E-01  0.2642000 
1 1 1 20 18 4  o 17.47000  0.1601000     17.58000  0.2271000     17.37000  0.2257000     0.2012000      0.3202000 
1 1 1 20 18 5  o 23.62000  0.2013000     23.66000  0.2852000     23.58000  0.2841000     0.7965000E-01  0.4026000 
1 1 1 20 18 6  o 9.672000  0.1755000     9.581000  0.2719000     9.763000  0.2221000     -0.1818000     0.3511000 
1 1 1 20 18 7  o 6.599000  0.1510000     6.659000  0.2134000     6.539000  0.2138000     0.1196000      0.3020000 
1 1 1 20 18 8  o 1.330000  0.3868000     1.339000  0.5344000     1.321000  0.5592000     0.1802000E-01  0.7735000 
1 1 1 20 18 9  o 7.567000  0.2395000     7.598000  0.4254000     7.537000  0.2200000     0.6041000E-01  0.4789000 
1 1 1 20 18 10 o 5.299000  0.2484000     5.274000  0.3547000     5.323000  0.3478000     -0.4874000E-01 0.4967000 
1 1 1 20 18 11 o 3.090000  0.4150000     3.149000  0.5559000     3.031000  0.6165000     0.1176000      0.8301000 
1 1 1 20 18 12 o 7.699000  0.2253000     7.358000  0.3157000     8.040000  0.3214000     -0.6813000     0.4505000 
1 1 1 20 18 13 o 2.730000  0.5107000     2.942000  0.6721000     2.518000  0.7691000     0.4241000      1.021000  
1 1 1 20 18 14 o 7.021000  0.2520000     6.887000  0.3509000     7.155000  0.3618000     -0.2671000     0.5040000 
1 1 1 20 18 15 o 3.793000  0.5584000     3.459000  0.9550000     4.127000  0.5789000     -0.6673000     1.117000  
1 1 1 20 18 16 o 4.363000  0.3691000     4.521000  0.4768000     4.205000  0.5636000     0.3162000      0.7382000 
1 1 1 20 18 17 o 3.187000  0.4679000     3.736000  0.5328000     2.637000  0.7694000     1.099000       0.9358000 
1 1 1 20 18 18 o 1.939000  0.5688000     1.627000  0.6787000     2.250000  0.9129000     -0.6222000     1.138000  
1 1 1 20 18 19 o 1.450000  0.4492000     1.277000  0.5940000     1.623000  0.6740000     -0.3459000     0.8984000 
1 1 1 20 18 20 o 2.064000  0.6152000     2.278000  1.012000      1.851000  0.7003000     0.4263000      1.230000  
1 1 1 20 18 21 o 2.045000  0.4713000     1.588000  0.6514000     2.502000  0.6814000     -0.9142000     0.9427000 
1 1 1 20 18 22 o 2.264000  0.5042000     2.524000  0.7208000     2.004000  0.7051000     0.5202000      1.008000  
1 1 1 20 18 23 o 1.263000  0.4383000     1.070000  0.5175000     1.456000  0.7077000     -0.3860000     0.8767000 
1 1 1 20 19 0  o 0.9913000 0.5408000     0.9913000 0.5408000     0.9913000 0.5408000     0.000000       0.000000  
1 1 1 20 19 1  o 14.53000  0.1411000     14.50000  0.1982000     14.56000  0.2008000     -0.5627000E-01 0.2822000 
1 1 1 20 19 2  o 15.66000  0.1481000     15.68000  0.2091000     15.65000  0.2097000     0.2194000E-01  0.2961000 
1 1 1 20 19 3  f 11.93000  0.1318000     11.91000  0.1851000     11.95000  0.1877000     -0.4230000E-01 0.2636000 
1 1 1 20 19 4  o 20.12000  0.1782000     20.04000  0.2509000     20.21000  0.2531000     -0.1638000     0.3564000 
1 1 1 20 19 5  o 9.880000  0.1343000     9.877000  0.1914000     9.884000  0.1885000     -0.6854000E-02 0.2687000 
1 1 1 20 19 6  o 3.835000  0.2641000     4.160000  0.3348000     3.510000  0.4084000     0.6505000      0.5281000 
1 1 1 20 19 7  o 4.925000  0.1815000     4.866000  0.2627000     4.984000  0.2505000     -0.1180000     0.3630000 
1 1 1 20 19 8  o 10.42000  0.1985000     10.02000  0.3025000     10.82000  0.2570000     -0.8001000     0.3969000 
1 1 1 20 19 9  o 13.31000  0.1574000     13.36000  0.2225000     13.25000  0.2227000     0.1092000      0.3148000 
1 1 1 20 19 10 o 7.665000  0.1903000     7.674000  0.3023000     7.656000  0.2311000     0.1796000E-01  0.3806000 
1 1 1 20 19 11 o 10.80000  0.1869000     10.86000  0.2559000     10.73000  0.2725000     0.1256000      0.3739000 
1 1 1 20 19 12 o 6.777000  0.2602000     6.933000  0.3575000     6.620000  0.3781000     0.3123000      0.5203000 
1 1 1 20 19 13 o 10.27000  0.2044000     10.31000  0.2786000     10.24000  0.2991000     0.7229000E-01  0.4088000 
1 1 1 20 19 14 o 2.286000  0.5693000     2.632000  0.7868000     1.940000  0.8231000     0.6919000      1.139000  
1 1 1 20 19 15 o 2.292000  0.5451000     2.160000  0.7542000     2.425000  0.7871000     -0.2655000     1.090000  
1 1 1 20 19 16 o 1.594000  0.4753000     1.141000  0.5485000     2.047000  0.7765000     -0.9054000     0.9507000 
1 1 1 20 19 17 o 1.525000  0.4748000     1.461000  0.6458000     1.590000  0.6961000     -0.1288000     0.9495000 
1 1 1 20 19 18 o 1.976000  0.5132000     1.523000  0.6574000     2.428000  0.7882000     -0.9051000     1.026000  
1 1 1 20 19 19 o 2.508000  0.4931000     2.747000  0.6646000     2.268000  0.7285000     0.4793000      0.9861000 
1 1 1 20 19 20 o 1.505000  0.5142000     1.768000  0.8491000     1.241000  0.5803000     0.5268000      1.028000  
1 1 1 20 19 21 o 1.726000  0.4732000     1.948000  0.6933000     1.504000  0.6443000     0.4435000      0.9464000 
1 1 1 20 19 22 o 1.376000  0.4353000     1.529000  0.6590000     1.224000  0.5688000     0.3051000      0.8705000 
1 1 1 20 19 23 o 1.304000  0.4612000     1.308000  0.6465000     1.300000  0.6580000     0.8489000E-02  0.9224000 
1 1 1 20 20 0  o 9.233000  0.1750000     9.233000  0.1750000     9.233000  0.1750000     -0.000000      0.000000  
1 1 1 20 20 1  o 20.50000  0.1777000     20.52000  0.2512000     20.49000  0.2515000     0.3593000E-01  0.3555000 
1 1 1 20 20 2  o 17.05000  0.1572000     17.14000  0.2225000     16.97000  0.2222000     0.1680000      0.3145000 
1 1 1 20 20 3  o 18.47000  0.1668000     18.51000  0.2356000     18.43000  0.2362000     0.8049000E-01  0.3336000 
1 1 1 20 20 4  o 19.34000  0.1739000     19.45000  0.2465000     19.22000  0.2453000     0.2285000      0.3477000 
1 1 1 20 20 5  o 12.34000  0.1846000     12.68000  0.2882000     12.00000  0.2308000     0.6766000      0.3693000 
1 1 1 20 20 6  o 12.41000  0.1453000     12.41000  0.2058000     12.42000  0.2052000     -0.1206000E-01 0.2906000 
1 1 1 20 20 7  o 25.48000  0.2368000     25.67000  0.3128000     25.28000  0.3555000     0.3871000      0.4735000 
1 1 1 20 20 8  o 14.46000  0.1771000     14.24000  0.2718000     14.67000  0.2273000     -0.4236000     0.3543000 
1 1 1 20 20 9  o 12.48000  0.1574000     12.42000  0.2224000     12.53000  0.2227000     -0.1078000     0.3147000 
1 1 1 20 20 10 o 5.342000  0.2331000     5.320000  0.3686000     5.363000  0.2855000     -0.4330000E-01 0.4662000 
1 1 1 20 20 11 o 9.063000  0.1868000     9.209000  0.2907000     8.917000  0.2348000     0.2914000      0.3737000 
1 1 1 20 20 12 o 7.889000  0.3681000     8.402000  0.3260000     7.377000  0.6600000     1.025000       0.7361000 
1 1 1 20 20 13 f 1.584000  0.4847000     1.625000  0.6900000     1.543000  0.6808000     0.8245000E-01  0.9693000 
1 1 1 20 20 14 o 2.649000  0.5946000     2.402000  0.8336000     2.895000  0.8481000     -0.4929000     1.189000  
1 1 1 20 20 15 o 6.839000  0.2654000     6.472000  0.3888000     7.206000  0.3615000     -0.7346000     0.5309000 
1 1 1 20 20 16 o 3.622000  0.4280000     3.228000  0.6510000     4.015000  0.5559000     -0.7876000     0.8560000 
1 1 1 20 20 17 o 2.524000  0.5178000     2.424000  0.7138000     2.624000  0.7504000     -0.1993000     1.036000  
1 1 1 20 20 18 o 1.257000  0.4147000     1.179000  0.5564000     1.336000  0.6152000     -0.1569000     0.8295000 
1 1 1 20 20 19 o 3.682000  0.3899000     3.281000  0.5953000     4.084000  0.5038000     -0.8025000     0.7798000 
1 1 1 20 20 20 o 2.038000  0.4778000     1.441000  0.6701000     2.635000  0.6811000     -1.195000      0.9555000 
1 1 1 20 20 21 o 1.667000  0.4751000     1.568000  0.6495000     1.766000  0.6934000     -0.1976000     0.9501000 
1 1 1 20 20 22 o 1.222000  0.4056000     1.212000  0.5743000     1.232000  0.5727000     -0.1972000E-01 0.8111000 
1 1 1 20 21 0  o 5.917000  0.1968000     5.917000  0.1968000     5.917000  0.1968000     -0.000000      0.000000  
1 1 1 20 21 1  o 10.75000  0.1298000     10.77000  0.1838000     10.72000  0.1832000     0.4625000E-01  0.2595000 
1 1 1 20 21 2  o 8.316000  0.1303000     8.225000  0.1845000     8.408000  0.1840000     -0.1839000     0.2606000 
1 1 1 20 21 3  o 15.04000  0.1493000     14.94000  0.2100000     15.13000  0.2122000     -0.1968000     0.2985000 
1 1 1 20 21 4  o 7.037000  0.1548000     7.295000  0.2357000     6.778000  0.2009000     0.5164000      0.3097000 
1 1 1 20 21 5  o 13.85000  0.1767000     13.90000  0.2113000     13.81000  0.2832000     0.9352000E-01  0.3533000 
1 1 1 20 21 6  o 9.312000  0.1540000     9.381000  0.2021000     9.242000  0.2325000     0.1391000      0.3081000 
1 1 1 20 21 7  o 7.860000  0.2047000     7.887000  0.3133000     7.833000  0.2635000     0.5396000E-01  0.4093000 
1 1 1 20 21 8  o 12.86000  0.1551000     12.98000  0.2199000     12.73000  0.2187000     0.2490000      0.3101000 
1 1 1 20 21 9  o 2.803000  0.3501000     2.518000  0.5139000     3.088000  0.4755000     -0.5693000     0.7001000 
1 1 1 20 21 10 o 7.424000  0.1791000     7.732000  0.2465000     7.117000  0.2598000     0.6149000      0.3581000 
1 1 1 20 21 11 o 10.73000  0.1829000     10.82000  0.2889000     10.64000  0.2244000     0.1725000      0.3658000 
1 1 1 20 21 12 o 12.61000  0.2119000     12.51000  0.2734000     12.71000  0.3239000     -0.1969000     0.4239000 
1 1 1 20 21 13 o 3.432000  0.4482000     3.250000  0.6549000     3.615000  0.6122000     -0.3649000     0.8965000 
1 1 1 20 21 14 o 4.935000  0.6299000     4.892000  1.160000      4.979000  0.4925000     -0.8735000E-01 1.260000  
1 1 1 20 21 15 o 2.509000  0.5405000     2.845000  0.7399000     2.173000  0.7881000     0.6722000      1.081000  
1 1 1 20 21 16 o 2.414000  0.4970000     2.917000  0.6599000     1.911000  0.7434000     1.006000       0.9940000 
1 1 1 20 21 17 o 1.579000  0.4842000     1.735000  0.7094000     1.424000  0.6592000     0.3113000      0.9684000 
1 1 1 20 21 18 o 3.497000  0.4194000     3.119000  0.6323000     3.875000  0.5513000     -0.7556000     0.8389000 
1 1 1 20 21 19 o 1.568000  0.4743000     1.669000  0.6827000     1.467000  0.6586000     0.2021000      0.9486000 
1 1 1 20 21 20 o 2.426000  0.4894000     2.623000  0.6734000     2.228000  0.7104000     0.3952000      0.9788000 
1 1 1 20 21 21 o 1.214000  0.3978000     1.125000  0.5306000     1.303000  0.5929000     -0.1787000     0.7956000 
1 1 1 20 21 22 o 1.343000  0.4312000     1.424000  0.6319000     1.261000  0.5868000     0.1633000      0.8623000 
1 1 1 20 22 0  o 15.90000  0.2158000     15.90000  0.2158000     15.90000  0.2158000     -0.000000      0.000000  
1 1 1 20 22 1  o 3.141000  0.2183000     3.307000  0.2887000     2.974000  0.3276000     0.3330000      0.4367000 
1 1 1 20 22 2  o 5.007000  0.1603000     5.014000  0.2257000     5.000000  0.2276000     0.1338000E-01  0.3205000 
1 1 1 20 22 3  o 7.518000  0.1514000     7.673000  0.2314000     7.362000  0.1952000     0.3103000      0.3027000 
1 1 1 20 22 4  o 9.906000  0.1689000     10.07000  0.2207000     9.745000  0.2557000     0.3215000      0.3378000 
1 1 1 20 22 5  o 3.597000  0.2212000     3.889000  0.2892000     3.304000  0.3348000     0.5853000      0.4424000 
1 1 1 20 22 6  o 1.120000  0.3676000     1.067000  0.4869000     1.173000  0.5510000     -0.1056000     0.7353000 
1 1 1 20 22 7  o 13.55000  0.1728000     13.36000  0.2661000     13.75000  0.2206000     -0.3887000     0.3456000 
1 1 1 20 22 8  o 8.436000  0.1561000     8.264000  0.2213000     8.608000  0.2204000     -0.3440000     0.3123000 
1 1 1 20 22 9  o 9.731000  0.1610000     9.534000  0.2289000     9.929000  0.2264000     -0.3956000     0.3219000 
1 1 1 20 22 10 o 1.840000  0.4377000     2.098000  0.6143000     1.582000  0.6238000     0.5155000      0.8755000 
1 1 1 20 22 11 o 6.323000  0.2315000     6.322000  0.3581000     6.325000  0.2935000     -0.3198000E-02 0.4631000 
1 1 1 20 22 12 o 2.038000  0.4836000     1.853000  0.7136000     2.224000  0.6530000     -0.3707000     0.9673000 
1 1 1 20 22 13 o 4.010000  0.3827000     4.164000  0.4941000     3.856000  0.5846000     0.3080000      0.7655000 
1 1 1 20 22 14 f 3.205000  0.5241000     2.119000  0.8847000     4.291000  0.5620000     -2.172000      1.048000  
1 1 1 20 22 15 o 1.757000  0.5087000     1.868000  0.7270000     1.646000  0.7118000     0.2222000      1.017000  
1 1 1 20 22 16 o 2.380000  0.5197000     2.272000  0.7186000     2.488000  0.7511000     -0.2161000     1.039000  
1 1 1 20 22 17 o 2.462000  0.5710000     2.744000  0.6982000     2.180000  0.9037000     0.5634000      1.142000  
1 1 1 20 22 18 o 1.667000  0.4755000     1.354000  0.6092000     1.981000  0.7303000     -0.6276000     0.9511000 
1 1 1 20 22 19 o 2.022000  0.5263000     1.754000  0.7140000     2.290000  0.7735000     -0.5356000     1.053000  
1 1 1 20 22 20 f 1.739000  0.4781000     1.869000  0.6889000     1.608000  0.6631000     0.2613000      0.9562000 
1 1 1 20 22 21 o 1.651000  0.4583000     1.920000  0.6781000     1.382000  0.6168000     0.5384000      0.9167000 
1 1 1 20 22 22 o 1.340000  0.4341000     1.219000  0.5778000     1.461000  0.6481000     -0.2425000     0.8683000 
1 1 1 20 23 0  o 6.887000  0.1980000     6.887000  0.1980000     6.887000  0.1980000     -0.000000      0.000000  
1 1 1 20 23 1  o 8.582000  0.1331000     8.636000  0.1880000     8.529000  0.1885000     0.1072000      0.2662000 
1 1 1 20 23 2  o 15.45000  0.1664000     15.45000  0.2524000     15.44000  0.2169000     0.8520000E-02  0.3328000 
1 1 1 20 23 3  o 14.18000  0.1944000     13.96000  0.3017000     14.40000  0.2451000     -0.4413000     0.3887000 
1 1 1 20 23 4  o 6.390000  0.1788000     6.281000  0.2167000     6.498000  0.2845000     -0.2168000     0.3576000 
1 1 1 20 23 5  o 7.761000  0.1961000     7.673000  0.2285000     7.848000  0.3188000     -0.1746000     0.3923000 
1 1 1 20 23 6  o 8.056000  0.1671000     8.260000  0.2558000     7.852000  0.2149000     0.4075000      0.3341000 
1 1 1 20 23 7  o 10.35000  0.1513000     10.45000  0.2123000     10.25000  0.2156000     0.1995000      0.3026000 
1 1 1 20 23 8  o 6.384000  0.1804000     6.803000  0.2418000     5.965000  0.2678000     0.8379000      0.3609000 
1 1 1 20 23 9  o 9.183000  0.1693000     9.248000  0.2509000     9.119000  0.2275000     0.1290000      0.3387000 
1 1 1 20 23 10 o 4.982000  0.2354000     5.240000  0.3019000     4.723000  0.3612000     0.5170000      0.4708000 
1 1 1 20 23 11 o 2.051000  0.4909000     1.563000  0.6869000     2.540000  0.7016000     -0.9771000     0.9819000 
1 1 1 20 23 12 o 6.571000  0.2390000     6.499000  0.3842000     6.643000  0.2843000     -0.1433000     0.4779000 
1 1 1 20 23 13 o 4.742000  0.3779000     4.932000  0.4773000     4.553000  0.5859000     0.3790000      0.7557000 
1 1 1 20 23 14 o 5.951000  0.2853000     5.906000  0.3937000     5.995000  0.4131000     -0.8922000E-01 0.5707000 
1 1 1 20 23 15 o 1.751000  0.4869000     2.087000  0.7260000     1.415000  0.6490000     0.6718000      0.9738000 
1 1 1 20 23 16 o 5.425000  0.2824000     5.561000  0.3851000     5.290000  0.4131000     0.2701000      0.5648000 
1 1 1 20 23 17 o 2.225000  0.5725000     2.147000  0.7061000     2.304000  0.9013000     -0.1577000     1.145000  
1 1 1 20 23 18 o 2.081000  0.5107000     2.407000  0.7320000     1.755000  0.7124000     0.6520000      1.021000  
1 1 1 20 23 19 o 2.165000  0.6443000     2.393000  1.047000      1.937000  0.7509000     0.4554000      1.289000  
1 1 1 20 23 20 o 1.966000  0.4898000     2.102000  0.6924000     1.829000  0.6930000     0.2728000      0.9797000 
1 1 1 20 23 21 o 1.952000  0.4538000     1.348000  0.6069000     2.557000  0.6750000     -1.209000      0.9077000 
1 1 1 20 23 22 o 1.203000  0.4233000     0.9699000 0.4845000     1.436000  0.6942000     -0.4664000     0.8465000 
1 1 1 20 24 0  o 18.45000  0.2793000     18.45000  0.2793000     18.45000  0.2793000     -0.000000      0.000000  
1 1 1 20 24 1  o 3.904000  0.2361000     4.146000  0.3205000     3.663000  0.3469000     0.4836000      0.4723000 
1 1 1 20 24 2  o 24.79000  0.2726000     24.97000  0.3462000     24.61000  0.4212000     0.3609000      0.5452000 
1 1 1 20 24 3  o 18.56000  0.2097000     18.56000  0.2438000     18.56000  0.3412000     0.1431000E-03  0.4193000 
1 1 1 20 24 4  o 9.216000  0.1889000     9.618000  0.2211000     8.813000  0.3064000     0.8047000      0.3779000 
1 1 1 20 24 5  o 5.498000  0.1931000     5.297000  0.2991000     5.700000  0.2443000     -0.4037000     0.3862000 
1 1 1 20 24 6  o 16.12000  0.1656000     15.91000  0.2321000     16.34000  0.2362000     -0.4242000     0.3311000 
1 1 1 20 24 7  o 6.879000  0.1664000     6.937000  0.2365000     6.822000  0.2342000     0.1154000      0.3328000 
1 1 1 20 24 8  o 1.735000  0.4233000     1.570000  0.5959000     1.900000  0.6015000     -0.3296000     0.8467000 
1 1 1 20 24 9  o 2.034000  0.4335000     2.157000  0.6003000     1.910000  0.6255000     0.2462000      0.8670000 
1 1 1 20 24 10 o 6.735000  0.1930000     6.773000  0.2623000     6.696000  0.2833000     0.7775000E-01  0.3860000 
1 1 1 20 24 11 o 8.865000  0.2151000     9.083000  0.2467000     8.646000  0.3524000     0.4367000      0.4302000 
1 1 1 20 24 12 o 2.627000  0.4925000     2.666000  0.7482000     2.589000  0.6405000     0.7726000E-01  0.9849000 
1 1 1 20 24 13 o 3.287000  0.7056000     3.706000  1.197000      2.868000  0.7469000     0.8385000      1.411000  
1 1 1 20 24 14 f 2.439000  0.5281000     2.756000  0.7067000     2.121000  0.7850000     0.6355000      1.056000  
1 1 1 20 24 15 o 3.897000  0.3893000     3.772000  0.5511000     4.022000  0.5502000     -0.2505000     0.7787000 
1 1 1 20 24 16 o 2.465000  0.4816000     3.012000  0.6332000     1.918000  0.7257000     1.094000       0.9631000 
1 1 1 20 24 17 o 1.893000  0.4673000     1.122000  0.5429000     2.664000  0.7608000     -1.541000      0.9346000 
1 1 1 20 24 18 o 1.253000  0.4135000     1.128000  0.5408000     1.379000  0.6256000     -0.2512000     0.8269000 
1 1 1 20 24 19 o 1.944000  0.5589000     1.769000  0.8522000     2.119000  0.7233000     -0.3494000     1.118000  
1 1 1 20 24 20 o 1.920000  0.4948000     1.777000  0.6805000     2.063000  0.7183000     -0.2858000     0.9895000 
1 1 1 20 24 21 o 1.490000  0.4542000     1.340000  0.6106000     1.640000  0.6725000     -0.2993000     0.9083000 
1 1 1 20 24 22 o 1.471000  0.4840000     1.293000  0.5983000     1.648000  0.7609000     -0.3549000     0.9679000 
1 1 1 20 25 0  o 3.011000  0.5422000     3.011000  0.5422000     3.011000  0.5422000     -0.000000      0.000000  
1 1 1 20 25 1  o 21.89000  0.3816000     21.89000  0.3816000     ?         ?             ?              ?         
1 1 1 20 25 2  o 13.75000  0.1921000     13.48000  0.2384000     14.03000  0.3013000     -0.5468000     0.3842000 
1 1 1 20 25 3  o 5.826000  0.2085000     5.897000  0.3125000     5.755000  0.2762000     0.1423000      0.4170000 
1 1 1 20 25 4  o 9.031000  0.1571000     8.968000  0.2394000     9.094000  0.2035000     -0.1264000     0.3142000 
1 1 1 20 25 5  o 3.521000  0.2417000     3.734000  0.3241000     3.308000  0.3586000     0.4257000      0.4833000 
1 1 1 20 25 6  o 7.844000  0.1580000     7.846000  0.2236000     7.842000  0.2231000     0.3855000E-02  0.3159000 
1 1 1 20 25 7  o 6.162000  0.1823000     6.347000  0.2554000     5.976000  0.2602000     0.3715000      0.3646000 
1 1 1 20 25 8  o 6.033000  0.1887000     5.970000  0.2653000     6.095000  0.2685000     -0.1253000     0.3774000 
1 1 1 20 25 9  o 4.420000  0.2489000     4.773000  0.3232000     4.068000  0.3786000     0.7051000      0.4978000 
1 1 1 20 25 10 o 7.718000  0.2253000     7.406000  0.3671000     8.031000  0.2612000     -0.6251000     0.4505000 
1 1 1 20 25 11 o 2.183000  0.4727000     2.025000  0.6606000     2.340000  0.6764000     -0.3150000     0.9455000 
1 1 1 20 25 12 o 6.560000  0.2341000     6.499000  0.3137000     6.620000  0.3476000     -0.1208000     0.4682000 
1 1 1 20 25 13 o 8.160000  0.3174000     7.876000  0.5742000     8.443000  0.2707000     -0.5667000     0.6349000 
1 1 1 20 25 14 o 3.109000  0.4781000     2.610000  0.7296000     3.609000  0.6180000     -0.9991000     0.9562000 
1 1 1 20 25 15 o 1.666000  0.4878000     1.671000  0.6866000     1.662000  0.6931000     0.9711000E-02  0.9756000 
1 1 1 20 25 16 f 3.092000  0.4714000     3.452000  0.5423000     2.732000  0.7712000     0.7196000      0.9428000 
1 1 1 20 25 17 o 1.475000  0.4552000     1.356000  0.6079000     1.593000  0.6778000     -0.2366000     0.9105000 
1 1 1 20 25 18 o 2.016000  0.5113000     2.131000  0.7175000     1.901000  0.7287000     0.2299000      1.023000  
1 1 1 20 25 19 o 1.441000  0.4584000     1.383000  0.6503000     1.499000  0.6463000     -0.1161000     0.9169000 
1 1 1 20 25 20 o 1.323000  0.4278000     1.367000  0.6191000     1.278000  0.5907000     0.8916000E-01  0.8557000 
1 1 1 20 25 21 f 1.114000  0.3783000     1.141000  0.5442000     1.088000  0.5257000     0.5350000E-01  0.7567000 
1 1 1 20 25 22 o 1.153000  0.4165000     1.230000  0.6233000     1.076000  0.5527000     0.1542000      0.8331000 
1 1 1 20 26 0  o 5.090000  0.2794000     5.090000  0.2794000     5.090000  0.2794000     0.000000       0.000000  
1 1 1 20 26 1  o 7.147000  0.1583000     6.990000  0.2398000     7.304000  0.2067000     -0.3138000     0.3166000 
1 1 1 20 26 2  o 9.447000  0.1530000     9.156000  0.2311000     9.737000  0.2006000     -0.5809000     0.3060000 
1 1 1 20 26 3  o 2.343000  0.3406000     2.633000  0.4304000     2.054000  0.5281000     0.5788000      0.6813000 
1 1 1 20 26 4  o 8.360000  0.1479000     8.200000  0.2098000     8.520000  0.2084000     -0.3199000     0.2957000 
1 1 1 20 26 5  o 3.099000  0.2776000     2.878000  0.4160000     3.320000  0.3675000     -0.4422000     0.5551000 
1 1 1 20 26 6  o 7.007000  0.1669000     6.754000  0.2371000     7.260000  0.2350000     -0.5058000     0.3339000 
1 1 1 20 26 7  o 4.066000  0.2414000     4.399000  0.3209000     3.733000  0.3606000     0.6662000      0.4827000 
1 1 1 20 26 8  o 4.429000  0.2414000     4.411000  0.3482000     4.447000  0.3345000     -0.3634000E-01 0.4828000 
1 1 1 20 26 9  o 1.603000  0.4038000     1.099000  0.5151000     2.108000  0.6220000     -1.009000      0.8075000 
1 1 1 20 26 10 o 9.916000  0.2134000     9.795000  0.2708000     10.04000  0.3298000     -0.2426000     0.4267000 
1 1 1 20 26 11 o 15.34000  0.1805000     15.06000  0.2536000     15.63000  0.2568000     -0.5704000     0.3610000 
1 1 1 20 26 12 o 6.474000  0.2950000     6.854000  0.3133000     6.094000  0.5000000     0.7599000      0.5901000 
1 1 1 20 26 13 o 2.054000  0.5082000     2.040000  0.7487000     2.069000  0.6873000     -0.2878000E-01 1.016000  
1 1 1 20 26 14 o 3.842000  0.3734000     3.816000  0.5819000     3.869000  0.4680000     -0.5292000E-01 0.7468000 
1 1 1 20 26 15 o 3.457000  0.4334000     3.899000  0.5017000     3.016000  0.7070000     0.8836000      0.8669000 
1 1 1 20 26 16 o 1.864000  0.5526000     1.647000  0.6846000     2.081000  0.8676000     -0.4343000     1.105000  
1 1 1 20 26 17 o 2.688000  0.4959000     2.447000  0.7231000     2.928000  0.6788000     -0.4810000     0.9918000 
1 1 1 20 26 18 o 1.945000  0.5215000     1.855000  0.7157000     2.035000  0.7587000     -0.1791000     1.043000  
1 1 1 20 26 19 o 1.661000  0.4701000     1.457000  0.6264000     1.865000  0.7011000     -0.4079000     0.9402000 
1 1 1 20 26 20 o 0.9805000 0.3429000     0.9419000 0.4694000     1.019000  0.4999000     -0.7716000E-01 0.6858000 
1 1 1 20 26 21 o 1.324000  0.4253000     1.349000  0.6034000     1.299000  0.5995000     0.4993000E-01  0.8506000 
1 1 1 20 27 0  o 10.84000  0.2032000     10.84000  0.2032000     10.84000  0.2032000     -0.000000      0.000000  
1 1 1 20 27 1  o 5.187000  0.1774000     5.286000  0.2465000     5.087000  0.2552000     0.1990000      0.3548000 
1 1 1 20 27 2  o 9.045000  0.1441000     9.039000  0.2031000     9.050000  0.2045000     -0.1068000E-01 0.2882000 
1 1 1 20 27 3  o 4.076000  0.2149000     4.145000  0.2951000     4.007000  0.3125000     0.1379000      0.4298000 
1 1 1 20 27 4  o 4.512000  0.2017000     4.683000  0.2777000     4.342000  0.2926000     0.3408000      0.4034000 
1 1 1 20 27 5  o 14.88000  0.1616000     15.04000  0.2288000     14.72000  0.2283000     0.3149000      0.3232000 
1 1 1 20 27 6  o 2.290000  0.3730000     1.694000  0.5905000     2.885000  0.4559000     -1.192000      0.7460000 
1 1 1 20 27 7  o 12.47000  0.1601000     12.64000  0.2269000     12.30000  0.2258000     0.3388000      0.3201000 
1 1 1 20 27 8  o 8.262000  0.1733000     8.381000  0.2446000     8.144000  0.2456000     0.2373000      0.3466000 
1 1 1 20 27 9  o 2.617000  0.4435000     2.510000  0.6763000     2.723000  0.5739000     -0.2127000     0.8870000 
1 1 1 20 27 10 o 5.932000  0.2227000     5.882000  0.3025000     5.982000  0.3268000     -0.9930000E-01 0.4453000 
1 1 1 20 27 11 o 6.982000  0.2081000     6.794000  0.2945000     7.169000  0.2941000     -0.3755000     0.4162000 
1 1 1 20 27 12 o 2.565000  0.5305000     2.949000  0.7843000     2.181000  0.7146000     0.7681000      1.061000  
1 1 1 20 27 13 o 3.806000  0.3455000     3.639000  0.4900000     3.974000  0.4871000     -0.3347000     0.6910000 
1 1 1 20 27 14 o 2.593000  0.5086000     2.821000  0.7492000     2.365000  0.6879000     0.4560000      1.017000  
1 1 1 20 27 15 o 2.669000  0.5066000     2.396000  0.7203000     2.942000  0.7127000     -0.5465000     1.013000  
1 1 1 20 27 16 o 1.835000  0.5392000     1.704000  0.6837000     1.966000  0.8338000     -0.2615000     1.078000  
1 1 1 20 27 17 o 3.064000  0.4434000     2.907000  0.6461000     3.221000  0.6075000     -0.3134000     0.8869000 
1 1 1 20 27 18 o 1.904000  0.5063000     2.401000  0.7857000     1.408000  0.6388000     0.9927000      1.013000  
1 1 1 20 27 19 o 1.800000  0.4870000     1.866000  0.6874000     1.734000  0.6900000     0.1323000      0.9740000 
1 1 1 20 27 20 o 1.408000  0.4420000     1.262000  0.5855000     1.555000  0.6623000     -0.2934000     0.8840000 
1 1 1 20 27 21 o 1.276000  0.4188000     1.514000  0.6603000     1.037000  0.5154000     0.4771000      0.8376000 
1 1 1 20 28 0  o 10.71000  0.2051000     10.71000  0.2051000     10.71000  0.2051000     -0.000000      0.000000  
1 1 1 20 28 1  o 3.719000  0.2284000     3.550000  0.3375000     3.888000  0.3079000     -0.3378000     0.4568000 
1 1 1 20 28 2  o 18.07000  0.1740000     17.87000  0.2446000     18.27000  0.2475000     -0.4049000     0.3479000 
1 1 1 20 28 3  o 8.411000  0.1524000     8.600000  0.2129000     8.222000  0.2180000     0.3778000      0.3047000 
1 1 1 20 28 4  o 6.772000  0.1647000     6.677000  0.2323000     6.868000  0.2336000     -0.1918000     0.3294000 
1 1 1 20 28 5  o 6.864000  0.1713000     6.869000  0.2402000     6.858000  0.2444000     0.1022000E-01  0.3427000 
1 1 1 20 28 6  o 5.532000  0.1965000     5.572000  0.2744000     5.492000  0.2815000     0.8011000E-01  0.3931000 
1 1 1 20 28 7  o 8.033000  0.1700000     8.279000  0.2365000     7.787000  0.2442000     0.4923000      0.3400000 
1 1 1 20 28 8  o 7.089000  0.1853000     7.013000  0.2666000     7.164000  0.2575000     -0.1509000     0.3706000 
1 1 1 20 28 9  o 8.373000  0.2360000     8.040000  0.3662000     8.705000  0.2980000     -0.6643000     0.4721000 
1 1 1 20 28 10 o 5.780000  0.2266000     6.085000  0.3066000     5.474000  0.3338000     0.6113000      0.4532000 
1 1 1 20 28 11 o 9.576000  0.2434000     9.718000  0.2812000     9.435000  0.3974000     0.2828000      0.4869000 
1 1 1 20 28 12 f 9.937000  0.2033000     9.690000  0.2873000     10.18000  0.2877000     -0.4942000     0.4066000 
1 1 1 20 28 13 o 4.439000  0.2903000     4.219000  0.4116000     4.659000  0.4096000     -0.4394000     0.5807000 
1 1 1 20 28 14 o 1.942000  0.4941000     1.817000  0.7130000     2.066000  0.6842000     -0.2496000     0.9881000 
1 1 1 20 28 15 o 1.459000  0.4621000     1.415000  0.6425000     1.502000  0.6643000     -0.8725000E-01 0.9242000 
1 1 1 20 28 16 o 3.358000  0.4349000     2.910000  0.6178000     3.805000  0.6122000     -0.8952000     0.8698000 
1 1 1 20 28 17 o 1.954000  0.4563000     2.559000  0.6763000     1.350000  0.6128000     1.209000       0.9126000 
1 1 1 20 28 18 o 2.311000  0.4408000     1.338000  0.6728000     3.284000  0.5696000     -1.947000      0.8815000 
1 1 1 20 28 19 o 1.852000  0.4584000     1.285000  0.5874000     2.419000  0.7040000     -1.135000      0.9169000 
1 1 1 20 28 20 o 1.186000  0.3948000     1.306000  0.5938000     1.067000  0.5204000     0.2387000      0.7896000 
1 1 1 20 28 21 o 1.505000  0.4909000     1.643000  0.7176000     1.367000  0.6702000     0.2757000      0.9819000 
1 1 1 20 29 0  o 22.44000  0.2829000     22.44000  0.2829000     22.44000  0.2829000     -0.000000      0.000000  
1 1 1 20 29 1  o 9.776000  0.1476000     9.692000  0.2100000     9.860000  0.2075000     -0.1683000     0.2952000 
1 1 1 20 29 2  o 13.39000  0.1546000     13.42000  0.2188000     13.37000  0.2186000     0.4820000E-01  0.3093000 
1 1 1 20 29 3  o 4.867000  0.2020000     5.207000  0.2665000     4.527000  0.3036000     0.6799000      0.4040000 
1 1 1 20 29 4  o 13.61000  0.1582000     13.40000  0.2216000     13.81000  0.2259000     -0.4124000     0.3164000 
1 1 1 20 29 5  o 6.576000  0.1774000     6.842000  0.2465000     6.310000  0.2551000     0.5319000      0.3547000 
1 1 1 20 29 6  f 8.571000  0.1636000     8.537000  0.2296000     8.604000  0.2332000     -0.6703000E-01 0.3272000 
1 1 1 20 29 7  o 10.93000  0.1625000     11.20000  0.2281000     10.66000  0.2316000     0.5419000      0.3251000 
1 1 1 20 29 8  o 11.31000  0.1853000     11.24000  0.2840000     11.38000  0.2379000     -0.1390000     0.3705000 
1 1 1 20 29 9  o 6.982000  0.2075000     6.991000  0.2863000     6.972000  0.3005000     0.1935000E-01  0.4151000 
1 1 1 20 29 10 o 8.993000  0.1841000     8.846000  0.2600000     9.140000  0.2608000     -0.2944000     0.3683000 
1 1 1 20 29 11 o 2.493000  0.5509000     2.705000  0.7894000     2.281000  0.7687000     0.4243000      1.102000  
1 1 1 20 29 12 o 4.823000  0.2704000     4.892000  0.3641000     4.755000  0.3998000     0.1376000      0.5408000 
1 1 1 20 29 13 o 3.134000  0.4050000     2.478000  0.6389000     3.790000  0.4981000     -1.312000      0.8101000 
1 1 1 20 29 14 o 1.654000  0.4708000     1.755000  0.6705000     1.554000  0.6610000     0.2005000      0.9415000 
1 1 1 20 29 15 o 2.124000  0.5034000     1.815000  0.7403000     2.433000  0.6824000     -0.6178000     1.007000  
1 1 1 20 29 16 o 1.969000  0.5023000     1.987000  0.7008000     1.951000  0.7198000     0.3587000E-01  1.005000  
1 1 1 20 29 17 o 1.644000  0.4789000     1.844000  0.6967000     1.443000  0.6573000     0.4005000      0.9578000 
1 1 1 20 29 18 o 1.648000  0.4671000     1.347000  0.6040000     1.949000  0.7128000     -0.6021000     0.9343000 
1 1 1 20 29 19 f 1.608000  0.4698000     1.589000  0.6586000     1.627000  0.6703000     -0.3754000E-01 0.9397000 
1 1 1 20 29 20 o 1.264000  0.4082000     0.9986000 0.4921000     1.530000  0.6515000     -0.5315000     0.8165000 
1 1 1 20 29 21 o 2.298000  0.5910000     2.274000  0.7719000     2.322000  0.8951000     -0.4810000E-01 1.182000  
1 1 1 20 30 0  o 10.55000  0.2126000     10.55000  0.2126000     10.55000  0.2126000     -0.000000      0.000000  
1 1 1 20 30 1  o 4.894000  0.1958000     5.122000  0.2665000     4.666000  0.2870000     0.4561000      0.3917000 
1 1 1 20 30 2  o 15.14000  0.1629000     15.25000  0.2314000     15.04000  0.2293000     0.2070000      0.3257000 
1 1 1 20 30 3  o 2.815000  0.3287000     3.012000  0.4195000     2.618000  0.5061000     0.3938000      0.6574000 
1 1 1 20 30 4  o 9.231000  0.1556000     9.301000  0.2204000     9.161000  0.2197000     0.1398000      0.3112000 
1 1 1 20 30 5  o 18.59000  0.1832000     18.19000  0.2565000     19.00000  0.2617000     -0.8031000     0.3664000 
1 1 1 20 30 6  o 3.855000  0.2724000     3.897000  0.3704000     3.812000  0.3995000     0.8554000E-01  0.5448000 
1 1 1 20 30 7  o 8.055000  0.1762000     8.108000  0.2463000     8.003000  0.2519000     0.1054000      0.3523000 
1 1 1 20 30 8  o 2.368000  0.5013000     2.308000  0.7404000     2.428000  0.6761000     -0.1193000     1.003000  
1 1 1 20 30 9  o 4.185000  0.2885000     3.930000  0.4303000     4.440000  0.3842000     -0.5099000     0.5769000 
1 1 1 20 30 10 o 6.271000  0.2966000     6.249000  0.3437000     6.292000  0.4836000     -0.4259000E-01 0.5933000 
1 1 1 20 30 11 o 4.944000  0.2722000     4.808000  0.3974000     5.081000  0.3720000     -0.2733000     0.5444000 
1 1 1 20 30 12 o 5.658000  0.2455000     5.613000  0.3382000     5.703000  0.3560000     -0.9075000E-01 0.4910000 
1 1 1 20 30 13 f 4.505000  0.2952000     4.303000  0.4300000     4.708000  0.4044000     -0.4044000     0.5903000 
1 1 1 20 30 14 o 1.984000  0.4707000     1.611000  0.6382000     2.358000  0.6920000     -0.7469000     0.9414000 
1 1 1 20 30 15 o 4.360000  0.4188000     4.541000  0.5746000     4.179000  0.6096000     0.3622000      0.8377000 
1 1 1 20 30 16 o 4.326000  0.3225000     4.346000  0.4424000     4.306000  0.4694000     0.4014000E-01  0.6450000 
1 1 1 20 30 17 o 1.854000  0.5173000     1.572000  0.7008000     2.136000  0.7611000     -0.5644000     1.035000  
1 1 1 20 30 18 o 1.425000  0.4344000     1.222000  0.5681000     1.628000  0.6574000     -0.4052000     0.8689000 
1 1 1 20 30 19 o 1.943000  0.4999000     1.798000  0.6940000     2.088000  0.7197000     -0.2892000     0.9998000 
1 1 1 20 30 20 o 1.245000  0.4094000     1.246000  0.5771000     1.243000  0.5810000     0.3576000E-02  0.8189000 
1 1 1 20 31 0  o 6.628000  0.2427000     6.628000  0.2427000     6.628000  0.2427000     0.000000       0.000000  
1 1 1 20 31 1  o 5.443000  0.1912000     5.147000  0.2822000     5.740000  0.2582000     -0.5928000     0.3825000 
1 1 1 20 31 2  o 11.76000  0.1542000     11.70000  0.2183000     11.83000  0.2179000     -0.1300000     0.3084000 
1 1 1 20 31 3  o 9.789000  0.1553000     9.897000  0.2184000     9.680000  0.2208000     0.2170000      0.3106000 
1 1 1 20 31 4  o 7.241000  0.1704000     7.449000  0.2380000     7.032000  0.2440000     0.4167000      0.3409000 
1 1 1 20 31 5  f 12.24000  0.1616000     12.16000  0.2295000     12.33000  0.2276000     -0.1720000     0.3233000 
1 1 1 20 31 6  o 4.800000  0.2319000     4.814000  0.3239000     4.787000  0.3319000     0.2753000E-01  0.4638000 
1 1 1 20 31 7  o 2.321000  0.4662000     1.911000  0.7399000     2.730000  0.5674000     -0.8194000     0.9324000 
1 1 1 20 31 8  f 6.210000  0.2170000     6.523000  0.2864000     5.897000  0.3262000     0.6261000      0.4341000 
1 1 1 20 31 9  o 6.414000  0.2264000     6.382000  0.3029000     6.447000  0.3366000     -0.6441000E-01 0.4528000 
1 1 1 20 31 10 o 4.767000  0.3360000     4.963000  0.5435000     4.572000  0.3953000     0.3912000      0.6720000 
1 1 1 20 31 11 o 4.416000  0.2912000     4.545000  0.3923000     4.286000  0.4304000     0.2583000      0.5823000 
1 1 1 20 31 12 o 7.051000  0.2136000     7.184000  0.2909000     6.918000  0.3130000     0.2655000      0.4273000 
1 1 1 20 31 13 o 1.972000  0.4896000     1.853000  0.6730000     2.091000  0.7114000     -0.2375000     0.9793000 
1 1 1 20 31 14 o 6.815000  0.2239000     6.811000  0.3086000     6.820000  0.3245000     -0.9070000E-02 0.4478000 
1 1 1 20 31 15 o 1.866000  0.4706000     1.459000  0.6237000     2.274000  0.7048000     -0.8156000     0.9412000 
1 1 1 20 31 16 o 2.201000  0.4930000     2.764000  0.7542000     1.639000  0.6351000     1.126000       0.9860000 
1 1 1 20 31 17 o 2.307000  0.5969000     2.152000  0.9628000     2.462000  0.7057000     -0.3095000     1.194000  
1 1 1 20 31 18 o 1.273000  0.4114000     1.436000  0.6257000     1.111000  0.5344000     0.3249000      0.8229000 
1 1 1 20 31 19 o 1.576000  0.4502000     1.895000  0.6891000     1.257000  0.5796000     0.6385000      0.9005000 
1 1 1 20 31 20 o 1.668000  0.4652000     1.087000  0.5245000     2.250000  0.7684000     -1.162000      0.9303000 
1 1 1 20 32 0  o 3.995000  0.3425000     3.995000  0.3425000     3.995000  0.3425000     -0.000000      0.000000  
1 1 1 20 32 1  o 6.598000  0.1737000     6.564000  0.2465000     6.633000  0.2448000     -0.6898000E-01 0.3474000 
1 1 1 20 32 2  o 5.152000  0.2030000     5.174000  0.2857000     5.131000  0.2884000     0.4331000E-01  0.4059000 
1 1 1 20 32 3  o 9.407000  0.1597000     9.322000  0.2266000     9.492000  0.2252000     -0.1700000     0.3195000 
1 1 1 20 32 4  o 6.376000  0.1863000     6.534000  0.2570000     6.218000  0.2699000     0.3158000      0.3727000 
1 1 1 20 32 5  o 12.56000  0.1643000     12.56000  0.2311000     12.56000  0.2336000     0.2789000E-02  0.3286000 
1 1 1 20 32 6  o 7.550000  0.2008000     7.742000  0.3060000     7.359000  0.2601000     0.3824000      0.4016000 
1 1 1 20 32 7  o 3.511000  0.3915000     3.331000  0.5427000     3.692000  0.5645000     -0.3616000     0.7830000 
1 1 1 20 32 8  o 6.375000  0.2122000     6.656000  0.2926000     6.093000  0.3076000     0.5633000      0.4245000 
1 1 1 20 32 9  o 7.841000  0.2308000     7.885000  0.3059000     7.798000  0.3458000     0.8650000E-01  0.4617000 
1 1 1 20 32 10 o 4.505000  0.2840000     4.766000  0.3827000     4.244000  0.4197000     0.5210000      0.5680000 
1 1 1 20 32 11 o 11.70000  0.1814000     11.45000  0.2558000     11.95000  0.2572000     -0.4992000     0.3627000 
1 1 1 20 32 12 o 6.297000  0.2300000     6.547000  0.3107000     6.046000  0.3392000     0.5010000      0.4600000 
1 1 1 20 32 13 o 4.331000  0.3070000     4.729000  0.3857000     3.933000  0.4778000     0.7962000      0.6141000 
1 1 1 20 32 14 o 4.061000  0.3950000     3.878000  0.6386000     4.245000  0.4651000     -0.3666000     0.7900000 
1 1 1 20 32 15 o 2.109000  0.4435000     2.716000  0.6217000     1.501000  0.6327000     1.215000       0.8870000 
1 1 1 20 32 16 o 1.483000  0.4534000     1.732000  0.7112000     1.233000  0.5627000     0.4989000      0.9069000 
1 1 1 20 32 17 o 1.923000  0.4964000     1.548000  0.6981000     2.298000  0.7060000     -0.7497000     0.9929000 
1 1 1 20 32 18 o 1.680000  0.4696000     1.869000  0.6775000     1.490000  0.6504000     0.3793000      0.9392000 
1 1 1 20 32 19 o 1.397000  0.4360000     1.307000  0.5873000     1.487000  0.6444000     -0.1806000     0.8719000 
1 1 1 20 32 20 f 1.829000  0.5526000     1.624000  0.6946000     2.033000  0.8597000     -0.4097000     1.105000  
1 1 1 20 33 0  o 5.154000  0.2929000     5.154000  0.2929000     5.154000  0.2929000     0.000000       0.000000  
1 1 1 20 33 1  o 4.550000  0.2257000     4.443000  0.3220000     4.657000  0.3163000     -0.2141000     0.4514000 
1 1 1 20 33 2  o 1.560000  0.4077000     1.307000  0.5581000     1.813000  0.5945000     -0.5053000     0.8154000 
1 1 1 20 33 3  o 7.924000  0.1707000     7.634000  0.2439000     8.214000  0.2390000     -0.5798000     0.3414000 
1 1 1 20 33 4  o 6.370000  0.1918000     6.356000  0.2698000     6.384000  0.2728000     -0.2759000E-01 0.3837000 
1 1 1 20 33 5  o 11.12000  0.1814000     11.38000  0.2764000     10.86000  0.2350000     0.5134000      0.3628000 
1 1 1 20 33 6  o 11.24000  0.1959000     11.68000  0.2733000     10.80000  0.2809000     0.8749000      0.3919000 
1 1 1 20 33 7  o 11.62000  0.1703000     11.79000  0.2381000     11.46000  0.2437000     0.3360000      0.3407000 
1 1 1 20 33 8  o 1.623000  0.4952000     1.616000  0.6629000     1.630000  0.7360000     -0.1416000E-01 0.9905000 
1 1 1 20 33 9  o 8.119000  0.2158000     8.032000  0.3359000     8.205000  0.2711000     -0.1725000     0.4317000 
1 1 1 20 33 10 o 7.972000  0.1957000     7.820000  0.2802000     8.125000  0.2734000     -0.3047000     0.3915000 
1 1 1 20 33 11 f 3.366000  0.3790000     3.587000  0.4772000     3.145000  0.5890000     0.4418000      0.7581000 
1 1 1 20 33 12 o 6.491000  0.2289000     6.498000  0.3233000     6.483000  0.3241000     0.1570000E-01  0.4578000 
1 1 1 20 33 13 o 3.310000  0.4147000     4.171000  0.4356000     2.448000  0.7059000     1.723000       0.8295000 
1 1 1 20 33 14 o 2.208000  0.5301000     1.775000  0.6916000     2.641000  0.8036000     -0.8660000     1.060000  
1 1 1 20 33 15 o 1.559000  0.4523000     1.633000  0.6473000     1.484000  0.6318000     0.1487000      0.9046000 
1 1 1 20 33 16 o 6.015000  0.3278000     6.460000  0.3802000     5.570000  0.5340000     0.8901000      0.6555000 
1 1 1 20 33 17 o 1.861000  0.4835000     1.994000  0.7388000     1.728000  0.6240000     0.2651000      0.9671000 
1 1 1 20 33 18 o 1.536000  0.4481000     1.855000  0.6924000     1.217000  0.5692000     0.6382000      0.8963000 
1 1 1 20 33 19 o 1.506000  0.4569000     1.472000  0.6314000     1.539000  0.6605000     -0.6727000E-01 0.9138000 
1 1 1 20 33 20 o 1.553000  0.5010000     1.469000  0.6663000     1.636000  0.7484000     -0.1671000     1.002000  
1 1 1 20 34 0  o 3.447000  0.4358000     3.447000  0.4358000     3.447000  0.4358000     -0.000000      0.000000  
1 1 1 20 34 1  o 7.610000  0.1744000     7.666000  0.2469000     7.555000  0.2462000     0.1114000      0.3487000 
1 1 1 20 34 2  o 6.877000  0.1827000     6.970000  0.2564000     6.785000  0.2605000     0.1854000      0.3655000 
1 1 1 20 34 3  o 12.89000  0.1643000     13.06000  0.2316000     12.73000  0.2332000     0.3291000      0.3287000 
1 1 1 20 34 4  o 9.883000  0.1844000     9.882000  0.2817000     9.883000  0.2381000     -0.1037000E-02 0.3689000 
1 1 1 20 34 5  o 3.435000  0.4312000     2.820000  0.7308000     4.051000  0.4577000     -1.231000      0.8624000 
1 1 1 20 34 6  o 5.302000  0.2471000     5.339000  0.3177000     5.265000  0.3786000     0.7478000E-01  0.4942000 
1 1 1 20 34 7  o 1.730000  0.4963000     1.792000  0.6711000     1.667000  0.7313000     0.1251000      0.9925000 
1 1 1 20 34 8  o 5.257000  0.2725000     5.489000  0.4118000     5.025000  0.3570000     0.4636000      0.5450000 
1 1 1 20 34 9  o 6.558000  0.2172000     6.032000  0.3198000     7.085000  0.2940000     -1.053000      0.4344000 
1 1 1 20 34 10 o 7.546000  0.2007000     7.460000  0.2839000     7.632000  0.2837000     -0.1718000     0.4014000 
1 1 1 20 34 11 o 9.795000  0.1881000     9.861000  0.2608000     9.730000  0.2713000     0.1307000      0.3763000 
1 1 1 20 34 12 o 9.079000  0.1961000     9.107000  0.2754000     9.051000  0.2792000     0.5584000E-01  0.3922000 
1 1 1 20 34 13 o 4.585000  0.3282000     4.990000  0.4619000     4.180000  0.4663000     0.8103000      0.6563000 
1 1 1 20 34 14 o 2.945000  0.4521000     3.419000  0.5037000     2.472000  0.7509000     0.9463000      0.9042000 
1 1 1 20 34 15 o 6.543000  0.2286000     6.591000  0.3165000     6.494000  0.3299000     0.9686000E-01  0.4572000 
1 1 1 20 34 16 o 2.285000  0.4822000     2.726000  0.7057000     1.843000  0.6573000     0.8829000      0.9644000 
1 1 1 20 34 17 o 1.734000  0.4805000     2.082000  0.7600000     1.386000  0.5880000     0.6954000      0.9609000 
1 1 1 20 34 18 o 1.360000  0.4226000     1.562000  0.6442000     1.158000  0.5472000     0.4036000      0.8452000 
1 1 1 20 34 19 o 1.663000  0.4689000     1.428000  0.6212000     1.897000  0.7026000     -0.4686000     0.9378000 
1 1 1 20 35 0  o 1.690000  0.7519000     1.690000  0.7519000     1.690000  0.7519000     -0.000000      0.000000  
1 1 1 20 35 1  o 7.967000  0.1733000     8.031000  0.2450000     7.903000  0.2452000     0.1287000      0.3466000 
1 1 1 20 35 2  f 12.34000  0.1654000     12.24000  0.2338000     12.43000  0.2341000     -0.1876000     0.3309000 
1 1 1 20 35 3  o 4.711000  0.2593000     4.804000  0.3915000     4.617000  0.3401000     0.1870000      0.5186000 
1 1 1 20 35 4  o 8.578000  0.2286000     8.440000  0.3572000     8.715000  0.2854000     -0.2748000     0.4572000 
1 1 1 20 35 5  o 4.256000  0.3261000     4.555000  0.3549000     3.957000  0.5473000     0.5987000      0.6523000 
1 1 1 20 35 6  o 2.164000  0.5292000     1.728000  0.6609000     2.600000  0.8268000     -0.8714000     1.058000  
1 1 1 20 35 7  o 4.873000  0.2854000     5.027000  0.4209000     4.718000  0.3856000     0.3085000      0.5709000 
1 1 1 20 35 8  o 4.277000  0.2885000     4.377000  0.4074000     4.177000  0.4087000     0.1996000      0.5771000 
1 1 1 20 35 9  o 1.746000  0.4532000     2.053000  0.6655000     1.439000  0.6154000     0.6141000      0.9064000 
1 1 1 20 35 10 o 3.146000  0.4006000     3.271000  0.5365000     3.021000  0.5950000     0.2497000      0.8011000 
1 1 1 20 35 11 o 4.085000  0.3178000     4.578000  0.3924000     3.591000  0.5000000     0.9867000      0.6356000 
1 1 1 20 35 12 o 2.703000  0.4354000     3.431000  0.5111000     1.975000  0.7049000     1.456000       0.8707000 
1 1 1 20 35 13 o 4.277000  0.4118000     4.241000  0.6137000     4.313000  0.5492000     -0.7285000E-01 0.8236000 
1 1 1 20 35 14 o 3.339000  0.3813000     3.609000  0.4838000     3.070000  0.5894000     0.5387000      0.7625000 
1 1 1 20 35 15 o 3.726000  0.4318000     3.147000  0.5531000     4.304000  0.6633000     -1.157000      0.8637000 
1 1 1 20 35 16 o 1.729000  0.4549000     1.705000  0.6406000     1.752000  0.6459000     -0.4664000E-01 0.9097000 
1 1 1 20 35 17 o 3.189000  0.4415000     2.730000  0.7676000     3.649000  0.4362000     -0.9190000     0.8829000 
1 1 1 20 35 18 o 1.454000  0.4499000     1.264000  0.5961000     1.645000  0.6740000     -0.3803000     0.8998000 
1 1 1 20 35 19 o 1.845000  0.5105000     1.489000  0.6575000     2.200000  0.7811000     -0.7110000     1.021000  
1 1 1 20 36 0  o 3.738000  0.5034000     3.738000  0.5034000     3.738000  0.5034000     0.000000       0.000000  
1 1 1 20 36 1  o 5.856000  0.2243000     5.897000  0.3431000     5.815000  0.2890000     0.8186000E-01  0.4486000 
1 1 1 20 36 2  o 5.167000  0.3303000     5.235000  0.4743000     5.099000  0.4599000     0.1355000      0.6606000 
1 1 1 20 36 3  o 11.69000  0.2655000     11.51000  0.2737000     11.87000  0.4549000     -0.3571000     0.5309000 
1 1 1 20 36 4  o 6.728000  0.2460000     6.864000  0.2771000     6.592000  0.4066000     0.2711000      0.4921000 
1 1 1 20 36 5  o 11.57000  0.1999000     11.03000  0.2741000     12.11000  0.2911000     -1.085000      0.3998000 
1 1 1 20 36 6  o 5.673000  0.2520000     5.663000  0.3889000     5.684000  0.3206000     -0.2188000E-01 0.5040000 
1 1 1 20 36 7  o 4.736000  0.2589000     4.819000  0.3536000     4.653000  0.3783000     0.1659000      0.5178000 
1 1 1 20 36 8  o 3.410000  0.3600000     3.170000  0.5374000     3.649000  0.4791000     -0.4789000     0.7200000 
1 1 1 20 36 9  o 3.745000  0.3367000     3.658000  0.4906000     3.832000  0.4614000     -0.1745000     0.6735000 
1 1 1 20 36 10 o 4.004000  0.3143000     3.938000  0.4506000     4.070000  0.4382000     -0.1328000     0.6285000 
1 1 1 20 36 11 o 6.691000  0.2260000     6.547000  0.3214000     6.835000  0.3179000     -0.2881000     0.4520000 
1 1 1 20 36 12 o 1.753000  0.4796000     1.648000  0.6667000     1.859000  0.6896000     -0.2114000     0.9592000 
1 1 1 20 36 13 o 6.791000  0.2645000     6.926000  0.3168000     6.655000  0.4237000     0.2710000      0.5290000 
1 1 1 20 36 14 o 4.338000  0.2999000     4.572000  0.4041000     4.104000  0.4433000     0.4683000      0.5999000 
1 1 1 20 36 15 f 1.374000  0.4475000     1.279000  0.5973000     1.468000  0.6667000     -0.1893000     0.8951000 
1 1 1 20 36 16 o 2.112000  0.4763000     2.189000  0.6714000     2.035000  0.6758000     0.1547000      0.9527000 
1 1 1 20 36 17 o 1.299000  0.4116000     1.325000  0.5868000     1.273000  0.5772000     0.5271000E-01  0.8231000 
1 1 1 20 36 18 o 1.278000  0.4158000     1.111000  0.5407000     1.446000  0.6319000     -0.3350000     0.8317000 
1 1 1 20 36 19 o 1.304000  0.4555000     1.138000  0.5494000     1.470000  0.7266000     -0.3325000     0.9109000 
1 1 1 20 37 0  o 2.530000  0.9220000     2.530000  0.9220000     2.530000  0.9220000     -0.000000      0.000000  
1 1 1 20 37 1  o 5.944000  0.3983000     5.944000  0.3983000     ?         ?             ?              ?         
1 1 1 20 37 2  o 1.593000  0.4983000     1.590000  0.6439000     1.597000  0.7606000     -0.7204000E-02 0.9965000 
1 1 1 20 37 3  o 6.316000  0.2662000     6.621000  0.3192000     6.011000  0.4260000     0.6097000      0.5324000 
1 1 1 20 37 4  o 4.720000  0.3383000     4.680000  0.5110000     4.759000  0.4434000     -0.7940000E-01 0.6765000 
1 1 1 20 37 5  o 9.940000  0.1931000     10.15000  0.2914000     9.733000  0.2534000     0.4134000      0.3861000 
1 1 1 20 37 6  o 9.359000  0.1814000     9.574000  0.2512000     9.144000  0.2617000     0.4303000      0.3627000 
1 1 1 20 37 7  f 1.992000  0.4620000     2.283000  0.6403000     1.700000  0.6662000     0.5827000      0.9241000 
1 1 1 20 37 8  o 2.542000  0.4541000     2.701000  0.6223000     2.382000  0.6616000     0.3194000      0.9083000 
1 1 1 20 37 9  o 7.236000  0.2075000     7.653000  0.2810000     6.820000  0.3053000     0.8327000      0.4149000 
1 1 1 20 37 10 f 2.814000  0.4188000     3.341000  0.4905000     2.287000  0.6789000     1.054000       0.8375000 
1 1 1 20 37 11 o 3.045000  0.4160000     2.747000  0.6289000     3.343000  0.5447000     -0.5965000     0.8320000 
1 1 1 20 37 12 o 4.788000  0.3841000     4.325000  0.6240000     5.252000  0.4482000     -0.9274000     0.7683000 
1 1 1 20 37 13 o 1.228000  0.4012000     1.161000  0.5454000     1.295000  0.5885000     -0.1334000     0.8024000 
1 1 1 20 37 14 o 5.130000  0.3488000     5.181000  0.3753000     5.079000  0.5881000     0.1022000      0.6977000 
1 1 1 20 37 15 o 1.547000  0.4562000     1.400000  0.6267000     1.694000  0.6631000     -0.2943000     0.9124000 
1 1 1 20 37 16 o 1.805000  0.4516000     2.175000  0.6556000     1.435000  0.6211000     0.7396000      0.9031000 
1 1 1 20 37 17 o 1.291000  0.4075000     1.247000  0.5661000     1.335000  0.5864000     -0.8809000E-01 0.8151000 
1 1 1 20 37 18 o 1.340000  0.4368000     1.401000  0.6390000     1.279000  0.5956000     0.1222000      0.8736000 
1 1 1 20 38 0  f 3.471000  0.5481000     3.471000  0.5481000     3.471000  0.5481000     -0.000000      0.000000  
1 1 1 20 38 1  f 1.630000  0.4556000     1.819000  0.6790000     1.442000  0.6077000     0.3777000      0.9112000 
1 1 1 20 38 2  o 14.55000  0.1905000     14.68000  0.2881000     14.42000  0.2493000     0.2522000      0.3810000 
1 1 1 20 38 3  o 5.880000  0.2400000     5.685000  0.3702000     6.075000  0.3057000     -0.3902000     0.4801000 
1 1 1 20 38 4  o 8.515000  0.1851000     8.652000  0.2586000     8.379000  0.2649000     0.2728000      0.3701000 
1 1 1 20 38 5  o 6.629000  0.2100000     6.527000  0.2976000     6.731000  0.2965000     -0.2033000     0.4201000 
1 1 1 20 38 6  o 5.370000  0.2471000     5.220000  0.3553000     5.521000  0.3435000     -0.3006000     0.4942000 
1 1 1 20 38 7  o 6.671000  0.2173000     6.922000  0.2942000     6.419000  0.3200000     0.5024000      0.4347000 
1 1 1 20 38 8  o 8.637000  0.1908000     8.629000  0.2652000     8.645000  0.2744000     -0.1619000E-01 0.3816000 
1 1 1 20 38 9  f 1.769000  0.4730000     1.768000  0.6614000     1.770000  0.6762000     -0.2238000E-02 0.9459000 
1 1 1 20 38 10 o 2.354000  0.4626000     2.786000  0.6100000     1.922000  0.6956000     0.8644000      0.9252000 
1 1 1 20 38 11 o 6.731000  0.2281000     6.578000  0.3215000     6.884000  0.3236000     -0.3061000     0.4562000 
1 1 1 20 38 12 o 5.927000  0.2909000     5.878000  0.3483000     5.977000  0.4660000     -0.9906000E-01 0.5818000 
1 1 1 20 38 13 o 2.544000  0.4764000     2.731000  0.6699000     2.357000  0.6774000     0.3743000      0.9527000 
1 1 1 20 38 14 o 2.852000  0.5377000     2.649000  0.8016000     3.055000  0.7170000     -0.4064000     1.075000  
1 1 1 20 38 15 o 1.495000  0.4383000     1.744000  0.6656000     1.247000  0.5705000     0.4967000      0.8766000 
1 1 1 20 38 16 o 1.147000  0.3807000     1.091000  0.5194000     1.203000  0.5567000     -0.1125000     0.7614000 
1 1 1 20 38 17 o 1.322000  0.4120000     1.332000  0.5800000     1.313000  0.5854000     0.1907000E-01  0.8241000 
1 1 1 20 38 18 o 1.340000  0.4454000     1.606000  0.7164000     1.075000  0.5293000     0.5304000      0.8907000 
1 1 1 20 39 0  o 1.916000  0.7865000     1.916000  0.7865000     1.916000  0.7865000     0.000000       0.000000  
1 1 1 20 39 1  f 4.170000  0.2846000     4.663000  0.3621000     3.677000  0.4391000     0.9862000      0.5691000 
1 1 1 20 39 2  o 4.771000  0.2561000     4.435000  0.3825000     5.106000  0.3406000     -0.6705000     0.5122000 
1 1 1 20 39 3  o 1.349000  0.4159000     1.390000  0.5966000     1.307000  0.5797000     0.8332000E-01  0.8318000 
1 1 1 20 39 4  o 8.615000  0.1842000     8.524000  0.2589000     8.707000  0.2622000     -0.1831000     0.3684000 
1 1 1 20 39 5  o 7.204000  0.2039000     7.114000  0.2851000     7.293000  0.2915000     -0.1789000     0.4077000 
1 1 1 20 39 6  o 6.153000  0.2283000     6.423000  0.3090000     5.883000  0.3361000     0.5399000      0.4565000 
1 1 1 20 39 7  o 7.145000  0.2080000     7.318000  0.2893000     6.973000  0.2989000     0.3452000      0.4159000 
1 1 1 20 39 8  o 2.454000  0.4577000     2.836000  0.6036000     2.073000  0.6882000     0.7624000      0.9154000 
1 1 1 20 39 9  o 6.716000  0.2215000     6.735000  0.3075000     6.696000  0.3190000     0.3941000E-01  0.4431000 
1 1 1 20 39 10 o 2.550000  0.4538000     2.094000  0.6974000     3.007000  0.5808000     -0.9138000     0.9075000 
1 1 1 20 39 11 o 1.693000  0.5090000     1.792000  0.7463000     1.593000  0.6924000     0.1994000      1.018000  
1 1 1 20 39 12 o 5.749000  0.2767000     5.576000  0.4319000     5.922000  0.3459000     -0.3457000     0.5533000 
1 1 1 20 39 13 o 2.588000  0.5453000     2.799000  0.6712000     2.377000  0.8596000     0.4220000      1.091000  
1 1 1 20 39 14 o 3.063000  0.4495000     3.376000  0.6359000     2.750000  0.6354000     0.6253000      0.8989000 
1 1 1 20 39 15 o 1.725000  0.4587000     1.468000  0.6216000     1.981000  0.6747000     -0.5130000     0.9174000 
1 1 1 20 39 16 o 1.717000  0.4620000     1.947000  0.6740000     1.487000  0.6322000     0.4597000      0.9240000 
1 1 1 20 39 17 o 1.201000  0.3887000     1.256000  0.5643000     1.147000  0.5349000     0.1092000      0.7775000 
1 1 1 20 39 18 o 1.601000  0.5013000     1.763000  0.7030000     1.439000  0.7149000     0.3245000      1.003000  
1 1 1 20 40 0  o 3.018000  0.5973000     3.018000  0.5973000     3.018000  0.5973000     0.000000       0.000000  
1 1 1 20 40 1  o 1.803000  0.4594000     1.670000  0.6379000     1.937000  0.6613000     -0.2674000     0.9189000 
1 1 1 20 40 2  o 4.591000  0.2651000     4.510000  0.3807000     4.671000  0.3689000     -0.1615000     0.5301000 
1 1 1 20 40 3  o 11.87000  0.1748000     12.14000  0.2452000     11.60000  0.2491000     0.5368000      0.3495000 
1 1 1 20 40 4  o 6.862000  0.2071000     6.928000  0.2832000     6.795000  0.3023000     0.1334000      0.4142000 
1 1 1 20 40 5  o 8.123000  0.1935000     7.967000  0.2722000     8.279000  0.2752000     -0.3115000     0.3871000 
1 1 1 20 40 6  o 4.980000  0.2591000     4.862000  0.3740000     5.097000  0.3585000     -0.2352000     0.5181000 
1 1 1 20 40 7  o 3.739000  0.3457000     4.242000  0.4205000     3.236000  0.5489000     1.006000       0.6915000 
1 1 1 20 40 8  o 7.697000  0.2058000     7.853000  0.2843000     7.542000  0.2976000     0.3103000      0.4115000 
1 1 1 20 40 9  o 1.577000  0.4512000     1.281000  0.5802000     1.874000  0.6911000     -0.5936000     0.9023000 
1 1 1 20 40 10 o 2.042000  0.4553000     1.405000  0.6455000     2.678000  0.6423000     -1.273000      0.9106000 
1 1 1 20 40 11 o 1.400000  0.4414000     1.527000  0.6359000     1.273000  0.6122000     0.2541000      0.8827000 
1 1 1 20 40 12 o 3.214000  0.4246000     3.614000  0.4981000     2.814000  0.6877000     0.8001000      0.8491000 
1 1 1 20 40 13 o 6.014000  0.3219000     6.176000  0.4643000     5.851000  0.4461000     0.3249000      0.6439000 
1 1 1 20 40 14 o 1.709000  0.4594000     1.884000  0.6634000     1.534000  0.6357000     0.3498000      0.9188000 
1 1 1 20 40 15 o 1.878000  0.4757000     1.852000  0.6596000     1.904000  0.6855000     -0.5212000E-01 0.9513000 
1 1 1 20 40 16 o 1.931000  0.4656000     2.249000  0.6651000     1.613000  0.6517000     0.6362000      0.9312000 
1 1 1 20 40 17 o 1.456000  0.4344000     1.640000  0.6458000     1.272000  0.5812000     0.3679000      0.8688000 
1 1 1 20 41 0  o 1.578000  0.8065000     1.578000  0.8065000     1.578000  0.8065000     0.000000       0.000000  
1 1 1 20 41 1  o 1.571000  0.4456000     1.551000  0.6232000     1.590000  0.6371000     -0.3898000E-01 0.8912000 
1 1 1 20 41 2  o 6.573000  0.2124000     6.315000  0.3105000     6.830000  0.2898000     -0.5151000     0.4247000 
1 1 1 20 41 3  o 3.437000  0.3633000     2.759000  0.5940000     4.114000  0.4185000     -1.354000      0.7266000 
1 1 1 20 41 4  o 5.454000  0.2398000     5.645000  0.3174000     5.262000  0.3596000     0.3832000      0.4796000 
1 1 1 20 41 5  o 5.797000  0.2317000     5.360000  0.3415000     6.234000  0.3132000     -0.8744000     0.4634000 
1 1 1 20 41 6  o 5.773000  0.2368000     6.064000  0.3196000     5.482000  0.3495000     0.5821000      0.4736000 
1 1 1 20 41 7  o 2.436000  0.4444000     1.855000  0.6773000     3.017000  0.5756000     -1.163000      0.8888000 
1 1 1 20 41 8  o 2.913000  0.4733000     2.776000  0.7432000     3.051000  0.5863000     -0.2747000     0.9466000 
1 1 1 20 41 9  o 8.151000  0.2068000     8.280000  0.2855000     8.022000  0.2994000     0.2575000      0.4137000 
1 1 1 20 41 10 o 2.337000  0.5225000     2.252000  0.7213000     2.421000  0.7563000     -0.1695000     1.045000  
1 1 1 20 41 11 o 1.723000  0.4650000     1.965000  0.6848000     1.481000  0.6294000     0.4843000      0.9301000 
1 1 1 20 41 12 o 4.250000  0.4172000     4.041000  0.5064000     4.460000  0.6632000     -0.4183000     0.8344000 
1 1 1 20 41 13 o 1.998000  0.4772000     2.292000  0.6819000     1.704000  0.6676000     0.5880000      0.9543000 
1 1 1 20 41 14 o 1.645000  0.4418000     2.001000  0.6657000     1.289000  0.5812000     0.7118000      0.8837000 
1 1 1 20 41 15 o 2.035000  0.4805000     2.162000  0.6809000     1.909000  0.6783000     0.2524000      0.9611000 
1 1 1 20 41 16 o 2.337000  0.4726000     2.230000  0.6718000     2.445000  0.6650000     -0.2155000     0.9453000 
1 1 1 20 41 17 f 2.393000  0.5859000     2.181000  0.8354000     2.605000  0.8216000     -0.4241000     1.172000  
1 1 1 20 42 0  o 6.263000  0.3070000     6.263000  0.3070000     6.263000  0.3070000     0.000000       0.000000  
1 1 1 20 42 1  o 3.091000  0.3870000     3.035000  0.5491000     3.147000  0.5454000     -0.1119000     0.7739000 
1 1 1 20 42 2  o 4.564000  0.2698000     4.350000  0.3923000     4.779000  0.3704000     -0.4290000     0.5395000 
1 1 1 20 42 3  f 6.383000  0.2138000     6.144000  0.3011000     6.621000  0.3035000     -0.4764000     0.4275000 
1 1 1 20 42 4  o 1.203000  0.3916000     1.280000  0.5753000     1.126000  0.5316000     0.1540000      0.7833000 
1 1 1 20 42 5  f 6.748000  0.2170000     6.832000  0.3054000     6.663000  0.3085000     0.1681000      0.4341000 
1 1 1 20 42 6  o 2.550000  0.4497000     2.116000  0.6748000     2.985000  0.5945000     -0.8686000     0.8993000 
1 1 1 20 42 7  o 6.685000  0.2229000     6.991000  0.3095000     6.379000  0.3208000     0.6127000      0.4457000 
1 1 1 20 42 8  o 5.748000  0.2496000     5.869000  0.3435000     5.626000  0.3623000     0.2424000      0.4992000 
1 1 1 20 42 9  o 4.458000  0.3964000     4.857000  0.5684000     4.060000  0.5528000     0.7974000      0.7929000 
1 1 1 20 42 10 o 3.387000  0.3958000     2.971000  0.5954000     3.803000  0.5218000     -0.8322000     0.7917000 
1 1 1 20 42 11 o 5.313000  0.2833000     5.017000  0.3803000     5.608000  0.4200000     -0.5911000     0.5666000 
1 1 1 20 42 12 o 1.842000  0.4806000     2.261000  0.7436000     1.423000  0.6090000     0.8375000      0.9612000 
1 1 1 20 42 13 o 4.046000  0.3522000     4.504000  0.4176000     3.588000  0.5671000     0.9163000      0.7043000 
1 1 1 20 42 14 o 2.427000  0.4375000     3.078000  0.5516000     1.776000  0.6791000     1.302000       0.8749000 
1 1 1 20 42 15 o 1.592000  0.4455000     1.896000  0.6760000     1.288000  0.5803000     0.6073000      0.8909000 
1 1 1 20 42 16 o 1.863000  0.4698000     1.602000  0.6464000     2.124000  0.6818000     -0.5217000     0.9395000 
1 1 1 20 43 0  o 1.122000  0.6999000     1.122000  0.6999000     1.122000  0.6999000     0.000000       0.000000  
1 1 1 20 43 1  f 2.595000  0.4437000     2.399000  0.6453000     2.792000  0.6091000     -0.3929000     0.8874000 
1 1 1 20 43 2  o 1.714000  0.4646000     1.727000  0.6586000     1.702000  0.6554000     0.2536000E-01  0.9291000 
1 1 1 20 43 3  o 3.781000  0.3234000     3.912000  0.4337000     3.650000  0.4798000     0.2621000      0.6468000 
1 1 1 20 43 4  o 5.180000  0.2559000     5.214000  0.3550000     5.146000  0.3687000     0.6828000E-01  0.5118000 
1 1 1 20 43 5  o 2.647000  0.4486000     2.804000  0.6047000     2.490000  0.6628000     0.3140000      0.8972000 
1 1 1 20 43 6  o 7.375000  0.2111000     7.664000  0.2877000     7.085000  0.3091000     0.5789000      0.4223000 
1 1 1 20 43 7  o 3.243000  0.4043000     3.440000  0.5487000     3.045000  0.5938000     0.3950000      0.8085000 
1 1 1 20 43 8  o 5.207000  0.2989000     5.215000  0.4581000     5.199000  0.3841000     0.1629000E-01  0.5978000 
1 1 1 20 43 9  o 4.943000  0.3357000     5.115000  0.3895000     4.771000  0.5469000     0.3448000      0.6714000 
1 1 1 20 43 10 o 2.997000  0.4471000     3.363000  0.5212000     2.630000  0.7267000     0.7324000      0.8943000 
1 1 1 20 43 11 o 1.298000  0.4297000     1.091000  0.5396000     1.505000  0.6688000     -0.4135000     0.8593000 
1 1 1 20 43 12 o 1.343000  0.4201000     1.276000  0.5795000     1.410000  0.6083000     -0.1345000     0.8402000 
1 1 1 20 43 13 o 2.670000  0.4549000     2.206000  0.6877000     3.134000  0.5956000     -0.9285000     0.9097000 
1 1 1 20 43 14 o 2.489000  0.4511000     2.872000  0.5859000     2.106000  0.6861000     0.7655000      0.9022000 
1 1 1 20 43 15 o 1.254000  0.4029000     1.329000  0.5861000     1.180000  0.5529000     0.1496000      0.8058000 
1 1 1 20 43 16 f 1.369000  0.4357000     1.259000  0.6025000     1.479000  0.6297000     -0.2192000     0.8715000 
1 1 1 20 44 0  o 13.19000  0.2570000     13.19000  0.2570000     13.19000  0.2570000     -0.000000      0.000000  
1 1 1 20 44 1  o 5.945000  0.2348000     6.224000  0.3237000     5.665000  0.3402000     0.5591000      0.4696000 
1 1 1 20 44 2  o 3.005000  0.3974000     3.284000  0.5105000     2.727000  0.6091000     0.5573000      0.7947000 
1 1 1 20 44 3  o 5.392000  0.2478000     5.607000  0.3396000     5.177000  0.3609000     0.4300000      0.4955000 
1 1 1 20 44 4  o 2.394000  0.4261000     3.112000  0.5489000     1.675000  0.6518000     1.438000       0.8521000 
1 1 1 20 44 5  o 2.337000  0.4332000     1.576000  0.6442000     3.097000  0.5793000     -1.520000      0.8663000 
1 1 1 20 44 6  o 2.615000  0.4604000     2.881000  0.6152000     2.349000  0.6851000     0.5322000      0.9208000 
1 1 1 20 44 7  o 4.700000  0.3268000     4.809000  0.4996000     4.591000  0.4213000     0.2187000      0.6535000 
1 1 1 20 44 8  o 3.068000  0.4914000     3.735000  0.5612000     2.401000  0.8068000     1.334000       0.9828000 
1 1 1 20 44 9  o 3.246000  0.4265000     2.731000  0.6561000     3.762000  0.5452000     -1.031000      0.8530000 
1 1 1 20 44 10 o 2.128000  0.5262000     2.144000  0.7219000     2.112000  0.7659000     0.3158000E-01  1.052000  
1 1 1 20 44 11 o 2.339000  0.4189000     1.436000  0.6289000     3.241000  0.5536000     -1.805000      0.8378000 
1 1 1 20 44 12 o 2.541000  0.4649000     2.520000  0.6488000     2.562000  0.6660000     -0.4236000E-01 0.9298000 
1 1 1 20 44 13 o 1.758000  0.4639000     1.542000  0.6313000     1.974000  0.6798000     -0.4323000     0.9277000 
1 1 1 20 44 14 o 2.118000  0.4769000     2.387000  0.6719000     1.849000  0.6768000     0.5384000      0.9537000 
1 1 1 20 44 15 o 1.756000  0.4417000     2.255000  0.6686000     1.256000  0.5775000     0.9994000      0.8835000 
1 1 1 20 44 16 o 1.212000  0.4272000     1.160000  0.5657000     1.265000  0.6403000     -0.1058000     0.8544000 
1 1 1 20 45 0  o 4.122000  0.4350000     4.122000  0.4350000     4.122000  0.4350000     0.000000       0.000000  
1 1 1 20 45 1  o 7.987000  0.2021000     8.290000  0.2790000     7.684000  0.2924000     0.6058000      0.4041000 
1 1 1 20 45 2  o 3.771000  0.3369000     4.204000  0.4168000     3.337000  0.5293000     0.8674000      0.6737000 
1 1 1 20 45 3  o 4.687000  0.2804000     4.842000  0.3749000     4.532000  0.4172000     0.3107000      0.5609000 
1 1 1 20 45 4  o 3.131000  0.4158000     2.465000  0.6685000     3.797000  0.4945000     -1.332000      0.8315000 
1 1 1 20 45 5  o 2.367000  0.4851000     2.561000  0.6766000     2.174000  0.6952000     0.3867000      0.9701000 
1 1 1 20 45 6  o 3.991000  0.3874000     3.268000  0.6643000     4.715000  0.3987000     -1.447000      0.7748000 
1 1 1 20 45 7  o 2.099000  0.5082000     1.465000  0.6500000     2.732000  0.7813000     -1.267000      1.016000  
1 1 1 20 45 8  o 7.668000  0.2339000     7.537000  0.3096000     7.800000  0.3508000     -0.2630000     0.4679000 
1 1 1 20 45 9  o 5.826000  0.2992000     5.958000  0.3884000     5.694000  0.4551000     0.2636000      0.5983000 
1 1 1 20 45 10 o 2.075000  0.4907000     2.423000  0.7157000     1.728000  0.6714000     0.6947000      0.9813000 
1 1 1 20 45 11 o 5.727000  0.2496000     6.015000  0.3403000     5.438000  0.3653000     0.5770000      0.4993000 
1 1 1 20 45 12 o 4.581000  0.2953000     4.243000  0.4502000     4.918000  0.3823000     -0.6748000     0.5906000 
1 1 1 20 45 13 o 1.623000  0.4425000     1.271000  0.5746000     1.976000  0.6730000     -0.7050000     0.8849000 
1 1 1 20 45 14 o 2.307000  0.4891000     2.559000  0.6815000     2.055000  0.7017000     0.5038000      0.9782000 
1 1 1 20 45 15 o 1.364000  0.4404000     1.513000  0.6792000     1.214000  0.5607000     0.2995000      0.8807000 
1 1 1 20 46 0  o 7.049000  0.3107000     7.049000  0.3107000     7.049000  0.3107000     0.000000       0.000000  
1 1 1 20 46 1  o 1.615000  0.4527000     1.893000  0.6808000     1.338000  0.5967000     0.5554000      0.9053000 
1 1 1 20 46 2  o 3.791000  0.3483000     4.089000  0.4491000     3.493000  0.5324000     0.5959000      0.6966000 
1 1 1 20 46 3  o 3.585000  0.3627000     3.685000  0.4937000     3.485000  0.5315000     0.2002000      0.7254000 
1 1 1 20 46 4  o 2.427000  0.4713000     2.474000  0.6489000     2.380000  0.6838000     0.9445000E-01  0.9427000 
1 1 1 20 46 5  o 2.753000  0.4953000     2.729000  0.7447000     2.777000  0.6532000     -0.4756000E-01 0.9906000 
1 1 1 20 46 6  o 1.589000  0.4873000     1.536000  0.6646000     1.642000  0.7128000     -0.1053000     0.9746000 
1 1 1 20 46 7  o 4.352000  0.3875000     4.876000  0.3995000     3.829000  0.6641000     1.047000       0.7750000 
1 1 1 20 46 8  o 1.401000  0.4506000     1.260000  0.5859000     1.543000  0.6847000     -0.2823000     0.9012000 
1 1 1 20 46 9  o 2.122000  0.4628000     1.501000  0.6546000     2.743000  0.6544000     -1.243000      0.9257000 
1 1 1 20 46 10 o 2.016000  0.4189000     1.217000  0.5597000     2.814000  0.6234000     -1.597000      0.8378000 
1 1 1 20 46 11 o 1.749000  0.4782000     1.682000  0.6634000     1.816000  0.6889000     -0.1339000     0.9564000 
1 1 1 20 46 12 o 1.388000  0.4317000     1.444000  0.6249000     1.333000  0.5958000     0.1114000      0.8634000 
1 1 1 20 46 13 o 3.268000  0.4121000     2.772000  0.6581000     3.765000  0.4963000     -0.9931000     0.8243000 
1 1 1 20 46 14 o 2.135000  0.4830000     1.814000  0.6745000     2.456000  0.6915000     -0.6421000     0.9660000 
1 1 1 20 46 15 o 1.214000  0.4283000     1.175000  0.5754000     1.254000  0.6345000     -0.7847000E-01 0.8566000 
1 1 1 20 47 0  o 5.172000  0.3854000     5.172000  0.3854000     5.172000  0.3854000     -0.000000      0.000000  
1 1 1 20 47 1  o 1.604000  0.4610000     1.753000  0.6739000     1.454000  0.6292000     0.2991000      0.9220000 
1 1 1 20 47 2  o 2.276000  0.4845000     2.341000  0.6860000     2.211000  0.6844000     0.1305000      0.9690000 
1 1 1 20 47 3  o 2.370000  0.5078000     2.501000  0.7483000     2.239000  0.6865000     0.2624000      1.016000  
1 1 1 20 47 4  o 6.948000  0.3000000     6.602000  0.4890000     7.294000  0.3476000     -0.6921000     0.5999000 
1 1 1 20 47 5  o 4.869000  0.4240000     4.633000  0.4660000     5.104000  0.7085000     -0.4705000     0.8480000 
1 1 1 20 47 6  o 1.715000  0.5060000     1.863000  0.7093000     1.566000  0.7217000     0.2974000      1.012000  
1 1 1 20 47 7  o 4.652000  0.3865000     4.982000  0.5413000     4.322000  0.5517000     0.6601000      0.7729000 
1 1 1 20 47 8  o 3.397000  0.4266000     3.657000  0.6075000     3.137000  0.5991000     0.5198000      0.8532000 
1 1 1 20 47 9  f 4.937000  0.2914000     5.427000  0.3612000     4.447000  0.4574000     0.9806000      0.5828000 
1 1 1 20 47 10 o 3.359000  0.3918000     2.767000  0.6302000     3.952000  0.4657000     -1.185000      0.7836000 
1 1 1 20 47 11 o 1.708000  0.4570000     2.027000  0.6819000     1.389000  0.6088000     0.6383000      0.9141000 
1 1 1 20 47 12 o 2.250000  0.4700000     2.760000  0.6553000     1.741000  0.6739000     1.019000       0.9400000 
1 1 1 20 47 13 o 1.364000  0.4275000     1.190000  0.5548000     1.539000  0.6505000     -0.3488000     0.8550000 
1 1 1 20 47 14 o 1.402000  0.4503000     1.603000  0.7007000     1.202000  0.5657000     0.4017000      0.9006000 
1 1 1 20 48 0  o 0.8785000 0.6087000     0.8785000 0.6087000     0.8785000 0.6087000     -0.000000      0.000000  
1 1 1 20 48 1  o 3.278000  0.4735000     4.113000  0.5592000     2.442000  0.7643000     1.671000       0.9470000 
1 1 1 20 48 2  o 2.927000  0.5821000     3.128000  0.8329000     2.727000  0.8136000     0.4011000      1.164000  
1 1 1 20 48 3  f 5.417000  0.4081000     5.434000  0.4347000     5.399000  0.6907000     0.3513000E-01  0.8161000 
1 1 1 20 48 4  o 1.995000  0.5493000     2.272000  0.7427000     1.718000  0.8096000     0.5537000      1.099000  
1 1 1 20 48 5  o 1.485000  0.4583000     1.272000  0.5887000     1.698000  0.7026000     -0.4257000     0.9167000 
1 1 1 20 48 6  o 1.583000  0.4705000     1.847000  0.7251000     1.319000  0.5996000     0.5277000      0.9410000 
1 1 1 20 48 7  o 3.157000  0.4208000     3.477000  0.5444000     2.837000  0.6419000     0.6399000      0.8417000 
1 1 1 20 48 8  o 3.136000  0.4167000     3.272000  0.5522000     3.000000  0.6244000     0.2722000      0.8335000 
1 1 1 20 48 9  o 1.059000  0.3593000     1.159000  0.5413000     0.9580000 0.4726000     0.2015000      0.7186000 
1 1 1 20 48 10 o 6.432000  0.2608000     7.017000  0.3190000     5.846000  0.4127000     1.172000       0.5216000 
1 1 1 20 48 11 o 1.296000  0.4140000     1.311000  0.5905000     1.282000  0.5804000     0.2902000E-01  0.8280000 
1 1 1 20 48 12 o 1.008000  0.3474000     0.9712000 0.4775000     1.045000  0.5048000     -0.7358000E-01 0.6948000 
1 1 1 20 48 13 o 2.766000  0.4536000     2.811000  0.6305000     2.722000  0.6523000     0.8887000E-01  0.9072000 
1 1 1 20 49 0  o 0.9734000 0.6975000     0.9734000 0.6975000     0.9734000 0.6975000     -0.000000      0.000000  
1 1 1 20 49 1  o 3.850000  0.5851000     4.581000  0.6221000     3.119000  0.9912000     1.462000       1.170000  
1 1 1 20 49 2  o 3.498000  0.5451000     3.766000  0.6896000     3.229000  0.8445000     0.5376000      1.090000  
1 1 1 20 49 3  o 2.918000  0.4951000     2.218000  0.7835000     3.618000  0.6057000     -1.401000      0.9903000 
1 1 1 20 49 4  o 3.822000  0.3799000     3.636000  0.6082000     4.008000  0.4554000     -0.3723000     0.7598000 
1 1 1 20 49 5  o 3.453000  0.4208000     4.083000  0.5539000     2.823000  0.6337000     1.260000       0.8417000 
1 1 1 20 49 6  o 1.628000  0.4646000     1.573000  0.6454000     1.683000  0.6686000     -0.1096000     0.9292000 
1 1 1 20 49 7  o 2.032000  0.4855000     1.959000  0.6792000     2.104000  0.6940000     -0.1451000     0.9711000 
1 1 1 20 49 8  o 1.320000  0.4215000     1.311000  0.5904000     1.329000  0.6017000     -0.1825000E-01 0.8430000 
1 1 1 20 49 9  o 1.288000  0.4117000     1.286000  0.5797000     1.290000  0.5848000     -0.3143000E-02 0.8234000 
1 1 1 20 49 10 o 1.828000  0.4563000     2.304000  0.6847000     1.353000  0.6033000     0.9506000      0.9126000 
1 1 1 20 49 11 o 1.128000  0.3776000     1.038000  0.5036000     1.218000  0.5628000     -0.1800000     0.7552000 
1 1 1 20 49 12 f 1.835000  0.4799000     1.622000  0.6640000     2.048000  0.6930000     -0.4256000     0.9598000 
1 1 1 20 49 13 o 1.986000  0.4951000     1.591000  0.7243000     2.382000  0.6753000     -0.7918000     0.9903000 
1 1 1 20 50 0  o 5.459000  0.3733000     5.459000  0.3733000     5.459000  0.3733000     -0.000000      0.000000  
1 1 1 20 50 1  o 4.317000  0.3440000     4.615000  0.4826000     4.018000  0.4903000     0.5975000      0.6880000 
1 1 1 20 50 2  o 3.518000  0.3759000     3.437000  0.5321000     3.600000  0.5311000     -0.1627000     0.7518000 
1 1 1 20 50 3  o 1.525000  0.4468000     1.766000  0.6742000     1.283000  0.5866000     0.4829000      0.8937000 
1 1 1 20 50 4  o 2.586000  0.4694000     2.344000  0.6831000     2.828000  0.6440000     -0.4837000     0.9388000 
1 1 1 20 50 5  o 2.609000  0.4553000     3.125000  0.5757000     2.094000  0.7054000     1.032000       0.9105000 
1 1 1 20 50 6  o 1.284000  0.4102000     1.100000  0.5217000     1.468000  0.6331000     -0.3677000     0.8203000 
1 1 1 20 50 7  o 3.569000  0.3689000     3.636000  0.5131000     3.503000  0.5301000     0.1325000      0.7377000 
1 1 1 20 50 8  o 2.668000  0.4601000     3.032000  0.6072000     2.304000  0.6913000     0.7286000      0.9201000 
1 1 1 20 50 9  o 1.921000  0.4791000     1.696000  0.6671000     2.146000  0.6880000     -0.4496000     0.9583000 
1 1 1 20 50 10 o 2.290000  0.4746000     2.716000  0.6500000     1.863000  0.6917000     0.8534000      0.9491000 
1 1 1 20 50 11 o 1.919000  0.4921000     1.968000  0.6967000     1.870000  0.6952000     0.9725000E-01  0.9842000 
1 1 1 20 50 12 o 1.313000  0.4176000     1.510000  0.6413000     1.117000  0.5351000     0.3933000      0.8352000 
1 1 1 20 51 0  o 5.468000  0.3764000     5.468000  0.3764000     5.468000  0.3764000     -0.000000      0.000000  
1 1 1 20 51 1  o 1.760000  0.4823000     1.710000  0.6718000     1.810000  0.6922000     -0.1006000     0.9646000 
1 1 1 20 51 2  o 1.215000  0.4003000     1.177000  0.5515000     1.252000  0.5803000     -0.7428000E-01 0.8006000 
1 1 1 20 51 3  o 3.151000  0.4129000     2.734000  0.6311000     3.569000  0.5327000     -0.8352000     0.8259000 
1 1 1 20 51 4  o 2.057000  0.4823000     2.266000  0.6752000     1.848000  0.6890000     0.4184000      0.9647000 
1 1 1 20 51 5  o 1.416000  0.4359000     1.362000  0.6008000     1.470000  0.6317000     -0.1077000     0.8718000 
1 1 1 20 51 6  o 2.069000  0.4685000     1.636000  0.6537000     2.502000  0.6714000     -0.8659000     0.9370000 
1 1 1 20 51 7  o 2.217000  0.4821000     2.618000  0.6730000     1.815000  0.6906000     0.8031000      0.9643000 
1 1 1 20 51 8  o 1.568000  0.4442000     1.969000  0.6985000     1.168000  0.5491000     0.8011000      0.8885000 
1 1 1 20 51 9  o 3.546000  0.3849000     3.281000  0.5758000     3.812000  0.5110000     -0.5312000     0.7699000 
1 1 1 20 51 10 o 2.312000  0.4909000     2.348000  0.6902000     2.276000  0.6981000     0.7135000E-01  0.9817000 
1 1 1 20 51 11 o 1.671000  0.4557000     2.050000  0.6956000     1.292000  0.5889000     0.7580000      0.9114000 
1 1 1 20 52 0  o 2.171000  0.8372000     2.171000  0.8372000     2.171000  0.8372000     0.000000       0.000000  
1 1 1 20 52 1  o 2.582000  0.4580000     3.104000  0.5797000     2.060000  0.7093000     1.044000       0.9160000 
1 1 1 20 52 2  o 7.923000  0.2194000     8.100000  0.3028000     7.746000  0.3178000     0.3540000      0.4389000 
1 1 1 20 52 3  o 3.494000  0.3905000     2.644000  0.6412000     4.343000  0.4458000     -1.700000      0.7810000 
1 1 1 20 52 4  o 1.691000  0.4672000     1.431000  0.6218000     1.950000  0.6976000     -0.5187000     0.9345000 
1 1 1 20 52 5  o 1.612000  0.4559000     1.861000  0.6806000     1.363000  0.6069000     0.4974000      0.9119000 
1 1 1 20 52 6  o 1.538000  0.4500000     1.687000  0.6652000     1.389000  0.6064000     0.2980000      0.9001000 
1 1 1 20 52 7  o 3.008000  0.4407000     2.847000  0.6422000     3.169000  0.6035000     -0.3219000     0.8813000 
1 1 1 20 52 8  o 1.537000  0.4579000     1.618000  0.6641000     1.456000  0.6307000     0.1614000      0.9159000 
1 1 1 20 52 9  o 1.203000  0.3963000     1.097000  0.5262000     1.309000  0.5928000     -0.2123000     0.7926000 
1 1 1 20 52 10 o 1.875000  0.4937000     1.875000  0.6897000     1.875000  0.7065000     -0.6694000E-03 0.9873000 
1 1 1 20 52 11 o 1.666000  0.5092000     1.835000  0.7871000     1.498000  0.6462000     0.3370000      1.018000  
1 1 1 20 53 0  o 1.100000  0.6968000     1.100000  0.6968000     1.100000  0.6968000     0.000000       0.000000  
1 1 1 20 53 1  o 2.005000  0.4782000     2.293000  0.6790000     1.717000  0.6736000     0.5764000      0.9565000 
1 1 1 20 53 2  o 2.304000  0.4821000     2.286000  0.6745000     2.323000  0.6890000     -0.3724000E-01 0.9642000 
1 1 1 20 53 3  o 6.919000  0.2315000     7.218000  0.3159000     6.619000  0.3384000     0.5991000      0.4629000 
1 1 1 20 53 4  f 3.845000  0.3494000     3.945000  0.4810000     3.744000  0.5068000     0.2010000      0.6987000 
1 1 1 20 53 5  o 3.372000  0.3880000     3.382000  0.5478000     3.361000  0.5496000     0.2155000E-01  0.7760000 
1 1 1 20 53 6  o 2.838000  0.4393000     2.196000  0.6983000     3.480000  0.5332000     -1.283000      0.8786000 
1 1 1 20 53 7  o 2.823000  0.4553000     3.216000  0.5967000     2.430000  0.6878000     0.7868000      0.9105000 
1 1 1 20 53 8  o 2.503000  0.4639000     1.889000  0.7000000     3.118000  0.6088000     -1.229000      0.9277000 
1 1 1 20 53 9  o 1.834000  0.4438000     2.450000  0.6855000     1.219000  0.5640000     1.231000       0.8877000 
1 1 1 20 53 10 o 1.547000  0.4715000     1.485000  0.6698000     1.609000  0.6639000     -0.1238000     0.9431000 
1 1 1 20 54 0  o 1.095000  0.6924000     1.095000  0.6924000     1.095000  0.6924000     0.000000       0.000000  
1 1 1 20 54 1  o 2.142000  0.4918000     2.138000  0.6951000     2.146000  0.6960000     -0.7432000E-02 0.9837000 
1 1 1 20 54 2  o 1.041000  0.3553000     1.125000  0.5314000     0.9573000 0.4719000     0.1680000      0.7106000 
1 1 1 20 54 3  o 3.750000  0.3789000     3.100000  0.6127000     4.401000  0.4459000     -1.301000      0.7578000 
1 1 1 20 54 4  o 1.246000  0.4051000     1.291000  0.5839000     1.200000  0.5616000     0.9045000E-01  0.8101000 
1 1 1 20 54 5  f 2.076000  0.4851000     2.377000  0.6923000     1.776000  0.6796000     0.6012000      0.9701000 
1 1 1 20 54 6  o 4.228000  0.3257000     4.130000  0.4670000     4.326000  0.4540000     -0.1965000     0.6514000 
1 1 1 20 54 7  f 3.645000  0.3949000     3.447000  0.5928000     3.843000  0.5219000     -0.3957000     0.7898000 
1 1 1 20 54 8  o 1.883000  0.4868000     2.192000  0.7052000     1.574000  0.6713000     0.6183000      0.9736000 
1 1 1 20 54 9  o 2.017000  0.5001000     1.593000  0.7014000     2.441000  0.7131000     -0.8480000     1.000000  
1 1 1 20 55 0  o 1.620000  0.8362000     1.620000  0.8362000     1.620000  0.8362000     0.000000       0.000000  
1 1 1 20 55 1  o 3.131000  0.4266000     3.387000  0.5523000     2.875000  0.6503000     0.5121000      0.8531000 
1 1 1 20 55 2  o 1.339000  0.4246000     1.285000  0.5867000     1.393000  0.6139000     -0.1076000     0.8492000 
1 1 1 20 55 3  o 5.592000  0.2762000     6.163000  0.3615000     5.022000  0.4177000     1.140000       0.5524000 
1 1 1 20 55 4  o 4.866000  0.3001000     4.786000  0.4230000     4.947000  0.4257000     -0.1610000     0.6001000 
1 1 1 20 55 5  o 2.546000  0.4743000     2.935000  0.6379000     2.158000  0.7020000     0.7768000      0.9485000 
1 1 1 20 55 6  o 3.336000  0.4179000     3.143000  0.6069000     3.529000  0.5747000     -0.3854000     0.8359000 
1 1 1 20 55 7  o 3.509000  0.4022000     3.594000  0.5428000     3.424000  0.5938000     0.1693000      0.8045000 
1 1 1 20 55 8  o 2.498000  0.5116000     3.321000  0.7571000     1.675000  0.6883000     1.646000       1.023000  
1 1 1 20 56 0  f 3.162000  0.6814000     3.162000  0.6814000     3.162000  0.6814000     -0.000000      0.000000  
1 1 1 20 56 1  f 3.457000  0.4111000     3.347000  0.6011000     3.568000  0.5610000     -0.2206000     0.8222000 
1 1 1 20 56 2  o 5.370000  0.2854000     5.291000  0.4117000     5.449000  0.3954000     -0.1578000     0.5708000 
1 1 1 20 56 3  o 4.288000  0.3411000     4.239000  0.4820000     4.337000  0.4829000     -0.9855000E-01 0.6823000 
1 1 1 20 56 4  o 1.858000  0.4846000     2.209000  0.7220000     1.507000  0.6466000     0.7011000      0.9692000 
1 1 1 20 56 5  o 3.744000  0.3749000     3.846000  0.5141000     3.643000  0.5457000     0.2027000      0.7497000 
1 1 1 20 56 6  o 2.078000  0.4985000     1.801000  0.6907000     2.356000  0.7191000     -0.5551000     0.9971000 
1 1 1 20 56 7  o 2.381000  0.5490000     2.151000  0.8046000     2.612000  0.7472000     -0.4603000     1.098000  
1 1 1 20 57 0  f 1.148000  0.7257000     1.148000  0.7257000     1.148000  0.7257000     -0.000000      0.000000  
1 1 1 20 57 1  o 2.408000  0.5090000     2.599000  0.7082000     2.217000  0.7314000     0.3819000      1.018000  
1 1 1 20 57 2  o 1.398000  0.4388000     1.232000  0.5755000     1.564000  0.6627000     -0.3319000     0.8777000 
1 1 1 20 57 3  o 1.727000  0.4812000     1.984000  0.7154000     1.470000  0.6437000     0.5142000      0.9623000 
1 1 1 20 57 4  o 3.506000  0.4084000     3.680000  0.5430000     3.333000  0.6100000     0.3472000      0.8167000 
1 1 1 20 57 5  o 1.784000  0.4942000     1.594000  0.6647000     1.974000  0.7314000     -0.3803000     0.9884000 
1 1 1 20 58 0  o 0.7741000 0.5482000     0.7741000 0.5482000     0.7741000 0.5482000     -0.000000      0.000000  
1 1 1 20 58 1  o 1.882000  0.4887000     1.524000  0.6491000     2.239000  0.7308000     -0.7150000     0.9774000 
1 1 1 20 58 2  o 1.404000  0.4395000     1.293000  0.5914000     1.514000  0.6503000     -0.2217000     0.8790000 
1 1 1 20 58 3  o 1.431000  0.4508000     1.419000  0.6335000     1.444000  0.6415000     -0.2498000E-01 0.9015000 
1 1 1 21 0  1  o 7.161000  0.1466000     7.161000  0.1466000     7.161000  0.1466000     0.000000       0.000000  
1 1 1 21 0  2  o 8.310000  0.1804000     8.310000  0.1804000     8.310000  0.1804000     0.000000       0.000000  
1 1 1 21 0  3  o 4.182000  0.1106000     4.182000  0.1106000     4.182000  0.1106000     -0.000000      0.000000  
1 1 1 21 0  4  f 4.764000  0.1505000     4.764000  0.1505000     4.764000  0.1505000     0.000000       0.000000  
1 1 1 21 0  5  o 8.352000  0.1790000     8.352000  0.1790000     8.352000  0.1790000     0.000000       0.000000  
1 1 1 21 0  6  o 0.7201000 0.4939000     0.7201000 0.4939000     0.7201000 0.4939000     0.000000       0.000000  
1 1 1 21 0  7  o 3.501000  0.4003000     3.501000  0.4003000     3.501000  0.4003000     0.000000       0.000000  
1 1 1 21 0  8  o 27.54000  0.3313000     27.54000  0.3313000     27.54000  0.3313000     0.000000       0.000000  
1 1 1 21 0  9  o 2.350000  0.9135000     2.350000  0.9135000     2.350000  0.9135000     -0.000000      0.000000  
1 1 1 21 0  10 o 0.8957000 0.6209000     0.8957000 0.6209000     0.8957000 0.6209000     0.000000       0.000000  
1 1 1 21 0  11 o 6.452000  0.3822000     6.452000  0.3822000     6.452000  0.3822000     0.000000       0.000000  
1 1 1 21 0  12 o 1.027000  0.7173000     1.027000  0.7173000     1.027000  0.7173000     0.000000       0.000000  
1 1 1 21 0  13 o 7.496000  0.3945000     7.496000  0.3945000     7.496000  0.3945000     0.000000       0.000000  
1 1 1 21 0  14 o 1.221000  0.8276000     1.221000  0.8276000     1.221000  0.8276000     0.000000       0.000000  
1 1 1 21 0  15 o 2.542000  1.085000      2.542000  1.085000      2.542000  1.085000      0.000000       0.000000  
1 1 1 21 0  16 o 5.489000  0.5963000     5.489000  0.5963000     5.489000  0.5963000     0.000000       0.000000  
1 1 1 21 0  17 o 1.000000  0.7094000     1.000000  0.7094000     1.000000  0.7094000     -0.000000      0.000000  
1 1 1 21 0  18 o 2.465000  1.093000      2.465000  1.093000      2.465000  1.093000      0.000000       0.000000  
1 1 1 21 0  19 o 3.832000  0.6796000     3.832000  0.6796000     3.832000  0.6796000     0.000000       0.000000  
1 1 1 21 0  20 o 2.375000  0.9057000     2.375000  0.9057000     2.375000  0.9057000     0.000000       0.000000  
1 1 1 21 0  21 o 1.881000  0.8953000     1.881000  0.8953000     1.881000  0.8953000     -0.000000      0.000000  
1 1 1 21 0  22 o 0.8803000 0.6118000     0.8803000 0.6118000     0.8803000 0.6118000     0.000000       0.000000  
1 1 1 21 0  23 o 0.9529000 0.6523000     0.9529000 0.6523000     0.9529000 0.6523000     0.000000       0.000000  
1 1 1 21 1  1  o 9.551000  0.1216000     9.398000  0.1678000     9.703000  0.1762000     -0.3058000     0.2433000 
1 1 1 21 1  2  o 4.902000  0.1634000     ?         ?             4.902000  0.1634000     ?              ?         
1 1 1 21 1  3  o 2.406000  0.1056000     2.296000  0.1656000     2.516000  0.1312000     -0.2199000     0.2113000 
1 1 1 21 1  4  o 17.06000  0.1797000     17.06000  0.2035000     17.07000  0.2962000     -0.4841000E-02 0.3593000 
1 1 1 21 1  5  o 10.74000  0.1309000     10.78000  0.1503000     10.69000  0.2143000     0.8914000E-01  0.2618000 
1 1 1 21 1  6  o 8.770000  0.1407000     8.798000  0.2024000     8.743000  0.1956000     0.5465000E-01  0.2815000 
1 1 1 21 1  7  o 3.888000  0.2629000     3.865000  0.3811000     3.911000  0.3623000     -0.4619000E-01 0.5259000 
1 1 1 21 1  8  o 11.86000  0.1612000     11.87000  0.2286000     11.86000  0.2274000     0.1053000E-01  0.3224000 
1 1 1 21 1  9  o 12.07000  0.1949000     12.33000  0.2770000     11.81000  0.2744000     0.5225000      0.3899000 
1 1 1 21 1  10 o 7.561000  0.2209000     7.764000  0.3090000     7.358000  0.3157000     0.4052000      0.4417000 
1 1 1 21 1  11 o 11.92000  0.1970000     11.89000  0.2792000     11.95000  0.2780000     -0.5729000E-01 0.3940000 
1 1 1 21 1  12 o 11.74000  0.2282000     11.52000  0.3008000     11.95000  0.3432000     -0.4337000     0.4564000 
1 1 1 21 1  13 o 7.461000  0.2793000     7.518000  0.3905000     7.405000  0.3996000     0.1131000      0.5587000 
1 1 1 21 1  14 o 9.770000  0.2815000     9.656000  0.4015000     9.884000  0.3946000     -0.2279000     0.5629000 
1 1 1 21 1  15 f 4.173000  0.5311000     5.137000  0.5882000     3.210000  0.8845000     1.928000       1.062000  
1 1 1 21 1  16 o 2.599000  0.6302000     2.169000  0.8690000     3.028000  0.9129000     -0.8586000     1.260000  
1 1 1 21 1  17 o 3.445000  0.5674000     2.132000  0.8780000     4.757000  0.7190000     -2.625000      1.135000  
1 1 1 21 1  18 o 3.570000  0.5768000     2.885000  0.8915000     4.255000  0.7321000     -1.370000      1.154000  
1 1 1 21 1  19 o 1.970000  0.5173000     2.536000  0.8032000     1.404000  0.6521000     1.132000       1.035000  
1 1 1 21 1  20 o 2.259000  0.5282000     1.909000  0.7400000     2.609000  0.7538000     -0.7006000     1.056000  
1 1 1 21 1  21 o 1.159000  0.3959000     1.231000  0.5863000     1.087000  0.5322000     0.1446000      0.7919000 
1 1 1 21 1  22 f 1.739000  0.4868000     1.405000  0.6363000     2.072000  0.7369000     -0.6663000     0.9736000 
1 1 1 21 1  23 o 1.330000  0.4304000     1.006000  0.5007000     1.654000  0.7001000     -0.6480000     0.8607000 
1 1 1 21 2  1  o 12.44000  0.1742000     12.55000  0.3013000     12.33000  0.1750000     0.2208000      0.3484000 
1 1 1 21 2  2  o 20.13000  0.2708000     20.23000  0.4714000     20.03000  0.2668000     0.2025000      0.5417000 
1 1 1 21 2  3  o 7.437000  0.1020000     7.337000  0.1329000     7.537000  0.1548000     -0.1997000     0.2040000 
1 1 1 21 2  4  o 9.426000  0.1169000     9.362000  0.1580000     9.489000  0.1724000     -0.1269000     0.2339000 
1 1 1 21 2  5  o 18.94000  0.1722000     19.09000  0.2082000     18.78000  0.2743000     0.3077000      0.3443000 
1 1 1 21 2  6  o 9.801000  0.1520000     9.871000  0.1986000     9.732000  0.2301000     0.1394000      0.3039000 
1 1 1 21 2  7  o 4.485000  0.2267000     4.821000  0.3065000     4.149000  0.3342000     0.6716000      0.4535000 
1 1 1 21 2  8  o 6.105000  0.2044000     6.164000  0.2900000     6.046000  0.2881000     0.1189000      0.4088000 
1 1 1 21 2  9  o 5.702000  0.2748000     5.572000  0.4022000     5.832000  0.3745000     -0.2594000     0.5495000 
1 1 1 21 2  10 f 6.009000  0.2557000     5.645000  0.3801000     6.374000  0.3422000     -0.7295000     0.5114000 
1 1 1 21 2  11 o 5.236000  0.3101000     5.265000  0.4433000     5.208000  0.4337000     0.5790000E-01  0.6201000 
1 1 1 21 2  12 o 4.622000  0.3871000     4.316000  0.5860000     4.929000  0.5059000     -0.6131000     0.7742000 
1 1 1 21 2  13 o 2.681000  0.6037000     2.541000  0.8514000     2.820000  0.8561000     -0.2791000     1.207000  
1 1 1 21 2  14 o 2.435000  0.6365000     2.804000  0.9292000     2.065000  0.8702000     0.7396000      1.273000  
1 1 1 21 2  15 o 2.250000  0.6122000     2.054000  0.8442000     2.447000  0.8869000     -0.3937000     1.224000  
1 1 1 21 2  16 o 3.103000  0.6185000     3.614000  0.8401000     2.591000  0.9079000     1.024000       1.237000  
1 1 1 21 2  17 o 3.163000  0.6482000     2.957000  0.9319000     3.369000  0.9011000     -0.4127000     1.296000  
1 1 1 21 2  18 o 2.107000  0.5724000     1.534000  0.7196000     2.680000  0.8903000     -1.146000      1.145000  
1 1 1 21 2  19 f 1.474000  0.4780000     1.524000  0.6914000     1.424000  0.6603000     0.1005000      0.9561000 
1 1 1 21 2  20 o 1.737000  0.4890000     1.305000  0.6118000     2.169000  0.7630000     -0.8645000     0.9780000 
1 1 1 21 2  21 o 1.692000  0.4803000     2.082000  0.7424000     1.303000  0.6097000     0.7791000      0.9606000 
1 1 1 21 2  22 o 2.295000  0.5167000     1.871000  0.7323000     2.719000  0.7291000     -0.8484000     1.033000  
1 1 1 21 2  23 o 1.442000  0.4584000     1.376000  0.6279000     1.507000  0.6681000     -0.1318000     0.9168000 
1 1 1 21 3  1  o 20.54000  0.2693000     20.86000  0.4688000     20.22000  0.2650000     0.6412000      0.5386000 
1 1 1 21 3  2  o 9.422000  0.1666000     9.365000  0.2884000     9.479000  0.1667000     -0.1142000     0.3332000 
1 1 1 21 3  3  o 10.55000  0.1034000     10.55000  0.1416000     10.55000  0.1506000     -0.6010000E-02 0.2067000 
1 1 1 21 3  4  o 2.611000  0.2152000     2.721000  0.2171000     2.500000  0.3716000     0.2201000      0.4303000 
1 1 1 21 3  5  o 8.183000  0.1212000     8.321000  0.1554000     8.046000  0.1860000     0.2749000      0.2424000 
1 1 1 21 3  6  o 9.363000  0.1416000     9.282000  0.1587000     9.444000  0.2345000     -0.1612000     0.2832000 
1 1 1 21 3  7  o 11.19000  0.1522000     11.01000  0.1729000     11.36000  0.2506000     -0.3463000     0.3045000 
1 1 1 21 3  8  o 7.102000  0.1851000     7.047000  0.2636000     7.158000  0.2601000     -0.1112000     0.3703000 
1 1 1 21 3  9  o 5.584000  0.2696000     5.403000  0.3923000     5.766000  0.3700000     -0.3627000     0.5393000 
1 1 1 21 3  10 o 10.90000  0.1860000     10.87000  0.2636000     10.92000  0.2624000     -0.5829000E-01 0.3719000 
1 1 1 21 3  11 o 10.34000  0.2033000     10.44000  0.2910000     10.24000  0.2838000     0.2005000      0.4065000 
1 1 1 21 3  12 f 13.42000  0.2031000     13.09000  0.2903000     13.75000  0.2841000     -0.6556000     0.4062000 
1 1 1 21 3  13 o 8.352000  0.2569000     8.386000  0.3674000     8.317000  0.3593000     0.6934000E-01  0.5139000 
1 1 1 21 3  14 o 6.483000  0.3687000     6.321000  0.5290000     6.645000  0.5139000     -0.3236000     0.7375000 
1 1 1 21 3  15 o 3.121000  0.6103000     3.396000  0.8416000     2.846000  0.8842000     0.5503000      1.221000  
1 1 1 21 3  16 o 4.647000  0.4701000     4.230000  0.7280000     5.064000  0.5949000     -0.8340000     0.9402000 
1 1 1 21 3  17 o 2.609000  0.6122000     3.266000  0.8829000     1.952000  0.8482000     1.314000       1.224000  
1 1 1 21 3  18 o 2.146000  0.5757000     2.710000  0.8823000     1.582000  0.7397000     1.128000       1.151000  
1 1 1 21 3  19 o 3.587000  0.4725000     3.316000  0.7063000     3.858000  0.6278000     -0.5424000     0.9450000 
1 1 1 21 3  20 o 1.610000  0.4825000     1.806000  0.7223000     1.415000  0.6399000     0.3911000      0.9650000 
1 1 1 21 3  21 o 1.148000  0.3906000     1.351000  0.6219000     0.9447000 0.4726000     0.4060000      0.7811000 
1 1 1 21 3  22 o 1.637000  0.4818000     1.406000  0.6377000     1.869000  0.7223000     -0.4627000     0.9635000 
1 1 1 21 3  23 o 1.819000  0.5118000     1.743000  0.7075000     1.895000  0.7398000     -0.1515000     1.024000  
1 1 1 21 4  0  o 28.32000  0.3613000     28.32000  0.3613000     28.32000  0.3613000     -0.000000      0.000000  
1 1 1 21 4  1  o 17.01000  0.2182000     16.97000  0.3895000     17.05000  0.1967000     -0.7827000E-01 0.4364000 
1 1 1 21 4  2  o 3.938000  0.9201000E-01 3.854000  0.1330000     4.021000  0.1272000     -0.1667000     0.1840000 
1 1 1 21 4  3  o 10.36000  0.1037000     10.23000  0.1423000     10.49000  0.1507000     -0.2572000     0.2073000 
1 1 1 21 4  4  o 12.44000  0.1834000     12.44000  0.1864000     12.43000  0.3160000     0.2285000E-02  0.3668000 
1 1 1 21 4  5  o 9.920000  0.1192000     9.948000  0.1636000     9.892000  0.1735000     0.5573000E-01  0.2384000 
1 1 1 21 4  6  o 9.158000  0.1382000     9.100000  0.1622000     9.216000  0.2237000     -0.1159000     0.2764000 
1 1 1 21 4  7  o 13.55000  0.1566000     13.54000  0.1826000     13.55000  0.2544000     -0.7705000E-02 0.3132000 
1 1 1 21 4  8  o 7.610000  0.1784000     7.732000  0.1904000     7.488000  0.3017000     0.2441000      0.3567000 
1 1 1 21 4  9  o 3.368000  0.4358000     3.770000  0.5493000     2.967000  0.6767000     0.8031000      0.8716000 
1 1 1 21 4  10 o 12.97000  0.1819000     13.00000  0.2587000     12.94000  0.2556000     0.6260000E-01  0.3637000 
1 1 1 21 4  11 o 6.455000  0.2628000     6.414000  0.3698000     6.496000  0.3735000     -0.8188000E-01 0.5256000 
1 1 1 21 4  12 o 9.256000  0.2265000     9.245000  0.3211000     9.267000  0.3196000     -0.2191000E-01 0.4531000 
1 1 1 21 4  13 o 12.03000  0.2162000     11.53000  0.3136000     12.54000  0.2976000     -1.018000      0.4323000 
1 1 1 21 4  14 o 7.936000  0.3182000     7.921000  0.4574000     7.951000  0.4424000     -0.2980000E-01 0.6364000 
1 1 1 21 4  15 o 7.224000  0.3153000     7.015000  0.4588000     7.433000  0.4327000     -0.4186000     0.6307000 
1 1 1 21 4  16 o 2.962000  0.6317000     3.122000  0.8921000     2.802000  0.8945000     0.3194000      1.263000  
1 1 1 21 4  17 o 2.443000  0.6378000     2.127000  0.8903000     2.759000  0.9136000     -0.6329000     1.276000  
1 1 1 21 4  18 o 1.867000  0.5564000     1.955000  0.8194000     1.779000  0.7529000     0.1759000      1.113000  
1 1 1 21 4  19 o 3.223000  0.5132000     3.389000  0.7002000     3.058000  0.7504000     0.3318000      1.026000  
1 1 1 21 4  20 o 1.518000  0.4709000     1.529000  0.6702000     1.506000  0.6618000     0.2314000E-01  0.9419000 
1 1 1 21 4  21 o 1.920000  0.4655000     2.629000  0.7309000     1.211000  0.5765000     1.418000       0.9309000 
1 1 1 21 4  22 o 1.602000  0.4774000     1.824000  0.7200000     1.381000  0.6270000     0.4431000      0.9548000 
1 1 1 21 4  23 o 1.491000  0.4647000     1.577000  0.6772000     1.405000  0.6366000     0.1719000      0.9294000 
1 1 1 21 5  0  o 2.414000  0.1825000     2.414000  0.1825000     2.414000  0.1825000     0.000000       0.000000  
1 1 1 21 5  1  o 9.777000  0.1004000     9.697000  0.1472000     9.856000  0.1364000     -0.1593000     0.2007000 
1 1 1 21 5  2  o 6.588000  0.8690000E-01 6.565000  0.1182000     6.611000  0.1274000     -0.4588000E-01 0.1738000 
1 1 1 21 5  3  o 8.167000  0.9895000E-01 8.212000  0.1358000     8.122000  0.1440000     0.9034000E-01  0.1979000 
1 1 1 21 5  4  o 16.72000  0.1790000     16.93000  0.2071000     16.51000  0.2921000     0.4155000      0.3581000 
1 1 1 21 5  5  o 19.85000  0.1706000     19.79000  0.2385000     19.90000  0.2440000     -0.1100000     0.3412000 
1 1 1 21 5  6  o 18.62000  0.1937000     18.59000  0.2698000     18.65000  0.2781000     -0.5949000E-01 0.3874000 
1 1 1 21 5  7  f 9.911000  0.1335000     10.10000  0.1749000     9.727000  0.2016000     0.3682000      0.2669000 
1 1 1 21 5  8  o 5.870000  0.2114000     6.102000  0.2143000     5.637000  0.3645000     0.4649000      0.4228000 
1 1 1 21 5  9  o 10.04000  0.2093000     10.19000  0.2339000     9.899000  0.3471000     0.2897000      0.4186000 
1 1 1 21 5  10 o 6.995000  0.2294000     6.709000  0.3348000     7.282000  0.3137000     -0.5729000     0.4588000 
1 1 1 21 5  11 o 7.070000  0.2486000     6.822000  0.3618000     7.319000  0.3412000     -0.4968000     0.4973000 
1 1 1 21 5  12 o 2.148000  0.5462000     2.543000  0.8017000     1.753000  0.7420000     0.7899000      1.092000  
1 1 1 21 5  13 o 2.579000  0.5859000     2.353000  0.8366000     2.806000  0.8206000     -0.4537000     1.172000  
1 1 1 21 5  14 o 7.380000  0.3367000     7.364000  0.4802000     7.396000  0.4721000     -0.3278000E-01 0.6734000 
1 1 1 21 5  15 o 4.139000  0.5092000     4.054000  0.7309000     4.223000  0.7091000     -0.1690000     1.018000  
1 1 1 21 5  16 o 2.288000  0.6145000     2.183000  0.8556000     2.393000  0.8823000     -0.2100000     1.229000  
1 1 1 21 5  17 o 4.699000  0.4945000     5.245000  0.6145000     4.153000  0.7750000     1.092000       0.9891000 
1 1 1 21 5  18 o 3.371000  0.5338000     3.144000  0.8187000     3.598000  0.6853000     -0.4542000     1.068000  
1 1 1 21 5  19 o 1.818000  0.5206000     2.124000  0.7825000     1.512000  0.6867000     0.6123000      1.041000  
1 1 1 21 5  20 o 1.977000  0.5198000     2.232000  0.7638000     1.721000  0.7052000     0.5109000      1.040000  
1 1 1 21 5  21 o 2.151000  0.5358000     2.378000  0.7534000     1.924000  0.7621000     0.4548000      1.072000  
1 1 1 21 5  22 o 1.551000  0.4682000     1.840000  0.7255000     1.263000  0.5921000     0.5774000      0.9364000 
1 1 1 21 5  23 o 1.094000  0.3773000     1.172000  0.5634000     1.016000  0.5020000     0.1561000      0.7546000 
1 1 1 21 6  0  o 11.60000  0.1438000     11.60000  0.1438000     11.60000  0.1438000     0.000000       0.000000  
1 1 1 21 6  1  o 11.71000  0.1079000     11.79000  0.1707000     11.63000  0.1322000     0.1562000      0.2159000 
1 1 1 21 6  2  o 15.07000  0.1327000     15.02000  0.2083000     15.13000  0.1643000     -0.1037000     0.2653000 
1 1 1 21 6  3  o 6.798000  0.1003000     6.767000  0.1372000     6.828000  0.1463000     -0.6135000E-01 0.2006000 
1 1 1 21 6  4  o 13.87000  0.1401000     13.89000  0.1835000     13.86000  0.2119000     0.2921000E-01  0.2803000 
1 1 1 21 6  5  o 13.61000  0.1355000     13.75000  0.1898000     13.47000  0.1935000     0.2868000      0.2711000 
1 1 1 21 6  6  o 3.963000  0.4102000     3.703000  0.7761000     4.224000  0.2657000     -0.5210000     0.8203000 
1 1 1 21 6  7  o 6.337000  0.1508000     6.259000  0.2063000     6.414000  0.2200000     -0.1545000     0.3016000 
1 1 1 21 6  8  o 3.272000  0.2757000     3.593000  0.3228000     2.951000  0.4469000     0.6425000      0.5513000 
1 1 1 21 6  9  o 9.806000  0.2614000     9.678000  0.2351000     9.934000  0.4668000     -0.2556000     0.5227000 
1 1 1 21 6  10 o 11.57000  0.2152000     11.66000  0.2121000     11.49000  0.3744000     0.1757000      0.4303000 
1 1 1 21 6  11 o 1.986000  0.5535000     1.710000  0.7168000     2.262000  0.8436000     -0.5523000     1.107000  
1 1 1 21 6  12 o 6.284000  0.2911000     5.394000  0.4588000     7.174000  0.3586000     -1.780000      0.5823000 
1 1 1 21 6  13 o 7.706000  0.2672000     7.647000  0.3831000     7.765000  0.3727000     -0.1185000     0.5345000 
1 1 1 21 6  14 f 2.289000  0.6299000     2.633000  0.9434000     1.945000  0.8350000     0.6882000      1.260000  
1 1 1 21 6  15 o 3.076000  0.6123000     3.461000  0.8290000     2.692000  0.9013000     0.7690000      1.225000  
1 1 1 21 6  16 o 2.620000  0.6237000     2.437000  0.8729000     2.802000  0.8910000     -0.3649000     1.247000  
1 1 1 21 6  17 o 2.496000  0.6247000     2.934000  0.9067000     2.058000  0.8598000     0.8761000      1.249000  
1 1 1 21 6  18 o 1.779000  0.5232000     2.130000  0.8103000     1.429000  0.6622000     0.7012000      1.046000  
1 1 1 21 6  19 o 1.741000  0.5302000     1.643000  0.7507000     1.839000  0.7490000     -0.1962000     1.060000  
1 1 1 21 6  20 o 2.500000  0.5161000     2.285000  0.7442000     2.716000  0.7152000     -0.4307000     1.032000  
1 1 1 21 6  21 o 1.328000  0.4374000     1.338000  0.6188000     1.318000  0.6183000     0.1985000E-01  0.8748000 
1 1 1 21 6  22 o 1.329000  0.4310000     1.250000  0.5843000     1.407000  0.6338000     -0.1567000     0.8621000 
1 1 1 21 6  23 o 1.448000  0.4539000     1.303000  0.6016000     1.592000  0.6799000     -0.2895000     0.9078000 
1 1 1 21 7  0  o 5.453000  0.1179000     5.453000  0.1179000     5.453000  0.1179000     -0.000000      0.000000  
1 1 1 21 7  1  o 8.292000  0.8792000E-01 8.158000  0.1239000     8.426000  0.1247000     -0.2674000     0.1758000 
1 1 1 21 7  2  o 16.87000  0.1459000     16.79000  0.2291000     16.95000  0.1809000     -0.1573000     0.2919000 
1 1 1 21 7  3  o 8.051000  0.1149000     8.048000  0.1607000     8.054000  0.1643000     -0.6347000E-02 0.2298000 
1 1 1 21 7  4  o 2.955000  0.1750000     2.950000  0.2344000     2.959000  0.2600000     -0.8949000E-02 0.3501000 
1 1 1 21 7  5  f 9.028000  0.1215000     9.167000  0.1672000     8.888000  0.1763000     0.2784000      0.2430000 
1 1 1 21 7  6  o 4.016000  0.2657000     4.130000  0.4531000     3.903000  0.2778000     0.2271000      0.5315000 
1 1 1 21 7  7  o 3.718000  0.2190000     3.854000  0.2789000     3.582000  0.3378000     0.2728000      0.4380000 
1 1 1 21 7  8  o 10.02000  0.1479000     9.774000  0.2049000     10.26000  0.2133000     -0.4872000     0.2958000 
1 1 1 21 7  9  o 16.45000  0.2283000     16.53000  0.2699000     16.36000  0.3684000     0.1715000      0.4567000 
1 1 1 21 7  10 o 5.180000  0.2784000     5.398000  0.2686000     4.963000  0.4878000     0.4350000      0.5569000 
1 1 1 21 7  11 o 10.33000  0.2502000     10.77000  0.2478000     9.890000  0.4347000     0.8845000      0.5003000 
1 1 1 21 7  12 o 3.943000  0.4607000     3.962000  0.6006000     3.923000  0.6987000     0.3874000E-01  0.9213000 
1 1 1 21 7  13 o 3.830000  0.4824000     3.990000  0.6602000     3.669000  0.7036000     0.3212000      0.9649000 
1 1 1 21 7  14 o 2.883000  0.6568000     2.375000  0.9699000     3.391000  0.8859000     -1.016000      1.314000  
1 1 1 21 7  15 o 8.547000  0.2757000     8.213000  0.4018000     8.882000  0.3775000     -0.6698000     0.5513000 
1 1 1 21 7  16 o 3.061000  0.5787000     2.026000  0.8253000     4.096000  0.8116000     -2.071000      1.157000  
1 1 1 21 7  17 o 2.042000  0.5961000     2.251000  0.8759000     1.833000  0.8089000     0.4183000      1.192000  
1 1 1 21 7  18 f 2.043000  0.5586000     1.765000  0.7585000     2.321000  0.8204000     -0.5552000     1.117000  
1 1 1 21 7  19 o 2.451000  0.6244000     2.671000  0.8996000     2.230000  0.8660000     0.4418000      1.249000  
1 1 1 21 7  20 o 1.717000  0.4911000     1.922000  0.7280000     1.512000  0.6593000     0.4095000      0.9821000 
1 1 1 21 7  21 o 1.699000  0.4970000     2.090000  0.7805000     1.307000  0.6155000     0.7830000      0.9940000 
1 1 1 21 7  22 o 1.577000  0.4654000     1.251000  0.5877000     1.903000  0.7219000     -0.6522000     0.9309000 
1 1 1 21 7  23 o 1.883000  0.5021000     1.545000  0.6729000     2.221000  0.7453000     -0.6762000     1.004000  
1 1 1 21 8  0  o 20.99000  0.2391000     20.99000  0.2391000     20.99000  0.2391000     -0.000000      0.000000  
1 1 1 21 8  1  o 13.32000  0.1165000     13.31000  0.1643000     13.33000  0.1653000     -0.1400000E-01 0.2331000 
1 1 1 21 8  2  o 2.815000  0.1318000     2.930000  0.1835000     2.700000  0.1892000     0.2302000      0.2636000 
1 1 1 21 8  3  o 4.359000  0.1624000     4.330000  0.2172000     4.388000  0.2416000     -0.5716000E-01 0.3249000 
1 1 1 21 8  4  o 21.92000  0.1832000     21.89000  0.2567000     21.95000  0.2615000     -0.6295000E-01 0.3664000 
1 1 1 21 8  5  o 12.95000  0.1486000     13.06000  0.1876000     12.83000  0.2305000     0.2350000      0.2972000 
1 1 1 21 8  6  o 12.53000  0.1390000     12.51000  0.1931000     12.55000  0.2001000     -0.3613000E-01 0.2781000 
1 1 1 21 8  7  o 8.768000  0.1440000     8.836000  0.1971000     8.700000  0.2100000     0.1361000      0.2880000 
1 1 1 21 8  8  o 2.741000  0.3245000     2.452000  0.4734000     3.031000  0.4438000     -0.5784000     0.6489000 
1 1 1 21 8  9  o 7.878000  0.2328000     8.046000  0.2329000     7.710000  0.4032000     0.3365000      0.4657000 
1 1 1 21 8  10 o 5.159000  0.2211000     4.855000  0.3124000     5.463000  0.3131000     -0.6076000     0.4423000 
1 1 1 21 8  11 o 6.233000  0.3309000     6.240000  0.3193000     6.226000  0.5796000     0.1437000E-01  0.6617000 
1 1 1 21 8  12 o 5.064000  0.3154000     4.697000  0.3603000     5.432000  0.5178000     -0.7348000     0.6308000 
1 1 1 21 8  13 o 6.114000  0.3140000     6.529000  0.2991000     5.698000  0.5523000     0.8309000      0.6281000 
1 1 1 21 8  14 o 10.29000  0.3392000     10.28000  0.4745000     10.29000  0.4848000     -0.1081000E-01 0.6784000 
1 1 1 21 8  15 o 9.846000  0.2534000     9.519000  0.3651000     10.17000  0.3514000     -0.6537000     0.5067000 
1 1 1 21 8  16 o 1.855000  0.5751000     2.187000  0.8972000     1.523000  0.7197000     0.6645000      1.150000  
1 1 1 21 8  17 o 2.705000  0.6317000     3.148000  0.8859000     2.262000  0.9007000     0.8858000      1.263000  
1 1 1 21 8  18 o 1.544000  0.4966000     1.469000  0.6800000     1.619000  0.7238000     -0.1500000     0.9931000 
1 1 1 21 8  19 o 1.916000  0.5755000     1.977000  0.8414000     1.856000  0.7852000     0.1201000      1.151000  
1 1 1 21 8  20 o 1.628000  0.4811000     1.841000  0.7210000     1.414000  0.6373000     0.4272000      0.9622000 
1 1 1 21 8  21 o 1.624000  0.4924000     1.352000  0.6319000     1.895000  0.7553000     -0.5428000     0.9848000 
1 1 1 21 8  22 o 1.467000  0.4599000     1.446000  0.6465000     1.487000  0.6542000     -0.4055000E-01 0.9198000 
1 1 1 21 8  23 o 1.637000  0.4640000     1.153000  0.5552000     2.120000  0.7435000     -0.9675000     0.9279000 
1 1 1 21 9  0  o 3.308000  0.1729000     3.308000  0.1729000     3.308000  0.1729000     0.000000       0.000000  
1 1 1 21 9  1  o 14.37000  0.1253000     14.48000  0.1773000     14.26000  0.1770000     0.2186000      0.2505000 
1 1 1 21 9  2  o 8.469000  0.9692000E-01 8.444000  0.1372000     8.495000  0.1370000     -0.5074000E-01 0.1938000 
1 1 1 21 9  3  o 6.500000  0.1197000     6.611000  0.1763000     6.388000  0.1619000     0.2233000      0.2393000 
1 1 1 21 9  4  o 7.912000  0.1187000     7.869000  0.1840000     7.954000  0.1500000     -0.8474000E-01 0.2374000 
1 1 1 21 9  5  o 21.36000  0.2371000     21.36000  0.3619000     21.36000  0.3065000     -0.4873000E-02 0.4742000 
1 1 1 21 9  6  o 5.820000  0.1528000     5.905000  0.2039000     5.734000  0.2275000     0.1704000      0.3055000 
1 1 1 21 9  7  o 8.679000  0.1450000     8.436000  0.2032000     8.922000  0.2069000     -0.4854000     0.2900000 
1 1 1 21 9  8  o 9.742000  0.1541000     9.757000  0.2137000     9.728000  0.2221000     0.2881000E-01  0.3083000 
1 1 1 21 9  9  o 2.171000  0.4280000     2.344000  0.5467000     1.997000  0.6586000     0.3471000      0.8559000 
1 1 1 21 9  10 o 11.59000  0.1700000     11.66000  0.2361000     11.53000  0.2445000     0.1285000      0.3399000 
1 1 1 21 9  11 o 6.419000  0.4507000     5.851000  0.8523000     6.987000  0.2937000     -1.135000      0.9015000 
1 1 1 21 9  12 o 2.683000  0.5333000     2.414000  0.6379000     2.953000  0.8548000     -0.5395000     1.067000  
1 1 1 21 9  13 o 7.152000  0.2740000     6.886000  0.2898000     7.419000  0.4650000     -0.5327000     0.5479000 
1 1 1 21 9  14 o 11.41000  0.2809000     11.28000  0.2818000     11.54000  0.4860000     -0.2586000     0.5618000 
1 1 1 21 9  15 f 3.983000  0.5285000     3.728000  0.8006000     4.238000  0.6902000     -0.5096000     1.057000  
1 1 1 21 9  16 o 1.954000  0.5886000     2.120000  0.8593000     1.788000  0.8047000     0.3319000      1.177000  
1 1 1 21 9  17 f 1.907000  0.5852000     1.676000  0.7680000     2.137000  0.8831000     -0.4612000     1.170000  
1 1 1 21 9  18 o 1.846000  0.5122000     1.336000  0.6402000     2.357000  0.7998000     -1.021000      1.024000  
1 1 1 21 9  19 o 2.005000  0.5279000     2.625000  0.8390000     1.385000  0.6410000     1.240000       1.056000  
1 1 1 21 9  20 o 1.503000  0.4603000     1.281000  0.5985000     1.724000  0.6995000     -0.4434000     0.9206000 
1 1 1 21 9  21 o 2.146000  0.5397000     2.453000  0.7844000     1.839000  0.7416000     0.6142000      1.079000  
1 1 1 21 9  22 o 1.812000  0.4953000     1.496000  0.6563000     2.127000  0.7419000     -0.6311000     0.9905000 
1 1 1 21 9  23 o 1.615000  0.4828000     1.526000  0.6627000     1.704000  0.7023000     -0.1774000     0.9656000 
1 1 1 21 10 0  o 5.247000  0.1418000     5.247000  0.1418000     5.247000  0.1418000     -0.000000      0.000000  
1 1 1 21 10 1  o 5.334000  0.9981000E-01 5.156000  0.1415000     5.513000  0.1408000     -0.3570000     0.1996000 
1 1 1 21 10 2  o 14.79000  0.1687000     14.77000  0.2606000     14.80000  0.2144000     -0.3024000E-01 0.3374000 
1 1 1 21 10 3  o 14.75000  0.1330000     14.85000  0.1889000     14.66000  0.1872000     0.1892000      0.2659000 
1 1 1 21 10 4  o 23.21000  0.2085000     23.18000  0.3142000     23.23000  0.2742000     -0.4414000E-01 0.4170000 
1 1 1 21 10 5  o 12.28000  0.2289000     12.78000  0.4170000     11.78000  0.1887000     0.9909000      0.4577000 
1 1 1 21 10 6  o 16.43000  0.1590000     16.44000  0.2222000     16.42000  0.2276000     0.1844000E-01  0.3180000 
1 1 1 21 10 7  o 12.10000  0.1680000     12.11000  0.2091000     12.08000  0.2630000     0.3432000E-01  0.3359000 
1 1 1 21 10 8  o 8.465000  0.1573000     8.489000  0.2162000     8.441000  0.2285000     0.4801000E-01  0.3146000 
1 1 1 21 10 9  o 5.445000  0.2256000     5.527000  0.2778000     5.363000  0.3556000     0.1642000      0.4513000 
1 1 1 21 10 10 o 4.930000  0.2319000     4.930000  0.3156000     4.930000  0.3399000     0.5264000E-03  0.4638000 
1 1 1 21 10 11 f 6.671000  0.3173000     6.259000  0.5637000     7.084000  0.2916000     -0.8241000     0.6346000 
1 1 1 21 10 12 o 7.776000  0.2058000     7.936000  0.2834000     7.617000  0.2986000     0.3195000      0.4117000 
1 1 1 21 10 13 o 6.194000  0.2360000     5.958000  0.3157000     6.430000  0.3510000     -0.4720000     0.4720000 
1 1 1 21 10 14 o 3.443000  0.5929000     3.548000  0.5667000     3.338000  1.042000      0.2094000      1.186000  
1 1 1 21 10 15 o 3.857000  0.4950000     3.566000  0.5599000     4.147000  0.8164000     -0.5813000     0.9900000 
1 1 1 21 10 16 o 2.039000  0.6100000     1.587000  0.6960000     2.491000  1.002000      -0.9039000     1.220000  
1 1 1 21 10 17 o 3.270000  0.6338000     3.150000  0.8990000     3.390000  0.8936000     -0.2401000     1.268000  
1 1 1 21 10 18 f 1.972000  0.5539000     1.922000  0.7881000     2.022000  0.7784000     -0.1005000     1.108000  
1 1 1 21 10 19 o 1.558000  0.4855000     1.325000  0.6332000     1.792000  0.7360000     -0.4670000     0.9709000 
1 1 1 21 10 20 o 1.334000  0.4340000     1.375000  0.6274000     1.292000  0.5998000     0.8277000E-01  0.8680000 
1 1 1 21 10 21 o 1.503000  0.4869000     1.631000  0.7328000     1.376000  0.6412000     0.2546000      0.9737000 
1 1 1 21 10 22 o 1.419000  0.4474000     1.279000  0.5982000     1.559000  0.6654000     -0.2808000     0.8948000 
1 1 1 21 10 23 o 0.9343000 0.3310000     1.034000  0.5083000     0.8349000 0.4241000     0.1988000      0.6620000 
1 1 1 21 11 0  o 10.41000  0.1509000     10.41000  0.1509000     10.41000  0.1509000     0.000000       0.000000  
1 1 1 21 11 1  o 13.47000  0.1335000     13.40000  0.2015000     13.53000  0.1752000     -0.1291000     0.2670000 
1 1 1 21 11 2  o 6.744000  0.1225000     6.750000  0.1632000     6.739000  0.1828000     0.1155000E-01  0.2451000 
1 1 1 21 11 3  o 12.84000  0.1242000     12.78000  0.1746000     12.90000  0.1766000     -0.1253000     0.2483000 
1 1 1 21 11 4  o 4.723000  0.1546000     4.991000  0.1943000     4.455000  0.2405000     0.5366000      0.3092000 
1 1 1 21 11 5  o 1.501000  0.3345000     1.604000  0.4960000     1.398000  0.4489000     0.2057000      0.6689000 
1 1 1 21 11 6  o 19.50000  0.1767000     19.48000  0.2476000     19.53000  0.2521000     -0.4450000E-01 0.3533000 
1 1 1 21 11 7  o 8.332000  0.1496000     8.257000  0.2048000     8.408000  0.2181000     -0.1507000     0.2992000 
1 1 1 21 11 8  o 9.756000  0.1696000     10.00000  0.2327000     9.512000  0.2467000     0.4879000      0.3391000 
1 1 1 21 11 9  o 2.959000  0.3387000     2.519000  0.5012000     3.399000  0.4556000     -0.8795000     0.6773000 
1 1 1 21 11 10 o 6.261000  0.2120000     6.355000  0.2941000     6.168000  0.3054000     0.1872000      0.4239000 
1 1 1 21 11 11 o 5.572000  0.3081000     5.662000  0.5131000     5.482000  0.3411000     0.1799000      0.6162000 
1 1 1 21 11 12 o 2.497000  0.4835000     2.607000  0.6469000     2.386000  0.7188000     0.2219000      0.9670000 
1 1 1 21 11 13 o 8.082000  0.2117000     8.027000  0.2925000     8.136000  0.3061000     -0.1094000     0.4234000 
1 1 1 21 11 14 o 12.49000  0.2100000     12.57000  0.2743000     12.41000  0.3179000     0.1669000      0.4199000 
1 1 1 21 11 15 o 2.889000  0.5685000     2.175000  0.7291000     3.604000  0.8725000     -1.429000      1.137000  
1 1 1 21 11 16 o 5.804000  0.4479000     5.867000  0.6773000     5.741000  0.5863000     0.1267000      0.8958000 
1 1 1 21 11 17 o 2.877000  0.5809000     2.367000  0.7501000     3.387000  0.8871000     -1.020000      1.162000  
1 1 1 21 11 18 o 5.932000  0.3443000     5.938000  0.4597000     5.926000  0.5128000     0.1163000E-01  0.6887000 
1 1 1 21 11 19 o 1.650000  0.5126000     1.573000  0.7170000     1.726000  0.7327000     -0.1535000     1.025000  
1 1 1 21 11 20 o 1.266000  0.4182000     1.320000  0.6093000     1.211000  0.5731000     0.1092000      0.8365000 
1 1 1 21 11 21 o 1.459000  0.4805000     1.523000  0.7024000     1.395000  0.6557000     0.1275000      0.9609000 
1 1 1 21 11 22 o 1.075000  0.3708000     0.9595000 0.4785000     1.190000  0.5666000     -0.2304000     0.7416000 
1 1 1 21 11 23 o 1.183000  0.3982000     1.315000  0.6073000     1.052000  0.5152000     0.2623000      0.7964000 
1 1 1 21 12 0  f 17.24000  0.2426000     17.24000  0.2426000     17.24000  0.2426000     -0.000000      0.000000  
1 1 1 21 12 1  o 3.133000  0.2082000     3.327000  0.2265000     2.939000  0.3494000     0.3887000      0.4164000 
1 1 1 21 12 2  o 4.010000  0.1461000     4.005000  0.1873000     4.015000  0.2241000     -0.9753000E-02 0.2921000 
1 1 1 21 12 3  o 12.07000  0.1618000     12.04000  0.1938000     12.10000  0.2591000     -0.6169000E-01 0.3235000 
1 1 1 21 12 4  o 6.223000  0.1333000     6.305000  0.2058000     6.140000  0.1695000     0.1649000      0.2666000 
1 1 1 21 12 5  o 4.325000  0.1638000     4.309000  0.2587000     4.341000  0.2011000     -0.3153000E-01 0.3276000 
1 1 1 21 12 6  o 5.508000  0.1559000     5.722000  0.2362000     5.293000  0.2035000     0.4296000      0.3118000 
1 1 1 21 12 7  o 22.75000  0.2007000     23.16000  0.2854000     22.33000  0.2823000     0.8268000      0.4014000 
1 1 1 21 12 8  o 7.958000  0.2231000     7.958000  0.2440000     7.957000  0.3735000     0.9308000E-03  0.4462000 
1 1 1 21 12 9  o 8.359000  0.1722000     8.330000  0.2402000     8.389000  0.2469000     -0.5955000E-01 0.3445000 
1 1 1 21 12 10 o 3.441000  0.3779000     3.597000  0.4448000     3.286000  0.6111000     0.3111000      0.7558000 
1 1 1 21 12 11 o 5.107000  0.2556000     5.484000  0.3247000     4.731000  0.3949000     0.7524000      0.5112000 
1 1 1 21 12 12 o 15.08000  0.2055000     15.06000  0.2693000     15.09000  0.3105000     -0.2760000E-01 0.4110000 
1 1 1 21 12 13 o 16.58000  0.1982000     16.72000  0.2792000     16.44000  0.2814000     0.2820000      0.3964000 
1 1 1 21 12 14 o 4.520000  0.3358000     4.719000  0.4182000     4.321000  0.5255000     0.3979000      0.6716000 
1 1 1 21 12 15 o 6.994000  0.2584000     7.174000  0.3490000     6.814000  0.3811000     0.3599000      0.5167000 
1 1 1 21 12 16 o 3.338000  0.5225000     2.636000  0.8926000     4.041000  0.5433000     -1.405000      1.045000  
1 1 1 21 12 17 o 1.788000  0.5347000     1.757000  0.7065000     1.819000  0.8029000     -0.6176000E-01 1.069000  
1 1 1 21 12 18 o 1.446000  0.4668000     1.173000  0.5490000     1.720000  0.7552000     -0.5468000     0.9337000 
1 1 1 21 12 19 o 1.721000  0.5030000     1.365000  0.5929000     2.077000  0.8126000     -0.7127000     1.006000  
1 1 1 21 12 20 o 2.881000  0.5309000     3.001000  0.6735000     2.760000  0.8207000     0.2408000      1.062000  
1 1 1 21 12 21 o 1.997000  0.5166000     2.533000  0.7815000     1.462000  0.6758000     1.071000       1.033000  
1 1 1 21 12 22 o 1.851000  0.4849000     1.423000  0.6384000     2.278000  0.7300000     -0.8550000     0.9698000 
1 1 1 21 12 23 o 1.213000  0.4051000     1.043000  0.5132000     1.384000  0.6269000     -0.3408000     0.8102000 
1 1 1 21 13 0  o 22.08000  0.5100000     22.08000  0.5100000     22.08000  0.5100000     0.000000       0.000000  
1 1 1 21 13 1  o 14.96000  0.1734000     14.85000  0.2177000     15.07000  0.2700000     -0.2188000     0.3468000 
1 1 1 21 13 2  o 25.53000  0.2676000     25.42000  0.4120000     25.64000  0.3417000     -0.2131000     0.5352000 
1 1 1 21 13 3  o 17.73000  0.1682000     17.73000  0.2551000     17.72000  0.2194000     0.1205000E-01  0.3364000 
1 1 1 21 13 4  o 8.615000  0.1158000     8.665000  0.1653000     8.564000  0.1621000     0.1016000      0.2315000 
1 1 1 21 13 5  o 6.511000  0.1268000     6.619000  0.1767000     6.403000  0.1819000     0.2161000      0.2536000 
1 1 1 21 13 6  o 20.75000  0.1898000     20.83000  0.3011000     20.66000  0.2314000     0.1689000      0.3797000 
1 1 1 21 13 7  o 9.382000  0.1573000     9.368000  0.2275000     9.397000  0.2174000     -0.2867000E-01 0.3147000 
1 1 1 21 13 8  o 8.434000  0.2174000     8.252000  0.2301000     8.617000  0.3688000     -0.3655000     0.4347000 
1 1 1 21 13 9  o 4.036000  0.2694000     3.970000  0.3657000     4.103000  0.3956000     -0.1322000     0.5388000 
1 1 1 21 13 10 o 6.176000  0.2451000     6.193000  0.3306000     6.160000  0.3618000     0.3385000E-01  0.4901000 
1 1 1 21 13 11 o 5.678000  0.2416000     5.554000  0.3341000     5.803000  0.3492000     -0.2486000     0.4833000 
1 1 1 21 13 12 o 11.65000  0.1916000     11.50000  0.2695000     11.81000  0.2725000     -0.3091000     0.3833000 
1 1 1 21 13 13 o 7.917000  0.2302000     7.970000  0.3097000     7.865000  0.3407000     0.1045000      0.4604000 
1 1 1 21 13 14 o 4.361000  0.3530000     4.626000  0.4277000     4.096000  0.5618000     0.5307000      0.7061000 
1 1 1 21 13 15 o 3.730000  0.4082000     3.825000  0.5451000     3.634000  0.6079000     0.1911000      0.8165000 
1 1 1 21 13 16 o 1.755000  0.5337000     1.580000  0.7492000     1.930000  0.7603000     -0.3498000     1.067000  
1 1 1 21 13 17 o 1.739000  0.5013000     1.425000  0.6478000     2.053000  0.7653000     -0.6276000     1.003000  
1 1 1 21 13 18 o 4.443000  0.3033000     4.448000  0.4108000     4.438000  0.4462000     0.9292000E-02  0.6065000 
1 1 1 21 13 19 o 3.297000  0.5115000     2.897000  0.7117000     3.696000  0.7349000     -0.7986000     1.023000  
1 1 1 21 13 20 o 1.653000  0.4794000     1.139000  0.5305000     2.167000  0.7988000     -1.028000      0.9589000 
1 1 1 21 13 21 o 2.014000  0.5251000     1.442000  0.6567000     2.586000  0.8195000     -1.145000      1.050000  
1 1 1 21 13 22 o 1.544000  0.4711000     1.313000  0.5660000     1.774000  0.7531000     -0.4606000     0.9421000 
1 1 1 21 13 23 o 1.199000  0.4061000     0.9452000 0.4758000     1.452000  0.6583000     -0.5072000     0.8123000 
1 1 1 21 14 0  f 24.47000  0.2814000     24.47000  0.2814000     24.47000  0.2814000     0.000000       0.000000  
1 1 1 21 14 1  o 25.41000  0.2227000     25.34000  0.3356000     25.49000  0.2927000     -0.1546000     0.4453000 
1 1 1 21 14 2  o 21.83000  0.1969000     21.90000  0.2983000     21.77000  0.2571000     0.1295000      0.3938000 
1 1 1 21 14 3  o 16.98000  0.1515000     16.84000  0.2124000     17.12000  0.2160000     -0.2871000     0.3029000 
1 1 1 21 14 4  o 4.083000  0.1565000     4.244000  0.2141000     3.923000  0.2282000     0.3210000      0.3129000 
1 1 1 21 14 5  f 24.58000  0.2053000     24.64000  0.2912000     24.52000  0.2896000     0.1158000      0.4107000 
1 1 1 21 14 6  o 8.616000  0.1298000     8.733000  0.1841000     8.500000  0.1829000     0.2332000      0.2595000 
1 1 1 21 14 7  o 23.03000  0.2087000     23.09000  0.3304000     22.96000  0.2549000     0.1301000      0.4173000 
1 1 1 21 14 8  o 4.985000  0.2145000     4.779000  0.2814000     5.192000  0.3237000     -0.4131000     0.4289000 
1 1 1 21 14 9  o 12.52000  0.1665000     12.38000  0.2313000     12.66000  0.2397000     -0.2734000     0.3331000 
1 1 1 21 14 10 o 7.924000  0.3577000     7.776000  0.6568000     8.071000  0.2837000     -0.2950000     0.7155000 
1 1 1 21 14 11 o 9.927000  0.1866000     9.710000  0.2618000     10.14000  0.2659000     -0.4349000     0.3732000 
1 1 1 21 14 12 o 7.060000  0.2323000     6.977000  0.3224000     7.142000  0.3345000     -0.1653000     0.4646000 
1 1 1 21 14 13 o 12.16000  0.2171000     12.20000  0.3043000     12.13000  0.3096000     0.6328000E-01  0.4341000 
1 1 1 21 14 14 o 9.560000  0.2097000     9.569000  0.2876000     9.551000  0.3052000     0.1871000E-01  0.4194000 
1 1 1 21 14 15 o 6.512000  0.2592000     6.541000  0.3503000     6.484000  0.3822000     0.5736000E-01  0.5185000 
1 1 1 21 14 16 o 4.595000  0.3501000     4.657000  0.4789000     4.533000  0.5107000     0.1238000      0.7001000 
1 1 1 21 14 17 o 3.962000  0.4049000     3.720000  0.6007000     4.205000  0.5430000     -0.4847000     0.8098000 
1 1 1 21 14 18 o 2.005000  0.5271000     2.007000  0.7243000     2.003000  0.7658000     0.3443000E-02  1.054000  
1 1 1 21 14 19 o 2.150000  0.4488000     1.388000  0.6152000     2.911000  0.6537000     -1.522000      0.8976000 
1 1 1 21 14 20 o 2.455000  0.4217000     3.133000  0.5093000     1.777000  0.6723000     1.356000       0.8434000 
1 1 1 21 14 21 o 1.233000  0.4182000     0.9916000 0.4851000     1.475000  0.6813000     -0.4837000     0.8364000 
1 1 1 21 14 22 o 1.322000  0.4346000     1.107000  0.5193000     1.537000  0.6970000     -0.4304000     0.8692000 
1 1 1 21 14 23 o 1.195000  0.4033000     1.254000  0.5709000     1.137000  0.5700000     0.1172000      0.8067000 
1 1 1 21 15 0  o 1.428000  0.5218000     1.428000  0.5218000     1.428000  0.5218000     -0.000000      0.000000  
1 1 1 21 15 1  o 12.88000  0.1270000     13.03000  0.1801000     12.72000  0.1791000     0.3157000      0.2540000 
1 1 1 21 15 2  o 10.05000  0.1173000     10.24000  0.1659000     9.866000  0.1659000     0.3761000      0.2347000 
1 1 1 21 15 3  o 8.166000  0.1177000     8.025000  0.1664000     8.306000  0.1664000     -0.2816000     0.2354000 
1 1 1 21 15 4  o 6.208000  0.1274000     6.265000  0.1791000     6.151000  0.1813000     0.1146000      0.2548000 
1 1 1 21 15 5  o 3.390000  0.1974000     3.170000  0.2988000     3.610000  0.2580000     -0.4399000     0.3948000 
1 1 1 21 15 6  f 23.88000  0.2028000     23.86000  0.2866000     23.90000  0.2869000     -0.4173000E-01 0.4056000 
1 1 1 21 15 7  o 6.533000  0.1770000     6.148000  0.2877000     6.919000  0.2063000     -0.7716000     0.3541000 
1 1 1 21 15 8  o 6.586000  0.1678000     6.595000  0.2636000     6.578000  0.2076000     0.1625000E-01  0.3355000 
1 1 1 21 15 9  o 1.353000  0.3982000     1.592000  0.5994000     1.113000  0.5244000     0.4797000      0.7965000 
1 1 1 21 15 10 o 5.064000  0.3797000     4.905000  0.6719000     5.223000  0.3539000     -0.3176000     0.7594000 
1 1 1 21 15 11 o 6.816000  0.2197000     6.838000  0.2994000     6.794000  0.3216000     0.4449000E-01  0.4394000 
1 1 1 21 15 12 o 11.71000  0.1922000     12.18000  0.2669000     11.24000  0.2768000     0.9352000      0.3845000 
1 1 1 21 15 13 o 7.472000  0.3841000     7.394000  0.3570000     7.549000  0.6803000     -0.1545000     0.7682000 
1 1 1 21 15 14 o 8.116000  0.2308000     8.012000  0.3267000     8.221000  0.3261000     -0.2095000     0.4616000 
1 1 1 21 15 15 o 3.647000  0.4549000     3.309000  0.6494000     3.984000  0.6371000     -0.6753000     0.9097000 
1 1 1 21 15 16 o 2.026000  0.5302000     2.026000  0.7467000     2.026000  0.7529000     -0.2270000E-03 1.060000  
1 1 1 21 15 17 o 1.753000  0.4847000     1.233000  0.5890000     2.273000  0.7700000     -1.040000      0.9694000 
1 1 1 21 15 18 o 1.637000  0.4958000     1.852000  0.7504000     1.422000  0.6483000     0.4300000      0.9916000 
1 1 1 21 15 19 o 3.410000  0.3876000     3.133000  0.5839000     3.687000  0.5100000     -0.5540000     0.7753000 
1 1 1 21 15 20 o 3.727000  0.3716000     3.945000  0.4973000     3.508000  0.5521000     0.4365000      0.7431000 
1 1 1 21 15 21 o 1.919000  0.4561000     2.422000  0.6733000     1.416000  0.6155000     1.005000       0.9122000 
1 1 1 21 15 22 o 2.742000  0.4275000     2.430000  0.6113000     3.053000  0.5978000     -0.6233000     0.8550000 
1 1 1 21 15 23 o 1.685000  0.4967000     1.900000  0.6739000     1.469000  0.7299000     0.4314000      0.9935000 
1 1 1 21 16 0  f 7.224000  0.1619000     7.224000  0.1619000     7.224000  0.1619000     -0.000000      0.000000  
1 1 1 21 16 1  o 28.13000  0.2274000     28.15000  0.3216000     28.11000  0.3217000     0.4412000E-01  0.4549000 
1 1 1 21 16 2  o 28.47000  0.2304000     28.63000  0.3270000     28.32000  0.3247000     0.3165000      0.4608000 
1 1 1 21 16 3  o 21.62000  0.1833000     21.76000  0.2602000     21.48000  0.2582000     0.2800000      0.3665000 
1 1 1 21 16 4  o 14.83000  0.1434000     14.84000  0.2029000     14.81000  0.2029000     0.3080000E-01  0.2869000 
1 1 1 21 16 5  o 12.54000  0.1357000     12.93000  0.1948000     12.15000  0.1890000     0.7800000      0.2714000 
1 1 1 21 16 6  o 14.95000  0.1506000     14.79000  0.2120000     15.10000  0.2139000     -0.3078000     0.3012000 
1 1 1 21 16 7  o 17.57000  0.2102000     17.90000  0.2712000     17.24000  0.3212000     0.6558000      0.4204000 
1 1 1 21 16 8  o 8.769000  0.1768000     8.705000  0.2562000     8.834000  0.2437000     -0.1291000     0.3536000 
1 1 1 21 16 9  o 7.098000  0.2241000     7.239000  0.2866000     6.957000  0.3446000     0.2815000      0.4482000 
1 1 1 21 16 10 o 11.12000  0.1783000     11.25000  0.2462000     10.99000  0.2579000     0.2605000      0.3566000 
1 1 1 21 16 11 o 2.287000  0.4794000     2.509000  0.6503000     2.065000  0.7044000     0.4437000      0.9587000 
1 1 1 21 16 12 o 4.541000  0.3213000     4.787000  0.4075000     4.294000  0.4970000     0.4929000      0.6427000 
1 1 1 21 16 13 o 9.551000  0.2909000     9.639000  0.2967000     9.462000  0.5005000     0.1768000      0.5818000 
1 1 1 21 16 14 o 3.984000  0.3984000     4.072000  0.5142000     3.896000  0.6086000     0.1761000      0.7968000 
1 1 1 21 16 15 o 4.533000  0.4038000     4.331000  0.5943000     4.736000  0.5468000     -0.4054000     0.8075000 
1 1 1 21 16 16 o 1.370000  0.4450000     1.306000  0.6072000     1.435000  0.6508000     -0.1293000     0.8901000 
1 1 1 21 16 17 o 1.732000  0.4974000     1.499000  0.6592000     1.965000  0.7451000     -0.4666000     0.9948000 
1 1 1 21 16 18 f 1.553000  0.5043000     1.347000  0.6149000     1.760000  0.7996000     -0.4131000     1.009000  
1 1 1 21 16 19 f 2.068000  0.4947000     2.173000  0.6983000     1.963000  0.7008000     0.2099000      0.9894000 
1 1 1 21 16 20 f 2.387000  0.4971000     2.074000  0.6954000     2.701000  0.7105000     -0.6272000     0.9942000 
1 1 1 21 16 21 o 2.225000  0.4928000     2.471000  0.6910000     1.979000  0.7027000     0.4919000      0.9855000 
1 1 1 21 16 22 o 1.259000  0.4074000     1.427000  0.6238000     1.092000  0.5243000     0.3357000      0.8149000 
1 1 1 21 16 23 o 1.225000  0.6250000     1.225000  0.6250000     ?         ?             ?              ?         
1 1 1 21 17 0  o 16.63000  0.2127000     16.63000  0.2127000     16.63000  0.2127000     0.000000       0.000000  
1 1 1 21 17 1  o 5.643000  0.1300000     5.409000  0.1830000     5.877000  0.1848000     -0.4678000     0.2600000 
1 1 1 21 17 2  o 10.75000  0.1224000     10.79000  0.1730000     10.71000  0.1733000     0.8062000E-01  0.2449000 
1 1 1 21 17 3  o 5.612000  0.1346000     5.679000  0.1896000     5.545000  0.1911000     0.1341000      0.2692000 
1 1 1 21 17 4  f 4.801000  0.1522000     5.030000  0.2091000     4.572000  0.2212000     0.4575000      0.3044000 
1 1 1 21 17 5  o 7.474000  0.1331000     7.525000  0.1898000     7.423000  0.1865000     0.1026000      0.2661000 
1 1 1 21 17 6  o 8.979000  0.1744000     8.898000  0.2297000     9.059000  0.2624000     -0.1606000     0.3488000 
1 1 1 21 17 7  o 5.715000  0.1655000     5.657000  0.2258000     5.773000  0.2420000     -0.1161000     0.3309000 
1 1 1 21 17 8  o 7.838000  0.1683000     7.708000  0.2658000     7.967000  0.2067000     -0.2591000     0.3367000 
1 1 1 21 17 9  f 6.308000  0.3848000     6.323000  0.7129000     6.293000  0.2903000     0.3045000E-01  0.7697000 
1 1 1 21 17 10 o 3.872000  0.3108000     3.996000  0.4186000     3.747000  0.4594000     0.2495000      0.6216000 
1 1 1 21 17 11 o 4.936000  0.2900000     5.405000  0.3757000     4.467000  0.4418000     0.9382000      0.5800000 
1 1 1 21 17 12 o 6.170000  0.2534000     6.496000  0.3297000     5.844000  0.3849000     0.6517000      0.5068000 
1 1 1 21 17 13 o 14.84000  0.2127000     15.10000  0.2784000     14.57000  0.3218000     0.5286000      0.4255000 
1 1 1 21 17 14 o 2.432000  0.5306000     2.416000  0.7343000     2.449000  0.7660000     -0.3287000E-01 1.061000  
1 1 1 21 17 15 o 2.750000  0.7251000     3.612000  1.239000      1.888000  0.7542000     1.723000       1.450000  
1 1 1 21 17 16 o 4.909000  0.3175000     4.849000  0.4291000     4.969000  0.4682000     -0.1202000     0.6351000 
1 1 1 21 17 17 o 2.927000  0.5034000     2.968000  0.7069000     2.885000  0.7168000     0.8219000E-01  1.007000  
1 1 1 21 17 18 o 2.321000  0.6408000     1.477000  0.6486000     3.164000  1.105000      -1.687000      1.282000  
1 1 1 21 17 19 o 1.562000  0.4434000     1.185000  0.5567000     1.939000  0.6903000     -0.7543000     0.8868000 
1 1 1 21 17 20 o 1.881000  0.4980000     1.609000  0.6825000     2.153000  0.7254000     -0.5443000     0.9961000 
1 1 1 21 17 21 o 1.615000  0.4515000     1.296000  0.5851000     1.934000  0.6879000     -0.6384000     0.9030000 
1 1 1 21 17 22 o 1.544000  0.4584000     1.515000  0.6384000     1.573000  0.6579000     -0.5826000E-01 0.9168000 
1 1 1 21 18 0  o 9.773000  0.1706000     9.773000  0.1706000     9.773000  0.1706000     -0.000000      0.000000  
1 1 1 21 18 1  o 13.86000  0.1359000     14.04000  0.1929000     13.69000  0.1914000     0.3570000      0.2717000 
1 1 1 21 18 2  o 7.725000  0.1219000     7.855000  0.1704000     7.594000  0.1743000     0.2611000      0.2437000 
1 1 1 21 18 3  o 2.949000  0.2150000     2.822000  0.3124000     3.075000  0.2954000     -0.2533000     0.4300000 
1 1 1 21 18 4  o 3.750000  0.1849000     3.457000  0.2817000     4.042000  0.2396000     -0.5845000     0.3699000 
1 1 1 21 18 5  o 6.977000  0.1350000     6.926000  0.1932000     7.028000  0.1886000     -0.1014000     0.2700000 
1 1 1 21 18 6  o 7.377000  0.1792000     7.779000  0.2718000     6.974000  0.2334000     0.8048000      0.3583000 
1 1 1 21 18 7  o 8.913000  0.1422000     8.883000  0.2008000     8.942000  0.2014000     -0.5875000E-01 0.2844000 
1 1 1 21 18 8  o 8.175000  0.1632000     8.325000  0.2117000     8.025000  0.2486000     0.3005000      0.3265000 
1 1 1 21 18 9  o 13.26000  0.2169000     12.78000  0.3786000     13.75000  0.2116000     -0.9678000     0.4337000 
1 1 1 21 18 10 o 11.94000  0.1780000     11.75000  0.2480000     12.13000  0.2555000     -0.3796000     0.3560000 
1 1 1 21 18 11 o 4.972000  0.2808000     5.005000  0.3845000     4.938000  0.4092000     0.6717000E-01  0.5615000 
1 1 1 21 18 12 o 10.43000  0.2067000     10.61000  0.2729000     10.25000  0.3104000     0.3619000      0.4133000 
1 1 1 21 18 13 o 4.710000  0.3341000     4.511000  0.4734000     4.909000  0.4716000     -0.3981000     0.6682000 
1 1 1 21 18 14 o 1.774000  0.5099000     1.528000  0.6607000     2.020000  0.7767000     -0.4921000     1.020000  
1 1 1 21 18 15 o 6.182000  0.4412000     5.235000  0.8028000     7.129000  0.3663000     -1.894000      0.8824000 
1 1 1 21 18 16 o 4.083000  0.3807000     4.044000  0.5252000     4.121000  0.5513000     -0.7694000E-01 0.7614000 
1 1 1 21 18 17 o 2.112000  0.5230000     2.129000  0.7373000     2.094000  0.7419000     0.3503000E-01  1.046000  
1 1 1 21 18 18 o 1.827000  0.5328000     1.789000  0.6882000     1.865000  0.8134000     -0.7655000E-01 1.066000  
1 1 1 21 18 19 o 1.471000  0.4479000     1.531000  0.6425000     1.411000  0.6242000     0.1204000      0.8958000 
1 1 1 21 18 20 o 1.545000  0.5204000     1.792000  0.8542000     1.299000  0.5949000     0.4935000      1.041000  
1 1 1 21 18 21 o 2.245000  0.4777000     1.832000  0.6920000     2.658000  0.6588000     -0.8257000     0.9555000 
1 1 1 21 18 22 f 1.764000  0.4464000     1.260000  0.5764000     2.268000  0.6819000     -1.008000      0.8929000 
1 1 1 21 19 0  o 17.08000  0.2191000     17.08000  0.2191000     17.08000  0.2191000     0.000000       0.000000  
1 1 1 21 19 1  o 5.828000  0.1331000     5.753000  0.1876000     5.903000  0.1888000     -0.1498000     0.2661000 
1 1 1 21 19 2  f 8.148000  0.1240000     8.115000  0.1750000     8.180000  0.1756000     -0.6592000E-01 0.2479000 
1 1 1 21 19 3  o 10.80000  0.1284000     10.78000  0.1806000     10.82000  0.1826000     -0.3987000E-01 0.2568000 
1 1 1 21 19 4  o 15.08000  0.1486000     15.19000  0.2104000     14.97000  0.2098000     0.2139000      0.2971000 
1 1 1 21 19 5  o 7.419000  0.1508000     7.447000  0.2295000     7.391000  0.1957000     0.5644000E-01  0.3016000 
1 1 1 21 19 6  o 10.61000  0.1626000     10.57000  0.1971000     10.64000  0.2588000     -0.7005000E-01 0.3253000 
1 1 1 21 19 7  o 8.509000  0.1455000     8.508000  0.2049000     8.510000  0.2067000     -0.2083000E-02 0.2910000 
1 1 1 21 19 8  o 18.64000  0.2086000     18.47000  0.2842000     18.82000  0.3053000     -0.3498000     0.4171000 
1 1 1 21 19 9  o 12.20000  0.1618000     12.25000  0.2237000     12.15000  0.2337000     0.1016000      0.3235000 
1 1 1 21 19 10 o 4.682000  0.2533000     4.997000  0.3800000     4.368000  0.3350000     0.6285000      0.5066000 
1 1 1 21 19 11 o 8.307000  0.2064000     8.528000  0.2777000     8.087000  0.3055000     0.4417000      0.4129000 
1 1 1 21 19 12 o 3.563000  0.5195000     2.480000  0.7588000     4.646000  0.7099000     -2.166000      1.039000  
1 1 1 21 19 13 o 2.550000  0.5206000     2.398000  0.7321000     2.703000  0.7404000     -0.3055000     1.041000  
1 1 1 21 19 14 o 5.890000  0.3214000     6.391000  0.3524000     5.388000  0.5376000     1.003000       0.6428000 
1 1 1 21 19 15 o 1.470000  0.4675000     1.469000  0.6501000     1.472000  0.6720000     -0.2683000E-02 0.9350000 
1 1 1 21 19 16 o 1.942000  0.5155000     1.863000  0.6982000     2.022000  0.7586000     -0.1589000     1.031000  
1 1 1 21 19 17 o 3.052000  0.4573000     2.239000  0.7329000     3.865000  0.5472000     -1.626000      0.9147000 
1 1 1 21 19 18 o 1.504000  0.4561000     1.678000  0.6703000     1.329000  0.6186000     0.3485000      0.9121000 
1 1 1 21 19 19 f 1.290000  0.4064000     1.596000  0.6518000     0.9837000 0.4854000     0.6120000      0.8127000 
1 1 1 21 19 20 f 2.237000  0.6256000     2.456000  1.037000      2.018000  0.7001000     0.4386000      1.251000  
1 1 1 21 19 21 o 1.672000  0.4700000     1.658000  0.6552000     1.687000  0.6740000     -0.2835000E-01 0.9400000 
1 1 1 21 19 22 o 1.533000  0.4547000     1.571000  0.6501000     1.494000  0.6359000     0.7691000E-01  0.9093000 
1 1 1 21 20 0  o 3.751000  0.2472000     3.751000  0.2472000     3.751000  0.2472000     -0.000000      0.000000  
1 1 1 21 20 1  o 12.27000  0.1323000     12.20000  0.1865000     12.35000  0.1877000     -0.1479000     0.2646000 
1 1 1 21 20 2  o 4.184000  0.1677000     4.232000  0.2345000     4.136000  0.2398000     0.9625000E-01  0.3354000 
1 1 1 21 20 3  o 5.582000  0.1463000     5.450000  0.2070000     5.714000  0.2067000     -0.2641000     0.2926000 
1 1 1 21 20 4  o 13.37000  0.1432000     13.18000  0.2013000     13.56000  0.2039000     -0.3775000     0.2865000 
1 1 1 21 20 5  o 17.02000  0.2115000     17.05000  0.3272000     16.98000  0.2682000     0.7303000E-01  0.4231000 
1 1 1 21 20 6  o 4.805000  0.1853000     4.838000  0.2638000     4.771000  0.2602000     0.6723000E-01  0.3705000 
1 1 1 21 20 7  f 4.499000  0.2217000     4.276000  0.3025000     4.721000  0.3241000     -0.4446000     0.4433000 
1 1 1 21 20 8  o 5.285000  0.2155000     5.464000  0.3270000     5.107000  0.2808000     0.3576000      0.4310000 
1 1 1 21 20 9  o 11.24000  0.1577000     11.44000  0.2220000     11.04000  0.2241000     0.3984000      0.3155000 
1 1 1 21 20 10 o 3.978000  0.2922000     4.236000  0.4419000     3.721000  0.3824000     0.5147000      0.5843000 
1 1 1 21 20 11 o 10.95000  0.2005000     11.01000  0.2891000     10.89000  0.2779000     0.1188000      0.4010000 
1 1 1 21 20 12 o 8.665000  0.3088000     9.522000  0.3188000     7.808000  0.5289000     1.714000       0.6175000 
1 1 1 21 20 13 o 5.162000  0.3153000     5.057000  0.4332000     5.268000  0.4582000     -0.2115000     0.6306000 
1 1 1 21 20 14 o 2.095000  0.5713000     1.842000  0.7660000     2.348000  0.8479000     -0.5064000     1.143000  
1 1 1 21 20 15 o 6.145000  0.2784000     6.236000  0.3752000     6.055000  0.4116000     0.1811000      0.5569000 
1 1 1 21 20 16 o 2.225000  0.5044000     1.703000  0.6918000     2.746000  0.7342000     -1.043000      1.009000  
1 1 1 21 20 17 o 2.634000  0.4923000     3.160000  0.6423000     2.108000  0.7461000     1.052000       0.9845000 
1 1 1 21 20 18 o 2.614000  0.4798000     2.318000  0.7050000     2.910000  0.6510000     -0.5922000     0.9596000 
1 1 1 21 20 19 o 1.643000  0.4658000     1.786000  0.6711000     1.501000  0.6461000     0.2853000      0.9315000 
1 1 1 21 20 20 o 1.846000  0.5523000     2.235000  0.9080000     1.456000  0.6291000     0.7790000      1.105000  
1 1 1 21 20 21 o 1.606000  0.4427000     1.979000  0.6754000     1.234000  0.5724000     0.7443000      0.8853000 
1 1 1 21 20 22 o 1.378000  0.4318000     1.298000  0.5857000     1.457000  0.6346000     -0.1594000     0.8636000 
1 1 1 21 21 0  o 0.8553000 0.5229000     0.8553000 0.5229000     0.8553000 0.5229000     0.000000       0.000000  
1 1 1 21 21 1  o 19.69000  0.1740000     19.79000  0.2468000     19.58000  0.2453000     0.2129000      0.3480000 
1 1 1 21 21 2  o 11.75000  0.1340000     11.68000  0.1879000     11.81000  0.1911000     -0.1284000     0.2680000 
1 1 1 21 21 3  o 3.584000  0.2011000     3.536000  0.2853000     3.633000  0.2836000     -0.9790000E-01 0.4023000 
1 1 1 21 21 4  f 15.45000  0.1672000     15.51000  0.2546000     15.38000  0.2168000     0.1305000      0.3344000 
1 1 1 21 21 5  o 13.81000  0.1772000     13.63000  0.2096000     14.00000  0.2857000     -0.3694000     0.3544000 
1 1 1 21 21 6  o 7.235000  0.1561000     7.098000  0.2210000     7.373000  0.2203000     -0.2740000     0.3121000 
1 1 1 21 21 7  o 6.272000  0.2240000     6.718000  0.3282000     5.826000  0.3050000     0.8917000      0.4480000 
1 1 1 21 21 8  o 4.021000  0.2801000     4.506000  0.2988000     3.536000  0.4740000     0.9700000      0.5603000 
1 1 1 21 21 9  o 6.079000  0.1895000     6.012000  0.2635000     6.146000  0.2722000     -0.1346000     0.3789000 
1 1 1 21 21 10 o 2.729000  0.3882000     3.041000  0.4928000     2.418000  0.6000000     0.6230000      0.7765000 
1 1 1 21 21 11 o 4.807000  0.2782000     4.717000  0.4433000     4.897000  0.3364000     -0.1799000     0.5565000 
1 1 1 21 21 12 o 4.821000  0.3470000     5.395000  0.3816000     4.248000  0.5797000     1.148000       0.6940000 
1 1 1 21 21 13 o 3.412000  0.4358000     3.210000  0.6259000     3.613000  0.6066000     -0.4032000     0.8716000 
1 1 1 21 21 14 o 3.476000  0.6283000     2.632000  1.132000      4.320000  0.5446000     -1.688000      1.257000  
1 1 1 21 21 15 o 2.382000  0.5264000     2.217000  0.7508000     2.548000  0.7380000     -0.3309000     1.053000  
1 1 1 21 21 16 o 1.303000  0.4261000     1.280000  0.5920000     1.325000  0.6131000     -0.4483000E-01 0.8522000 
1 1 1 21 21 17 o 1.986000  0.5172000     1.512000  0.6677000     2.460000  0.7901000     -0.9472000     1.034000  
1 1 1 21 21 18 o 1.617000  0.4692000     1.310000  0.5977000     1.924000  0.7235000     -0.6140000     0.9384000 
1 1 1 21 21 19 o 1.656000  0.4676000     1.870000  0.6873000     1.443000  0.6342000     0.4272000      0.9352000 
1 1 1 21 21 20 o 1.889000  0.4806000     1.743000  0.6698000     2.035000  0.6894000     -0.2926000     0.9612000 
1 1 1 21 21 21 o 1.553000  0.4393000     1.942000  0.6848000     1.165000  0.5505000     0.7766000      0.8786000 
1 1 1 21 21 22 o 1.304000  0.4273000     1.114000  0.5401000     1.495000  0.6623000     -0.3811000     0.8546000 
1 1 1 21 22 0  o 1.123000  0.5946000     1.123000  0.5946000     1.123000  0.5946000     -0.000000      0.000000  
1 1 1 21 22 1  o 3.340000  0.2134000     3.727000  0.2652000     2.953000  0.3344000     0.7736000      0.4268000 
1 1 1 21 22 2  f 8.076000  0.1338000     7.824000  0.1905000     8.327000  0.1879000     -0.5030000     0.2676000 
1 1 1 21 22 3  o 7.466000  0.1514000     7.391000  0.2323000     7.542000  0.1942000     -0.1511000     0.3028000 
1 1 1 21 22 4  o 5.571000  0.1954000     5.611000  0.2528000     5.531000  0.2979000     0.8030000E-01  0.3907000 
1 1 1 21 22 5  o 12.00000  0.1441000     12.23000  0.2042000     11.76000  0.2034000     0.4756000      0.2882000 
1 1 1 21 22 6  o 8.092000  0.2010000     8.142000  0.2302000     8.041000  0.3296000     0.1006000      0.4020000 
1 1 1 21 22 7  o 9.445000  0.1698000     9.517000  0.2639000     9.372000  0.2136000     0.1451000      0.3395000 
1 1 1 21 22 8  o 9.825000  0.1563000     9.912000  0.2194000     9.738000  0.2227000     0.1743000      0.3126000 
1 1 1 21 22 9  o 10.58000  0.1608000     10.66000  0.2271000     10.50000  0.2276000     0.1555000      0.3215000 
1 1 1 21 22 10 o 3.043000  0.3580000     2.806000  0.5300000     3.280000  0.4813000     -0.4739000     0.7160000 
1 1 1 21 22 11 o 8.987000  0.2149000     9.242000  0.3490000     8.733000  0.2510000     0.5086000      0.4299000 
1 1 1 21 22 12 o 1.756000  0.5049000     1.858000  0.7224000     1.654000  0.7055000     0.2035000      1.010000  
1 1 1 21 22 13 o 2.162000  0.4790000     2.879000  0.6996000     1.446000  0.6546000     1.432000       0.9581000 
1 1 1 21 22 14 o 1.837000  0.4993000     1.278000  0.6293000     2.396000  0.7754000     -1.118000      0.9986000 
1 1 1 21 22 15 o 1.936000  0.4960000     2.233000  0.7151000     1.639000  0.6876000     0.5936000      0.9920000 
1 1 1 21 22 16 o 3.779000  0.3899000     3.955000  0.4983000     3.602000  0.5999000     0.3533000      0.7799000 
1 1 1 21 22 17 o 1.575000  0.5317000     1.294000  0.6063000     1.857000  0.8736000     -0.5624000     1.063000  
1 1 1 21 22 18 o 2.034000  0.5101000     1.918000  0.7148000     2.151000  0.7278000     -0.2331000     1.020000  
1 1 1 21 22 19 f 1.677000  0.4909000     1.619000  0.6698000     1.735000  0.7179000     -0.1153000     0.9818000 
1 1 1 21 22 20 o 1.416000  0.4343000     1.241000  0.5733000     1.591000  0.6526000     -0.3497000     0.8687000 
1 1 1 21 22 21 o 1.657000  0.4674000     1.373000  0.6139000     1.942000  0.7050000     -0.5690000     0.9349000 
1 1 1 21 22 22 o 1.730000  0.5566000     1.565000  0.6717000     1.894000  0.8878000     -0.3284000     1.113000  
1 1 1 21 23 0  o 7.122000  0.1960000     7.122000  0.1960000     7.122000  0.1960000     0.000000       0.000000  
1 1 1 21 23 1  o 5.782000  0.1504000     6.068000  0.2054000     5.496000  0.2197000     0.5725000      0.3008000 
1 1 1 21 23 2  o 16.05000  0.1704000     16.15000  0.2592000     15.95000  0.2213000     0.1988000      0.3408000 
1 1 1 21 23 3  o 15.49000  0.2013000     15.41000  0.3117000     15.58000  0.2550000     -0.1692000     0.4027000 
1 1 1 21 23 4  o 17.83000  0.1821000     17.62000  0.2368000     18.03000  0.2767000     -0.4157000     0.3642000 
1 1 1 21 23 5  o 7.203000  0.2068000     7.301000  0.2293000     7.106000  0.3442000     0.1951000      0.4136000 
1 1 1 21 23 6  o 3.974000  0.2616000     3.658000  0.4334000     4.290000  0.2929000     -0.6315000     0.5231000 
1 1 1 21 23 7  o 6.518000  0.1713000     6.183000  0.2457000     6.853000  0.2388000     -0.6700000     0.3426000 
1 1 1 21 23 8  o 6.609000  0.1787000     6.663000  0.2480000     6.555000  0.2574000     0.1077000      0.3575000 
1 1 1 21 23 9  o 7.957000  0.1740000     8.124000  0.2434000     7.789000  0.2488000     0.3351000      0.3480000 
1 1 1 21 23 10 o 12.24000  0.1673000     12.26000  0.2348000     12.21000  0.2383000     0.4696000E-01  0.3345000 
1 1 1 21 23 11 o 5.577000  0.3204000     6.429000  0.4096000     4.724000  0.4928000     1.705000       0.6408000 
1 1 1 21 23 12 o 10.76000  0.1963000     10.71000  0.3104000     10.80000  0.2403000     -0.9269000E-01 0.3926000 
1 1 1 21 23 13 o 5.892000  0.2986000     5.506000  0.4061000     6.277000  0.4378000     -0.7713000     0.5972000 
1 1 1 21 23 14 o 7.575000  0.2400000     7.384000  0.3289000     7.766000  0.3497000     -0.3813000     0.4801000 
1 1 1 21 23 15 o 1.622000  0.4762000     1.413000  0.6267000     1.832000  0.7173000     -0.4187000     0.9525000 
1 1 1 21 23 16 o 1.927000  0.5138000     1.923000  0.7252000     1.932000  0.7280000     -0.8537000E-02 1.028000  
1 1 1 21 23 17 o 3.158000  0.5696000     3.064000  0.7111000     3.253000  0.8900000     -0.1892000     1.139000  
1 1 1 21 23 18 o 1.223000  0.4032000     1.309000  0.5958000     1.137000  0.5434000     0.1721000      0.8063000 
1 1 1 21 23 19 o 1.346000  0.4357000     1.115000  0.5460000     1.577000  0.6791000     -0.4622000     0.8713000 
1 1 1 21 23 20 o 1.471000  0.4432000     1.721000  0.6814000     1.220000  0.5668000     0.5006000      0.8863000 
1 1 1 21 23 21 o 1.172000  0.3910000     1.294000  0.5931000     1.050000  0.5098000     0.2436000      0.7821000 
1 1 1 21 24 0  o 3.316000  0.3994000     3.316000  0.3994000     3.316000  0.3994000     0.000000       0.000000  
1 1 1 21 24 1  o 9.743000  0.1615000     9.698000  0.2290000     9.788000  0.2277000     -0.9007000E-01 0.3230000 
1 1 1 21 24 2  o 14.04000  0.1927000     14.06000  0.2422000     14.03000  0.2998000     0.3785000E-01  0.3855000 
1 1 1 21 24 3  o 8.435000  0.1709000     8.566000  0.1994000     8.304000  0.2777000     0.2626000      0.3418000 
1 1 1 21 24 4  o 3.086000  0.3723000     3.216000  0.3931000     2.956000  0.6324000     0.2594000      0.7446000 
1 1 1 21 24 5  o 9.443000  0.1651000     9.426000  0.2513000     9.459000  0.2143000     -0.3340000E-01 0.3303000 
1 1 1 21 24 6  o 2.770000  0.3270000     3.048000  0.4096000     2.492000  0.5099000     0.5565000      0.6540000 
1 1 1 21 24 7  o 3.513000  0.2716000     3.444000  0.3897000     3.583000  0.3784000     -0.1386000     0.5432000 
1 1 1 21 24 8  o 8.129000  0.1678000     8.543000  0.2304000     7.715000  0.2441000     0.8285000      0.3357000 
1 1 1 21 24 9  o 2.798000  0.3700000     2.914000  0.4873000     2.682000  0.5569000     0.2311000      0.7400000 
1 1 1 21 24 10 o 1.529000  0.4315000     1.675000  0.6258000     1.382000  0.5943000     0.2935000      0.8630000 
1 1 1 21 24 11 o 6.131000  0.2279000     6.201000  0.2992000     6.062000  0.3440000     0.1388000      0.4559000 
1 1 1 21 24 12 o 4.786000  0.2913000     4.737000  0.4562000     4.836000  0.3625000     -0.9956000E-01 0.5827000 
1 1 1 21 24 13 o 2.287000  0.6588000     2.492000  1.073000      2.082000  0.7644000     0.4102000      1.318000  
1 1 1 21 24 14 o 3.291000  0.4504000     3.393000  0.5910000     3.190000  0.6798000     0.2029000      0.9008000 
1 1 1 21 24 15 o 1.676000  0.4662000     1.294000  0.5949000     2.058000  0.7178000     -0.7637000     0.9323000 
1 1 1 21 24 16 o 2.638000  0.4974000     2.438000  0.7273000     2.838000  0.6788000     -0.4001000     0.9949000 
1 1 1 21 24 17 o 1.661000  0.4936000     1.557000  0.6787000     1.764000  0.7169000     -0.2073000     0.9872000 
1 1 1 21 24 18 o 1.490000  0.4466000     1.175000  0.5540000     1.805000  0.7006000     -0.6305000     0.8932000 
1 1 1 21 24 19 o 1.781000  0.5468000     1.757000  0.8428000     1.805000  0.6968000     -0.4829000E-01 1.094000  
1 1 1 21 24 20 o 1.842000  0.4784000     1.492000  0.6414000     2.192000  0.7099000     -0.7006000     0.9568000 
1 1 1 21 24 21 o 1.046000  0.3595000     0.9263000 0.4596000     1.165000  0.5530000     -0.2385000     0.7191000 
1 1 1 21 25 0  o 15.99000  0.3141000     15.99000  0.3141000     15.99000  0.3141000     0.000000       0.000000  
1 1 1 21 25 1  o 4.918000  0.3411000     4.918000  0.3411000     ?         ?             ?              ?         
1 1 1 21 25 2  f 4.179000  0.2622000     4.422000  0.2967000     3.937000  0.4324000     0.4850000      0.5244000 
1 1 1 21 25 3  o 7.209000  0.1958000     7.262000  0.2947000     7.156000  0.2579000     0.1057000      0.3916000 
1 1 1 21 25 4  o 5.124000  0.2018000     5.234000  0.3036000     5.014000  0.2661000     0.2206000      0.4037000 
1 1 1 21 25 5  o 2.631000  0.3287000     2.717000  0.4462000     2.546000  0.4829000     0.1713000      0.6575000 
1 1 1 21 25 6  o 5.284000  0.1914000     5.131000  0.2736000     5.437000  0.2679000     -0.3059000     0.3829000 
1 1 1 21 25 7  o 7.709000  0.1653000     7.896000  0.2304000     7.522000  0.2370000     0.3732000      0.3305000 
1 1 1 21 25 8  o 7.149000  0.1794000     7.590000  0.2457000     6.709000  0.2616000     0.8804000      0.3589000 
1 1 1 21 25 9  o 9.678000  0.1679000     9.958000  0.2354000     9.399000  0.2393000     0.5590000      0.3357000 
1 1 1 21 25 10 o 10.93000  0.2116000     11.20000  0.3421000     10.66000  0.2490000     0.5356000      0.4231000 
1 1 1 21 25 11 o 4.950000  0.2490000     4.799000  0.3550000     5.101000  0.3494000     -0.3021000     0.4981000 
1 1 1 21 25 12 o 6.230000  0.2356000     6.092000  0.3179000     6.367000  0.3479000     -0.2755000     0.4713000 
1 1 1 21 25 13 o 2.619000  0.5491000     2.241000  0.9365000     2.997000  0.5737000     -0.7557000     1.098000  
1 1 1 21 25 14 f 1.938000  0.5068000     2.265000  0.7414000     1.610000  0.6911000     0.6550000      1.014000  
1 1 1 21 25 15 o 1.720000  0.4881000     1.452000  0.6459000     1.988000  0.7319000     -0.5356000     0.9762000 
1 1 1 21 25 16 o 2.922000  0.5424000     2.975000  0.7718000     2.870000  0.7622000     0.1048000      1.085000  
1 1 1 21 25 17 o 3.275000  0.4411000     3.464000  0.6215000     3.086000  0.6261000     0.3776000      0.8822000 
1 1 1 21 25 18 o 2.778000  0.4661000     2.677000  0.6445000     2.878000  0.6734000     -0.2005000     0.9321000 
1 1 1 21 25 19 o 1.472000  0.4671000     1.467000  0.6778000     1.477000  0.6430000     -0.9809000E-02 0.9342000 
1 1 1 21 25 20 o 1.159000  0.3880000     1.147000  0.5428000     1.171000  0.5546000     -0.2332000E-01 0.7760000 
1 1 1 21 25 21 o 3.059000  0.4562000     2.506000  0.7149000     3.611000  0.5668000     -1.105000      0.9123000 
1 1 1 21 26 0  o 5.350000  0.2792000     5.350000  0.2792000     5.350000  0.2792000     0.000000       0.000000  
1 1 1 21 26 1  o 15.98000  0.1733000     15.72000  0.2609000     16.24000  0.2283000     -0.5146000     0.3467000 
1 1 1 21 26 2  o 3.856000  0.2375000     3.723000  0.3674000     3.989000  0.3009000     -0.2660000     0.4749000 
1 1 1 21 26 3  o 4.287000  0.2074000     4.399000  0.2838000     4.174000  0.3025000     0.2255000      0.4148000 
1 1 1 21 26 4  o 8.953000  0.1488000     9.041000  0.2094000     8.865000  0.2115000     0.1761000      0.2976000 
1 1 1 21 26 5  o 10.98000  0.1509000     11.07000  0.2128000     10.89000  0.2139000     0.1807000      0.3017000 
1 1 1 21 26 6  o 3.509000  0.2749000     3.731000  0.3680000     3.287000  0.4085000     0.4448000      0.5498000 
1 1 1 21 26 7  o 6.503000  0.1815000     6.797000  0.2496000     6.209000  0.2636000     0.5878000      0.3630000 
1 1 1 21 26 8  o 6.191000  0.1982000     6.308000  0.2768000     6.074000  0.2838000     0.2338000      0.3965000 
1 1 1 21 26 9  o 4.435000  0.2641000     4.838000  0.3438000     4.033000  0.4010000     0.8058000      0.5282000 
1 1 1 21 26 10 o 3.245000  0.4241000     3.505000  0.4894000     2.985000  0.6927000     0.5198000      0.8482000 
1 1 1 21 26 11 o 7.084000  0.2027000     7.026000  0.2856000     7.143000  0.2876000     -0.1167000     0.4053000 
1 1 1 21 26 12 f 4.452000  0.3914000     4.395000  0.4413000     4.510000  0.6466000     -0.1152000     0.7828000 
1 1 1 21 26 13 o 2.214000  0.5046000     2.389000  0.7403000     2.039000  0.6859000     0.3498000      1.009000  
1 1 1 21 26 14 o 1.952000  0.5120000     2.059000  0.7158000     1.845000  0.7323000     0.2133000      1.024000  
1 1 1 21 26 15 o 2.800000  0.4452000     1.883000  0.7009000     3.717000  0.5493000     -1.834000      0.8905000 
1 1 1 21 26 16 o 3.121000  0.5651000     3.392000  0.6288000     2.850000  0.9391000     0.5415000      1.130000  
1 1 1 21 26 17 o 2.623000  0.5099000     2.731000  0.7178000     2.514000  0.7244000     0.2168000      1.020000  
1 1 1 21 26 18 o 1.594000  0.4721000     1.680000  0.6626000     1.508000  0.6727000     0.1714000      0.9442000 
1 1 1 21 26 19 o 1.579000  0.4535000     1.858000  0.6905000     1.301000  0.5882000     0.5569000      0.9071000 
1 1 1 21 26 20 o 1.661000  0.4779000     1.621000  0.6631000     1.700000  0.6884000     -0.7914000E-01 0.9558000 
1 1 1 21 26 21 o 1.149000  0.3868000     1.046000  0.5112000     1.252000  0.5805000     -0.2067000     0.7735000 
1 1 1 21 27 0  o 0.7961000 0.5270000     0.7961000 0.5270000     0.7961000 0.5270000     -0.000000      0.000000  
1 1 1 21 27 1  o 2.439000  0.3327000     2.515000  0.4563000     2.363000  0.4842000     0.1523000      0.6653000 
1 1 1 21 27 2  o 10.82000  0.1462000     10.74000  0.2057000     10.90000  0.2078000     -0.1618000     0.2924000 
1 1 1 21 27 3  o 5.492000  0.1792000     5.517000  0.2497000     5.467000  0.2572000     0.4972000E-01  0.3585000 
1 1 1 21 27 4  f 19.00000  0.1807000     18.97000  0.2545000     19.03000  0.2566000     -0.6243000E-01 0.3614000 
1 1 1 21 27 5  o 8.090000  0.1608000     8.261000  0.2261000     7.919000  0.2287000     0.3422000      0.3216000 
1 1 1 21 27 6  o 8.809000  0.1596000     8.647000  0.2233000     8.970000  0.2281000     -0.3228000     0.3193000 
1 1 1 21 27 7  o 2.557000  0.3849000     2.842000  0.4912000     2.271000  0.5926000     0.5716000      0.7697000 
1 1 1 21 27 8  o 10.66000  0.1748000     10.76000  0.2609000     10.56000  0.2327000     0.2033000      0.3496000 
1 1 1 21 27 9  o 2.281000  0.4620000     2.079000  0.7090000     2.483000  0.5924000     -0.4045000     0.9239000 
1 1 1 21 27 10 o 4.598000  0.2675000     4.324000  0.3749000     4.872000  0.3817000     -0.5475000     0.5351000 
1 1 1 21 27 11 o 4.720000  0.2700000     4.624000  0.3780000     4.817000  0.3856000     -0.1930000     0.5400000 
1 1 1 21 27 12 o 3.588000  0.4647000     3.968000  0.6062000     3.208000  0.7044000     0.7596000      0.9294000 
1 1 1 21 27 13 o 3.632000  0.3560000     3.838000  0.4495000     3.425000  0.5521000     0.4127000      0.7120000 
1 1 1 21 27 14 o 3.561000  0.4518000     3.287000  0.7015000     3.834000  0.5694000     -0.5465000     0.9035000 
1 1 1 21 27 15 o 2.558000  0.4879000     2.798000  0.6615000     2.318000  0.7175000     0.4796000      0.9759000 
1 1 1 21 27 16 o 1.526000  0.4803000     1.632000  0.6815000     1.420000  0.6770000     0.2113000      0.9606000 
1 1 1 21 27 17 o 2.148000  0.5036000     1.791000  0.7162000     2.506000  0.7080000     -0.7147000     1.007000  
1 1 1 21 27 18 o 1.734000  0.4969000     1.508000  0.6674000     1.960000  0.7363000     -0.4522000     0.9937000 
1 1 1 21 27 19 o 1.560000  0.4651000     1.550000  0.6593000     1.570000  0.6562000     -0.1961000E-01 0.9302000 
1 1 1 21 27 20 o 1.563000  0.4608000     1.536000  0.6423000     1.590000  0.6608000     -0.5376000E-01 0.9215000 
1 1 1 21 27 21 o 1.605000  0.4877000     1.528000  0.6675000     1.682000  0.7113000     -0.1535000     0.9754000 
1 1 1 21 28 0  o 9.069000  0.2108000     9.069000  0.2108000     9.069000  0.2108000     0.000000       0.000000  
1 1 1 21 28 1  o 4.782000  0.1959000     4.943000  0.2683000     4.620000  0.2856000     0.3227000      0.3918000 
1 1 1 21 28 2  o 7.504000  0.1567000     7.300000  0.2226000     7.707000  0.2207000     -0.4075000     0.3135000 
1 1 1 21 28 3  o 4.319000  0.2182000     4.444000  0.2967000     4.195000  0.3201000     0.2496000      0.4364000 
1 1 1 21 28 4  o 17.64000  0.1744000     17.78000  0.2475000     17.49000  0.2459000     0.2905000      0.3489000 
1 1 1 21 28 5  o 10.45000  0.1556000     10.42000  0.2206000     10.48000  0.2195000     -0.5672000E-01 0.3112000 
1 1 1 21 28 6  o 5.611000  0.1985000     5.415000  0.2839000     5.807000  0.2775000     -0.3923000     0.3970000 
1 1 1 21 28 7  o 6.736000  0.1842000     6.655000  0.2625000     6.817000  0.2584000     -0.1613000     0.3683000 
1 1 1 21 28 8  o 4.226000  0.2660000     4.338000  0.3642000     4.114000  0.3878000     0.2245000      0.5320000 
1 1 1 21 28 9  o 5.567000  0.2896000     5.635000  0.4327000     5.500000  0.3850000     0.1353000      0.5792000 
1 1 1 21 28 10 o 6.623000  0.2082000     6.487000  0.2920000     6.759000  0.2969000     -0.2726000     0.4164000 
1 1 1 21 28 11 o 2.563000  0.5189000     1.841000  0.6721000     3.284000  0.7907000     -1.443000      1.038000  
1 1 1 21 28 12 o 4.455000  0.3309000     4.574000  0.4989000     4.337000  0.4348000     0.2361000      0.6618000 
1 1 1 21 28 13 o 3.064000  0.4075000     3.502000  0.4716000     2.625000  0.6648000     0.8773000      0.8150000 
1 1 1 21 28 14 o 1.633000  0.4623000     2.118000  0.7400000     1.148000  0.5542000     0.9700000      0.9245000 
1 1 1 21 28 15 o 1.852000  0.4906000     1.670000  0.6624000     2.033000  0.7238000     -0.3632000     0.9811000 
1 1 1 21 28 16 o 1.718000  0.4953000     1.604000  0.6733000     1.833000  0.7266000     -0.2285000     0.9906000 
1 1 1 21 28 17 o 1.706000  0.4635000     2.104000  0.7138000     1.308000  0.5916000     0.7962000      0.9271000 
1 1 1 21 28 18 o 1.616000  0.5248000     1.827000  0.8528000     1.406000  0.6119000     0.4203000      1.050000  
1 1 1 21 28 19 o 1.307000  0.4225000     1.478000  0.6468000     1.136000  0.5438000     0.3421000      0.8450000 
1 1 1 21 28 20 o 1.368000  0.4354000     1.248000  0.5830000     1.487000  0.6468000     -0.2397000     0.8707000 
1 1 1 21 29 0  o 4.727000  0.2840000     4.727000  0.2840000     4.727000  0.2840000     0.000000       0.000000  
1 1 1 21 29 1  o 4.355000  0.2156000     4.586000  0.2921000     4.123000  0.3172000     0.4629000      0.4312000 
1 1 1 21 29 2  f 2.661000  0.3272000     2.660000  0.4552000     2.662000  0.4701000     -0.1798000E-02 0.6544000 
1 1 1 21 29 3  o 12.35000  0.1536000     12.30000  0.2168000     12.40000  0.2177000     -0.9036000E-01 0.3073000 
1 1 1 21 29 4  o 6.404000  0.1765000     6.558000  0.2461000     6.250000  0.2530000     0.3081000      0.3529000 
1 1 1 21 29 5  o 11.19000  0.1576000     11.18000  0.2222000     11.20000  0.2235000     -0.1713000E-01 0.3151000 
1 1 1 21 29 6  o 8.530000  0.1665000     8.680000  0.2300000     8.379000  0.2407000     0.3009000      0.3329000 
1 1 1 21 29 7  o 15.49000  0.1737000     15.34000  0.2437000     15.64000  0.2475000     -0.3078000     0.3474000 
1 1 1 21 29 8  o 3.254000  0.3767000     3.470000  0.5430000     3.038000  0.5221000     0.4324000      0.7533000 
1 1 1 21 29 9  o 2.511000  0.4503000     2.511000  0.6359000     2.510000  0.6378000     0.7119000E-03  0.9007000 
1 1 1 21 29 10 o 1.936000  0.4565000     2.310000  0.6470000     1.561000  0.6442000     0.7483000      0.9130000 
1 1 1 21 29 11 o 7.162000  0.2800000     6.926000  0.4328000     7.399000  0.3552000     -0.4726000     0.5599000 
1 1 1 21 29 12 o 2.853000  0.4371000     3.210000  0.5496000     2.496000  0.6797000     0.7147000      0.8741000 
1 1 1 21 29 13 o 1.682000  0.4690000     1.538000  0.6293000     1.827000  0.6955000     -0.2886000     0.9380000 
1 1 1 21 29 14 o 2.641000  0.4803000     2.537000  0.6452000     2.744000  0.7118000     -0.2079000     0.9607000 
1 1 1 21 29 15 o 2.093000  0.4741000     1.483000  0.6764000     2.703000  0.6644000     -1.220000      0.9482000 
1 1 1 21 29 16 o 2.065000  0.5084000     2.252000  0.7296000     1.877000  0.7082000     0.3744000      1.017000  
1 1 1 21 29 17 o 1.405000  0.4376000     1.601000  0.6616000     1.210000  0.5727000     0.3906000      0.8751000 
1 1 1 21 29 18 o 1.750000  0.4793000     1.384000  0.6449000     2.116000  0.7092000     -0.7322000     0.9586000 
1 1 1 21 29 19 o 1.358000  0.4296000     1.600000  0.6701000     1.116000  0.5376000     0.4839000      0.8591000 
1 1 1 21 29 20 o 1.520000  0.4539000     1.755000  0.6853000     1.286000  0.5954000     0.4687000      0.9078000 
1 1 1 21 30 0  o 9.290000  0.2154000     9.290000  0.2154000     9.290000  0.2154000     -0.000000      0.000000  
1 1 1 21 30 1  o 6.486000  0.1730000     6.771000  0.2344000     6.201000  0.2544000     0.5698000      0.3460000 
1 1 1 21 30 2  o 6.421000  0.1720000     6.398000  0.2432000     6.444000  0.2433000     -0.4679000E-01 0.3440000 
1 1 1 21 30 3  o 10.91000  0.1540000     11.16000  0.2167000     10.67000  0.2190000     0.4831000      0.3081000 
1 1 1 21 30 4  o 1.676000  0.4115000     1.473000  0.5722000     1.878000  0.5917000     -0.4046000     0.8231000 
1 1 1 21 30 5  o 11.21000  0.1590000     11.08000  0.2259000     11.33000  0.2238000     -0.2463000     0.3179000 
1 1 1 21 30 6  o 5.672000  0.2016000     6.001000  0.2700000     5.344000  0.2994000     0.6570000      0.4031000 
1 1 1 21 30 7  o 3.140000  0.3552000     3.630000  0.4161000     2.650000  0.5758000     0.9801000      0.7104000 
1 1 1 21 30 8  o 7.169000  0.2216000     7.009000  0.3096000     7.329000  0.3172000     -0.3200000     0.4432000 
1 1 1 21 30 9  o 5.459000  0.2391000     5.458000  0.3372000     5.460000  0.3390000     -0.1250000E-02 0.4782000 
1 1 1 21 30 10 o 4.247000  0.4111000     4.313000  0.4371000     4.182000  0.6963000     0.1312000      0.8221000 
1 1 1 21 30 11 o 2.418000  0.4983000     2.819000  0.7163000     2.018000  0.6930000     0.8008000      0.9967000 
1 1 1 21 30 12 o 2.530000  0.4632000     2.185000  0.6737000     2.875000  0.6359000     -0.6899000     0.9264000 
1 1 1 21 30 13 o 5.088000  0.2729000     5.620000  0.3373000     4.556000  0.4291000     1.064000       0.5458000 
1 1 1 21 30 14 o 1.976000  0.5084000     1.805000  0.6626000     2.146000  0.7713000     -0.3412000     1.017000  
1 1 1 21 30 15 o 2.056000  0.6363000     2.648000  1.094000      1.465000  0.6502000     1.183000       1.273000  
1 1 1 21 30 16 o 1.706000  0.4696000     2.152000  0.7369000     1.259000  0.5824000     0.8934000      0.9393000 
1 1 1 21 30 17 o 2.140000  0.5288000     1.850000  0.7477000     2.429000  0.7480000     -0.5788000     1.058000  
1 1 1 21 30 18 o 1.406000  0.4364000     1.390000  0.6101000     1.421000  0.6242000     -0.3145000E-01 0.8728000 
1 1 1 21 30 19 o 2.059000  0.4843000     1.658000  0.6703000     2.459000  0.6991000     -0.8015000     0.9685000 
1 1 1 21 30 20 o 1.506000  0.4551000     1.667000  0.6758000     1.346000  0.6097000     0.3207000      0.9101000 
1 1 1 21 31 0  o 10.61000  0.2157000     10.61000  0.2157000     10.61000  0.2157000     -0.000000      0.000000  
1 1 1 21 31 1  o 11.07000  0.1532000     11.10000  0.2165000     11.04000  0.2167000     0.5818000E-01  0.3063000 
1 1 1 21 31 2  o 11.63000  0.1553000     11.61000  0.2187000     11.65000  0.2205000     -0.3809000E-01 0.3106000 
1 1 1 21 31 3  o 2.379000  0.3837000     1.954000  0.5957000     2.803000  0.4839000     -0.8494000     0.7675000 
1 1 1 21 31 4  o 3.585000  0.2797000     3.745000  0.3795000     3.426000  0.4110000     0.3189000      0.5594000 
1 1 1 21 31 5  o 9.597000  0.1642000     9.542000  0.2332000     9.652000  0.2312000     -0.1097000     0.3284000 
1 1 1 21 31 6  o 11.70000  0.1648000     11.54000  0.2321000     11.86000  0.2341000     -0.3159000     0.3297000 
1 1 1 21 31 7  o 13.42000  0.2103000     13.44000  0.3422000     13.40000  0.2446000     0.3947000E-01  0.4206000 
1 1 1 21 31 8  o 9.211000  0.1849000     9.504000  0.2483000     8.918000  0.2741000     0.5860000      0.3698000 
1 1 1 21 31 9  o 1.578000  0.4563000     1.639000  0.6356000     1.516000  0.6550000     0.1225000      0.9127000 
1 1 1 21 31 10 o 5.384000  0.3246000     5.200000  0.4973000     5.568000  0.4173000     -0.3684000     0.6492000 
1 1 1 21 31 11 o 6.855000  0.2139000     6.690000  0.3068000     7.021000  0.2982000     -0.3312000     0.4278000 
1 1 1 21 31 12 o 2.635000  0.4573000     2.604000  0.6322000     2.666000  0.6609000     -0.6157000E-01 0.9146000 
1 1 1 21 31 13 o 3.536000  0.3678000     3.699000  0.4657000     3.373000  0.5695000     0.3261000      0.7356000 
1 1 1 21 31 14 o 3.774000  0.3993000     4.022000  0.4437000     3.526000  0.6641000     0.4961000      0.7987000 
1 1 1 21 31 15 o 2.519000  0.4773000     2.163000  0.7522000     2.876000  0.5877000     -0.7128000     0.9546000 
1 1 1 21 31 16 o 2.049000  0.4953000     1.943000  0.7716000     2.155000  0.6212000     -0.2125000     0.9905000 
1 1 1 21 31 17 o 1.637000  0.5402000     2.079000  0.9241000     1.196000  0.5595000     0.8826000      1.080000  
1 1 1 21 31 18 o 1.228000  0.3944000     0.8397000 0.4235000     1.616000  0.6654000     -0.7760000     0.7887000 
1 1 1 21 31 19 o 1.250000  0.4052000     1.436000  0.6240000     1.065000  0.5172000     0.3711000      0.8105000 
1 1 1 21 31 20 o 1.614000  0.4899000     1.512000  0.6754000     1.715000  0.7097000     -0.2026000     0.9798000 
1 1 1 21 32 0  o 14.36000  0.2293000     14.36000  0.2293000     14.36000  0.2293000     -0.000000      0.000000  
1 1 1 21 32 1  o 1.692000  0.4214000     1.554000  0.5889000     1.830000  0.6029000     -0.2764000     0.8428000 
1 1 1 21 32 2  o 10.81000  0.1568000     10.79000  0.2211000     10.83000  0.2225000     -0.4495000E-01 0.3136000 
1 1 1 21 32 3  o 10.44000  0.1594000     10.54000  0.2245000     10.33000  0.2263000     0.2145000      0.3188000 
1 1 1 21 32 4  o 1.335000  0.3982000     1.194000  0.5347000     1.477000  0.5903000     -0.2838000     0.7965000 
1 1 1 21 32 5  o 5.392000  0.2121000     5.348000  0.3035000     5.436000  0.2963000     -0.8879000E-01 0.4241000 
1 1 1 21 32 6  o 13.59000  0.1856000     13.73000  0.2833000     13.44000  0.2397000     0.2950000      0.3711000 
1 1 1 21 32 7  o 6.876000  0.2368000     7.007000  0.3016000     6.745000  0.3651000     0.2626000      0.4736000 
1 1 1 21 32 8  o 1.823000  0.4509000     2.173000  0.6560000     1.474000  0.6187000     0.6995000      0.9017000 
1 1 1 21 32 9  o 1.698000  0.4898000     1.628000  0.6650000     1.768000  0.7192000     -0.1394000     0.9795000 
1 1 1 21 32 10 o 1.837000  0.4394000     1.287000  0.5798000     2.388000  0.6604000     -1.101000      0.8788000 
1 1 1 21 32 11 o 4.036000  0.3175000     4.367000  0.3985000     3.704000  0.4945000     0.6632000      0.6351000 
1 1 1 21 32 12 o 2.945000  0.4209000     3.298000  0.5321000     2.592000  0.6523000     0.7055000      0.8418000 
1 1 1 21 32 13 o 2.959000  0.4871000     3.000000  0.5875000     2.918000  0.7771000     0.8232000E-01  0.9741000 
1 1 1 21 32 14 o 2.743000  0.5536000     2.247000  0.8091000     3.238000  0.7557000     -0.9909000     1.107000  
1 1 1 21 32 15 o 2.719000  0.4308000     2.477000  0.6404000     2.960000  0.5764000     -0.4833000     0.8616000 
1 1 1 21 32 16 o 1.564000  0.4692000     1.552000  0.7010000     1.576000  0.6237000     -0.2339000E-01 0.9384000 
1 1 1 21 32 17 o 1.654000  0.4880000     1.618000  0.6976000     1.690000  0.6824000     -0.7216000E-01 0.9759000 
1 1 1 21 32 18 o 2.696000  0.4796000     2.612000  0.6716000     2.780000  0.6848000     -0.1676000     0.9592000 
1 1 1 21 32 19 o 1.492000  0.4505000     1.701000  0.6788000     1.284000  0.5924000     0.4170000      0.9009000 
1 1 1 21 33 0  o 4.038000  0.3638000     4.038000  0.3638000     4.038000  0.3638000     -0.000000      0.000000  
1 1 1 21 33 1  f 11.06000  0.1591000     10.90000  0.2256000     11.23000  0.2244000     -0.3228000     0.3182000 
1 1 1 21 33 2  o 6.900000  0.1789000     6.718000  0.2561000     7.082000  0.2499000     -0.3640000     0.3578000 
1 1 1 21 33 3  o 3.427000  0.2991000     3.670000  0.3924000     3.184000  0.4514000     0.4852000      0.5982000 
1 1 1 21 33 4  o 6.041000  0.1973000     6.301000  0.2760000     5.782000  0.2819000     0.5193000      0.3946000 
1 1 1 21 33 5  o 2.000000  0.4655000     2.155000  0.6839000     1.845000  0.6318000     0.3099000      0.9310000 
1 1 1 21 33 6  o 8.537000  0.2067000     8.363000  0.2879000     8.712000  0.2968000     -0.3483000     0.4135000 
1 1 1 21 33 7  o 8.320000  0.2032000     8.119000  0.3126000     8.521000  0.2597000     -0.4021000     0.4064000 
1 1 1 21 33 8  o 2.804000  0.5261000     2.815000  0.6296000     2.793000  0.8430000     0.2178000E-01  1.052000  
1 1 1 21 33 9  o 7.140000  0.2280000     7.165000  0.3511000     7.116000  0.2909000     0.4887000E-01  0.4559000 
1 1 1 21 33 10 o 3.921000  0.3205000     4.166000  0.4095000     3.677000  0.4932000     0.4890000      0.6410000 
1 1 1 21 33 11 o 2.918000  0.4193000     3.244000  0.5301000     2.593000  0.6499000     0.6517000      0.8387000 
1 1 1 21 33 12 o 2.740000  0.4422000     3.064000  0.5768000     2.416000  0.6705000     0.6476000      0.8844000 
1 1 1 21 33 13 o 1.399000  0.4484000     1.356000  0.6058000     1.442000  0.6613000     -0.8589000E-01 0.8968000 
1 1 1 21 33 14 o 3.508000  0.5447000     4.548000  0.4427000     2.468000  0.9955000     2.080000       1.089000  
1 1 1 21 33 15 o 3.015000  0.4058000     3.644000  0.4863000     2.385000  0.6498000     1.259000       0.8116000 
1 1 1 21 33 16 o 1.635000  0.4910000     1.517000  0.6807000     1.752000  0.7078000     -0.2353000     0.9820000 
1 1 1 21 33 17 o 1.907000  0.4820000     1.520000  0.6652000     2.295000  0.6975000     -0.7743000     0.9639000 
1 1 1 21 33 18 o 1.283000  0.4135000     1.364000  0.6032000     1.202000  0.5657000     0.1614000      0.8269000 
1 1 1 21 33 19 o 1.141000  0.3833000     1.039000  0.5040000     1.242000  0.5775000     -0.2033000     0.7665000 
1 1 1 21 34 0  o 1.940000  0.7354000     1.940000  0.7354000     1.940000  0.7354000     -0.000000      0.000000  
1 1 1 21 34 1  o 2.588000  0.3825000     2.100000  0.6073000     3.076000  0.4652000     -0.9760000     0.7650000 
1 1 1 21 34 2  o 1.869000  0.3897000     1.227000  0.5440000     2.511000  0.5583000     -1.285000      0.7795000 
1 1 1 21 34 3  o 1.678000  0.4351000     1.747000  0.6178000     1.608000  0.6127000     0.1389000      0.8701000 
1 1 1 21 34 4  o 1.502000  0.4381000     1.452000  0.6293000     1.552000  0.6095000     -0.9997000E-01 0.8761000 
1 1 1 21 34 5  o 5.387000  0.2901000     5.821000  0.4295000     4.953000  0.3902000     0.8686000      0.5803000 
1 1 1 21 34 6  o 16.09000  0.1926000     16.13000  0.2554000     16.04000  0.2885000     0.9473000E-01  0.3853000 
1 1 1 21 34 7  o 7.640000  0.2594000     8.014000  0.2873000     7.266000  0.4320000     0.7475000      0.5188000 
1 1 1 21 34 8  o 3.881000  0.3659000     3.394000  0.6101000     4.368000  0.4040000     -0.9739000     0.7317000 
1 1 1 21 34 9  o 2.086000  0.4630000     2.476000  0.6384000     1.696000  0.6706000     0.7801000      0.9259000 
1 1 1 21 34 10 f 2.005000  0.4697000     2.255000  0.6605000     1.755000  0.6679000     0.4995000      0.9393000 
1 1 1 21 34 11 o 4.814000  0.2699000     4.977000  0.3616000     4.650000  0.4006000     0.3273000      0.5397000 
1 1 1 21 34 12 o 3.255000  0.3898000     3.305000  0.5424000     3.205000  0.5601000     0.1006000      0.7797000 
1 1 1 21 34 13 o 5.705000  0.3125000     5.730000  0.4224000     5.680000  0.4606000     0.5077000E-01  0.6249000 
1 1 1 21 34 14 o 3.394000  0.4752000     3.887000  0.4380000     2.901000  0.8435000     0.9864000      0.9504000 
1 1 1 21 34 15 o 1.915000  0.4438000     2.386000  0.6434000     1.443000  0.6115000     0.9428000      0.8876000 
1 1 1 21 34 16 o 1.624000  0.4680000     1.850000  0.7154000     1.398000  0.6036000     0.4523000      0.9360000 
1 1 1 21 34 17 o 1.296000  0.3933000     1.028000  0.5068000     1.564000  0.6017000     -0.5352000     0.7866000 
1 1 1 21 34 18 o 1.867000  0.4922000     1.931000  0.6992000     1.803000  0.6928000     0.1274000      0.9843000 
1 1 1 21 34 19 o 1.421000  0.4412000     1.144000  0.5470000     1.699000  0.6923000     -0.5547000     0.8823000 
1 1 1 21 35 0  o 7.174000  0.2552000     7.174000  0.2552000     7.174000  0.2552000     0.000000       0.000000  
1 1 1 21 35 1  o 6.456000  0.1905000     6.437000  0.2711000     6.476000  0.2676000     -0.3922000E-01 0.3810000 
1 1 1 21 35 2  o 7.978000  0.1758000     8.028000  0.2479000     7.928000  0.2493000     0.1005000      0.3516000 
1 1 1 21 35 3  o 4.011000  0.2968000     4.005000  0.4548000     4.017000  0.3816000     -0.1231000E-01 0.5937000 
1 1 1 21 35 4  o 3.950000  0.3378000     4.342000  0.4212000     3.558000  0.5281000     0.7836000      0.6756000 
1 1 1 21 35 5  o 8.493000  0.2150000     8.598000  0.2529000     8.388000  0.3477000     0.2104000      0.4299000 
1 1 1 21 35 6  o 3.624000  0.4517000     3.757000  0.4827000     3.490000  0.7636000     0.2671000      0.9034000 
1 1 1 21 35 7  o 3.463000  0.3873000     3.696000  0.5453000     3.231000  0.5502000     0.4652000      0.7746000 
1 1 1 21 35 8  o 5.466000  0.2394000     5.316000  0.3437000     5.616000  0.3333000     -0.2998000     0.4788000 
1 1 1 21 35 9  f 3.667000  0.3384000     3.699000  0.4710000     3.636000  0.4860000     0.6275000E-01  0.6768000 
1 1 1 21 35 10 o 4.397000  0.2912000     4.237000  0.4052000     4.556000  0.4184000     -0.3190000     0.5824000 
1 1 1 21 35 11 o 2.250000  0.4790000     2.407000  0.6559000     2.093000  0.6982000     0.3141000      0.9580000 
1 1 1 21 35 12 o 2.895000  0.4338000     3.237000  0.5561000     2.554000  0.6660000     0.6822000      0.8676000 
1 1 1 21 35 13 o 2.082000  0.5828000     1.969000  0.7843000     2.195000  0.8622000     -0.2259000     1.166000  
1 1 1 21 35 14 o 4.482000  0.2987000     4.591000  0.3980000     4.372000  0.4456000     0.2192000      0.5975000 
1 1 1 21 35 15 o 4.034000  0.4586000     4.941000  0.3815000     3.127000  0.8341000     1.815000       0.9172000 
1 1 1 21 35 16 o 1.358000  0.4200000     1.245000  0.5687000     1.471000  0.6182000     -0.2264000     0.8400000 
1 1 1 21 35 17 o 1.839000  0.4781000     1.809000  0.7258000     1.869000  0.6225000     -0.5917000E-01 0.9562000 
1 1 1 21 35 18 o 1.098000  0.3733000     1.127000  0.5371000     1.069000  0.5186000     0.5839000E-01  0.7466000 
1 1 1 21 35 19 o 0.9330000 0.4813000     0.9330000 0.4813000     ?         ?             ?              ?         
1 1 1 21 36 0  o 1.069000  0.6862000     1.069000  0.6862000     1.069000  0.6862000     -0.000000      0.000000  
1 1 1 21 36 1  o 10.30000  0.1840000     10.33000  0.2796000     10.26000  0.2394000     0.6767000E-01  0.3681000 
1 1 1 21 36 2  o 6.486000  0.2866000     6.440000  0.4126000     6.531000  0.3978000     -0.9129000E-01 0.5731000 
1 1 1 21 36 3  o 4.125000  0.4191000     3.742000  0.4763000     4.507000  0.6898000     -0.7650000     0.8382000 
1 1 1 21 36 4  o 5.124000  0.2906000     5.218000  0.3381000     5.031000  0.4726000     0.1870000      0.5811000 
1 1 1 21 36 5  o 5.026000  0.2853000     4.736000  0.4063000     5.315000  0.4006000     -0.5782000     0.5706000 
1 1 1 21 36 6  o 7.927000  0.2147000     7.703000  0.3329000     8.150000  0.2713000     -0.4463000     0.4295000 
1 1 1 21 36 7  f 8.635000  0.1882000     8.460000  0.2669000     8.809000  0.2655000     -0.3493000     0.3765000 
1 1 1 21 36 8  o 5.506000  0.2417000     5.315000  0.3420000     5.696000  0.3417000     -0.3811000     0.4835000 
1 1 1 21 36 9  o 2.298000  0.4183000     3.129000  0.5478000     1.466000  0.6322000     1.663000       0.8366000 
1 1 1 21 36 10 o 5.165000  0.2507000     5.013000  0.3572000     5.317000  0.3519000     -0.3038000     0.5015000 
1 1 1 21 36 11 o 1.707000  0.4561000     1.396000  0.6046000     2.019000  0.6831000     -0.6223000     0.9122000 
1 1 1 21 36 12 o 1.954000  0.4981000     2.409000  0.7621000     1.500000  0.6415000     0.9091000      0.9962000 
1 1 1 21 36 13 f 1.556000  0.4708000     1.651000  0.6540000     1.461000  0.6773000     0.1893000      0.9415000 
1 1 1 21 36 14 o 3.944000  0.3360000     4.064000  0.4486000     3.825000  0.5003000     0.2388000      0.6720000 
1 1 1 21 36 15 f 1.994000  0.5217000     2.208000  0.7426000     1.780000  0.7329000     0.4275000      1.043000  
1 1 1 21 36 16 o 1.806000  0.4622000     1.572000  0.6523000     2.040000  0.6549000     -0.4678000     0.9244000 
1 1 1 21 36 17 o 2.112000  0.4627000     2.338000  0.6440000     1.886000  0.6646000     0.4526000      0.9254000 
1 1 1 21 36 18 o 1.659000  0.4280000     1.156000  0.5603000     2.162000  0.6473000     -1.006000      0.8561000 
1 1 1 21 37 0  o 0.9894000 0.6736000     0.9894000 0.6736000     0.9894000 0.6736000     -0.000000      0.000000  
1 1 1 21 37 1  o 2.521000  0.7462000     2.521000  0.7462000     ?         ?             ?              ?         
1 1 1 21 37 2  o 1.628000  0.5234000     1.316000  0.5930000     1.940000  0.8626000     -0.6235000     1.047000  
1 1 1 21 37 3  o 10.75000  0.2012000     11.05000  0.2767000     10.46000  0.2922000     0.5907000      0.4024000 
1 1 1 21 37 4  o 4.928000  0.4713000     4.477000  0.8500000     5.379000  0.4074000     -0.9014000     0.9426000 
1 1 1 21 37 5  o 12.21000  0.1910000     11.99000  0.2917000     12.43000  0.2467000     -0.4365000     0.3820000 
1 1 1 21 37 6  o 4.644000  0.2738000     5.121000  0.3499000     4.168000  0.4211000     0.9528000      0.5475000 
1 1 1 21 37 7  o 7.978000  0.1943000     7.928000  0.2724000     8.029000  0.2772000     -0.1007000     0.3886000 
1 1 1 21 37 8  o 3.444000  0.3559000     3.511000  0.4769000     3.377000  0.5283000     0.1334000      0.7117000 
1 1 1 21 37 9  o 1.619000  0.4600000     1.484000  0.6238000     1.754000  0.6763000     -0.2703000     0.9200000 
1 1 1 21 37 10 o 3.160000  0.4068000     3.032000  0.5849000     3.289000  0.5656000     -0.2565000     0.8136000 
1 1 1 21 37 11 o 2.447000  0.4582000     2.905000  0.5925000     1.989000  0.6991000     0.9159000      0.9164000 
1 1 1 21 37 12 o 6.627000  0.3629000     6.668000  0.4788000     6.585000  0.5456000     0.8254000E-01  0.7259000 
1 1 1 21 37 13 o 2.590000  0.4638000     3.323000  0.5570000     1.857000  0.7417000     1.465000       0.9275000 
1 1 1 21 37 14 o 2.366000  0.4745000     1.888000  0.6674000     2.843000  0.6747000     -0.9551000     0.9490000 
1 1 1 21 37 15 o 3.064000  0.4620000     2.696000  0.7686000     3.431000  0.5127000     -0.7349000     0.9239000 
1 1 1 21 37 16 o 1.419000  0.4320000     1.560000  0.6424000     1.279000  0.5779000     0.2805000      0.8640000 
1 1 1 21 37 17 o 1.807000  0.4386000     2.273000  0.6486000     1.342000  0.5906000     0.9309000      0.8772000 
1 1 1 21 37 18 o 1.303000  0.4241000     1.418000  0.6527000     1.189000  0.5418000     0.2294000      0.8483000 
1 1 1 21 38 0  o 4.428000  0.4406000     4.428000  0.4406000     4.428000  0.4406000     -0.000000      0.000000  
1 1 1 21 38 1  o 4.055000  0.3098000     4.148000  0.4559000     3.963000  0.4194000     0.1853000      0.6195000 
1 1 1 21 38 2  o 2.017000  0.4192000     1.333000  0.5983000     2.702000  0.5874000     -1.369000      0.8384000 
1 1 1 21 38 3  o 2.512000  0.4590000     2.640000  0.6722000     2.383000  0.6252000     0.2579000      0.9180000 
1 1 1 21 38 4  o 5.166000  0.2446000     4.967000  0.3563000     5.365000  0.3352000     -0.3974000     0.4892000 
1 1 1 21 38 5  o 1.539000  0.4449000     1.563000  0.6335000     1.515000  0.6249000     0.4796000E-01  0.8898000 
1 1 1 21 38 6  o 4.983000  0.2600000     5.271000  0.3461000     4.694000  0.3880000     0.5772000      0.5199000 
1 1 1 21 38 7  o 3.618000  0.3512000     4.043000  0.4226000     3.193000  0.5610000     0.8498000      0.7023000 
1 1 1 21 38 8  o 6.274000  0.2216000     6.249000  0.3092000     6.299000  0.3174000     -0.5087000E-01 0.4431000 
1 1 1 21 38 9  o 4.822000  0.2751000     4.615000  0.3961000     5.030000  0.3819000     -0.4155000     0.5502000 
1 1 1 21 38 10 o 3.114000  0.4090000     3.692000  0.4886000     2.537000  0.6561000     1.156000       0.8181000 
1 1 1 21 38 11 o 1.693000  0.4867000     1.981000  0.7485000     1.406000  0.6222000     0.5751000      0.9733000 
1 1 1 21 38 12 o 3.817000  0.5563000     4.758000  0.3882000     2.875000  1.043000      1.883000       1.113000  
1 1 1 21 38 13 o 2.267000  0.5081000     2.428000  0.6609000     2.107000  0.7718000     0.3218000      1.016000  
1 1 1 21 38 14 o 2.306000  0.5584000     2.468000  0.8028000     2.145000  0.7764000     0.3230000      1.117000  
1 1 1 21 38 15 o 1.737000  0.4565000     1.430000  0.6226000     2.044000  0.6678000     -0.6140000     0.9130000 
1 1 1 21 38 16 o 3.073000  0.4207000     2.879000  0.6492000     3.266000  0.5352000     -0.3871000     0.8413000 
1 1 1 21 38 17 o 1.189000  0.3889000     1.157000  0.5416000     1.221000  0.5582000     -0.6421000E-01 0.7777000 
1 1 1 21 39 0  o 2.675000  0.6645000     2.675000  0.6645000     2.675000  0.6645000     0.000000       0.000000  
1 1 1 21 39 1  o 6.256000  0.2118000     6.094000  0.3027000     6.418000  0.2965000     -0.3235000     0.4237000 
1 1 1 21 39 2  o 4.211000  0.2777000     4.188000  0.3957000     4.234000  0.3897000     -0.4539000E-01 0.5554000 
1 1 1 21 39 3  o 5.935000  0.2198000     6.106000  0.3044000     5.763000  0.3172000     0.3430000      0.4396000 
1 1 1 21 39 4  o 13.67000  0.1774000     13.58000  0.2497000     13.76000  0.2520000     -0.1775000     0.3548000 
1 1 1 21 39 5  o 9.599000  0.1829000     9.533000  0.2571000     9.666000  0.2602000     -0.1330000     0.3658000 
1 1 1 21 39 6  o 3.807000  0.3144000     3.875000  0.4250000     3.738000  0.4634000     0.1372000      0.6288000 
1 1 1 21 39 7  o 1.402000  0.4218000     1.708000  0.6617000     1.097000  0.5233000     0.6116000      0.8437000 
1 1 1 21 39 8  f 4.359000  0.2884000     4.239000  0.4179000     4.479000  0.3975000     -0.2396000     0.5768000 
1 1 1 21 39 9  o 1.528000  0.4515000     1.512000  0.6363000     1.543000  0.6408000     -0.3149000E-01 0.9031000 
1 1 1 21 39 10 o 2.452000  0.4682000     2.795000  0.6319000     2.108000  0.6910000     0.6869000      0.9364000 
1 1 1 21 39 11 o 2.061000  0.5356000     2.627000  0.8446000     1.495000  0.6590000     1.132000       1.071000  
1 1 1 21 39 12 o 3.937000  0.3954000     4.022000  0.4825000     3.853000  0.6267000     0.1696000      0.7909000 
1 1 1 21 39 13 f 5.509000  0.3495000     5.627000  0.3652000     5.392000  0.5961000     0.2348000      0.6991000 
1 1 1 21 39 14 o 1.183000  0.3929000     1.391000  0.6242000     0.9750000 0.4774000     0.4157000      0.7858000 
1 1 1 21 39 15 o 1.863000  0.4912000     1.950000  0.6892000     1.776000  0.7001000     0.1742000      0.9825000 
1 1 1 21 39 16 o 1.864000  0.4643000     1.602000  0.6441000     2.126000  0.6689000     -0.5242000     0.9286000 
1 1 1 21 39 17 o 1.339000  0.4177000     1.486000  0.6251000     1.192000  0.5540000     0.2933000      0.8353000 
1 1 1 21 40 0  o 7.581000  0.2752000     7.581000  0.2752000     7.581000  0.2752000     -0.000000      0.000000  
1 1 1 21 40 1  o 5.265000  0.2405000     5.344000  0.3357000     5.187000  0.3446000     0.1565000      0.4810000 
1 1 1 21 40 2  o 1.477000  0.4363000     1.462000  0.6130000     1.493000  0.6210000     -0.3136000E-01 0.8725000 
1 1 1 21 40 3  f 6.720000  0.2058000     6.319000  0.2978000     7.120000  0.2840000     -0.8013000     0.4116000 
1 1 1 21 40 4  o 8.087000  0.1913000     8.377000  0.2661000     7.798000  0.2748000     0.5783000      0.3825000 
1 1 1 21 40 5  o 5.889000  0.2269000     5.865000  0.3163000     5.914000  0.3254000     -0.4828000E-01 0.4538000 
1 1 1 21 40 6  o 5.136000  0.2496000     5.164000  0.3444000     5.108000  0.3612000     0.5533000E-01  0.4991000 
1 1 1 21 40 7  o 9.006000  0.1887000     8.989000  0.2639000     9.022000  0.2699000     -0.3340000E-01 0.3775000 
1 1 1 21 40 8  o 6.753000  0.2194000     6.892000  0.3055000     6.613000  0.3149000     0.2788000      0.4388000 
1 1 1 21 40 9  o 4.986000  0.2720000     5.212000  0.3634000     4.761000  0.4048000     0.4510000      0.5440000 
1 1 1 21 40 10 o 5.932000  0.3065000     6.265000  0.4154000     5.599000  0.4508000     0.6661000      0.6130000 
1 1 1 21 40 11 o 1.947000  0.4867000     2.220000  0.6886000     1.674000  0.6881000     0.5457000      0.9734000 
1 1 1 21 40 12 o 1.392000  0.4570000     1.166000  0.5469000     1.618000  0.7323000     -0.4515000     0.9140000 
1 1 1 21 40 13 o 3.735000  0.4800000     2.937000  0.7942000     4.534000  0.5394000     -1.597000      0.9600000 
1 1 1 21 40 14 o 1.666000  0.4598000     1.557000  0.6246000     1.776000  0.6748000     -0.2191000     0.9195000 
1 1 1 21 40 15 o 2.040000  0.4794000     2.009000  0.6882000     2.072000  0.6676000     -0.6337000E-01 0.9588000 
1 1 1 21 40 16 o 1.660000  0.4526000     1.811000  0.6621000     1.508000  0.6174000     0.3031000      0.9053000 
1 1 1 21 40 17 o 1.419000  0.4511000     1.529000  0.6844000     1.308000  0.5876000     0.2213000      0.9021000 
1 1 1 21 41 0  o 7.368000  0.2796000     7.368000  0.2796000     7.368000  0.2796000     0.000000       0.000000  
1 1 1 21 41 1  o 8.814000  0.1838000     8.590000  0.2641000     9.037000  0.2556000     -0.4473000     0.3676000 
1 1 1 21 41 2  o 3.575000  0.3334000     3.248000  0.5094000     3.902000  0.4303000     -0.6540000     0.6668000 
1 1 1 21 41 3  o 4.181000  0.2888000     4.439000  0.3861000     3.924000  0.4296000     0.5159000      0.5776000 
1 1 1 21 41 4  o 4.063000  0.3043000     4.206000  0.4056000     3.921000  0.4538000     0.2849000      0.6086000 
1 1 1 21 41 5  o 4.326000  0.2863000     4.088000  0.4198000     4.564000  0.3893000     -0.4760000     0.5725000 
1 1 1 21 41 6  o 2.491000  0.4387000     2.131000  0.6555000     2.851000  0.5834000     -0.7204000     0.8775000 
1 1 1 21 41 7  o 5.460000  0.2456000     5.202000  0.3561000     5.718000  0.3383000     -0.5159000     0.4912000 
1 1 1 21 41 8  o 7.246000  0.2260000     6.797000  0.3140000     7.695000  0.3251000     -0.8977000     0.4520000 
1 1 1 21 41 9  o 2.206000  0.4843000     2.309000  0.6702000     2.103000  0.6993000     0.2061000      0.9686000 
1 1 1 21 41 10 o 6.602000  0.2782000     6.658000  0.3609000     6.547000  0.4236000     0.1117000      0.5565000 
1 1 1 21 41 11 o 3.185000  0.4117000     3.472000  0.5332000     2.898000  0.6274000     0.5734000      0.8234000 
1 1 1 21 41 12 o 2.986000  0.5341000     2.832000  0.6488000     3.139000  0.8487000     -0.3061000     1.068000  
1 1 1 21 41 13 o 2.725000  0.4734000     2.695000  0.7023000     2.754000  0.6349000     -0.5887000E-01 0.9467000 
1 1 1 21 41 14 f 1.473000  0.4325000     1.165000  0.5393000     1.782000  0.6762000     -0.6175000     0.8650000 
1 1 1 21 41 15 o 2.332000  0.4852000     2.161000  0.7127000     2.504000  0.6586000     -0.3430000     0.9704000 
1 1 1 21 41 16 o 1.345000  0.4014000     1.758000  0.6578000     0.9314000 0.4602000     0.8263000      0.8028000 
1 1 1 21 42 0  o 6.119000  0.3105000     6.119000  0.3105000     6.119000  0.3105000     0.000000       0.000000  
1 1 1 21 42 1  o 3.408000  0.3452000     3.182000  0.5207000     3.634000  0.4534000     -0.4523000     0.6904000 
1 1 1 21 42 2  o 3.295000  0.3591000     3.149000  0.5331000     3.440000  0.4812000     -0.2915000     0.7182000 
1 1 1 21 42 3  o 4.912000  0.2552000     4.823000  0.3665000     5.001000  0.3553000     -0.1786000     0.5104000 
1 1 1 21 42 4  o 2.481000  0.4495000     2.258000  0.6626000     2.704000  0.6077000     -0.4453000     0.8991000 
1 1 1 21 42 5  o 1.713000  0.4612000     1.800000  0.6563000     1.626000  0.6482000     0.1735000      0.9224000 
1 1 1 21 42 6  o 2.269000  0.4719000     1.997000  0.6830000     2.540000  0.6512000     -0.5431000     0.9437000 
1 1 1 21 42 7  o 5.086000  0.2679000     5.095000  0.3773000     5.077000  0.3804000     0.1753000E-01  0.5358000 
1 1 1 21 42 8  o 3.032000  0.4182000     3.011000  0.5763000     3.052000  0.6062000     -0.4067000E-01 0.8364000 
1 1 1 21 42 9  o 2.144000  0.5480000     2.486000  0.8304000     1.802000  0.7154000     0.6842000      1.096000  
1 1 1 21 42 10 o 1.591000  0.4479000     1.932000  0.6813000     1.249000  0.5816000     0.6832000      0.8958000 
1 1 1 21 42 11 o 3.526000  0.4808000     3.282000  0.5615000     3.769000  0.7807000     -0.4871000     0.9616000 
1 1 1 21 42 12 o 1.564000  0.4541000     2.024000  0.7319000     1.105000  0.5378000     0.9192000      0.9083000 
1 1 1 21 42 13 o 2.832000  0.4194000     2.886000  0.5734000     2.778000  0.6123000     0.1077000      0.8388000 
1 1 1 21 42 14 o 1.822000  0.4651000     1.415000  0.6175000     2.229000  0.6957000     -0.8140000     0.9302000 
1 1 1 21 42 15 o 1.429000  0.4422000     1.534000  0.6563000     1.324000  0.5927000     0.2094000      0.8843000 
1 1 1 21 42 16 o 1.946000  0.4714000     2.141000  0.6677000     1.750000  0.6656000     0.3904000      0.9428000 
1 1 1 21 43 0  o 3.148000  0.5545000     3.148000  0.5545000     3.148000  0.5545000     -0.000000      0.000000  
1 1 1 21 43 1  o 9.913000  0.1805000     9.994000  0.2532000     9.833000  0.2574000     0.1610000      0.3611000 
1 1 1 21 43 2  o 5.852000  0.2319000     6.080000  0.3150000     5.623000  0.3403000     0.4571000      0.4637000 
1 1 1 21 43 3  o 1.775000  0.4746000     2.048000  0.7164000     1.501000  0.6226000     0.5467000      0.9491000 
1 1 1 21 43 4  o 1.717000  0.4107000     2.379000  0.6451000     1.054000  0.5085000     1.325000       0.8215000 
1 1 1 21 43 5  o 2.669000  0.4468000     2.704000  0.6356000     2.635000  0.6282000     0.6867000E-01  0.8936000 
1 1 1 21 43 6  o 6.097000  0.2394000     6.445000  0.3230000     5.750000  0.3535000     0.6946000      0.4789000 
1 1 1 21 43 7  o 7.497000  0.2143000     7.513000  0.3077000     7.480000  0.2985000     0.3302000E-01  0.4287000 
1 1 1 21 43 8  o 5.544000  0.2940000     5.915000  0.4402000     5.174000  0.3899000     0.7411000      0.5881000 
1 1 1 21 43 9  o 2.229000  0.4984000     1.928000  0.6789000     2.530000  0.7297000     -0.6014000     0.9967000 
1 1 1 21 43 10 o 1.297000  0.4107000     1.447000  0.6131000     1.146000  0.5467000     0.3007000      0.8214000 
1 1 1 21 43 11 o 2.335000  0.5484000     2.169000  0.7664000     2.501000  0.7847000     -0.3321000     1.097000  
1 1 1 21 43 12 o 2.303000  0.5097000     2.122000  0.6628000     2.483000  0.7744000     -0.3616000     1.019000  
1 1 1 21 43 13 o 3.002000  0.4079000     3.043000  0.5618000     2.961000  0.5915000     0.8200000E-01  0.8158000 
1 1 1 21 43 14 o 1.946000  0.4906000     1.867000  0.6932000     2.024000  0.6945000     -0.1569000     0.9813000 
1 1 1 21 43 15 o 1.338000  0.4179000     1.568000  0.6477000     1.108000  0.5284000     0.4602000      0.8359000 
1 1 1 21 44 0  o 7.615000  0.2790000     7.615000  0.2790000     7.615000  0.2790000     0.000000       0.000000  
1 1 1 21 44 1  o 1.420000  0.4389000     1.342000  0.5883000     1.499000  0.6514000     -0.1572000     0.8777000 
1 1 1 21 44 2  o 4.440000  0.2836000     4.160000  0.4191000     4.720000  0.3821000     -0.5597000     0.5672000 
1 1 1 21 44 3  o 1.337000  0.4090000     1.611000  0.6400000     1.062000  0.5095000     0.5487000      0.8180000 
1 1 1 21 44 4  o 4.975000  0.2679000     5.171000  0.3640000     4.778000  0.3932000     0.3935000      0.5358000 
1 1 1 21 44 5  o 3.661000  0.3507000     3.457000  0.5185000     3.866000  0.4725000     -0.4085000     0.7015000 
1 1 1 21 44 6  o 8.291000  0.2039000     8.222000  0.2893000     8.359000  0.2875000     -0.1367000     0.4078000 
1 1 1 21 44 7  o 1.336000  0.4279000     1.224000  0.5834000     1.448000  0.6260000     -0.2239000     0.8557000 
1 1 1 21 44 8  o 1.647000  0.4933000     1.684000  0.6852000     1.611000  0.7099000     0.7274000E-01  0.9866000 
1 1 1 21 44 9  o 3.612000  0.3848000     3.979000  0.4616000     3.244000  0.6157000     0.7351000      0.7695000 
1 1 1 21 44 10 o 2.459000  0.5231000     2.295000  0.7003000     2.624000  0.7772000     -0.3291000     1.046000  
1 1 1 21 44 11 o 2.295000  0.5115000     2.313000  0.6491000     2.277000  0.7906000     0.3591000E-01  1.023000  
1 1 1 21 44 12 o 1.433000  0.4458000     1.471000  0.6184000     1.396000  0.6422000     0.7493000E-01  0.8915000 
1 1 1 21 44 13 o 1.465000  0.4377000     1.402000  0.6043000     1.528000  0.6335000     -0.1262000     0.8755000 
1 1 1 21 44 14 o 1.615000  0.4410000     1.229000  0.5696000     2.001000  0.6733000     -0.7717000     0.8819000 
1 1 1 21 44 15 o 1.644000  0.4674000     1.512000  0.6485000     1.776000  0.6733000     -0.2636000     0.9349000 
1 1 1 21 45 0  o 4.703000  0.3974000     4.703000  0.3974000     4.703000  0.3974000     -0.000000      0.000000  
1 1 1 21 45 1  o 3.434000  0.3632000     3.525000  0.5049000     3.343000  0.5223000     0.1826000      0.7264000 
1 1 1 21 45 2  o 5.945000  0.2377000     5.969000  0.3336000     5.921000  0.3387000     0.4771000E-01  0.4755000 
1 1 1 21 45 3  o 6.154000  0.2336000     6.225000  0.3282000     6.084000  0.3325000     0.1403000      0.4672000 
1 1 1 21 45 4  o 3.506000  0.3715000     3.161000  0.5629000     3.852000  0.4851000     -0.6911000     0.7431000 
1 1 1 21 45 5  o 4.132000  0.3245000     4.419000  0.4197000     3.846000  0.4950000     0.5731000      0.6489000 
1 1 1 21 45 6  o 5.406000  0.2874000     5.527000  0.4345000     5.284000  0.3764000     0.2421000      0.5749000 
1 1 1 21 45 7  o 3.647000  0.4565000     3.526000  0.6032000     3.768000  0.6854000     -0.2414000     0.9130000 
1 1 1 21 45 8  o 2.663000  0.4744000     2.911000  0.6106000     2.415000  0.7263000     0.4956000      0.9489000 
1 1 1 21 45 9  f 4.808000  0.3556000     5.440000  0.4086000     4.176000  0.5821000     1.264000       0.7112000 
1 1 1 21 45 10 o 1.617000  0.4450000     1.158000  0.5492000     2.076000  0.7003000     -0.9187000     0.8900000 
1 1 1 21 45 11 o 2.483000  0.4868000     1.881000  0.6711000     3.085000  0.7055000     -1.204000      0.9737000 
1 1 1 21 45 12 o 2.357000  0.4575000     1.703000  0.6709000     3.011000  0.6223000     -1.307000      0.9150000 
1 1 1 21 45 13 o 1.519000  0.4534000     1.449000  0.6256000     1.588000  0.6565000     -0.1391000     0.9069000 
1 1 1 21 45 14 o 2.235000  0.4508000     2.996000  0.6493000     1.475000  0.6254000     1.521000       0.9015000 
1 1 1 21 46 0  o 6.293000  0.3297000     6.293000  0.3297000     6.293000  0.3297000     0.000000       0.000000  
1 1 1 21 46 1  f 8.009000  0.2053000     7.918000  0.2893000     8.101000  0.2913000     -0.1831000     0.4106000 
1 1 1 21 46 2  o 5.007000  0.2702000     5.110000  0.3744000     4.903000  0.3896000     0.2064000      0.5403000 
1 1 1 21 46 3  o 4.150000  0.3133000     4.272000  0.4154000     4.029000  0.4690000     0.2430000      0.6265000 
1 1 1 21 46 4  o 3.193000  0.3951000     3.300000  0.5444000     3.086000  0.5728000     0.2133000      0.7902000 
1 1 1 21 46 5  o 4.071000  0.3602000     3.834000  0.5756000     4.308000  0.4331000     -0.4737000     0.7204000 
1 1 1 21 46 6  o 1.298000  0.4306000     1.235000  0.5799000     1.361000  0.6368000     -0.1259000     0.8613000 
1 1 1 21 46 7  o 1.460000  0.4510000     1.382000  0.6106000     1.537000  0.6640000     -0.1551000     0.9021000 
1 1 1 21 46 8  o 1.177000  0.3990000     0.9595000 0.4759000     1.395000  0.6406000     -0.4351000     0.7980000 
1 1 1 21 46 9  o 3.270000  0.4215000     2.722000  0.6972000     3.817000  0.4737000     -1.094000      0.8429000 
1 1 1 21 46 10 o 1.278000  0.4144000     1.299000  0.5780000     1.256000  0.5940000     0.4247000E-01  0.8288000 
1 1 1 21 46 11 o 1.887000  0.4996000     1.925000  0.6756000     1.850000  0.7363000     0.7510000E-01  0.9993000 
1 1 1 21 46 12 o 1.139000  0.3763000     0.8847000 0.4406000     1.393000  0.6101000     -0.5085000     0.7526000 
1 1 1 21 46 13 o 1.261000  0.4022000     1.433000  0.6135000     1.090000  0.5204000     0.3429000      0.8045000 
1 1 1 21 46 14 o 1.689000  0.4645000     1.451000  0.6308000     1.927000  0.6820000     -0.4764000     0.9289000 
1 1 1 21 47 0  o 10.01000  0.2761000     10.01000  0.2761000     10.01000  0.2761000     -0.000000      0.000000  
1 1 1 21 47 1  f 1.838000  0.4819000     1.651000  0.6619000     2.024000  0.7006000     -0.3729000     0.9638000 
1 1 1 21 47 2  o 4.653000  0.2925000     4.615000  0.4118000     4.690000  0.4156000     -0.7495000E-01 0.5851000 
1 1 1 21 47 3  o 1.424000  0.4403000     1.254000  0.5905000     1.594000  0.6534000     -0.3406000     0.8807000 
1 1 1 21 47 4  o 2.184000  0.5602000     2.485000  0.8513000     1.883000  0.7286000     0.6025000      1.120000  
1 1 1 21 47 5  o 4.721000  0.4754000     5.090000  0.4317000     4.353000  0.8471000     0.7368000      0.9507000 
1 1 1 21 47 6  o 2.253000  0.4614000     3.083000  0.6326000     1.424000  0.6719000     1.659000       0.9228000 
1 1 1 21 47 7  o 1.933000  0.5105000     2.478000  0.8019000     1.387000  0.6318000     1.091000       1.021000  
1 1 1 21 47 8  o 4.647000  0.3243000     4.694000  0.4737000     4.600000  0.4431000     0.9480000E-01  0.6486000 
1 1 1 21 47 9  o 1.392000  0.4255000     1.573000  0.6389000     1.211000  0.5621000     0.3615000      0.8510000 
1 1 1 21 47 10 o 6.036000  0.2720000     5.698000  0.3502000     6.374000  0.4164000     -0.6764000     0.5441000 
1 1 1 21 47 11 o 2.695000  0.4784000     3.052000  0.5743000     2.339000  0.7652000     0.7124000      0.9567000 
1 1 1 21 47 12 o 1.319000  0.4121000     1.077000  0.5145000     1.562000  0.6440000     -0.4844000     0.8243000 
1 1 1 21 47 13 o 2.291000  0.4917000     2.472000  0.6792000     2.109000  0.7112000     0.3627000      0.9834000 
1 1 1 21 48 0  o 0.7299000 0.5264000     0.7299000 0.5264000     0.7299000 0.5264000     0.000000       0.000000  
1 1 1 21 48 1  o 3.111000  0.4680000     4.041000  0.5460000     2.182000  0.7602000     1.860000       0.9360000 
1 1 1 21 48 2  o 8.083000  0.3071000     7.813000  0.4496000     8.353000  0.4184000     -0.5407000     0.6142000 
1 1 1 21 48 3  o 3.627000  0.5220000     4.803000  0.4670000     2.451000  0.9338000     2.351000       1.044000  
1 1 1 21 48 4  o 3.320000  0.5664000     3.929000  0.5184000     2.712000  1.007000      1.217000       1.133000  
1 1 1 21 48 5  o 4.444000  0.3609000     4.626000  0.4678000     4.263000  0.5497000     0.3631000      0.7219000 
1 1 1 21 48 6  o 3.030000  0.4614000     2.660000  0.7415000     3.400000  0.5493000     -0.7406000     0.9229000 
1 1 1 21 48 7  o 4.055000  0.3314000     4.073000  0.4679000     4.037000  0.4696000     0.3597000E-01  0.6629000 
1 1 1 21 48 8  o 1.414000  0.4297000     1.158000  0.5453000     1.669000  0.6642000     -0.5116000     0.8594000 
1 1 1 21 48 9  o 2.971000  0.4340000     3.537000  0.4950000     2.405000  0.7129000     1.132000       0.8679000 
1 1 1 21 48 10 o 1.335000  0.4144000     1.642000  0.6531000     1.029000  0.5104000     0.6128000      0.8289000 
1 1 1 21 48 11 o 2.335000  0.5164000     2.090000  0.6903000     2.580000  0.7682000     -0.4902000     1.033000  
1 1 1 21 48 12 o 1.835000  0.4371000     1.259000  0.5753000     2.410000  0.6581000     -1.151000      0.8741000 
1 1 1 21 48 13 o 1.438000  0.4455000     1.362000  0.6161000     1.514000  0.6437000     -0.1521000     0.8910000 
1 1 1 21 49 0  o 6.344000  0.6419000     6.344000  0.6419000     6.344000  0.6419000     0.000000       0.000000  
1 1 1 21 49 1  o 4.872000  0.5274000     5.718000  0.5192000     4.026000  0.9182000     1.692000       1.055000  
1 1 1 21 49 2  f 3.201000  0.5221000     3.935000  0.6261000     2.466000  0.8356000     1.469000       1.044000  
1 1 1 21 49 3  o 1.430000  0.4589000     1.276000  0.6074000     1.584000  0.6879000     -0.3087000     0.9177000 
1 1 1 21 49 4  o 2.418000  0.4597000     1.750000  0.7016000     3.085000  0.5941000     -1.335000      0.9194000 
1 1 1 21 49 5  o 1.307000  0.4232000     1.354000  0.6189000     1.260000  0.5774000     0.9385000E-01  0.8464000 
1 1 1 21 49 6  o 3.249000  0.4017000     3.546000  0.5045000     2.952000  0.6253000     0.5937000      0.8034000 
1 1 1 21 49 7  o 3.537000  0.3663000     3.604000  0.5010000     3.471000  0.5344000     0.1330000      0.7325000 
1 1 1 21 49 8  o 2.337000  0.4897000     2.291000  0.6949000     2.383000  0.6903000     -0.9237000E-01 0.9794000 
1 1 1 21 49 9  o 1.860000  0.4862000     1.884000  0.6764000     1.836000  0.6986000     0.4811000E-01  0.9724000 
1 1 1 21 49 10 o 1.452000  0.4546000     1.418000  0.6152000     1.485000  0.6695000     -0.6711000E-01 0.9092000 
1 1 1 21 49 11 f 1.144000  0.3803000     0.9458000 0.4677000     1.341000  0.5999000     -0.3954000     0.7607000 
1 1 1 21 49 12 o 1.626000  0.4653000     1.766000  0.6757000     1.486000  0.6399000     0.2793000      0.9306000 
1 1 1 21 50 0  o 2.289000  0.8551000     2.289000  0.8551000     2.289000  0.8551000     0.000000       0.000000  
1 1 1 21 50 1  o 2.381000  0.4856000     1.981000  0.7017000     2.781000  0.6715000     -0.7997000     0.9713000 
1 1 1 21 50 2  o 3.659000  0.3755000     3.454000  0.5537000     3.863000  0.5074000     -0.4083000     0.7511000 
1 1 1 21 50 3  o 1.301000  0.4162000     1.366000  0.6054000     1.237000  0.5714000     0.1285000      0.8325000 
1 1 1 21 50 4  o 4.700000  0.2939000     4.719000  0.4081000     4.680000  0.4231000     0.3856000E-01  0.5878000 
1 1 1 21 50 5  o 3.096000  0.4216000     2.758000  0.6412000     3.435000  0.5475000     -0.6770000     0.8431000 
1 1 1 21 50 6  f 1.451000  0.4418000     1.489000  0.6326000     1.413000  0.6169000     0.7601000E-01  0.8837000 
1 1 1 21 50 7  o 3.520000  0.3780000     3.874000  0.4806000     3.165000  0.5836000     0.7096000      0.7560000 
1 1 1 21 50 8  o 1.945000  0.4735000     1.597000  0.6471000     2.293000  0.6913000     -0.6962000     0.9469000 
1 1 1 21 50 9  o 1.581000  0.4746000     1.585000  0.6499000     1.576000  0.6919000     0.9250000E-02  0.9492000 
1 1 1 21 50 10 o 1.520000  0.4549000     1.027000  0.4995000     2.013000  0.7605000     -0.9857000     0.9098000 
1 1 1 21 50 11 o 2.353000  0.4903000     2.237000  0.6953000     2.470000  0.6916000     -0.2333000     0.9807000 
1 1 1 21 51 0  o 2.117000  0.8547000     2.117000  0.8547000     2.117000  0.8547000     0.000000       0.000000  
1 1 1 21 51 1  o 2.533000  0.4786000     2.813000  0.6369000     2.253000  0.7146000     0.5604000      0.9572000 
1 1 1 21 51 2  o 6.230000  0.2481000     6.351000  0.3393000     6.109000  0.3620000     0.2425000      0.4962000 
1 1 1 21 51 3  f 3.468000  0.3815000     3.392000  0.5521000     3.544000  0.5265000     -0.1518000     0.7629000 
1 1 1 21 51 4  o 1.867000  0.4825000     1.714000  0.6684000     2.021000  0.6960000     -0.3074000     0.9650000 
1 1 1 21 51 5  o 4.820000  0.2924000     4.582000  0.4212000     5.058000  0.4056000     -0.4761000     0.5847000 
1 1 1 21 51 6  o 5.447000  0.2905000     5.177000  0.4538000     5.718000  0.3629000     -0.5402000     0.5811000 
1 1 1 21 51 7  o 1.679000  0.4674000     1.474000  0.6337000     1.885000  0.6872000     -0.4112000     0.9348000 
1 1 1 21 51 8  o 1.622000  0.4680000     1.703000  0.6788000     1.542000  0.6445000     0.1611000      0.9360000 
1 1 1 21 51 9  o 2.571000  0.4920000     3.044000  0.6031000     2.098000  0.7775000     0.9463000      0.9840000 
1 1 1 21 51 10 o 1.489000  0.4402000     1.849000  0.6852000     1.129000  0.5528000     0.7204000      0.8804000 
1 1 1 21 51 11 o 1.296000  0.4252000     1.095000  0.5380000     1.497000  0.6586000     -0.4027000     0.8504000 
1 1 1 21 52 0  o 1.378000  0.7856000     1.378000  0.7856000     1.378000  0.7856000     0.000000       0.000000  
1 1 1 21 52 1  o 4.253000  0.3257000     4.503000  0.4215000     4.003000  0.4966000     0.4999000      0.6513000 
1 1 1 21 52 2  o 2.856000  0.4531000     2.418000  0.6915000     3.295000  0.5857000     -0.8772000     0.9062000 
1 1 1 21 52 3  o 7.367000  0.2278000     7.016000  0.3232000     7.718000  0.3211000     -0.7024000     0.4556000 
1 1 1 21 52 4  o 4.734000  0.2956000     4.663000  0.4131000     4.805000  0.4230000     -0.1420000     0.5913000 
1 1 1 21 52 5  o 2.702000  0.4676000     2.693000  0.6541000     2.712000  0.6684000     -0.1893000E-01 0.9352000 
1 1 1 21 52 6  o 2.337000  0.4897000     2.102000  0.7033000     2.572000  0.6817000     -0.4707000     0.9794000 
1 1 1 21 52 7  o 1.560000  0.4608000     1.482000  0.6365000     1.637000  0.6665000     -0.1546000     0.9216000 
1 1 1 21 52 8  o 2.713000  0.4616000     2.185000  0.7044000     3.241000  0.5968000     -1.056000      0.9232000 
1 1 1 21 52 9  o 1.609000  0.4808000     1.197000  0.5625000     2.020000  0.7799000     -0.8233000     0.9616000 
1 1 1 21 52 10 o 1.717000  0.4992000     1.687000  0.6728000     1.748000  0.7376000     -0.6114000E-01 0.9983000 
1 1 1 21 53 0  o 1.599000  0.8319000     1.599000  0.8319000     1.599000  0.8319000     0.000000       0.000000  
1 1 1 21 53 1  o 1.296000  0.4177000     1.178000  0.5544000     1.414000  0.6250000     -0.2361000     0.8354000 
1 1 1 21 53 2  o 3.214000  0.4069000     3.421000  0.5400000     3.008000  0.6090000     0.4125000      0.8139000 
1 1 1 21 53 3  o 2.202000  0.4974000     2.002000  0.6918000     2.401000  0.7148000     -0.3997000     0.9948000 
1 1 1 21 53 4  o 2.636000  0.4659000     2.948000  0.6160000     2.324000  0.6991000     0.6231000      0.9318000 
1 1 1 21 53 5  o 4.223000  0.3300000     4.055000  0.4788000     4.391000  0.4542000     -0.3360000     0.6600000 
1 1 1 21 53 6  o 1.350000  0.4267000     1.420000  0.6202000     1.279000  0.5861000     0.1402000      0.8533000 
1 1 1 21 53 7  o 1.228000  0.4020000     1.046000  0.5102000     1.410000  0.6214000     -0.3641000     0.8040000 
1 1 1 21 53 8  o 3.276000  0.4691000     3.309000  0.5968000     3.244000  0.7239000     0.6414000E-01  0.9382000 
1 1 1 21 53 9  o 1.441000  0.4540000     1.079000  0.5228000     1.804000  0.7425000     -0.7255000     0.9081000 
1 1 1 21 54 0  o 1.521000  0.8163000     1.521000  0.8163000     1.521000  0.8163000     -0.000000      0.000000  
1 1 1 21 54 1  o 1.478000  0.4481000     1.315000  0.5945000     1.641000  0.6706000     -0.3261000     0.8962000 
1 1 1 21 54 2  o 1.263000  0.4080000     1.498000  0.6429000     1.027000  0.5024000     0.4708000      0.8160000 
1 1 1 21 54 3  o 5.411000  0.2740000     5.391000  0.3699000     5.431000  0.4044000     -0.3924000E-01 0.5480000 
1 1 1 21 54 4  o 4.892000  0.2865000     5.022000  0.3889000     4.762000  0.4207000     0.2598000      0.5729000 
1 1 1 21 54 5  o 1.528000  0.4564000     1.669000  0.6746000     1.386000  0.6148000     0.2824000      0.9127000 
1 1 1 21 54 6  o 1.257000  0.4092000     1.183000  0.5533000     1.331000  0.6030000     -0.1471000     0.8184000 
1 1 1 21 54 7  o 1.394000  0.4405000     1.417000  0.6283000     1.371000  0.6176000     0.4599000E-01  0.8811000 
1 1 1 21 54 8  o 3.747000  0.4268000     3.632000  0.5606000     3.863000  0.6437000     -0.2314000     0.8536000 
1 1 1 21 55 0  o 4.624000  0.4392000     4.624000  0.4392000     4.624000  0.4392000     -0.000000      0.000000  
1 1 1 21 55 1  o 2.785000  0.4665000     3.038000  0.6148000     2.533000  0.7018000     0.5052000      0.9331000 
1 1 1 21 55 2  o 5.389000  0.2795000     5.698000  0.3792000     5.081000  0.4107000     0.6170000      0.5590000 
1 1 1 21 55 3  o 6.197000  0.2618000     6.260000  0.3664000     6.134000  0.3740000     0.1265000      0.5236000 
1 1 1 21 55 4  o 2.844000  0.4554000     2.184000  0.7196000     3.504000  0.5584000     -1.321000      0.9109000 
1 1 1 21 55 5  o 2.223000  0.5052000     2.239000  0.6988000     2.207000  0.7299000     0.3256000E-01  1.010000  
1 1 1 21 55 6  o 1.541000  0.4627000     1.484000  0.6380000     1.597000  0.6704000     -0.1126000     0.9255000 
1 1 1 21 55 7  o 2.109000  0.5673000     2.247000  0.7817000     1.970000  0.8223000     0.2772000      1.135000  
1 1 1 21 56 0  o 0.7567000 0.5375000     0.7567000 0.5375000     0.7567000 0.5375000     -0.000000      0.000000  
1 1 1 21 56 1  o 2.432000  0.5089000     2.411000  0.7055000     2.453000  0.7335000     -0.4113000E-01 1.018000  
1 1 1 21 56 2  o 2.098000  0.5070000     2.181000  0.7174000     2.015000  0.7166000     0.1657000      1.014000  
1 1 1 21 56 3  o 1.523000  0.4616000     1.513000  0.6525000     1.533000  0.6532000     -0.1971000E-01 0.9233000 
1 1 1 21 56 4  o 1.253000  0.4067000     0.9826000 0.4843000     1.524000  0.6536000     -0.5416000     0.8135000 
1 1 1 21 56 5  o 1.906000  0.5006000     1.835000  0.7013000     1.976000  0.7145000     -0.1412000     1.001000  
1 1 1 21 57 0  o 2.029000  0.8891000     2.029000  0.8891000     2.029000  0.8891000     -0.000000      0.000000  
1 1 1 21 57 1  o 3.724000  0.3974000     4.250000  0.4644000     3.198000  0.6449000     1.052000       0.7948000 
1 1 1 21 57 2  o 2.229000  0.4480000     1.393000  0.6174000     3.064000  0.6493000     -1.672000      0.8960000 
1 1 1 21 57 3  o 1.986000  0.4856000     2.454000  0.7196000     1.518000  0.6522000     0.9362000      0.9712000 
1 1 1 22 0  1  o 2.535000  0.1880000     2.535000  0.1880000     2.535000  0.1880000     -0.000000      0.000000  
1 1 1 22 0  2  o 0.7196000 0.4402000     0.7196000 0.4402000     0.7196000 0.4402000     0.000000       0.000000  
1 1 1 22 0  3  o 1.080000  0.6440000     1.080000  0.6440000     1.080000  0.6440000     0.000000       0.000000  
1 1 1 22 0  4  o 0.9220000 0.4635000     0.9220000 0.4635000     0.9220000 0.4635000     0.000000       0.000000  
1 1 1 22 0  5  o 5.686000  0.2061000     5.686000  0.2061000     5.686000  0.2061000     0.000000       0.000000  
1 1 1 22 0  6  o 6.096000  0.2347000     6.096000  0.2347000     6.096000  0.2347000     0.000000       0.000000  
1 1 1 22 0  7  o 12.96000  0.2551000     12.96000  0.2551000     12.96000  0.2551000     0.000000       0.000000  
1 1 1 22 0  8  o 9.036000  0.2412000     9.036000  0.2412000     9.036000  0.2412000     0.000000       0.000000  
1 1 1 22 0  9  o 15.56000  0.2854000     15.56000  0.2854000     15.56000  0.2854000     0.000000       0.000000  
1 1 1 22 0  10 o 3.674000  0.6086000     3.674000  0.6086000     3.674000  0.6086000     0.000000       0.000000  
1 1 1 22 0  11 o 1.656000  0.9569000     1.656000  0.9569000     1.656000  0.9569000     0.000000       0.000000  
1 1 1 22 0  12 o 18.05000  0.3428000     18.05000  0.3428000     18.05000  0.3428000     0.000000       0.000000  
1 1 1 22 0  13 o 6.479000  0.4567000     6.479000  0.4567000     6.479000  0.4567000     0.000000       0.000000  
1 1 1 22 0  14 o 3.365000  1.106000      3.365000  1.106000      3.365000  1.106000      0.000000       0.000000  
1 1 1 22 0  15 o 3.245000  1.047000      3.245000  1.047000      3.245000  1.047000      0.000000       0.000000  
1 1 1 22 0  16 o 1.649000  0.9563000     1.649000  0.9563000     1.649000  0.9563000     0.000000       0.000000  
1 1 1 22 0  17 o 1.489000  0.9200000     1.489000  0.9200000     1.489000  0.9200000     0.000000       0.000000  
1 1 1 22 0  18 o 0.9361000 0.6464000     0.9361000 0.6464000     0.9361000 0.6464000     0.000000       0.000000  
1 1 1 22 0  19 o 0.9860000 0.6768000     0.9860000 0.6768000     0.9860000 0.6768000     0.000000       0.000000  
1 1 1 22 0  20 o 1.580000  0.8665000     1.580000  0.8665000     1.580000  0.8665000     0.000000       0.000000  
1 1 1 22 0  21 o 2.023000  0.8981000     2.023000  0.8981000     2.023000  0.8981000     0.000000       0.000000  
1 1 1 22 0  22 o 0.9995000 0.6692000     0.9995000 0.6692000     0.9995000 0.6692000     0.000000       0.000000  
1 1 1 22 0  23 o 0.9583000 0.6541000     0.9583000 0.6541000     0.9583000 0.6541000     0.000000       0.000000  
1 1 1 22 1  1  o 5.549000  0.1249000     5.587000  0.1735000     5.512000  0.1797000     0.7416000E-01  0.2497000 
1 1 1 22 1  2  o 3.777000  0.2188000     3.768000  0.3950000     3.787000  0.1882000     -0.1908000E-01 0.4375000 
1 1 1 22 1  3  o 9.006000  0.9103000E-01 8.996000  0.1404000     9.016000  0.1158000     -0.1924000E-01 0.1821000 
1 1 1 22 1  4  o 6.266000  0.1262000     6.186000  0.1315000     6.346000  0.2154000     -0.1594000     0.2523000 
1 1 1 22 1  5  o 9.121000  0.1292000     9.176000  0.1437000     9.067000  0.2147000     0.1088000      0.2583000 
1 1 1 22 1  6  o 7.163000  0.1510000     7.082000  0.2172000     7.243000  0.2097000     -0.1607000     0.3019000 
1 1 1 22 1  7  o 16.48000  0.1936000     16.76000  0.2769000     16.21000  0.2707000     0.5502000      0.3872000 
1 1 1 22 1  8  o 4.641000  0.2636000     4.486000  0.3916000     4.797000  0.3530000     -0.3110000     0.5272000 
1 1 1 22 1  9  o 3.491000  0.4404000     3.392000  0.6530000     3.590000  0.5912000     -0.1982000     0.8809000 
1 1 1 22 1  10 o 6.920000  0.2418000     6.860000  0.3536000     6.980000  0.3298000     -0.1200000     0.4835000 
1 1 1 22 1  11 o 8.135000  0.2757000     8.033000  0.4022000     8.236000  0.3773000     -0.2026000     0.5515000 
1 1 1 22 1  12 o 14.13000  0.2393000     13.89000  0.3390000     14.38000  0.3378000     -0.4872000     0.4786000 
1 1 1 22 1  13 o 14.20000  0.2161000     14.08000  0.3082000     14.32000  0.3029000     -0.2402000     0.4321000 
1 1 1 22 1  14 o 10.01000  0.2821000     10.11000  0.3939000     9.920000  0.4040000     0.1898000      0.5642000 
1 1 1 22 1  15 o 5.518000  0.3819000     5.376000  0.5509000     5.659000  0.5290000     -0.2830000     0.7638000 
1 1 1 22 1  16 o 2.549000  0.5862000     2.094000  0.8223000     3.004000  0.8356000     -0.9101000     1.172000  
1 1 1 22 1  17 o 2.657000  0.6289000     2.426000  0.8806000     2.888000  0.8981000     -0.4623000     1.258000  
1 1 1 22 1  18 o 1.089000  0.3787000     1.096000  0.5390000     1.081000  0.5322000     0.1505000E-01  0.7574000 
1 1 1 22 1  19 o 2.398000  0.5559000     2.649000  0.7905000     2.146000  0.7818000     0.5023000      1.112000  
1 1 1 22 1  20 o 2.129000  0.5266000     2.316000  0.7556000     1.942000  0.7336000     0.3740000      1.053000  
1 1 1 22 1  21 o 2.336000  0.4656000     3.155000  0.6610000     1.517000  0.6560000     1.639000       0.9313000 
1 1 1 22 1  22 o 1.456000  0.4612000     1.464000  0.6559000     1.448000  0.6486000     0.1552000E-01  0.9224000 
1 1 1 22 1  23 f 1.446000  0.4569000     1.224000  0.5864000     1.668000  0.7009000     -0.4444000     0.9138000 
1 1 1 22 2  1  o 6.948000  0.9774000E-01 7.202000  0.1446000     6.694000  0.1315000     0.5082000      0.1955000 
1 1 1 22 2  2  o 9.196000  0.1664000     9.097000  0.2885000     9.296000  0.1658000     -0.1991000     0.3328000 
1 1 1 22 2  3  o 7.903000  0.1196000     8.040000  0.1829000     7.765000  0.1542000     0.2743000      0.2392000 
1 1 1 22 2  4  o 16.67000  0.1624000     16.63000  0.2253000     16.70000  0.2339000     -0.7266000E-01 0.3248000 
1 1 1 22 2  5  o 7.330000  0.1307000     7.318000  0.1478000     7.341000  0.2156000     -0.2243000E-01 0.2614000 
1 1 1 22 2  6  o 10.80000  0.1417000     10.76000  0.1639000     10.84000  0.2313000     -0.7534000E-01 0.2835000 
1 1 1 22 2  7  o 15.81000  0.1771000     15.93000  0.2313000     15.69000  0.2684000     0.2383000      0.3543000 
1 1 1 22 2  8  o 8.889000  0.1730000     8.917000  0.2458000     8.861000  0.2436000     0.5618000E-01  0.3460000 
1 1 1 22 2  9  o 2.569000  0.4936000     3.071000  0.6633000     2.066000  0.7311000     1.005000       0.9872000 
1 1 1 22 2  10 o 4.947000  0.3096000     4.677000  0.4655000     5.218000  0.4084000     -0.5411000     0.6192000 
1 1 1 22 2  11 o 4.242000  0.4695000     3.836000  0.7482000     4.647000  0.5675000     -0.8107000     0.9391000 
1 1 1 22 2  12 o 7.102000  0.3166000     7.218000  0.4477000     6.986000  0.4477000     0.2316000      0.6332000 
1 1 1 22 2  13 o 15.51000  0.2144000     15.46000  0.3059000     15.56000  0.3003000     -0.1039000     0.4287000 
1 1 1 22 2  14 o 9.422000  0.2884000     9.588000  0.4027000     9.256000  0.4130000     0.3316000      0.5768000 
1 1 1 22 2  15 o 7.376000  0.3071000     7.446000  0.4337000     7.306000  0.4348000     0.1396000      0.6141000 
1 1 1 22 2  16 f 2.124000  0.5800000     1.796000  0.7843000     2.451000  0.8548000     -0.6551000     1.160000  
1 1 1 22 2  17 o 3.554000  0.5730000     3.544000  0.8078000     3.565000  0.8127000     -0.2152000E-01 1.146000  
1 1 1 22 2  18 o 2.169000  0.5430000     2.040000  0.7638000     2.298000  0.7719000     -0.2580000     1.086000  
1 1 1 22 2  19 o 1.467000  0.4699000     1.512000  0.6756000     1.422000  0.6533000     0.8997000E-01  0.9398000 
1 1 1 22 2  20 f 1.348000  0.4370000     1.230000  0.5823000     1.466000  0.6519000     -0.2357000     0.8741000 
1 1 1 22 2  21 o 1.936000  0.5053000     2.054000  0.7204000     1.819000  0.7089000     0.2349000      1.011000  
1 1 1 22 2  22 o 2.006000  0.5079000     2.434000  0.7545000     1.578000  0.6801000     0.8564000      1.016000  
1 1 1 22 2  23 o 1.301000  0.4252000     1.554000  0.6756000     1.049000  0.5164000     0.5053000      0.8503000 
1 1 1 22 3  1  o 8.256000  0.1358000     8.319000  0.2304000     8.193000  0.1437000     0.1258000      0.2715000 
1 1 1 22 3  2  o 9.946000  0.1832000     9.846000  0.2905000     10.05000  0.2232000     -0.2007000     0.3664000 
1 1 1 22 3  3  o 10.54000  0.1115000     10.48000  0.1630000     10.61000  0.1521000     -0.1349000     0.2230000 
1 1 1 22 3  4  o 12.59000  0.1545000     12.38000  0.1861000     12.80000  0.2466000     -0.4179000     0.3089000 
1 1 1 22 3  5  o 5.369000  0.1276000     5.423000  0.1667000     5.315000  0.1933000     0.1074000      0.2552000 
1 1 1 22 3  6  o 17.51000  0.1692000     17.50000  0.2014000     17.51000  0.2719000     -0.5602000E-02 0.3384000 
1 1 1 22 3  7  o 9.463000  0.1525000     9.387000  0.1700000     9.538000  0.2533000     -0.1516000     0.3050000 
1 1 1 22 3  8  o 13.27000  0.1630000     13.37000  0.2322000     13.16000  0.2289000     0.2035000      0.3260000 
1 1 1 22 3  9  o 4.080000  0.3795000     3.532000  0.6080000     4.628000  0.4545000     -1.096000      0.7591000 
1 1 1 22 3  10 o 8.353000  0.2105000     8.446000  0.2947000     8.260000  0.3007000     0.1858000      0.4210000 
1 1 1 22 3  11 o 8.013000  0.2710000     8.006000  0.3885000     8.020000  0.3779000     -0.1443000E-01 0.5420000 
1 1 1 22 3  12 o 4.632000  0.4528000     4.990000  0.6023000     4.273000  0.6763000     0.7171000      0.9056000 
1 1 1 22 3  13 o 4.948000  0.3958000     5.226000  0.5360000     4.670000  0.5826000     0.5560000      0.7916000 
1 1 1 22 3  14 f 7.007000  0.3495000     6.854000  0.5003000     7.160000  0.4882000     -0.3057000     0.6990000 
1 1 1 22 3  15 o 2.399000  0.6246000     2.300000  0.8818000     2.498000  0.8849000     -0.1982000     1.249000  
1 1 1 22 3  16 o 2.518000  0.5967000     2.211000  0.8494000     2.824000  0.8383000     -0.6132000     1.193000  
1 1 1 22 3  17 o 2.068000  0.5766000     1.898000  0.7667000     2.239000  0.8614000     -0.3405000     1.153000  
1 1 1 22 3  18 o 4.044000  0.3931000     4.199000  0.5296000     3.889000  0.5811000     0.3101000      0.7862000 
1 1 1 22 3  19 o 2.276000  0.5547000     2.511000  0.7902000     2.040000  0.7788000     0.4710000      1.109000  
1 1 1 22 3  20 o 1.324000  0.4329000     1.383000  0.6298000     1.266000  0.5941000     0.1170000      0.8658000 
1 1 1 22 3  21 o 1.336000  0.4304000     1.462000  0.6445000     1.210000  0.5705000     0.2513000      0.8607000 
1 1 1 22 3  22 o 1.300000  0.4259000     1.365000  0.6230000     1.235000  0.5808000     0.1303000      0.8517000 
1 1 1 22 3  23 f 1.219000  0.4101000     1.186000  0.5670000     1.253000  0.5926000     -0.6729000E-01 0.8202000 
1 1 1 22 4  0  o 0.7443000 0.4121000     0.7443000 0.4121000     0.7443000 0.4121000     -0.000000      0.000000  
1 1 1 22 4  1  o 9.092000  0.1456000     9.178000  0.2471000     9.005000  0.1540000     0.1732000      0.2911000 
1 1 1 22 4  2  f 5.691000  0.1630000     5.332000  0.3035000     6.049000  0.1192000     -0.7170000     0.3260000 
1 1 1 22 4  3  o 13.97000  0.1244000     14.00000  0.1724000     13.93000  0.1793000     0.7255000E-01  0.2487000 
1 1 1 22 4  4  o 22.03000  0.2896000     21.95000  0.2890000     22.11000  0.5019000     -0.1624000     0.5791000 
1 1 1 22 4  5  o 1.280000  0.3183000     1.370000  0.4353000     1.190000  0.4645000     0.1799000      0.6366000 
1 1 1 22 4  6  o 8.978000  0.1292000     9.015000  0.1736000     8.942000  0.1914000     0.7299000E-01  0.2585000 
1 1 1 22 4  7  o 2.164000  0.3784000     2.330000  0.3887000     1.998000  0.6492000     0.3319000      0.7567000 
1 1 1 22 4  8  o 8.644000  0.1721000     8.732000  0.1926000     8.557000  0.2852000     0.1746000      0.3442000 
1 1 1 22 4  9  o 8.068000  0.2220000     7.444000  0.3291000     8.693000  0.2981000     -1.249000      0.4440000 
1 1 1 22 4  10 o 6.191000  0.2581000     6.715000  0.3396000     5.668000  0.3887000     1.047000       0.5161000 
1 1 1 22 4  11 o 4.897000  0.3929000     5.401000  0.4961000     4.393000  0.6094000     1.008000       0.7859000 
1 1 1 22 4  12 o 1.597000  0.5117000     1.366000  0.6558000     1.828000  0.7858000     -0.4620000     1.023000  
1 1 1 22 4  13 o 8.423000  0.2637000     8.296000  0.3823000     8.550000  0.3634000     -0.2534000     0.5274000 
1 1 1 22 4  14 o 7.946000  0.3204000     8.049000  0.4480000     7.843000  0.4582000     0.2052000      0.6408000 
1 1 1 22 4  15 o 4.722000  0.4484000     5.007000  0.5928000     4.438000  0.6730000     0.5691000      0.8968000 
1 1 1 22 4  16 o 2.580000  0.6083000     2.642000  0.8637000     2.517000  0.8569000     0.1253000      1.217000  
1 1 1 22 4  17 o 2.452000  0.5730000     2.193000  0.8167000     2.712000  0.8039000     -0.5196000     1.146000  
1 1 1 22 4  18 o 2.196000  0.5397000     2.146000  0.7648000     2.246000  0.7616000     -0.1001000     1.079000  
1 1 1 22 4  19 o 1.655000  0.5061000     1.548000  0.6919000     1.761000  0.7388000     -0.2123000     1.012000  
1 1 1 22 4  20 o 1.302000  0.4257000     1.478000  0.6531000     1.125000  0.5462000     0.3534000      0.8514000 
1 1 1 22 4  21 o 1.562000  0.4691000     1.722000  0.6971000     1.402000  0.6279000     0.3200000      0.9382000 
1 1 1 22 4  22 o 1.665000  0.4718000     2.054000  0.7314000     1.277000  0.5963000     0.7774000      0.9436000 
1 1 1 22 4  23 o 1.219000  0.4090000     1.100000  0.5362000     1.338000  0.6177000     -0.2381000     0.8179000 
1 1 1 22 5  0  o 16.72000  0.1924000     16.72000  0.1924000     16.72000  0.1924000     0.000000       0.000000  
1 1 1 22 5  1  o 6.194000  0.8650000E-01 6.156000  0.1280000     6.233000  0.1164000     -0.7778000E-01 0.1730000 
1 1 1 22 5  2  o 8.377000  0.9176000E-01 8.162000  0.1236000     8.592000  0.1357000     -0.4300000     0.1835000 
1 1 1 22 5  3  o 14.86000  0.1308000     14.82000  0.1818000     14.90000  0.1880000     -0.7937000E-01 0.2615000 
1 1 1 22 5  4  o 12.39000  0.1511000     12.37000  0.1701000     12.40000  0.2497000     -0.3196000E-01 0.3021000 
1 1 1 22 5  5  o 11.39000  0.1255000     11.33000  0.1735000     11.44000  0.1814000     -0.1073000     0.2510000 
1 1 1 22 5  6  f 3.197000  0.2472000     3.122000  0.3118000     3.271000  0.3835000     -0.1489000     0.4943000 
1 1 1 22 5  7  o 3.224000  0.2535000     3.572000  0.2879000     2.877000  0.4172000     0.6953000      0.5069000 
1 1 1 22 5  8  o 1.491000  0.4280000     1.283000  0.5208000     1.699000  0.6793000     -0.4167000     0.8560000 
1 1 1 22 5  9  o 8.346000  0.2384000     8.346000  0.2384000     ?         ?             ?              ?         
1 1 1 22 5  10 o 2.903000  0.5076000     3.202000  0.6395000     2.604000  0.7886000     0.5978000      1.015000  
1 1 1 22 5  11 o 2.443000  0.5912000     2.425000  0.8452000     2.461000  0.8268000     -0.3618000E-01 1.182000  
1 1 1 22 5  12 o 3.687000  0.5356000     3.499000  0.7972000     3.874000  0.7153000     -0.3753000     1.071000  
1 1 1 22 5  13 o 2.053000  0.5626000     2.477000  0.8522000     1.628000  0.7348000     0.8489000      1.125000  
1 1 1 22 5  14 o 3.272000  0.6362000     3.629000  0.8656000     2.915000  0.9327000     0.7136000      1.272000  
1 1 1 22 5  15 o 4.147000  0.4982000     4.165000  0.6972000     4.130000  0.7117000     0.3529000E-01  0.9963000 
1 1 1 22 5  16 o 2.764000  0.5319000     3.717000  0.7135000     1.811000  0.7889000     1.905000       1.064000  
1 1 1 22 5  17 o 2.032000  0.5478000     2.163000  0.7888000     1.901000  0.7603000     0.2615000      1.096000  
1 1 1 22 5  18 o 3.324000  0.4550000     2.893000  0.7059000     3.756000  0.5744000     -0.8622000     0.9101000 
1 1 1 22 5  19 f 2.838000  0.5611000     2.073000  0.8394000     3.602000  0.7448000     -1.529000      1.122000  
1 1 1 22 5  20 o 2.377000  0.5133000     2.144000  0.7482000     2.610000  0.7029000     -0.4655000     1.027000  
1 1 1 22 5  21 o 2.034000  0.4637000     2.676000  0.6873000     1.391000  0.6226000     1.285000       0.9274000 
1 1 1 22 5  22 o 1.405000  0.4419000     1.119000  0.5431000     1.691000  0.6972000     -0.5716000     0.8837000 
1 1 1 22 5  23 o 1.231000  0.4124000     1.129000  0.5472000     1.333000  0.6171000     -0.2040000     0.8248000 
1 1 1 22 6  0  o 2.305000  0.1778000     2.305000  0.1778000     2.305000  0.1778000     -0.000000      0.000000  
1 1 1 22 6  1  o 11.12000  0.1048000     11.13000  0.1648000     11.12000  0.1295000     0.9397000E-02  0.2096000 
1 1 1 22 6  2  o 5.097000  0.1022000     4.994000  0.1488000     5.199000  0.1401000     -0.2053000     0.2044000 
1 1 1 22 6  3  o 9.290000  0.1043000     9.245000  0.1444000     9.336000  0.1506000     -0.9127000E-01 0.2086000 
1 1 1 22 6  4  o 8.875000  0.1174000     8.752000  0.1549000     8.998000  0.1765000     -0.2466000     0.2348000 
1 1 1 22 6  5  f 9.586000  0.1203000     9.581000  0.1661000     9.590000  0.1741000     -0.8577000E-02 0.2406000 
1 1 1 22 6  6  o 10.80000  0.1678000     10.86000  0.2445000     10.74000  0.2300000     0.1176000      0.3357000 
1 1 1 22 6  7  o 5.916000  0.1585000     5.990000  0.2181000     5.842000  0.2301000     0.1479000      0.3171000 
1 1 1 22 6  8  o 6.953000  0.1615000     6.812000  0.2218000     7.094000  0.2349000     -0.2812000     0.3231000 
1 1 1 22 6  9  o 6.532000  0.2975000     6.417000  0.2606000     6.647000  0.5349000     -0.2299000     0.5950000 
1 1 1 22 6  10 o 8.884000  0.1992000     8.767000  0.2216000     9.001000  0.3310000     -0.2343000     0.3983000 
1 1 1 22 6  11 o 4.299000  0.4364000     4.092000  0.3818000     4.506000  0.7849000     -0.4143000     0.8728000 
1 1 1 22 6  12 o 3.531000  0.5585000     3.313000  0.8277000     3.748000  0.7501000     -0.4349000     1.117000  
1 1 1 22 6  13 o 11.18000  0.2265000     11.16000  0.3218000     11.20000  0.3189000     -0.3827000E-01 0.4531000 
1 1 1 22 6  14 o 8.299000  0.3392000     8.262000  0.5232000     8.336000  0.4317000     -0.7425000E-01 0.6783000 
1 1 1 22 6  15 o 1.908000  0.5708000     1.770000  0.7779000     2.046000  0.8355000     -0.2767000     1.142000  
1 1 1 22 6  16 o 3.106000  0.5452000     3.923000  0.6875000     2.289000  0.8463000     1.633000       1.090000  
1 1 1 22 6  17 o 2.483000  0.5647000     2.480000  0.7837000     2.486000  0.8132000     -0.5703000E-02 1.129000  
1 1 1 22 6  18 o 1.873000  0.5063000     1.583000  0.6821000     2.163000  0.7484000     -0.5795000     1.013000  
1 1 1 22 6  19 o 1.526000  0.4973000     1.279000  0.6234000     1.773000  0.7749000     -0.4943000     0.9945000 
1 1 1 22 6  20 o 2.057000  0.5194000     2.028000  0.7348000     2.086000  0.7342000     -0.5832000E-01 1.039000  
1 1 1 22 6  21 o 1.770000  0.4564000     2.364000  0.7180000     1.176000  0.5637000     1.188000       0.9128000 
1 1 1 22 6  22 o 1.310000  0.4182000     0.9330000 0.4668000     1.686000  0.6941000     -0.7531000     0.8365000 
1 1 1 22 6  23 o 1.544000  0.4659000     1.844000  0.7134000     1.244000  0.5996000     0.5997000      0.9319000 
1 1 1 22 7  0  o 1.301000  0.3806000     1.301000  0.3806000     1.301000  0.3806000     -0.000000      0.000000  
1 1 1 22 7  1  o 16.55000  0.1303000     16.45000  0.1921000     16.66000  0.1760000     -0.2131000     0.2605000 
1 1 1 22 7  2  o 3.566000  0.1171000     3.531000  0.1882000     3.601000  0.1394000     -0.6947000E-01 0.2342000 
1 1 1 22 7  3  o 7.780000  0.1084000     7.822000  0.1422000     7.739000  0.1635000     0.8292000E-01  0.2167000 
1 1 1 22 7  4  o 7.864000  0.1135000     7.832000  0.1566000     7.896000  0.1643000     -0.6432000E-01 0.2270000 
1 1 1 22 7  5  o 4.339000  0.1537000     4.398000  0.2004000     4.279000  0.2330000     0.1195000      0.3074000 
1 1 1 22 7  6  f 8.418000  0.2457000     8.467000  0.4520000     8.368000  0.1927000     0.9845000E-01  0.4914000 
1 1 1 22 7  7  o 2.225000  0.3394000     1.870000  0.4898000     2.579000  0.4701000     -0.7087000     0.6788000 
1 1 1 22 7  8  o 1.767000  0.4120000     1.827000  0.5680000     1.708000  0.5969000     0.1187000      0.8240000 
1 1 1 22 7  9  o 13.43000  0.2112000     13.87000  0.2276000     12.99000  0.3559000     0.8785000      0.4225000 
1 1 1 22 7  10 o 5.765000  0.2609000     5.822000  0.2786000     5.709000  0.4413000     0.1122000      0.5219000 
1 1 1 22 7  11 o 4.467000  0.4797000     4.881000  0.3727000     4.053000  0.8841000     0.8286000      0.9595000 
1 1 1 22 7  12 o 3.965000  0.4333000     3.940000  0.4512000     3.990000  0.7398000     -0.4921000E-01 0.8665000 
1 1 1 22 7  13 o 5.264000  0.3698000     5.059000  0.5512000     5.469000  0.4931000     -0.4106000     0.7396000 
1 1 1 22 7  14 o 4.443000  0.6192000     5.410000  0.7298000     3.477000  1.001000      1.933000       1.238000  
1 1 1 22 7  15 o 4.156000  0.4960000     4.088000  0.7222000     4.224000  0.6800000     -0.1355000     0.9920000 
1 1 1 22 7  16 o 2.507000  0.5610000     3.145000  0.7980000     1.869000  0.7887000     1.276000       1.122000  
1 1 1 22 7  17 o 1.863000  0.5279000     1.471000  0.6684000     2.256000  0.8172000     -0.7844000     1.056000  
1 1 1 22 7  18 o 2.302000  0.5243000     2.023000  0.7335000     2.581000  0.7492000     -0.5582000     1.049000  
1 1 1 22 7  19 o 2.218000  0.5762000     2.165000  0.8483000     2.271000  0.7800000     -0.1054000     1.152000  
1 1 1 22 7  20 f 1.739000  0.4834000     1.436000  0.6378000     2.042000  0.7265000     -0.6069000     0.9667000 
1 1 1 22 7  21 o 1.463000  0.4571000     1.715000  0.7089000     1.210000  0.5773000     0.5050000      0.9142000 
1 1 1 22 7  22 o 1.333000  0.4306000     1.176000  0.5604000     1.489000  0.6539000     -0.3132000     0.8612000 
1 1 1 22 7  23 o 1.300000  0.4313000     1.296000  0.6023000     1.303000  0.6175000     -0.6841000E-02 0.8626000 
1 1 1 22 8  0  o 8.131000  0.1508000     8.131000  0.1508000     8.131000  0.1508000     0.000000       0.000000  
1 1 1 22 8  1  o 7.011000  0.8826000E-01 6.912000  0.1255000     7.110000  0.1242000     -0.1970000     0.1765000 
1 1 1 22 8  2  o 2.818000  0.1558000     2.494000  0.2635000     3.142000  0.1661000     -0.6479000     0.3115000 
1 1 1 22 8  3  o 14.73000  0.1678000     14.88000  0.2605000     14.58000  0.2117000     0.3011000      0.3356000 
1 1 1 22 8  4  o 7.492000  0.1163000     7.433000  0.1607000     7.551000  0.1683000     -0.1183000     0.2327000 
1 1 1 22 8  5  f 8.980000  0.1400000     9.271000  0.1714000     8.689000  0.2215000     0.5818000      0.2801000 
1 1 1 22 8  6  o 3.811000  0.2583000     3.789000  0.4311000     3.833000  0.2847000     -0.4468000E-01 0.5166000 
1 1 1 22 8  7  o 9.934000  0.1447000     9.671000  0.2021000     10.20000  0.2070000     -0.5268000     0.2893000 
1 1 1 22 8  8  o 9.545000  0.1520000     9.605000  0.2071000     9.486000  0.2226000     0.1187000      0.3041000 
1 1 1 22 8  9  o 5.195000  0.2940000     5.115000  0.2891000     5.276000  0.5121000     -0.1611000     0.5880000 
1 1 1 22 8  10 o 3.477000  0.3108000     3.434000  0.4263000     3.521000  0.4524000     -0.8640000E-01 0.6216000 
1 1 1 22 8  11 o 5.615000  0.2556000     5.064000  0.3626000     6.166000  0.3604000     -1.103000      0.5112000 
1 1 1 22 8  12 o 12.64000  0.2420000     12.64000  0.3431000     12.64000  0.3413000     0.6046000E-02  0.4839000 
1 1 1 22 8  13 o 4.120000  0.4612000     4.705000  0.3919000     3.534000  0.8350000     1.171000       0.9224000 
1 1 1 22 8  14 o 5.919000  0.4850000     5.361000  0.7263000     6.477000  0.6430000     -1.116000      0.9700000 
1 1 1 22 8  15 o 3.725000  0.5376000     3.471000  0.8249000     3.980000  0.6896000     -0.5083000     1.075000  
1 1 1 22 8  16 o 1.901000  0.5646000     2.091000  0.8255000     1.710000  0.7706000     0.3803000      1.129000  
1 1 1 22 8  17 o 3.322000  0.5170000     2.724000  0.7847000     3.921000  0.6733000     -1.197000      1.034000  
1 1 1 22 8  18 o 2.029000  0.5189000     2.163000  0.7424000     1.896000  0.7252000     0.2666000      1.038000  
1 1 1 22 8  19 o 1.733000  0.5166000     2.005000  0.7905000     1.461000  0.6652000     0.5436000      1.033000  
1 1 1 22 8  20 o 1.840000  0.4651000     1.222000  0.5766000     2.458000  0.7299000     -1.236000      0.9302000 
1 1 1 22 8  21 f 1.253000  0.4189000     1.289000  0.6052000     1.216000  0.5792000     0.7267000E-01  0.8377000 
1 1 1 22 8  22 o 2.315000  0.4790000     1.672000  0.6912000     2.959000  0.6632000     -1.287000      0.9579000 
1 1 1 22 8  23 o 1.788000  0.4966000     1.641000  0.6872000     1.935000  0.7171000     -0.2940000     0.9932000 
1 1 1 22 9  0  o 1.999000  0.2692000     1.999000  0.2692000     1.999000  0.2692000     -0.000000      0.000000  
1 1 1 22 9  1  o 8.406000  0.9457000E-01 8.324000  0.1336000     8.488000  0.1338000     -0.1640000     0.1891000 
1 1 1 22 9  2  o 6.483000  0.9453000E-01 6.504000  0.1341000     6.462000  0.1333000     0.4231000E-01  0.1891000 
1 1 1 22 9  3  o 15.21000  0.1573000     15.44000  0.2273000     14.98000  0.2176000     0.4600000      0.3146000 
1 1 1 22 9  4  o 9.891000  0.1194000     9.984000  0.1887000     9.799000  0.1462000     0.1848000      0.2387000 
1 1 1 22 9  5  o 7.938000  0.1611000     8.073000  0.2230000     7.803000  0.2325000     0.2698000      0.3222000 
1 1 1 22 9  6  o 5.640000  0.1623000     5.883000  0.2216000     5.396000  0.2372000     0.4871000      0.3246000 
1 1 1 22 9  7  o 4.867000  0.1897000     4.793000  0.2625000     4.940000  0.2739000     -0.1462000     0.3793000 
1 1 1 22 9  8  o 9.828000  0.1541000     9.843000  0.2128000     9.812000  0.2229000     0.3103000E-01  0.3081000 
1 1 1 22 9  9  o 3.757000  0.3317000     4.081000  0.3392000     3.432000  0.5701000     0.6490000      0.6634000 
1 1 1 22 9  10 o 7.581000  0.2271000     7.661000  0.2647000     7.500000  0.3690000     0.1607000      0.4541000 
1 1 1 22 9  11 o 6.779000  0.4047000     7.543000  0.7276000     6.016000  0.3544000     1.527000       0.8093000 
1 1 1 22 9  12 o 2.062000  0.4958000     1.871000  0.6876000     2.253000  0.7145000     -0.3825000     0.9916000 
1 1 1 22 9  13 o 2.401000  0.5527000     2.514000  0.6493000     2.288000  0.8946000     0.2251000      1.105000  
1 1 1 22 9  14 o 4.225000  0.5407000     5.010000  0.4009000     3.441000  1.004000      1.569000       1.081000  
1 1 1 22 9  15 f 6.142000  0.3143000     6.074000  0.3295000     6.210000  0.5353000     -0.1359000     0.6286000 
1 1 1 22 9  16 o 2.463000  0.5859000     3.177000  0.8717000     1.749000  0.7832000     1.429000       1.172000  
1 1 1 22 9  17 o 2.141000  0.5712000     2.321000  0.8240000     1.961000  0.7913000     0.3593000      1.142000  
1 1 1 22 9  18 o 1.760000  0.4657000     2.351000  0.7453000     1.169000  0.5585000     1.182000       0.9313000 
1 1 1 22 9  19 o 1.892000  0.5368000     2.016000  0.7925000     1.767000  0.7242000     0.2487000      1.074000  
1 1 1 22 9  20 o 1.824000  0.5074000     1.708000  0.7222000     1.940000  0.7130000     -0.2316000     1.015000  
1 1 1 22 9  21 o 1.153000  0.3943000     1.042000  0.5148000     1.264000  0.5973000     -0.2216000     0.7885000 
1 1 1 22 9  22 o 1.393000  0.4400000     1.554000  0.6630000     1.233000  0.5785000     0.3210000      0.8799000 
1 1 1 22 9  23 o 1.438000  0.4512000     1.254000  0.5895000     1.622000  0.6832000     -0.3679000     0.9023000 
1 1 1 22 10 0  o 6.405000  0.1338000     6.405000  0.1338000     6.405000  0.1338000     0.000000       0.000000  
1 1 1 22 10 1  o 13.26000  0.1199000     13.30000  0.1695000     13.22000  0.1697000     0.7607000E-01  0.2399000 
1 1 1 22 10 2  o 4.078000  0.1550000     3.755000  0.2531000     4.401000  0.1789000     -0.6456000     0.3100000 
1 1 1 22 10 3  o 5.500000  0.1086000     5.642000  0.1548000     5.357000  0.1524000     0.2841000      0.2173000 
1 1 1 22 10 4  o 13.71000  0.1452000     13.85000  0.2183000     13.58000  0.1915000     0.2740000      0.2904000 
1 1 1 22 10 5  o 7.793000  0.2277000     8.026000  0.4159000     7.559000  0.1856000     0.4670000      0.4554000 
1 1 1 22 10 6  o 9.370000  0.1396000     9.043000  0.1929000     9.697000  0.2018000     -0.6549000     0.2791000 
1 1 1 22 10 7  o 7.502000  0.1525000     7.539000  0.2073000     7.466000  0.2236000     0.7298000E-01  0.3049000 
1 1 1 22 10 8  o 10.48000  0.1616000     10.73000  0.2137000     10.23000  0.2426000     0.4996000      0.3233000 
1 1 1 22 10 9  o 3.679000  0.2832000     3.554000  0.3897000     3.805000  0.4110000     -0.2507000     0.5664000 
1 1 1 22 10 10 o 9.164000  0.1792000     9.101000  0.2458000     9.227000  0.2609000     -0.1262000     0.3585000 
1 1 1 22 10 11 o 6.514000  0.4196000     6.474000  0.7789000     6.553000  0.3122000     -0.7856000E-01 0.8392000 
1 1 1 22 10 12 o 12.42000  0.1968000     12.50000  0.2883000     12.34000  0.2681000     0.1616000      0.3937000 
1 1 1 22 10 13 o 9.675000  0.2013000     9.463000  0.2787000     9.888000  0.2905000     -0.4248000     0.4026000 
1 1 1 22 10 14 o 4.402000  0.5246000     4.591000  0.4528000     4.213000  0.9466000     0.3773000      1.049000  
1 1 1 22 10 15 o 2.361000  0.5814000     1.911000  0.6962000     2.811000  0.9313000     -0.8997000     1.163000  
1 1 1 22 10 16 o 2.578000  0.5865000     3.020000  0.7087000     2.136000  0.9346000     0.8843000      1.173000  
1 1 1 22 10 17 o 2.782000  0.6057000     2.252000  0.8299000     3.311000  0.8825000     -1.060000      1.211000  
1 1 1 22 10 18 o 1.826000  0.5088000     2.009000  0.7429000     1.643000  0.6954000     0.3660000      1.018000  
1 1 1 22 10 19 o 2.981000  0.5320000     2.875000  0.7975000     3.087000  0.7044000     -0.2114000     1.064000  
1 1 1 22 10 20 o 1.896000  0.4798000     1.445000  0.6414000     2.346000  0.7139000     -0.9011000     0.9597000 
1 1 1 22 10 21 o 1.815000  0.5323000     1.891000  0.7833000     1.740000  0.7209000     0.1511000      1.065000  
1 1 1 22 10 22 o 1.501000  0.4628000     1.621000  0.6824000     1.381000  0.6253000     0.2398000      0.9255000 
1 1 1 22 10 23 o 1.312000  0.4290000     1.262000  0.5896000     1.362000  0.6232000     -0.1005000     0.8579000 
1 1 1 22 11 0  o 1.999000  0.3136000     1.999000  0.3136000     1.999000  0.3136000     0.000000       0.000000  
1 1 1 22 11 1  o 8.693000  0.1103000     8.678000  0.1677000     8.707000  0.1434000     -0.2862000E-01 0.2206000 
1 1 1 22 11 2  o 6.573000  0.1235000     6.408000  0.1655000     6.738000  0.1834000     -0.3305000     0.2470000 
1 1 1 22 11 3  o 7.805000  0.1067000     7.690000  0.1508000     7.920000  0.1510000     -0.2300000     0.2134000 
1 1 1 22 11 4  o 11.67000  0.1646000     11.72000  0.2410000     11.63000  0.2242000     0.8748000E-01  0.3291000 
1 1 1 22 11 5  o 3.934000  0.1717000     4.027000  0.2718000     3.841000  0.2098000     0.1863000      0.3434000 
1 1 1 22 11 6  o 17.93000  0.1689000     17.88000  0.2367000     17.99000  0.2410000     -0.1139000     0.3378000 
1 1 1 22 11 7  o 6.445000  0.1664000     6.762000  0.2190000     6.129000  0.2507000     0.6332000      0.3329000 
1 1 1 22 11 8  o 8.404000  0.1757000     8.470000  0.2368000     8.338000  0.2596000     0.1318000      0.3514000 
1 1 1 22 11 9  o 1.939000  0.4457000     1.919000  0.6154000     1.960000  0.6450000     -0.4060000E-01 0.8915000 
1 1 1 22 11 10 o 2.338000  0.4386000     2.887000  0.5682000     1.788000  0.6682000     1.099000       0.8772000 
1 1 1 22 11 11 o 11.32000  0.2508000     11.04000  0.4281000     11.61000  0.2615000     -0.5726000     0.5016000 
1 1 1 22 11 12 o 9.538000  0.2048000     9.745000  0.2967000     9.331000  0.2825000     0.4136000      0.4097000 
1 1 1 22 11 13 o 7.098000  0.2311000     7.113000  0.3190000     7.083000  0.3346000     0.3005000E-01  0.4623000 
1 1 1 22 11 14 o 4.947000  0.3127000     5.062000  0.4069000     4.832000  0.4749000     0.2306000      0.6254000 
1 1 1 22 11 15 o 1.522000  0.4608000     1.603000  0.6545000     1.441000  0.6488000     0.1613000      0.9216000 
1 1 1 22 11 16 o 2.766000  0.7256000     3.174000  0.9989000     2.358000  1.053000      0.8164000      1.451000  
1 1 1 22 11 17 o 2.190000  0.5665000     1.630000  0.6648000     2.751000  0.9174000     -1.122000      1.133000  
1 1 1 22 11 18 o 1.889000  0.5185000     1.532000  0.6144000     2.245000  0.8354000     -0.7136000     1.037000  
1 1 1 22 11 19 o 1.684000  0.5020000     1.530000  0.6619000     1.837000  0.7549000     -0.3060000     1.004000  
1 1 1 22 11 20 o 1.488000  0.4513000     1.159000  0.5538000     1.816000  0.7128000     -0.6567000     0.9027000 
1 1 1 22 11 21 o 1.701000  0.5230000     2.010000  0.8083000     1.392000  0.6639000     0.6184000      1.046000  
1 1 1 22 11 22 o 1.749000  0.4661000     2.235000  0.7243000     1.262000  0.5868000     0.9733000      0.9322000 
1 1 1 22 11 23 o 1.757000  0.5105000     1.908000  0.7464000     1.607000  0.6966000     0.3006000      1.021000  
1 1 1 22 12 0  o 2.993000  0.2736000     2.993000  0.2736000     2.993000  0.2736000     0.000000       0.000000  
1 1 1 22 12 1  o 7.980000  0.1526000     8.085000  0.2106000     7.875000  0.2209000     0.2097000      0.3052000 
1 1 1 22 12 2  o 8.588000  0.1175000     8.708000  0.1508000     8.468000  0.1803000     0.2404000      0.2350000 
1 1 1 22 12 3  o 14.59000  0.1788000     14.55000  0.2162000     14.63000  0.2849000     -0.8196000E-01 0.3576000 
1 1 1 22 12 4  o 9.802000  0.1303000     9.688000  0.2013000     9.916000  0.1655000     -0.2282000     0.2606000 
1 1 1 22 12 5  o 15.09000  0.1521000     15.32000  0.2421000     14.85000  0.1841000     0.4787000      0.3041000 
1 1 1 22 12 6  o 22.43000  0.2013000     22.65000  0.3207000     22.21000  0.2433000     0.4390000      0.4025000 
1 1 1 22 12 7  o 23.16000  0.2042000     22.95000  0.2856000     23.36000  0.2920000     -0.4106000     0.4085000 
1 1 1 22 12 8  o 13.03000  0.2477000     13.31000  0.2458000     12.74000  0.4300000     0.5760000      0.4953000 
1 1 1 22 12 9  o 4.560000  0.2480000     4.954000  0.3043000     4.166000  0.3917000     0.7876000      0.4960000 
1 1 1 22 12 10 o 9.197000  0.1973000     8.753000  0.2565000     9.640000  0.3000000     -0.8872000     0.3947000 
1 1 1 22 12 11 o 7.229000  0.2186000     7.258000  0.3097000     7.199000  0.3086000     0.5948000E-01  0.4372000 
1 1 1 22 12 12 f 2.536000  0.4940000     2.156000  0.7323000     2.917000  0.6633000     -0.7610000     0.9881000 
1 1 1 22 12 13 o 2.985000  0.4745000     3.075000  0.6410000     2.895000  0.6997000     0.1802000      0.9489000 
1 1 1 22 12 14 o 3.408000  0.4286000     2.771000  0.6720000     4.046000  0.5322000     -1.275000      0.8572000 
1 1 1 22 12 15 o 6.378000  0.2563000     6.369000  0.3541000     6.386000  0.3705000     -0.1711000E-01 0.5125000 
1 1 1 22 12 16 f 3.170000  0.6832000     2.929000  1.207000      3.411000  0.6411000     -0.4816000     1.366000  
1 1 1 22 12 17 o 1.744000  0.5141000     1.824000  0.6924000     1.665000  0.7602000     0.1591000      1.028000  
1 1 1 22 12 18 o 5.453000  0.3022000     5.588000  0.3050000     5.319000  0.5217000     0.2695000      0.6043000 
1 1 1 22 12 19 o 2.471000  0.5039000     2.689000  0.5777000     2.253000  0.8259000     0.4366000      1.008000  
1 1 1 22 12 20 o 1.894000  0.4851000     1.135000  0.5248000     2.653000  0.8159000     -1.518000      0.9701000 
1 1 1 22 12 21 o 1.448000  0.4606000     1.052000  0.5269000     1.845000  0.7556000     -0.7934000     0.9212000 
1 1 1 22 12 22 o 1.393000  0.4383000     1.195000  0.5682000     1.592000  0.6675000     -0.3970000     0.8765000 
1 1 1 22 12 23 o 1.287000  0.6424000     1.287000  0.6424000     ?         ?             ?              ?         
1 1 1 22 13 0  o 1.329000  0.6508000     1.329000  0.6508000     1.329000  0.6508000     0.000000       0.000000  
1 1 1 22 13 1  f 3.437000  0.1787000     3.149000  0.2508000     3.726000  0.2547000     -0.5766000     0.3574000 
1 1 1 22 13 2  o 12.04000  0.1399000     11.90000  0.1919000     12.19000  0.2036000     -0.2914000     0.2798000 
1 1 1 22 13 3  o 6.978000  0.1375000     6.986000  0.1932000     6.970000  0.1958000     0.1640000E-01  0.2751000 
1 1 1 22 13 4  o 13.42000  0.1330000     13.39000  0.1883000     13.45000  0.1878000     -0.6440000E-01 0.2659000 
1 1 1 22 13 5  o 4.873000  0.1438000     5.030000  0.2015000     4.717000  0.2052000     0.3130000      0.2876000 
1 1 1 22 13 6  o 3.923000  0.2063000     4.324000  0.3028000     3.521000  0.2803000     0.8034000      0.4127000 
1 1 1 22 13 7  o 3.016000  0.2991000     3.278000  0.3660000     2.754000  0.4732000     0.5236000      0.5983000 
1 1 1 22 13 8  o 12.93000  0.2059000     12.91000  0.2242000     12.95000  0.3455000     -0.4074000E-01 0.4118000 
1 1 1 22 13 9  o 6.040000  0.2021000     5.944000  0.2706000     6.137000  0.3003000     -0.1926000     0.4042000 
1 1 1 22 13 10 o 2.316000  0.4880000     2.458000  0.6255000     2.173000  0.7491000     0.2847000      0.9759000 
1 1 1 22 13 11 o 5.914000  0.2501000     6.144000  0.3474000     5.684000  0.3599000     0.4599000      0.5003000 
1 1 1 22 13 12 o 7.384000  0.2273000     7.165000  0.3315000     7.602000  0.3110000     -0.4368000     0.4546000 
1 1 1 22 13 13 o 7.901000  0.2403000     8.033000  0.3263000     7.769000  0.3528000     0.2638000      0.4805000 
1 1 1 22 13 14 o 2.178000  0.4983000     2.595000  0.6959000     1.762000  0.7135000     0.8328000      0.9967000 
1 1 1 22 13 15 o 6.287000  0.2541000     6.283000  0.3541000     6.291000  0.3646000     -0.8271000E-02 0.5083000 
1 1 1 22 13 16 o 2.420000  0.6390000     2.932000  1.032000      1.908000  0.7533000     1.024000       1.278000  
1 1 1 22 13 17 o 3.034000  0.4697000     3.179000  0.6070000     2.889000  0.7168000     0.2902000      0.9393000 
1 1 1 22 13 18 o 1.906000  0.4813000     2.276000  0.7029000     1.536000  0.6576000     0.7405000      0.9626000 
1 1 1 22 13 19 o 2.147000  0.5022000     2.388000  0.6243000     1.906000  0.7867000     0.4815000      1.004000  
1 1 1 22 13 20 o 1.690000  0.4627000     1.933000  0.6414000     1.448000  0.6670000     0.4851000      0.9253000 
1 1 1 22 13 21 o 1.472000  0.4720000     1.556000  0.6820000     1.387000  0.6527000     0.1687000      0.9440000 
1 1 1 22 13 22 o 1.585000  0.4397000     1.976000  0.6580000     1.195000  0.5836000     0.7811000      0.8795000 
1 1 1 22 14 0  o 17.64000  0.2162000     17.64000  0.2162000     17.64000  0.2162000     0.000000       0.000000  
1 1 1 22 14 1  o 12.64000  0.1339000     12.56000  0.2007000     12.72000  0.1772000     -0.1615000     0.2677000 
1 1 1 22 14 2  o 6.137000  0.1266000     6.199000  0.1921000     6.075000  0.1651000     0.1246000      0.2533000 
1 1 1 22 14 3  o 7.266000  0.1160000     7.295000  0.1637000     7.237000  0.1645000     0.5885000E-01  0.2321000 
1 1 1 22 14 4  o 3.571000  0.1796000     3.779000  0.2426000     3.362000  0.2647000     0.4174000      0.3591000 
1 1 1 22 14 5  o 2.834000  0.2289000     2.889000  0.3191000     2.779000  0.3283000     0.1108000      0.4578000 
1 1 1 22 14 6  o 29.03000  0.2481000     28.88000  0.3913000     29.19000  0.3052000     -0.3058000     0.4963000 
1 1 1 22 14 7  o 14.32000  0.1622000     14.24000  0.2546000     14.41000  0.2009000     -0.1632000     0.3243000 
1 1 1 22 14 8  o 1.844000  0.4180000     1.587000  0.5669000     2.102000  0.6145000     -0.5152000     0.8360000 
1 1 1 22 14 9  o 7.983000  0.1864000     7.945000  0.2561000     8.022000  0.2709000     -0.7646000E-01 0.3727000 
1 1 1 22 14 10 o 2.767000  0.6441000     3.527000  1.093000      2.007000  0.6822000     1.519000       1.288000  
1 1 1 22 14 11 o 2.626000  0.4779000     2.385000  0.6814000     2.867000  0.6704000     -0.4821000     0.9559000 
1 1 1 22 14 12 o 3.983000  0.3699000     3.775000  0.5496000     4.191000  0.4952000     -0.4161000     0.7398000 
1 1 1 22 14 13 o 6.180000  0.3597000     6.128000  0.3961000     6.233000  0.6006000     -0.1041000     0.7194000 
1 1 1 22 14 14 f 2.291000  0.4978000     1.663000  0.6896000     2.918000  0.7180000     -1.255000      0.9955000 
1 1 1 22 14 15 f 7.100000  0.2405000     7.764000  0.3132000     6.436000  0.3651000     1.328000       0.4810000 
1 1 1 22 14 16 o 1.561000  0.4746000     1.713000  0.6972000     1.408000  0.6441000     0.3049000      0.9492000 
1 1 1 22 14 17 o 3.500000  0.4056000     3.202000  0.5862000     3.797000  0.5607000     -0.5953000     0.8112000 
1 1 1 22 14 18 o 2.177000  0.5114000     1.898000  0.7047000     2.455000  0.7412000     -0.5572000     1.023000  
1 1 1 22 14 19 o 1.867000  0.4899000     1.862000  0.6865000     1.871000  0.6990000     -0.8272000E-02 0.9798000 
1 1 1 22 14 20 o 2.765000  0.4418000     2.802000  0.6109000     2.729000  0.6384000     0.7255000E-01  0.8837000 
1 1 1 22 14 21 o 1.484000  0.4680000     1.517000  0.6528000     1.452000  0.6709000     0.6513000E-01  0.9361000 
1 1 1 22 14 22 o 1.111000  0.3763000     1.155000  0.5325000     1.067000  0.5319000     0.8782000E-01  0.7527000 
1 1 1 22 15 0  o 13.59000  0.1838000     13.59000  0.1838000     13.59000  0.1838000     0.000000       0.000000  
1 1 1 22 15 1  o 8.378000  0.1126000     8.364000  0.1585000     8.392000  0.1600000     -0.2770000E-01 0.2252000 
1 1 1 22 15 2  o 2.836000  0.1913000     2.913000  0.2598000     2.759000  0.2810000     0.1546000      0.3827000 
1 1 1 22 15 3  o 14.35000  0.1378000     14.50000  0.1953000     14.21000  0.1946000     0.2907000      0.2757000 
1 1 1 22 15 4  o 14.28000  0.1396000     14.23000  0.1973000     14.33000  0.1976000     -0.1076000     0.2792000 
1 1 1 22 15 5  o 21.56000  0.1859000     21.51000  0.2630000     21.62000  0.2628000     -0.1086000     0.3718000 
1 1 1 22 15 6  o 14.73000  0.1498000     14.65000  0.2115000     14.80000  0.2122000     -0.1481000     0.2996000 
1 1 1 22 15 7  o 16.18000  0.2078000     16.28000  0.3212000     16.09000  0.2637000     0.1931000      0.4156000 
1 1 1 22 15 8  o 7.949000  0.1784000     7.834000  0.2558000     8.065000  0.2486000     -0.2305000     0.3568000 
1 1 1 22 15 9  o 14.64000  0.1752000     14.48000  0.2474000     14.80000  0.2481000     -0.3143000     0.3504000 
1 1 1 22 15 10 o 2.196000  0.5071000     1.742000  0.7928000     2.650000  0.6325000     -0.9072000     1.014000  
1 1 1 22 15 11 o 6.936000  0.2380000     7.154000  0.3372000     6.717000  0.3360000     0.4372000      0.4761000 
1 1 1 22 15 12 o 2.297000  0.5008000     2.638000  0.6768000     1.956000  0.7383000     0.6820000      1.002000  
1 1 1 22 15 13 o 5.751000  0.4527000     5.762000  0.4014000     5.740000  0.8116000     0.2123000E-01  0.9054000 
1 1 1 22 15 14 f 7.849000  0.2258000     7.432000  0.3156000     8.266000  0.3229000     -0.8340000     0.4515000 
1 1 1 22 15 15 o 1.944000  0.5283000     1.946000  0.7133000     1.942000  0.7796000     0.4146000E-02  1.057000  
1 1 1 22 15 16 o 1.372000  0.4424000     1.335000  0.6108000     1.410000  0.6402000     -0.7492000E-01 0.8849000 
1 1 1 22 15 17 o 3.309000  0.4251000     3.523000  0.5508000     3.096000  0.6476000     0.4267000      0.8502000 
1 1 1 22 15 18 o 1.422000  0.4666000     1.323000  0.6038000     1.521000  0.7115000     -0.1980000     0.9332000 
1 1 1 22 15 19 o 1.636000  0.4625000     1.484000  0.6322000     1.787000  0.6752000     -0.3028000     0.9250000 
1 1 1 22 15 20 o 1.159000  0.3832000     1.086000  0.5158000     1.233000  0.5668000     -0.1475000     0.7664000 
1 1 1 22 15 21 o 1.679000  0.4434000     1.188000  0.5489000     2.169000  0.6965000     -0.9814000     0.8869000 
1 1 1 22 15 22 o 1.271000  0.4034000     0.9723000 0.4771000     1.570000  0.6507000     -0.5974000     0.8069000 
1 1 1 22 16 0  o 5.248000  0.1814000     5.248000  0.1814000     5.248000  0.1814000     0.000000       0.000000  
1 1 1 22 16 1  o 11.57000  0.1232000     11.56000  0.1739000     11.58000  0.1747000     -0.2379000E-01 0.2465000 
1 1 1 22 16 2  f 11.78000  0.1254000     11.80000  0.1766000     11.77000  0.1781000     0.2210000E-01  0.2508000 
1 1 1 22 16 3  o 4.440000  0.1505000     4.411000  0.2136000     4.468000  0.2120000     -0.5712000E-01 0.3009000 
1 1 1 22 16 4  o 16.51000  0.1534000     16.55000  0.2172000     16.47000  0.2166000     0.7940000E-01  0.3067000 
1 1 1 22 16 5  o 6.921000  0.1487000     6.949000  0.1939000     6.892000  0.2254000     0.5695000E-01  0.2973000 
1 1 1 22 16 6  o 12.60000  0.1404000     12.82000  0.1999000     12.37000  0.1971000     0.4494000      0.2807000 
1 1 1 22 16 7  o 7.002000  0.1688000     6.908000  0.2243000     7.095000  0.2522000     -0.1869000     0.3375000 
1 1 1 22 16 8  o 2.397000  0.3812000     1.960000  0.6340000     2.834000  0.4235000     -0.8738000     0.7624000 
1 1 1 22 16 9  o 4.639000  0.2753000     4.557000  0.3419000     4.721000  0.4316000     -0.1647000     0.5506000 
1 1 1 22 16 10 o 3.760000  0.3237000     3.602000  0.4692000     3.919000  0.4461000     -0.3164000     0.6475000 
1 1 1 22 16 11 o 9.813000  0.2042000     10.04000  0.2936000     9.591000  0.2838000     0.4451000      0.4084000 
1 1 1 22 16 12 o 4.008000  0.3614000     4.355000  0.4622000     3.660000  0.5557000     0.6955000      0.7228000 
1 1 1 22 16 13 o 4.569000  0.5135000     5.107000  0.4142000     4.032000  0.9397000     1.075000       1.027000  
1 1 1 22 16 14 o 1.696000  0.4882000     1.979000  0.7327000     1.412000  0.6453000     0.5667000      0.9763000 
1 1 1 22 16 15 o 2.831000  0.5422000     2.590000  0.7673000     3.071000  0.7663000     -0.4816000     1.084000  
1 1 1 22 16 16 o 5.924000  0.2768000     6.134000  0.3696000     5.713000  0.4123000     0.4209000      0.5537000 
1 1 1 22 16 17 o 2.639000  0.4535000     3.291000  0.5420000     1.988000  0.7271000     1.303000       0.9069000 
1 1 1 22 16 18 o 1.765000  0.5666000     1.343000  0.6135000     2.188000  0.9528000     -0.8451000     1.133000  
1 1 1 22 16 19 o 1.360000  0.4224000     1.633000  0.6638000     1.087000  0.5226000     0.5467000      0.8448000 
1 1 1 22 16 20 o 2.461000  0.4826000     2.445000  0.6665000     2.477000  0.6980000     -0.3266000E-01 0.9651000 
1 1 1 22 16 21 o 1.661000  0.4687000     1.482000  0.6283000     1.839000  0.6956000     -0.3571000     0.9374000 
1 1 1 22 16 22 o 1.276000  0.4105000     1.323000  0.5940000     1.228000  0.5667000     0.9511000E-01  0.8210000 
1 1 1 22 17 0  o 4.632000  0.2003000     4.632000  0.2003000     4.632000  0.2003000     0.000000       0.000000  
1 1 1 22 17 1  o 2.410000  0.2457000     2.489000  0.3283000     2.331000  0.3657000     0.1582000      0.4914000 
1 1 1 22 17 2  o 11.89000  0.1272000     11.87000  0.1792000     11.90000  0.1805000     -0.2158000E-01 0.2543000 
1 1 1 22 17 3  o 5.489000  0.1374000     5.561000  0.1943000     5.416000  0.1944000     0.1447000      0.2748000 
1 1 1 22 17 4  o 16.38000  0.1538000     16.13000  0.2153000     16.64000  0.2196000     -0.5011000     0.3076000 
1 1 1 22 17 5  o 9.939000  0.1330000     10.01000  0.1889000     9.870000  0.1873000     0.1374000      0.2660000 
1 1 1 22 17 6  o 6.864000  0.1606000     7.074000  0.2444000     6.653000  0.2084000     0.4209000      0.3211000 
1 1 1 22 17 7  o 9.966000  0.1467000     10.14000  0.1996000     9.793000  0.2151000     0.3452000      0.2934000 
1 1 1 22 17 8  o 6.898000  0.1810000     7.245000  0.2741000     6.552000  0.2364000     0.6936000      0.3619000 
1 1 1 22 17 9  o 13.09000  0.2905000     13.49000  0.5252000     12.69000  0.2482000     0.8020000      0.5809000 
1 1 1 22 17 10 o 7.224000  0.2107000     7.107000  0.2950000     7.341000  0.3009000     -0.2342000     0.4214000 
1 1 1 22 17 11 o 5.195000  0.2754000     5.206000  0.3941000     5.184000  0.3848000     0.2202000E-01  0.5509000 
1 1 1 22 17 12 o 5.475000  0.2887000     5.434000  0.4032000     5.515000  0.4132000     -0.8082000E-01 0.5774000 
1 1 1 22 17 13 o 3.759000  0.4211000     3.898000  0.5102000     3.620000  0.6702000     0.2783000      0.8423000 
1 1 1 22 17 14 o 1.477000  0.4624000     1.287000  0.5994000     1.666000  0.7042000     -0.3791000     0.9247000 
1 1 1 22 17 15 o 4.115000  0.6731000     4.513000  1.192000      3.716000  0.6252000     0.7976000      1.346000  
1 1 1 22 17 16 o 4.135000  0.3614000     4.444000  0.4346000     3.826000  0.5775000     0.6184000      0.7228000 
1 1 1 22 17 17 o 1.612000  0.4640000     1.896000  0.7004000     1.329000  0.6089000     0.5667000      0.9281000 
1 1 1 22 17 18 o 1.705000  0.5132000     1.725000  0.6802000     1.685000  0.7687000     0.4033000E-01  1.026000  
1 1 1 22 17 19 o 1.722000  0.4355000     1.076000  0.5186000     2.368000  0.6998000     -1.292000      0.8710000 
1 1 1 22 17 20 o 1.973000  0.4889000     1.671000  0.6753000     2.274000  0.7072000     -0.6032000     0.9778000 
1 1 1 22 17 21 o 1.435000  0.4388000     1.372000  0.6023000     1.497000  0.6383000     -0.1251000     0.8776000 
1 1 1 22 17 22 o 1.181000  0.3877000     1.357000  0.6003000     1.004000  0.4909000     0.3528000      0.7755000 
1 1 1 22 18 0  o 7.730000  0.1692000     7.730000  0.1692000     7.730000  0.1692000     0.000000       0.000000  
1 1 1 22 18 1  o 13.56000  0.1355000     13.51000  0.1905000     13.60000  0.1927000     -0.8600000E-01 0.2710000 
1 1 1 22 18 2  o 5.184000  0.1405000     5.167000  0.1988000     5.202000  0.1985000     -0.3450000E-01 0.2809000 
1 1 1 22 18 3  o 3.395000  0.1954000     3.329000  0.2795000     3.461000  0.2731000     -0.1325000     0.3908000 
1 1 1 22 18 4  f 11.44000  0.1322000     11.42000  0.1867000     11.45000  0.1874000     -0.2599000E-01 0.2645000 
1 1 1 22 18 5  o 8.551000  0.1343000     8.779000  0.1889000     8.324000  0.1909000     0.4546000      0.2686000 
1 1 1 22 18 6  o 17.69000  0.2187000     18.20000  0.3433000     17.17000  0.2710000     1.025000       0.4374000 
1 1 1 22 18 7  o 11.94000  0.1462000     11.89000  0.2059000     11.99000  0.2078000     -0.1045000     0.2925000 
1 1 1 22 18 8  o 8.300000  0.1675000     8.273000  0.2186000     8.326000  0.2538000     -0.5317000E-01 0.3350000 
1 1 1 22 18 9  o 3.982000  0.4621000     3.413000  0.8375000     4.550000  0.3907000     -1.137000      0.9242000 
1 1 1 22 18 10 o 3.211000  0.3893000     3.382000  0.4986000     3.040000  0.5980000     0.3414000      0.7785000 
1 1 1 22 18 11 f 4.957000  0.2850000     4.822000  0.4143000     5.092000  0.3914000     -0.2705000     0.5700000 
1 1 1 22 18 12 o 9.256000  0.2376000     9.042000  0.3559000     9.471000  0.3149000     -0.4289000     0.4752000 
1 1 1 22 18 13 o 5.207000  0.2962000     4.947000  0.4057000     5.468000  0.4318000     -0.5209000     0.5925000 
1 1 1 22 18 14 o 2.546000  0.5171000     2.764000  0.7013000     2.329000  0.7599000     0.4350000      1.034000  
1 1 1 22 18 15 o 1.544000  0.5114000     1.779000  0.8179000     1.309000  0.6140000     0.4701000      1.023000  
1 1 1 22 18 16 o 2.315000  0.5247000     2.267000  0.7237000     2.363000  0.7600000     -0.9635000E-01 1.049000  
1 1 1 22 18 17 o 2.639000  0.4822000     2.495000  0.6865000     2.783000  0.6773000     -0.2884000     0.9644000 
1 1 1 22 18 18 o 2.270000  0.5116000     1.810000  0.6802000     2.730000  0.7643000     -0.9199000     1.023000  
1 1 1 22 18 19 o 2.517000  0.4844000     2.616000  0.6649000     2.418000  0.7046000     0.1976000      0.9688000 
1 1 1 22 18 20 o 1.677000  0.4869000     1.568000  0.6797000     1.785000  0.6974000     -0.2166000     0.9738000 
1 1 1 22 18 21 o 1.884000  0.4790000     1.954000  0.6753000     1.813000  0.6795000     0.1414000      0.9580000 
1 1 1 22 18 22 o 1.417000  0.4360000     1.364000  0.6011000     1.471000  0.6316000     -0.1075000     0.8719000 
1 1 1 22 19 0  f 14.76000  0.2014000     14.76000  0.2014000     14.76000  0.2014000     0.000000       0.000000  
1 1 1 22 19 1  o 6.503000  0.1304000     6.577000  0.1823000     6.429000  0.1865000     0.1481000      0.2609000 
1 1 1 22 19 2  o 5.307000  0.1428000     5.412000  0.1992000     5.201000  0.2046000     0.2106000      0.2856000 
1 1 1 22 19 3  o 15.15000  0.1478000     15.29000  0.2095000     15.02000  0.2086000     0.2745000      0.2956000 
1 1 1 22 19 4  o 6.557000  0.1383000     6.544000  0.1946000     6.571000  0.1965000     -0.2699000E-01 0.2766000 
1 1 1 22 19 5  o 12.26000  0.1546000     12.26000  0.2370000     12.25000  0.1986000     0.1538000E-01  0.3092000 
1 1 1 22 19 6  o 12.61000  0.1738000     12.40000  0.2106000     12.81000  0.2765000     -0.4048000     0.3475000 
1 1 1 22 19 7  o 17.65000  0.1720000     17.54000  0.2432000     17.77000  0.2434000     -0.2344000     0.3441000 
1 1 1 22 19 8  o 11.58000  0.2005000     11.53000  0.2352000     11.64000  0.3248000     -0.1141000     0.4010000 
1 1 1 22 19 9  o 11.35000  0.1846000     11.19000  0.2719000     11.51000  0.2498000     -0.3273000     0.3692000 
1 1 1 22 19 10 f 6.488000  0.2351000     6.269000  0.3477000     6.706000  0.3167000     -0.4374000     0.4703000 
1 1 1 22 19 11 o 1.444000  0.4498000     1.482000  0.6490000     1.405000  0.6230000     0.7755000E-01  0.8996000 
1 1 1 22 19 12 o 5.673000  0.4053000     6.415000  0.4155000     4.930000  0.6959000     1.485000       0.8106000 
1 1 1 22 19 13 o 6.684000  0.2537000     6.699000  0.3311000     6.670000  0.3845000     0.2966000E-01  0.5074000 
1 1 1 22 19 14 o 3.016000  0.5044000     2.801000  0.6862000     3.232000  0.7395000     -0.4305000     1.009000  
1 1 1 22 19 15 o 3.504000  0.4200000     4.010000  0.4891000     2.999000  0.6829000     1.011000       0.8400000 
1 1 1 22 19 16 f 1.939000  0.5007000     2.070000  0.6952000     1.808000  0.7207000     0.2620000      1.001000  
1 1 1 22 19 17 f 1.241000  0.4050000     1.320000  0.5922000     1.161000  0.5527000     0.1597000      0.8100000 
1 1 1 22 19 18 o 1.863000  0.4905000     1.740000  0.6742000     1.986000  0.7125000     -0.2460000     0.9809000 
1 1 1 22 19 19 o 1.581000  0.4571000     1.364000  0.6024000     1.797000  0.6877000     -0.4323000     0.9143000 
1 1 1 22 19 20 o 1.349000  0.4696000     1.555000  0.7690000     1.143000  0.5392000     0.4120000      0.9392000 
1 1 1 22 19 21 o 1.444000  0.4401000     1.360000  0.6008000     1.528000  0.6433000     -0.1681000     0.8802000 
1 1 1 22 19 22 o 1.579000  0.4295000     2.177000  0.7074000     0.9808000 0.4874000     1.196000       0.8590000 
1 1 1 22 20 0  o 7.430000  0.1808000     7.430000  0.1808000     7.430000  0.1808000     0.000000       0.000000  
1 1 1 22 20 1  o 18.84000  0.1679000     18.67000  0.2356000     19.01000  0.2393000     -0.3465000     0.3359000 
1 1 1 22 20 2  o 14.17000  0.1425000     14.41000  0.2023000     13.94000  0.2009000     0.4716000      0.2851000 
1 1 1 22 20 3  o 15.41000  0.1505000     15.35000  0.2113000     15.47000  0.2144000     -0.1225000     0.3011000 
1 1 1 22 20 4  f 6.515000  0.1430000     6.605000  0.2020000     6.425000  0.2026000     0.1803000      0.2861000 
1 1 1 22 20 5  o 5.316000  0.2131000     5.639000  0.3203000     4.993000  0.2812000     0.6460000      0.4262000 
1 1 1 22 20 6  o 11.60000  0.1462000     11.57000  0.2087000     11.63000  0.2048000     -0.5884000E-01 0.2924000 
1 1 1 22 20 7  f 10.51000  0.1645000     10.56000  0.2135000     10.46000  0.2503000     0.9581000E-01  0.3290000 
1 1 1 22 20 8  o 10.54000  0.1723000     10.57000  0.2653000     10.51000  0.2200000     0.6614000E-01  0.3446000 
1 1 1 22 20 9  o 5.501000  0.2323000     5.657000  0.2736000     5.345000  0.3756000     0.3118000      0.4647000 
1 1 1 22 20 10 o 4.019000  0.3432000     4.594000  0.4184000     3.444000  0.5441000     1.150000       0.6864000 
1 1 1 22 20 11 o 4.080000  0.3490000     3.881000  0.5053000     4.280000  0.4815000     -0.3989000     0.6980000 
1 1 1 22 20 12 o 6.410000  0.3613000     6.769000  0.3246000     6.051000  0.6457000     0.7188000      0.7227000 
1 1 1 22 20 13 o 7.469000  0.2365000     7.696000  0.3192000     7.241000  0.3491000     0.4558000      0.4730000 
1 1 1 22 20 14 o 3.683000  0.4589000     3.514000  0.5996000     3.852000  0.6948000     -0.3374000     0.9177000 
1 1 1 22 20 15 o 4.078000  0.3531000     3.765000  0.5207000     4.391000  0.4772000     -0.6263000     0.7063000 
1 1 1 22 20 16 o 1.638000  0.4842000     1.670000  0.6828000     1.605000  0.6867000     0.6555000E-01  0.9684000 
1 1 1 22 20 17 o 1.396000  0.4476000     1.281000  0.5867000     1.511000  0.6761000     -0.2301000     0.8951000 
1 1 1 22 20 18 o 2.010000  0.4710000     1.469000  0.6364000     2.550000  0.6944000     -1.081000      0.9419000 
1 1 1 22 20 19 o 2.008000  0.4635000     1.531000  0.6359000     2.484000  0.6745000     -0.9522000     0.9270000 
1 1 1 22 20 20 o 1.705000  0.5063000     1.705000  0.7635000     1.705000  0.6652000     0.1048000E-03  1.013000  
1 1 1 22 20 21 o 1.803000  0.4679000     1.429000  0.6272000     2.177000  0.6946000     -0.7478000     0.9359000 
1 1 1 22 20 22 o 1.143000  0.5834000     1.143000  0.5834000     ?         ?             ?              ?         
1 1 1 22 21 0  o 12.93000  0.1950000     12.93000  0.1950000     12.93000  0.1950000     0.000000       0.000000  
1 1 1 22 21 1  o 3.291000  0.2115000     3.412000  0.2847000     3.171000  0.3130000     0.2406000      0.4231000 
1 1 1 22 21 2  o 8.695000  0.1303000     8.691000  0.1837000     8.699000  0.1847000     -0.7527000E-02 0.2605000 
1 1 1 22 21 3  o 10.00000  0.1341000     9.969000  0.1893000     10.03000  0.1899000     -0.6322000E-01 0.2681000 
1 1 1 22 21 4  o 12.70000  0.1570000     12.66000  0.2405000     12.74000  0.2019000     -0.8680000E-01 0.3140000 
1 1 1 22 21 5  o 6.528000  0.1617000     6.305000  0.2224000     6.751000  0.2347000     -0.4459000     0.3233000 
1 1 1 22 21 6  o 4.613000  0.2006000     4.886000  0.2695000     4.339000  0.2971000     0.5472000      0.4011000 
1 1 1 22 21 7  o 12.07000  0.1772000     12.22000  0.2403000     11.91000  0.2605000     0.3082000      0.3544000 
1 1 1 22 21 8  o 10.16000  0.1539000     10.21000  0.2141000     10.11000  0.2211000     0.1032000      0.3078000 
1 1 1 22 21 9  o 6.965000  0.2005000     6.885000  0.2508000     7.045000  0.3128000     -0.1599000     0.4009000 
1 1 1 22 21 10 o 1.498000  0.4493000     1.309000  0.5933000     1.687000  0.6748000     -0.3778000     0.8985000 
1 1 1 22 21 11 o 9.175000  0.2078000     9.278000  0.3369000     9.072000  0.2432000     0.2062000      0.4155000 
1 1 1 22 21 12 o 5.390000  0.3023000     5.281000  0.3888000     5.498000  0.4632000     -0.2174000     0.6047000 
1 1 1 22 21 13 o 7.129000  0.2361000     6.939000  0.3331000     7.319000  0.3347000     -0.3795000     0.4722000 
1 1 1 22 21 14 o 4.505000  0.6514000     3.738000  1.222000      5.271000  0.4528000     -1.532000      1.303000  
1 1 1 22 21 15 o 3.377000  0.4226000     3.729000  0.4914000     3.026000  0.6876000     0.7028000      0.8452000 
1 1 1 22 21 16 o 3.141000  0.4542000     3.720000  0.5316000     2.563000  0.7366000     1.157000       0.9084000 
1 1 1 22 21 17 o 2.537000  0.5632000     2.802000  0.6607000     2.272000  0.9123000     0.5298000      1.126000  
1 1 1 22 21 18 o 1.622000  0.4709000     1.749000  0.6871000     1.495000  0.6442000     0.2533000      0.9419000 
1 1 1 22 21 19 o 2.984000  0.4339000     3.533000  0.5331000     2.436000  0.6847000     1.097000       0.8678000 
1 1 1 22 21 20 f 1.318000  0.4172000     1.224000  0.5636000     1.411000  0.6153000     -0.1875000     0.8345000 
1 1 1 22 21 21 o 1.429000  0.4398000     1.246000  0.5745000     1.612000  0.6661000     -0.3665000     0.8796000 
1 1 1 22 22 0  o 0.7628000 0.4962000     0.7628000 0.4962000     0.7628000 0.4962000     0.000000       0.000000  
1 1 1 22 22 1  o 7.836000  0.1345000     7.929000  0.1891000     7.744000  0.1913000     0.1845000      0.2690000 
1 1 1 22 22 2  o 15.66000  0.1535000     15.64000  0.2170000     15.68000  0.2172000     -0.4237000E-01 0.3070000 
1 1 1 22 22 3  o 12.03000  0.1536000     12.21000  0.2350000     11.85000  0.1977000     0.3558000      0.3071000 
1 1 1 22 22 4  o 3.138000  0.3062000     3.054000  0.4150000     3.223000  0.4503000     -0.1696000     0.6124000 
1 1 1 22 22 5  o 1.654000  0.3772000     1.979000  0.5351000     1.328000  0.5316000     0.6505000      0.7543000 
1 1 1 22 22 6  o 6.380000  0.2297000     6.714000  0.2450000     6.046000  0.3887000     0.6673000      0.4595000 
1 1 1 22 22 7  o 12.32000  0.1719000     12.37000  0.2656000     12.27000  0.2181000     0.9445000E-01  0.3437000 
1 1 1 22 22 8  o 14.12000  0.1635000     13.98000  0.2297000     14.26000  0.2326000     -0.2839000     0.3269000 
1 1 1 22 22 9  o 7.956000  0.2129000     8.040000  0.2984000     7.872000  0.3039000     0.1683000      0.4259000 
1 1 1 22 22 10 o 2.518000  0.4212000     2.981000  0.5136000     2.055000  0.6678000     0.9257000      0.8425000 
1 1 1 22 22 11 o 8.286000  0.2445000     8.498000  0.4090000     8.074000  0.2682000     0.4236000      0.4890000 
1 1 1 22 22 12 o 1.521000  0.4695000     1.526000  0.6577000     1.517000  0.6702000     0.9670000E-02  0.9390000 
1 1 1 22 22 13 o 2.439000  0.4876000     2.850000  0.6320000     2.028000  0.7427000     0.8219000      0.9752000 
1 1 1 22 22 14 o 2.396000  0.5837000     2.364000  0.8870000     2.427000  0.7591000     -0.6208000E-01 1.167000  
1 1 1 22 22 15 o 3.894000  0.3580000     3.812000  0.4916000     3.977000  0.5207000     -0.1654000     0.7161000 
1 1 1 22 22 16 o 2.461000  0.4914000     2.264000  0.7131000     2.658000  0.6763000     -0.3943000     0.9828000 
1 1 1 22 22 17 o 2.353000  0.6358000     1.318000  0.6078000     3.388000  1.117000      -2.070000      1.272000  
1 1 1 22 22 18 o 1.502000  0.4424000     1.764000  0.6691000     1.240000  0.5788000     0.5242000      0.8847000 
1 1 1 22 22 19 o 1.753000  0.5703000     1.262000  0.5758000     2.243000  0.9845000     -0.9805000     1.141000  
1 1 1 22 22 20 o 1.892000  0.4870000     1.973000  0.6967000     1.811000  0.6808000     0.1616000      0.9741000 
1 1 1 22 22 21 o 1.757000  0.4772000     1.604000  0.6527000     1.911000  0.6964000     -0.3072000     0.9545000 
1 1 1 22 23 0  o 15.49000  0.2168000     15.49000  0.2168000     15.49000  0.2168000     0.000000       0.000000  
1 1 1 22 23 1  o 9.155000  0.1360000     9.407000  0.1906000     8.902000  0.1939000     0.5050000      0.2719000 
1 1 1 22 23 2  o 1.704000  0.3947000     1.748000  0.5786000     1.660000  0.5370000     0.8718000E-01  0.7893000 
1 1 1 22 23 3  f 15.08000  0.1776000     15.01000  0.2496000     15.15000  0.2527000     -0.1449000     0.3552000 
1 1 1 22 23 4  o 11.29000  0.1524000     11.18000  0.2021000     11.39000  0.2281000     -0.2043000     0.3047000 
1 1 1 22 23 5  o 8.766000  0.1969000     8.752000  0.2303000     8.779000  0.3193000     -0.2675000E-01 0.3937000 
1 1 1 22 23 6  o 2.792000  0.4023000     3.119000  0.5306000     2.465000  0.6048000     0.6548000      0.8046000 
1 1 1 22 23 7  o 10.42000  0.1540000     10.14000  0.2189000     10.71000  0.2166000     -0.5700000     0.3080000 
1 1 1 22 23 8  o 3.164000  0.3653000     3.493000  0.3994000     2.835000  0.6116000     0.6576000      0.7305000 
1 1 1 22 23 9  o 1.527000  0.4424000     1.291000  0.5588000     1.764000  0.6860000     -0.4733000     0.8848000 
1 1 1 22 23 10 o 2.132000  0.4544000     2.355000  0.6245000     1.909000  0.6603000     0.4463000      0.9088000 
1 1 1 22 23 11 o 2.677000  0.5118000     2.195000  0.7881000     3.160000  0.6531000     -0.9645000     1.024000  
1 1 1 22 23 12 o 3.500000  0.3805000     3.795000  0.5473000     3.206000  0.5288000     0.5887000      0.7610000 
1 1 1 22 23 13 o 4.049000  0.4119000     4.674000  0.4202000     3.424000  0.7086000     1.250000       0.8238000 
1 1 1 22 23 14 o 4.843000  0.2994000     4.611000  0.4390000     5.075000  0.4071000     -0.4643000     0.5987000 
1 1 1 22 23 15 o 1.609000  0.4584000     1.187000  0.5586000     2.031000  0.7270000     -0.8441000     0.9169000 
1 1 1 22 23 16 o 1.503000  0.4525000     1.742000  0.6881000     1.264000  0.5878000     0.4778000      0.9050000 
1 1 1 22 23 17 o 1.956000  0.5145000     2.292000  0.7115000     1.620000  0.7434000     0.6717000      1.029000  
1 1 1 22 23 18 o 2.896000  0.4540000     2.973000  0.6220000     2.818000  0.6615000     0.1544000      0.9080000 
1 1 1 22 23 19 o 2.259000  0.4920000     1.680000  0.7117000     2.838000  0.6797000     -1.159000      0.9841000 
1 1 1 22 23 20 o 1.219000  0.3996000     1.131000  0.5360000     1.307000  0.5928000     -0.1759000     0.7992000 
1 1 1 22 23 21 o 1.395000  0.4314000     1.141000  0.5387000     1.649000  0.6740000     -0.5086000     0.8628000 
1 1 1 22 24 0  o 6.816000  0.2484000     6.816000  0.2484000     6.816000  0.2484000     0.000000       0.000000  
1 1 1 22 24 1  o 12.66000  0.1585000     12.55000  0.2383000     12.77000  0.2092000     -0.2204000     0.3171000 
1 1 1 22 24 2  o 17.40000  0.2154000     17.51000  0.2719000     17.29000  0.3342000     0.2265000      0.4309000 
1 1 1 22 24 3  o 7.429000  0.1750000     7.409000  0.2055000     7.449000  0.2834000     -0.3982000E-01 0.3501000 
1 1 1 22 24 4  o 11.35000  0.1933000     11.29000  0.2293000     11.42000  0.3113000     -0.1339000     0.3867000 
1 1 1 22 24 5  o 5.672000  0.2335000     5.971000  0.3438000     5.372000  0.3160000     0.5996000      0.4670000 
1 1 1 22 24 6  o 9.518000  0.1538000     9.300000  0.2184000     9.737000  0.2166000     -0.4371000     0.3076000 
1 1 1 22 24 7  o 6.173000  0.1798000     6.342000  0.2481000     6.004000  0.2604000     0.3379000      0.3597000 
1 1 1 22 24 8  f 3.089000  0.3743000     3.191000  0.4579000     2.986000  0.5923000     0.2045000      0.7486000 
1 1 1 22 24 9  o 5.900000  0.2318000     6.175000  0.2761000     5.626000  0.3724000     0.5486000      0.4636000 
1 1 1 22 24 10 o 6.954000  0.2036000     6.849000  0.2938000     7.059000  0.2820000     -0.2106000     0.4072000 
1 1 1 22 24 11 o 3.273000  0.4060000     3.985000  0.4385000     2.561000  0.6834000     1.424000       0.8120000 
1 1 1 22 24 12 f 3.789000  0.3564000     4.232000  0.5123000     3.345000  0.4955000     0.8866000      0.7127000 
1 1 1 22 24 13 o 4.056000  0.3955000     4.106000  0.5690000     4.006000  0.5495000     0.1006000      0.7910000 
1 1 1 22 24 14 o 5.267000  0.2847000     5.374000  0.3917000     5.159000  0.4133000     0.2145000      0.5695000 
1 1 1 22 24 15 o 4.861000  0.2911000     4.917000  0.3884000     4.804000  0.4337000     0.1128000      0.5823000 
1 1 1 22 24 16 o 1.823000  0.4612000     2.274000  0.6839000     1.371000  0.6189000     0.9029000      0.9224000 
1 1 1 22 24 17 o 2.620000  0.4809000     2.568000  0.6487000     2.672000  0.7102000     -0.1048000     0.9619000 
1 1 1 22 24 18 o 2.855000  0.4433000     2.679000  0.6302000     3.031000  0.6238000     -0.3518000     0.8867000 
1 1 1 22 24 19 o 1.694000  0.5455000     2.018000  0.9070000     1.370000  0.6063000     0.6484000      1.091000  
1 1 1 22 24 20 o 3.139000  0.4375000     2.667000  0.6746000     3.611000  0.5571000     -0.9442000     0.8750000 
1 1 1 22 24 21 o 1.246000  0.4055000     1.119000  0.5335000     1.373000  0.6108000     -0.2541000     0.8110000 
1 1 1 22 25 0  o 3.623000  0.4468000     3.623000  0.4468000     3.623000  0.4468000     0.000000       0.000000  
1 1 1 22 25 1  o 7.105000  0.2829000     7.105000  0.2829000     ?         ?             ?              ?         
1 1 1 22 25 2  o 21.10000  0.2442000     21.34000  0.3083000     20.87000  0.3789000     0.4742000      0.4885000 
1 1 1 22 25 3  f 14.53000  0.2004000     14.75000  0.3080000     14.32000  0.2563000     0.4299000      0.4008000 
1 1 1 22 25 4  o 5.010000  0.2117000     5.266000  0.3186000     4.753000  0.2788000     0.5125000      0.4234000 
1 1 1 22 25 5  o 6.429000  0.1711000     6.237000  0.2431000     6.620000  0.2407000     -0.3836000     0.3421000 
1 1 1 22 25 6  o 4.726000  0.2102000     4.642000  0.2934000     4.810000  0.3012000     -0.1689000     0.4205000 
1 1 1 22 25 7  o 13.55000  0.1613000     13.72000  0.2281000     13.37000  0.2282000     0.3483000      0.3227000 
1 1 1 22 25 8  o 8.916000  0.1842000     8.766000  0.2374000     9.066000  0.2818000     -0.3003000     0.3684000 
1 1 1 22 25 9  o 3.935000  0.3134000     3.930000  0.3884000     3.941000  0.4918000     -0.1067000E-01 0.6267000 
1 1 1 22 25 10 o 6.597000  0.2760000     6.391000  0.4659000     6.803000  0.2960000     -0.4119000     0.5520000 
1 1 1 22 25 11 o 4.091000  0.3026000     3.882000  0.4503000     4.299000  0.4043000     -0.4165000     0.6052000 
1 1 1 22 25 12 f 1.760000  0.4798000     2.086000  0.7371000     1.435000  0.6143000     0.6510000      0.9596000 
1 1 1 22 25 13 o 6.928000  0.3512000     6.523000  0.6463000     7.333000  0.2750000     -0.8095000     0.7024000 
1 1 1 22 25 14 o 3.904000  0.3767000     3.960000  0.4969000     3.848000  0.5662000     0.1119000      0.7533000 
1 1 1 22 25 15 o 3.190000  0.4336000     3.687000  0.4945000     2.692000  0.7125000     0.9949000      0.8673000 
1 1 1 22 25 16 o 3.675000  0.4025000     3.775000  0.5309000     3.575000  0.6052000     0.2005000      0.8050000 
1 1 1 22 25 17 o 1.753000  0.4856000     1.609000  0.6629000     1.898000  0.7099000     -0.2891000     0.9713000 
1 1 1 22 25 18 o 1.712000  0.4462000     1.202000  0.5588000     2.222000  0.6957000     -1.020000      0.8924000 
1 1 1 22 25 19 o 1.583000  0.4844000     1.896000  0.7754000     1.270000  0.5807000     0.6261000      0.9688000 
1 1 1 22 25 20 o 1.397000  0.4387000     1.479000  0.6401000     1.314000  0.6000000     0.1645000      0.8773000 
1 1 1 22 25 21 o 1.309000  0.4326000     1.185000  0.5708000     1.433000  0.6503000     -0.2475000     0.8652000 
1 1 1 22 26 0  o 9.667000  0.2328000     9.667000  0.2328000     9.667000  0.2328000     0.000000       0.000000  
1 1 1 22 26 1  o 9.422000  0.1552000     9.477000  0.2344000     9.366000  0.2035000     0.1109000      0.3104000 
1 1 1 22 26 2  o 2.676000  0.3502000     3.095000  0.4566000     2.257000  0.5311000     0.8383000      0.7004000 
1 1 1 22 26 3  o 3.005000  0.3158000     2.891000  0.5049000     3.119000  0.3796000     -0.2287000     0.6317000 
1 1 1 22 26 4  o 16.05000  0.1653000     16.10000  0.2343000     16.00000  0.2333000     0.1046000      0.3307000 
1 1 1 22 26 5  o 4.454000  0.2166000     4.579000  0.2972000     4.329000  0.3152000     0.2499000      0.4333000 
1 1 1 22 26 6  o 8.406000  0.1626000     8.327000  0.2297000     8.484000  0.2301000     -0.1574000     0.3251000 
1 1 1 22 26 7  o 12.37000  0.1606000     12.41000  0.2278000     12.33000  0.2265000     0.8280000E-01  0.3213000 
1 1 1 22 26 8  o 9.346000  0.1840000     9.436000  0.2354000     9.256000  0.2827000     0.1792000      0.3679000 
1 1 1 22 26 9  o 6.491000  0.2223000     6.489000  0.2786000     6.493000  0.3465000     -0.4510000E-02 0.4446000 
1 1 1 22 26 10 o 8.028000  0.2340000     7.908000  0.3066000     8.148000  0.3535000     -0.2402000     0.4679000 
1 1 1 22 26 11 o 4.283000  0.2939000     4.141000  0.4269000     4.425000  0.4040000     -0.2835000     0.5878000 
1 1 1 22 26 12 o 1.413000  0.4342000     1.651000  0.6466000     1.176000  0.5795000     0.4747000      0.8683000 
1 1 1 22 26 13 o 2.518000  0.4658000     1.947000  0.7479000     3.088000  0.5555000     -1.141000      0.9316000 
1 1 1 22 26 14 o 2.093000  0.5085000     2.430000  0.7273000     1.756000  0.7109000     0.6739000      1.017000  
1 1 1 22 26 15 o 1.619000  0.4685000     1.472000  0.6216000     1.767000  0.7012000     -0.2942000     0.9370000 
1 1 1 22 26 16 o 2.798000  0.6391000     2.576000  0.6818000     3.020000  1.081000      -0.4430000     1.278000  
1 1 1 22 26 17 o 2.020000  0.4928000     1.969000  0.6933000     2.071000  0.7005000     -0.1027000     0.9856000 
1 1 1 22 26 18 o 0.9959000 0.3477000     0.9700000 0.4785000     1.022000  0.5045000     -0.5176000E-01 0.6953000 
1 1 1 22 26 19 o 2.698000  0.4592000     3.197000  0.5767000     2.199000  0.7147000     0.9972000      0.9184000 
1 1 1 22 26 20 f 1.749000  0.4786000     1.592000  0.6568000     1.907000  0.6962000     -0.3151000     0.9571000 
1 1 1 22 27 0  o 11.16000  0.2069000     11.16000  0.2069000     11.16000  0.2069000     0.000000       0.000000  
1 1 1 22 27 1  o 16.97000  0.1676000     16.95000  0.2369000     16.99000  0.2372000     -0.3622000E-01 0.3353000 
1 1 1 22 27 2  o 15.74000  0.1623000     15.87000  0.2303000     15.61000  0.2287000     0.2540000      0.3245000 
1 1 1 22 27 3  o 2.293000  0.3660000     2.658000  0.4632000     1.929000  0.5667000     0.7297000      0.7319000 
1 1 1 22 27 4  o 11.84000  0.1518000     11.81000  0.2140000     11.87000  0.2152000     -0.6667000E-01 0.3035000 
1 1 1 22 27 5  o 6.680000  0.1765000     6.605000  0.2519000     6.755000  0.2473000     -0.1497000     0.3530000 
1 1 1 22 27 6  o 9.696000  0.1585000     9.599000  0.2225000     9.792000  0.2257000     -0.1934000     0.3169000 
1 1 1 22 27 7  o 6.263000  0.1920000     6.482000  0.2669000     6.043000  0.2761000     0.4392000      0.3840000 
1 1 1 22 27 8  o 5.040000  0.2501000     4.718000  0.3322000     5.361000  0.3741000     -0.6432000     0.5003000 
1 1 1 22 27 9  o 3.019000  0.4837000     3.863000  0.4927000     2.175000  0.8326000     1.688000       0.9674000 
1 1 1 22 27 10 o 1.557000  0.4493000     1.420000  0.6107000     1.695000  0.6592000     -0.2750000     0.8986000 
1 1 1 22 27 11 o 2.808000  0.4223000     2.323000  0.6708000     3.293000  0.5131000     -0.9705000     0.8445000 
1 1 1 22 27 12 o 3.970000  0.4376000     3.661000  0.6912000     4.279000  0.5369000     -0.6178000     0.8752000 
1 1 1 22 27 13 o 3.034000  0.4347000     3.026000  0.6672000     3.042000  0.5572000     -0.1607000E-01 0.8693000 
1 1 1 22 27 14 o 1.829000  0.4948000     1.934000  0.7479000     1.725000  0.6479000     0.2093000      0.9895000 
1 1 1 22 27 15 o 2.132000  0.4935000     1.943000  0.6940000     2.321000  0.7017000     -0.3778000     0.9869000 
1 1 1 22 27 16 o 1.581000  0.4945000     1.235000  0.5715000     1.928000  0.8073000     -0.6937000     0.9891000 
1 1 1 22 27 17 o 1.351000  0.4242000     1.253000  0.5739000     1.450000  0.6249000     -0.1972000     0.8485000 
1 1 1 22 27 18 o 1.272000  0.4194000     1.167000  0.5626000     1.377000  0.6220000     -0.2096000     0.8387000 
1 1 1 22 27 19 f 1.868000  0.4444000     2.451000  0.6633000     1.285000  0.5916000     1.165000       0.8888000 
1 1 1 22 27 20 f 1.842000  0.4794000     2.154000  0.6995000     1.531000  0.6558000     0.6232000      0.9588000 
1 1 1 22 28 0  o 14.02000  0.2205000     14.02000  0.2205000     14.02000  0.2205000     0.000000       0.000000  
1 1 1 22 28 1  f 10.01000  0.1495000     10.00000  0.2127000     10.02000  0.2102000     -0.1886000E-01 0.2990000 
1 1 1 22 28 2  o 9.565000  0.1516000     9.364000  0.2137000     9.766000  0.2151000     -0.4020000     0.3032000 
1 1 1 22 28 3  o 10.47000  0.1520000     10.33000  0.2152000     10.61000  0.2148000     -0.2815000     0.3040000 
1 1 1 22 28 4  o 3.925000  0.2461000     3.367000  0.3841000     4.484000  0.3079000     -1.116000      0.4922000 
1 1 1 22 28 5  o 10.92000  0.1562000     10.98000  0.2206000     10.85000  0.2212000     0.1326000      0.3124000 
1 1 1 22 28 6  f 7.106000  0.1769000     7.214000  0.2467000     6.998000  0.2536000     0.2164000      0.3538000 
1 1 1 22 28 7  o 4.659000  0.2410000     5.105000  0.3137000     4.213000  0.3660000     0.8914000      0.4821000 
1 1 1 22 28 8  o 4.761000  0.2719000     4.665000  0.3414000     4.858000  0.4232000     -0.1931000     0.5437000 
1 1 1 22 28 9  o 6.138000  0.3558000     6.325000  0.3292000     5.951000  0.6310000     0.3744000      0.7117000 
1 1 1 22 28 10 o 4.593000  0.2754000     4.458000  0.4044000     4.729000  0.3740000     -0.2706000     0.5508000 
1 1 1 22 28 11 o 2.691000  0.4792000     2.613000  0.6474000     2.769000  0.7066000     -0.1560000     0.9584000 
1 1 1 22 28 12 o 2.092000  0.4491000     1.366000  0.6225000     2.819000  0.6476000     -1.453000      0.8983000 
1 1 1 22 28 13 o 3.335000  0.3891000     3.176000  0.5497000     3.494000  0.5508000     -0.3184000     0.7781000 
1 1 1 22 28 14 o 1.786000  0.4711000     2.267000  0.7442000     1.305000  0.5779000     0.9619000      0.9423000 
1 1 1 22 28 15 o 2.493000  0.4855000     2.736000  0.6373000     2.251000  0.7325000     0.4850000      0.9709000 
1 1 1 22 28 16 o 1.574000  0.4549000     1.285000  0.5827000     1.863000  0.6988000     -0.5785000     0.9099000 
1 1 1 22 28 17 o 1.529000  0.4416000     1.787000  0.6651000     1.270000  0.5810000     0.5167000      0.8831000 
1 1 1 22 28 18 o 1.097000  0.3929000     1.292000  0.6440000     0.9033000 0.4503000     0.3883000      0.7858000 
1 1 1 22 28 19 o 1.486000  0.4452000     1.223000  0.5673000     1.749000  0.6863000     -0.5257000     0.8905000 
1 1 1 22 28 20 o 1.051000  0.3620000     1.049000  0.5103000     1.053000  0.5137000     -0.3471000E-02 0.7241000 
1 1 1 22 29 0  o 2.859000  0.4729000     2.859000  0.4729000     2.859000  0.4729000     0.000000       0.000000  
1 1 1 22 29 1  o 8.965000  0.1545000     8.847000  0.2177000     9.084000  0.2193000     -0.2374000     0.3090000 
1 1 1 22 29 2  o 12.65000  0.1545000     12.52000  0.2172000     12.78000  0.2199000     -0.2580000     0.3091000 
1 1 1 22 29 3  o 6.145000  0.1795000     6.057000  0.2547000     6.232000  0.2530000     -0.1749000     0.3590000 
1 1 1 22 29 4  o 3.461000  0.2841000     3.090000  0.4373000     3.833000  0.3628000     -0.7436000     0.5682000 
1 1 1 22 29 5  o 10.82000  0.1590000     10.76000  0.2242000     10.88000  0.2254000     -0.1119000     0.3179000 
1 1 1 22 29 6  o 8.373000  0.1692000     8.315000  0.2363000     8.430000  0.2423000     -0.1149000     0.3384000 
1 1 1 22 29 7  o 5.058000  0.2516000     5.377000  0.2964000     4.738000  0.4067000     0.6396000      0.5032000 
1 1 1 22 29 8  o 6.473000  0.2449000     6.895000  0.3263000     6.051000  0.3652000     0.8443000      0.4897000 
1 1 1 22 29 9  o 1.686000  0.4294000     2.170000  0.6489000     1.202000  0.5625000     0.9679000      0.8588000 
1 1 1 22 29 10 o 1.990000  0.4544000     1.528000  0.6381000     2.451000  0.6470000     -0.9233000     0.9087000 
1 1 1 22 29 11 o 3.172000  0.5036000     3.402000  0.7178000     2.942000  0.7067000     0.4601000      1.007000  
1 1 1 22 29 12 o 7.097000  0.2122000     7.259000  0.2844000     6.934000  0.3149000     0.3245000      0.4243000 
1 1 1 22 29 13 o 3.264000  0.3910000     3.578000  0.4751000     2.950000  0.6211000     0.6285000      0.7820000 
1 1 1 22 29 14 o 2.002000  0.4807000     1.794000  0.7167000     2.210000  0.6409000     -0.4158000     0.9615000 
1 1 1 22 29 15 o 1.794000  0.4969000     1.729000  0.7185000     1.859000  0.6866000     -0.1299000     0.9938000 
1 1 1 22 29 16 o 2.665000  0.4436000     3.342000  0.5298000     1.989000  0.7117000     1.353000       0.8873000 
1 1 1 22 29 17 f 1.158000  0.3880000     1.210000  0.5615000     1.107000  0.5356000     0.1033000      0.7760000 
1 1 1 22 29 18 o 1.398000  0.4454000     1.339000  0.6269000     1.456000  0.6330000     -0.1178000     0.8909000 
1 1 1 22 29 19 o 1.373000  0.4311000     1.416000  0.6154000     1.331000  0.6039000     0.8497000E-01  0.8623000 
1 1 1 22 29 20 o 1.041000  0.3596000     0.8828000 0.4441000     1.199000  0.5656000     -0.3158000     0.7192000 
1 1 1 22 30 0  o 20.75000  0.2715000     20.75000  0.2715000     20.75000  0.2715000     0.000000       0.000000  
1 1 1 22 30 1  o 14.94000  0.1629000     15.12000  0.2308000     14.76000  0.2300000     0.3660000      0.3259000 
1 1 1 22 30 2  o 7.882000  0.1629000     7.638000  0.2324000     8.127000  0.2283000     -0.4896000     0.3258000 
1 1 1 22 30 3  o 6.101000  0.1837000     6.012000  0.2612000     6.191000  0.2584000     -0.1795000     0.3674000 
1 1 1 22 30 4  o 6.212000  0.1861000     6.747000  0.2472000     5.677000  0.2783000     1.070000       0.3722000 
1 1 1 22 30 5  o 9.202000  0.1636000     9.350000  0.2311000     9.054000  0.2316000     0.2954000      0.3271000 
1 1 1 22 30 6  o 1.184000  0.3770000     1.262000  0.5511000     1.107000  0.5145000     0.1552000      0.7540000 
1 1 1 22 30 7  o 8.243000  0.1996000     8.477000  0.2484000     8.009000  0.3125000     0.4682000      0.3992000 
1 1 1 22 30 8  o 4.487000  0.4197000     4.477000  0.4060000     4.497000  0.7346000     -0.1999000E-01 0.8393000 
1 1 1 22 30 9  o 10.71000  0.1780000     10.61000  0.2512000     10.81000  0.2523000     -0.2003000     0.3560000 
1 1 1 22 30 10 o 5.438000  0.3148000     5.586000  0.3542000     5.289000  0.5205000     0.2968000      0.6296000 
1 1 1 22 30 11 o 1.396000  0.4448000     1.428000  0.6545000     1.364000  0.6024000     0.6395000E-01  0.8895000 
1 1 1 22 30 12 o 1.941000  0.4565000     1.374000  0.6007000     2.508000  0.6876000     -1.133000      0.9131000 
1 1 1 22 30 13 o 2.799000  0.4410000     2.678000  0.6181000     2.920000  0.6291000     -0.2423000     0.8819000 
1 1 1 22 30 14 o 2.926000  0.4051000     2.882000  0.5646000     2.970000  0.5811000     -0.8749000E-01 0.8102000 
1 1 1 22 30 15 o 2.114000  0.4671000     1.478000  0.6691000     2.750000  0.6518000     -1.272000      0.9341000 
1 1 1 22 30 16 o 1.408000  0.4384000     1.443000  0.6290000     1.373000  0.6109000     0.7012000E-01  0.8768000 
1 1 1 22 30 17 o 2.954000  0.5504000     2.494000  0.7649000     3.414000  0.7917000     -0.9202000     1.101000  
1 1 1 22 30 18 o 1.499000  0.4505000     1.544000  0.6466000     1.454000  0.6276000     0.9011000E-01  0.9011000 
1 1 1 22 30 19 o 1.431000  0.4451000     1.356000  0.6089000     1.507000  0.6493000     -0.1505000     0.8902000 
1 1 1 22 31 0  o 13.40000  0.2254000     13.40000  0.2254000     13.40000  0.2254000     0.000000       0.000000  
1 1 1 22 31 1  f 19.47000  0.1863000     19.81000  0.2667000     19.13000  0.2603000     0.6827000      0.3727000 
1 1 1 22 31 2  o 9.921000  0.1571000     9.892000  0.2228000     9.950000  0.2215000     -0.5781000E-01 0.3142000 
1 1 1 22 31 3  o 6.550000  0.1798000     6.242000  0.2607000     6.858000  0.2475000     -0.6163000     0.3595000 
1 1 1 22 31 4  o 3.550000  0.2860000     3.443000  0.4153000     3.658000  0.3933000     -0.2156000     0.5719000 
1 1 1 22 31 5  o 7.651000  0.1751000     7.759000  0.2457000     7.543000  0.2496000     0.2151000      0.3503000 
1 1 1 22 31 6  o 13.04000  0.1665000     13.16000  0.2347000     12.92000  0.2363000     0.2342000      0.3330000 
1 1 1 22 31 7  o 4.783000  0.3854000     4.672000  0.5095000     4.894000  0.5783000     -0.2223000     0.7708000 
1 1 1 22 31 8  o 4.593000  0.3131000     4.771000  0.3595000     4.416000  0.5127000     0.3551000      0.6262000 
1 1 1 22 31 9  o 8.751000  0.2030000     8.944000  0.2612000     8.559000  0.3108000     0.3852000      0.4060000 
1 1 1 22 31 10 f 7.620000  0.2592000     7.988000  0.3844000     7.251000  0.3478000     0.7372000      0.5184000 
1 1 1 22 31 11 o 2.533000  0.4585000     2.853000  0.6244000     2.213000  0.6715000     0.6406000      0.9170000 
1 1 1 22 31 12 o 1.954000  0.4695000     2.169000  0.6620000     1.738000  0.6659000     0.4310000      0.9390000 
1 1 1 22 31 13 o 3.220000  0.3961000     3.990000  0.4161000     2.449000  0.6742000     1.540000       0.7923000 
1 1 1 22 31 14 o 1.749000  0.4846000     1.866000  0.7218000     1.632000  0.6469000     0.2341000      0.9693000 
1 1 1 22 31 15 o 1.560000  0.4474000     1.363000  0.6204000     1.758000  0.6448000     -0.3946000     0.8948000 
1 1 1 22 31 16 o 1.620000  0.4708000     1.454000  0.6573000     1.786000  0.6742000     -0.3320000     0.9416000 
1 1 1 22 31 17 f 1.418000  0.4702000     1.470000  0.7196000     1.366000  0.6054000     0.1040000      0.9403000 
1 1 1 22 31 18 o 1.096000  0.3700000     1.192000  0.5540000     0.9995000 0.4907000     0.1930000      0.7401000 
1 1 1 22 31 19 o 1.323000  0.4214000     1.484000  0.6358000     1.162000  0.5533000     0.3216000      0.8429000 
1 1 1 22 32 0  o 6.075000  0.2653000     6.075000  0.2653000     6.075000  0.2653000     0.000000       0.000000  
1 1 1 22 32 1  o 1.672000  0.4085000     1.297000  0.5526000     2.047000  0.6018000     -0.7493000     0.8170000 
1 1 1 22 32 2  o 6.758000  0.1802000     6.979000  0.2483000     6.537000  0.2612000     0.4415000      0.3604000 
1 1 1 22 32 3  o 5.116000  0.2138000     5.379000  0.2892000     4.852000  0.3149000     0.5262000      0.4276000 
1 1 1 22 32 4  o 8.473000  0.1679000     8.785000  0.2359000     8.161000  0.2389000     0.6240000      0.3357000 
1 1 1 22 32 5  f 8.506000  0.1736000     8.708000  0.2417000     8.303000  0.2492000     0.4053000      0.3471000 
1 1 1 22 32 6  o 7.466000  0.2063000     7.638000  0.3089000     7.294000  0.2737000     0.3439000      0.4127000 
1 1 1 22 32 7  o 2.389000  0.5391000     2.689000  0.6362000     2.089000  0.8706000     0.5999000      1.078000  
1 1 1 22 32 8  o 4.036000  0.3476000     4.275000  0.3985000     3.797000  0.5696000     0.4780000      0.6951000 
1 1 1 22 32 9  o 7.990000  0.2262000     7.888000  0.2973000     8.092000  0.3409000     -0.2039000     0.4523000 
1 1 1 22 32 10 o 7.556000  0.2079000     7.597000  0.3043000     7.515000  0.2835000     0.8209000E-01  0.4159000 
1 1 1 22 32 11 o 3.594000  0.3491000     3.755000  0.4651000     3.434000  0.5208000     0.3214000      0.6982000 
1 1 1 22 32 12 o 2.283000  0.4661000     2.482000  0.6307000     2.083000  0.6866000     0.3992000      0.9323000 
1 1 1 22 32 13 o 2.916000  0.4169000     2.601000  0.6046000     3.230000  0.5742000     -0.6282000     0.8338000 
1 1 1 22 32 14 o 2.537000  0.5423000     2.282000  0.7944000     2.792000  0.7385000     -0.5106000     1.085000  
1 1 1 22 32 15 o 4.149000  0.2989000     4.121000  0.4322000     4.177000  0.4130000     -0.5618000E-01 0.5978000 
1 1 1 22 32 16 o 1.769000  0.4704000     2.186000  0.7364000     1.352000  0.5856000     0.8344000      0.9408000 
1 1 1 22 32 17 o 1.480000  0.4492000     1.260000  0.5999000     1.700000  0.6688000     -0.4402000     0.8984000 
1 1 1 22 32 18 o 1.586000  0.4595000     1.731000  0.6658000     1.441000  0.6334000     0.2900000      0.9190000 
1 1 1 22 32 19 o 1.021000  0.3530000     0.8712000 0.4370000     1.171000  0.5546000     -0.2998000     0.7061000 
1 1 1 22 33 0  o 8.400000  0.2348000     8.400000  0.2348000     8.400000  0.2348000     0.000000       0.000000  
1 1 1 22 33 1  o 1.931000  0.3962000     2.522000  0.5516000     1.339000  0.5689000     1.183000       0.7924000 
1 1 1 22 33 2  o 1.574000  0.4263000     1.616000  0.6026000     1.533000  0.6033000     0.8313000E-01  0.8527000 
1 1 1 22 33 3  o 6.357000  0.1892000     6.544000  0.2607000     6.170000  0.2743000     0.3743000      0.3784000 
1 1 1 22 33 4  o 2.479000  0.4070000     2.143000  0.6242000     2.814000  0.5226000     -0.6714000     0.8141000 
1 1 1 22 33 5  o 2.770000  0.4269000     2.227000  0.7132000     3.313000  0.4692000     -1.086000      0.8537000 
1 1 1 22 33 6  o 6.341000  0.2618000     6.227000  0.3360000     6.454000  0.4014000     -0.2277000     0.5235000 
1 1 1 22 33 7  o 4.335000  0.3080000     4.395000  0.3754000     4.274000  0.4883000     0.1211000      0.6159000 
1 1 1 22 33 8  o 6.683000  0.2737000     6.722000  0.3211000     6.643000  0.4435000     0.7911000E-01  0.5475000 
1 1 1 22 33 9  f 8.278000  0.2322000     8.154000  0.3818000     8.403000  0.2645000     -0.2487000     0.4645000 
1 1 1 22 33 10 o 5.596000  0.2507000     5.685000  0.3620000     5.507000  0.3468000     0.1787000      0.5013000 
1 1 1 22 33 11 o 1.191000  0.3909000     1.230000  0.5637000     1.152000  0.5418000     0.7764000E-01  0.7819000 
1 1 1 22 33 12 o 2.991000  0.4200000     2.967000  0.5889000     3.016000  0.5990000     -0.4891000E-01 0.8400000 
1 1 1 22 33 13 o 3.981000  0.3220000     4.312000  0.4154000     3.650000  0.4922000     0.6619000      0.6440000 
1 1 1 22 33 14 o 3.445000  0.4078000     3.092000  0.5297000     3.798000  0.6201000     -0.7057000     0.8156000 
1 1 1 22 33 15 o 1.137000  0.3740000     1.098000  0.5175000     1.176000  0.5400000     -0.7834000E-01 0.7480000 
1 1 1 22 33 16 o 2.304000  0.5340000     2.648000  0.7861000     1.961000  0.7229000     0.6867000      1.068000  
1 1 1 22 33 17 o 1.259000  0.4082000     1.117000  0.5304000     1.402000  0.6205000     -0.2849000     0.8163000 
1 1 1 22 33 18 o 1.786000  0.4634000     1.343000  0.6001000     2.230000  0.7064000     -0.8871000     0.9269000 
1 1 1 22 33 19 o 1.421000  0.4562000     1.555000  0.6905000     1.288000  0.5962000     0.2675000      0.9123000 
1 1 1 22 34 0  o 8.895000  0.2381000     8.895000  0.2381000     8.895000  0.2381000     0.000000       0.000000  
1 1 1 22 34 1  o 2.452000  0.4073000     2.403000  0.5889000     2.501000  0.5627000     -0.9867000E-01 0.8146000 
1 1 1 22 34 2  o 4.683000  0.2355000     4.396000  0.3467000     4.970000  0.3188000     -0.5739000     0.4710000 
1 1 1 22 34 3  o 1.367000  0.3987000     1.663000  0.6185000     1.072000  0.5035000     0.5913000      0.7975000 
1 1 1 22 34 4  o 4.450000  0.2788000     4.742000  0.4074000     4.158000  0.3806000     0.5835000      0.5575000 
1 1 1 22 34 5  o 8.257000  0.2121000     8.558000  0.2898000     7.957000  0.3097000     0.6013000      0.4241000 
1 1 1 22 34 6  f 4.990000  0.3091000     5.156000  0.3316000     4.824000  0.5219000     0.3318000      0.6183000 
1 1 1 22 34 7  o 1.957000  0.5007000     2.239000  0.6740000     1.674000  0.7407000     0.5658000      1.001000  
1 1 1 22 34 8  o 3.204000  0.4521000     3.381000  0.6127000     3.026000  0.6650000     0.3552000      0.9042000 
1 1 1 22 34 9  f 1.097000  0.3701000     1.188000  0.5557000     1.006000  0.4890000     0.1817000      0.7402000 
1 1 1 22 34 10 o 1.746000  0.4656000     1.772000  0.6646000     1.719000  0.6522000     0.5377000E-01  0.9311000 
1 1 1 22 34 11 o 3.137000  0.3986000     3.177000  0.5522000     3.096000  0.5750000     0.8137000E-01  0.7972000 
1 1 1 22 34 12 o 2.981000  0.4097000     2.986000  0.5736000     2.975000  0.5853000     0.1071000E-01  0.8195000 
1 1 1 22 34 13 o 4.327000  0.3299000     4.495000  0.5032000     4.159000  0.4268000     0.3358000      0.6598000 
1 1 1 22 34 14 o 3.033000  0.3967000     3.195000  0.5037000     2.871000  0.6129000     0.3235000      0.7933000 
1 1 1 22 34 15 o 1.540000  0.4429000     1.465000  0.6038000     1.616000  0.6483000     -0.1509000     0.8859000 
1 1 1 22 34 16 o 1.812000  0.4651000     1.899000  0.6942000     1.725000  0.6192000     0.1733000      0.9303000 
1 1 1 22 34 17 o 1.336000  0.4165000     1.772000  0.7074000     0.8997000 0.4399000     0.8727000      0.8330000 
1 1 1 22 34 18 o 1.315000  0.4187000     1.421000  0.6154000     1.209000  0.5678000     0.2119000      0.8374000 
1 1 1 22 35 0  o 2.042000  0.7744000     2.042000  0.7744000     2.042000  0.7744000     0.000000       0.000000  
1 1 1 22 35 1  f 2.964000  0.3610000     2.793000  0.5406000     3.136000  0.4787000     -0.3429000     0.7221000 
1 1 1 22 35 2  o 5.360000  0.2221000     5.200000  0.3193000     5.520000  0.3088000     -0.3201000     0.4442000 
1 1 1 22 35 3  o 3.623000  0.3347000     3.690000  0.4992000     3.556000  0.4459000     0.1339000      0.6694000 
1 1 1 22 35 4  o 3.965000  0.3312000     4.156000  0.4439000     3.774000  0.4916000     0.3821000      0.6623000 
1 1 1 22 35 5  o 2.063000  0.4997000     1.941000  0.6474000     2.185000  0.7614000     -0.2444000     0.9994000 
1 1 1 22 35 6  o 5.469000  0.3175000     5.642000  0.3530000     5.297000  0.5278000     0.3449000      0.6350000 
1 1 1 22 35 7  f 8.396000  0.2297000     8.421000  0.3248000     8.371000  0.3249000     0.5067000E-01  0.4594000 
1 1 1 22 35 8  o 6.346000  0.2209000     6.289000  0.3090000     6.403000  0.3158000     -0.1139000     0.4418000 
1 1 1 22 35 9  o 1.361000  0.4130000     1.040000  0.5040000     1.682000  0.6544000     -0.6417000     0.8260000 
1 1 1 22 35 10 o 2.008000  0.4844000     1.758000  0.6730000     2.257000  0.6969000     -0.4990000     0.9688000 
1 1 1 22 35 11 f 1.662000  0.4567000     1.343000  0.5972000     1.981000  0.6911000     -0.6378000     0.9134000 
1 1 1 22 35 12 o 3.211000  0.3843000     3.519000  0.4925000     2.903000  0.5899000     0.6155000      0.7685000 
1 1 1 22 35 13 o 3.950000  0.3871000     3.972000  0.4858000     3.928000  0.6029000     0.4440000E-01  0.7743000 
1 1 1 22 35 14 o 1.786000  0.4412000     2.190000  0.6432000     1.383000  0.6041000     0.8064000      0.8824000 
1 1 1 22 35 15 o 1.626000  0.4566000     1.710000  0.6345000     1.542000  0.6567000     0.1679000      0.9132000 
1 1 1 22 35 16 o 1.431000  0.4165000     1.099000  0.5191000     1.763000  0.6514000     -0.6636000     0.8330000 
1 1 1 22 35 17 f 1.636000  0.4484000     1.399000  0.6336000     1.872000  0.6347000     -0.4729000     0.8968000 
1 1 1 22 35 18 o 1.472000  0.4456000     1.711000  0.6775000     1.232000  0.5790000     0.4793000      0.8912000 
1 1 1 22 36 0  o 7.956000  0.3009000     7.956000  0.3009000     7.956000  0.3009000     0.000000       0.000000  
1 1 1 22 36 1  o 1.346000  0.4202000     1.337000  0.5975000     1.355000  0.5911000     -0.1841000E-01 0.8405000 
1 1 1 22 36 2  o 6.740000  0.2782000     6.782000  0.3985000     6.699000  0.3883000     0.8326000E-01  0.5564000 
1 1 1 22 36 3  o 6.559000  0.3168000     6.366000  0.3284000     6.752000  0.5418000     -0.3861000     0.6336000 
1 1 1 22 36 4  o 5.037000  0.2967000     4.954000  0.3618000     5.121000  0.4704000     -0.1677000     0.5934000 
1 1 1 22 36 5  o 6.395000  0.2438000     6.248000  0.3320000     6.542000  0.3570000     -0.2938000     0.4875000 
1 1 1 22 36 6  f 4.584000  0.3411000     4.185000  0.5241000     4.983000  0.4368000     -0.7976000     0.6822000 
1 1 1 22 36 7  o 6.472000  0.2363000     6.674000  0.2930000     6.270000  0.3708000     0.4037000      0.4726000 
1 1 1 22 36 8  o 3.164000  0.3988000     3.399000  0.4973000     2.928000  0.6237000     0.4710000      0.7977000 
1 1 1 22 36 9  o 2.169000  0.4789000     2.466000  0.6765000     1.873000  0.6780000     0.5932000      0.9578000 
1 1 1 22 36 10 o 4.244000  0.3129000     4.340000  0.4478000     4.147000  0.4373000     0.1928000      0.6259000 
1 1 1 22 36 11 o 1.812000  0.4504000     1.369000  0.6046000     2.255000  0.6677000     -0.8859000     0.9008000 
1 1 1 22 36 12 o 2.146000  0.5094000     2.396000  0.7555000     1.895000  0.6836000     0.5007000      1.019000  
1 1 1 22 36 13 o 1.387000  0.4269000     1.152000  0.5408000     1.622000  0.6608000     -0.4694000     0.8539000 
1 1 1 22 36 14 o 2.426000  0.4613000     2.511000  0.6487000     2.342000  0.6561000     0.1690000      0.9226000 
1 1 1 22 36 15 o 1.515000  0.4744000     1.560000  0.6760000     1.469000  0.6656000     0.9111000E-01  0.9487000 
1 1 1 22 36 16 o 1.223000  0.3936000     1.213000  0.5517000     1.234000  0.5615000     -0.2122000E-01 0.7872000 
1 1 1 22 36 17 o 1.524000  0.4549000     1.481000  0.6649000     1.567000  0.6208000     -0.8569000E-01 0.9097000 
1 1 1 22 36 18 f 1.989000  0.5412000     2.376000  0.8352000     1.602000  0.6884000     0.7746000      1.082000  
1 1 1 22 37 0  f 6.952000  0.4055000     6.952000  0.4055000     6.952000  0.4055000     0.000000       0.000000  
1 1 1 22 37 1  o 5.518000  0.4278000     5.518000  0.4278000     ?         ?             ?              ?         
1 1 1 22 37 2  o 3.604000  0.4206000     3.096000  0.5779000     4.113000  0.6111000     -1.018000      0.8411000 
1 1 1 22 37 3  o 1.582000  0.4630000     1.398000  0.6109000     1.766000  0.6959000     -0.3683000     0.9260000 
1 1 1 22 37 4  o 5.255000  0.3129000     5.631000  0.4373000     4.879000  0.4475000     0.7526000      0.6257000 
1 1 1 22 37 5  o 1.527000  0.4476000     1.840000  0.7013000     1.214000  0.5563000     0.6262000      0.8951000 
1 1 1 22 37 6  o 2.220000  0.4885000     1.898000  0.6653000     2.543000  0.7156000     -0.6445000     0.9770000 
1 1 1 22 37 7  o 1.444000  0.4423000     1.155000  0.5368000     1.732000  0.7032000     -0.5769000     0.8847000 
1 1 1 22 37 8  o 3.502000  0.3427000     3.635000  0.4448000     3.370000  0.5215000     0.2650000      0.6854000 
1 1 1 22 37 9  o 2.045000  0.4755000     2.366000  0.6823000     1.724000  0.6624000     0.6420000      0.9509000 
1 1 1 22 37 10 o 4.320000  0.3091000     4.569000  0.4343000     4.072000  0.4400000     0.4972000      0.6182000 
1 1 1 22 37 11 o 1.625000  0.4521000     1.855000  0.6653000     1.395000  0.6125000     0.4596000      0.9043000 
1 1 1 22 37 12 f 1.919000  0.5258000     1.808000  0.7548000     2.031000  0.7324000     -0.2229000     1.052000  
1 1 1 22 37 13 o 2.496000  0.4643000     2.576000  0.6516000     2.416000  0.6615000     0.1605000      0.9285000 
1 1 1 22 37 14 o 2.319000  0.4398000     2.968000  0.5482000     1.670000  0.6879000     1.297000       0.8796000 
1 1 1 22 37 15 o 1.330000  0.4101000     1.102000  0.5233000     1.558000  0.6316000     -0.4555000     0.8202000 
1 1 1 22 37 16 o 1.790000  0.4274000     1.267000  0.5696000     2.312000  0.6375000     -1.045000      0.8549000 
1 1 1 22 37 17 o 1.545000  0.4342000     1.299000  0.5775000     1.791000  0.6484000     -0.4920000     0.8683000 
1 1 1 22 38 0  o 15.42000  0.2931000     15.42000  0.2931000     15.42000  0.2931000     0.000000       0.000000  
1 1 1 22 38 1  o 1.773000  0.4490000     2.330000  0.7039000     1.216000  0.5575000     1.114000       0.8979000 
1 1 1 22 38 2  o 2.476000  0.4580000     2.725000  0.6499000     2.227000  0.6455000     0.4978000      0.9160000 
1 1 1 22 38 3  o 6.316000  0.2286000     6.011000  0.3521000     6.621000  0.2918000     -0.6100000     0.4573000 
1 1 1 22 38 4  o 4.789000  0.2560000     4.784000  0.3501000     4.795000  0.3734000     -0.1069000E-01 0.5119000 
1 1 1 22 38 5  o 1.800000  0.4607000     2.169000  0.6612000     1.431000  0.6417000     0.7380000      0.9214000 
1 1 1 22 38 6  o 2.225000  0.4695000     2.610000  0.6119000     1.839000  0.7122000     0.7714000      0.9390000 
1 1 1 22 38 7  o 4.984000  0.2652000     5.558000  0.3254000     4.409000  0.4189000     1.150000       0.5304000 
1 1 1 22 38 8  o 4.253000  0.2908000     4.589000  0.3793000     3.918000  0.4408000     0.6706000      0.5815000 
1 1 1 22 38 9  o 2.813000  0.4526000     2.770000  0.6773000     2.855000  0.6007000     -0.8530000E-01 0.9053000 
1 1 1 22 38 10 o 3.715000  0.3443000     3.832000  0.4832000     3.599000  0.4906000     0.2335000      0.6886000 
1 1 1 22 38 11 o 1.408000  0.4348000     1.843000  0.7274000     0.9734000 0.4764000     0.8694000      0.8695000 
1 1 1 22 38 12 o 3.252000  0.3968000     3.214000  0.5322000     3.289000  0.5887000     -0.7462000E-01 0.7936000 
1 1 1 22 38 13 o 1.422000  0.4182000     1.792000  0.6669000     1.052000  0.5048000     0.7399000      0.8364000 
1 1 1 22 38 14 o 1.256000  0.4180000     1.000000  0.4898000     1.513000  0.6775000     -0.5125000     0.8360000 
1 1 1 22 38 15 o 2.418000  0.4423000     1.993000  0.6646000     2.844000  0.5837000     -0.8505000     0.8845000 
1 1 1 22 38 16 o 1.698000  0.4608000     1.605000  0.6449000     1.792000  0.6584000     -0.1870000     0.9216000 
1 1 1 22 38 17 o 1.989000  0.4741000     2.173000  0.6817000     1.805000  0.6591000     0.3674000      0.9482000 
1 1 1 22 39 0  o 9.157000  0.2603000     9.157000  0.2603000     9.157000  0.2603000     0.000000       0.000000  
1 1 1 22 39 1  o 5.601000  0.2305000     5.716000  0.3203000     5.486000  0.3315000     0.2299000      0.4610000 
1 1 1 22 39 2  o 3.210000  0.3604000     3.424000  0.4757000     2.996000  0.5415000     0.4273000      0.7207000 
1 1 1 22 39 3  o 6.825000  0.2020000     6.758000  0.2860000     6.891000  0.2854000     -0.1331000     0.4041000 
1 1 1 22 39 4  o 5.153000  0.2496000     5.371000  0.3391000     4.935000  0.3663000     0.4355000      0.4992000 
1 1 1 22 39 5  o 1.691000  0.4620000     1.858000  0.6526000     1.525000  0.6542000     0.3327000      0.9241000 
1 1 1 22 39 6  o 2.236000  0.4886000     1.909000  0.6671000     2.562000  0.7140000     -0.6530000     0.9772000 
1 1 1 22 39 7  f 3.987000  0.3144000     3.929000  0.4518000     4.045000  0.4374000     -0.1163000     0.6288000 
1 1 1 22 39 8  o 4.259000  0.2945000     4.293000  0.4126000     4.224000  0.4204000     0.6930000E-01  0.5890000 
1 1 1 22 39 9  o 5.013000  0.2787000     4.864000  0.4200000     5.162000  0.3663000     -0.2977000     0.5573000 
1 1 1 22 39 10 o 2.682000  0.4429000     2.265000  0.6791000     3.099000  0.5688000     -0.8341000     0.8859000 
1 1 1 22 39 11 o 8.221000  0.2358000     8.120000  0.3325000     8.321000  0.3346000     -0.2009000     0.4717000 
1 1 1 22 39 12 o 3.213000  0.3881000     3.703000  0.4743000     2.723000  0.6143000     0.9797000      0.7761000 
1 1 1 22 39 13 o 4.156000  0.3295000     3.962000  0.4479000     4.349000  0.4835000     -0.3868000     0.6591000 
1 1 1 22 39 14 o 3.041000  0.4332000     2.776000  0.6827000     3.305000  0.5336000     -0.5293000     0.8665000 
1 1 1 22 39 15 o 1.305000  0.4066000     1.408000  0.5984000     1.202000  0.5507000     0.2058000      0.8133000 
1 1 1 22 39 16 o 1.134000  0.3776000     1.189000  0.5490000     1.079000  0.5186000     0.1100000      0.7552000 
1 1 1 22 40 0  o 9.046000  0.2603000     9.046000  0.2603000     9.046000  0.2603000     0.000000       0.000000  
1 1 1 22 40 1  f 6.693000  0.2075000     6.723000  0.2955000     6.663000  0.2914000     0.6073000E-01  0.4150000 
1 1 1 22 40 2  f 3.587000  0.3315000     3.894000  0.4239000     3.281000  0.5099000     0.6125000      0.6630000 
1 1 1 22 40 3  o 5.110000  0.2480000     5.502000  0.3236000     4.717000  0.3758000     0.7858000      0.4959000 
1 1 1 22 40 4  o 3.088000  0.3783000     3.002000  0.5337000     3.174000  0.5362000     -0.1720000     0.7565000 
1 1 1 22 40 5  o 1.777000  0.4816000     1.518000  0.6253000     2.036000  0.7326000     -0.5179000     0.9632000 
1 1 1 22 40 6  o 3.772000  0.3536000     3.680000  0.4703000     3.864000  0.5281000     -0.1846000     0.7071000 
1 1 1 22 40 7  o 1.804000  0.4538000     1.379000  0.6075000     2.228000  0.6743000     -0.8494000     0.9076000 
1 1 1 22 40 8  o 2.225000  0.4889000     2.175000  0.7088000     2.275000  0.6736000     -0.9911000E-01 0.9778000 
1 1 1 22 40 9  f 1.876000  0.4167000     1.155000  0.5475000     2.596000  0.6284000     -1.440000      0.8335000 
1 1 1 22 40 10 o 2.001000  0.5179000     2.164000  0.7524000     1.838000  0.7119000     0.3268000      1.036000  
1 1 1 22 40 11 o 2.162000  0.4805000     2.289000  0.6655000     2.034000  0.6934000     0.2545000      0.9611000 
1 1 1 22 40 12 o 1.581000  0.4515000     1.662000  0.6424000     1.499000  0.6347000     0.1627000      0.9031000 
1 1 1 22 40 13 o 1.364000  0.4473000     1.452000  0.6601000     1.276000  0.6038000     0.1753000      0.8947000 
1 1 1 22 40 14 o 1.231000  0.3941000     1.166000  0.5349000     1.297000  0.5789000     -0.1316000     0.7882000 
1 1 1 22 40 15 o 1.335000  0.4101000     1.063000  0.5067000     1.608000  0.6449000     -0.5456000     0.8201000 
1 1 1 22 40 16 f 1.331000  0.4120000     1.575000  0.6399000     1.086000  0.5190000     0.4888000      0.8239000 
1 1 1 22 41 0  f 0.7421000 0.5207000     0.7421000 0.5207000     0.7421000 0.5207000     0.000000       0.000000  
1 1 1 22 41 1  o 2.063000  0.4426000     2.514000  0.6137000     1.612000  0.6380000     0.9022000      0.8852000 
1 1 1 22 41 2  o 10.17000  0.1803000     10.13000  0.2560000     10.22000  0.2540000     -0.8807000E-01 0.3606000 
1 1 1 22 41 3  o 2.995000  0.3918000     2.945000  0.5661000     3.046000  0.5418000     -0.1016000     0.7836000 
1 1 1 22 41 4  o 3.047000  0.3911000     2.631000  0.5991000     3.463000  0.5028000     -0.8323000     0.7822000 
1 1 1 22 41 5  o 4.798000  0.2905000     5.026000  0.3518000     4.570000  0.4623000     0.4559000      0.5810000 
1 1 1 22 41 6  o 4.428000  0.3144000     4.465000  0.4073000     4.391000  0.4789000     0.7332000E-01  0.6287000 
1 1 1 22 41 7  o 2.643000  0.4276000     3.453000  0.5224000     1.833000  0.6772000     1.620000       0.8553000 
1 1 1 22 41 8  o 2.023000  0.4867000     1.870000  0.6945000     2.176000  0.6821000     -0.3061000     0.9734000 
1 1 1 22 41 9  o 1.724000  0.4578000     1.351000  0.6133000     2.097000  0.6798000     -0.7454000     0.9155000 
1 1 1 22 41 10 o 2.549000  0.5003000     2.979000  0.6354000     2.120000  0.7729000     0.8586000      1.001000  
1 1 1 22 41 11 o 1.739000  0.4645000     1.574000  0.6490000     1.904000  0.6647000     -0.3301000     0.9290000 
1 1 1 22 41 12 o 1.902000  0.4803000     2.379000  0.6886000     1.426000  0.6697000     0.9532000      0.9605000 
1 1 1 22 41 13 o 1.700000  0.4733000     1.611000  0.6729000     1.788000  0.6657000     -0.1771000     0.9465000 
1 1 1 22 41 14 o 2.008000  0.4710000     1.764000  0.6621000     2.251000  0.6700000     -0.4872000     0.9419000 
1 1 1 22 41 15 o 2.033000  0.4259000     2.690000  0.6006000     1.375000  0.6041000     1.315000       0.8519000 
1 1 1 22 41 16 o 1.226000  0.3964000     1.075000  0.5135000     1.378000  0.6041000     -0.3032000     0.7929000 
1 1 1 22 42 0  o 8.219000  0.2703000     8.219000  0.2703000     8.219000  0.2703000     0.000000       0.000000  
1 1 1 22 42 1  o 2.306000  0.4085000     3.064000  0.5237000     1.549000  0.6270000     1.515000       0.8170000 
1 1 1 22 42 2  o 2.323000  0.4219000     2.942000  0.5462000     1.704000  0.6431000     1.238000       0.8437000 
1 1 1 22 42 3  o 2.436000  0.4353000     2.738000  0.5773000     2.135000  0.6518000     0.6034000      0.8707000 
1 1 1 22 42 4  o 2.319000  0.4664000     1.710000  0.6515000     2.927000  0.6674000     -1.217000      0.9327000 
1 1 1 22 42 5  o 2.352000  0.4717000     1.712000  0.6569000     2.993000  0.6773000     -1.281000      0.9435000 
1 1 1 22 42 6  o 6.353000  0.2326000     6.062000  0.3388000     6.644000  0.3188000     -0.5813000     0.4652000 
1 1 1 22 42 7  o 1.467000  0.4429000     1.498000  0.6329000     1.437000  0.6196000     0.6017000E-01  0.8857000 
1 1 1 22 42 8  o 3.358000  0.3986000     3.411000  0.5818000     3.306000  0.5449000     0.1050000      0.7971000 
1 1 1 22 42 9  o 2.999000  0.5831000     3.289000  0.9384000     2.710000  0.6924000     0.5789000      1.166000  
1 1 1 22 42 10 o 1.507000  0.4406000     1.334000  0.5921000     1.681000  0.6525000     -0.3472000     0.8812000 
1 1 1 22 42 11 o 1.439000  0.4345000     1.573000  0.6313000     1.306000  0.5972000     0.2665000      0.8690000 
1 1 1 22 42 12 o 3.633000  0.3717000     3.637000  0.5441000     3.629000  0.5064000     0.8605000E-02  0.7433000 
1 1 1 22 42 13 o 2.364000  0.4515000     1.911000  0.6731000     2.817000  0.6020000     -0.9060000     0.9030000 
1 1 1 22 42 14 o 1.147000  0.3773000     1.273000  0.5713000     1.021000  0.4931000     0.2521000      0.7547000 
1 1 1 22 42 15 o 1.202000  0.3928000     1.168000  0.5475000     1.236000  0.5633000     -0.6750000E-01 0.7855000 
1 1 1 22 43 0  o 7.725000  0.2789000     7.725000  0.2789000     7.725000  0.2789000     0.000000       0.000000  
1 1 1 22 43 1  o 6.146000  0.2232000     6.130000  0.3181000     6.161000  0.3132000     -0.3090000E-01 0.4464000 
1 1 1 22 43 2  o 4.749000  0.2611000     4.550000  0.3785000     4.948000  0.3597000     -0.3979000     0.5222000 
1 1 1 22 43 3  o 2.156000  0.4547000     1.744000  0.6607000     2.568000  0.6249000     -0.8244000     0.9094000 
1 1 1 22 43 4  f 1.769000  0.4901000     1.765000  0.6615000     1.773000  0.7234000     -0.8386000E-02 0.9802000 
1 1 1 22 43 5  o 5.785000  0.2788000     6.534000  0.3161000     5.036000  0.4594000     1.498000       0.5576000 
1 1 1 22 43 6  o 2.765000  0.4317000     2.309000  0.6686000     3.222000  0.5462000     -0.9128000     0.8633000 
1 1 1 22 43 7  o 3.910000  0.3290000     3.915000  0.4673000     3.904000  0.4633000     0.1094000E-01  0.6580000 
1 1 1 22 43 8  o 1.560000  0.5008000     1.847000  0.8168000     1.273000  0.5797000     0.5740000      1.002000  
1 1 1 22 43 9  o 1.155000  0.3889000     1.160000  0.5516000     1.151000  0.5483000     0.9238000E-02  0.7778000 
1 1 1 22 43 10 o 1.123000  0.3788000     0.9848000 0.4805000     1.261000  0.5857000     -0.2760000     0.7575000 
1 1 1 22 43 11 o 2.003000  0.5220000     1.679000  0.7011000     2.327000  0.7736000     -0.6474000     1.044000  
1 1 1 22 43 12 o 1.419000  0.4140000     1.794000  0.6566000     1.045000  0.5044000     0.7489000      0.8280000 
1 1 1 22 43 13 o 2.624000  0.4442000     2.324000  0.6430000     2.924000  0.6129000     -0.6004000     0.8883000 
1 1 1 22 43 14 o 3.015000  0.4044000     3.251000  0.5230000     2.780000  0.6171000     0.4717000      0.8089000 
1 1 1 22 43 15 o 1.995000  0.4627000     2.377000  0.6571000     1.612000  0.6517000     0.7646000      0.9254000 
1 1 1 22 44 0  o 1.022000  0.6558000     1.022000  0.6558000     1.022000  0.6558000     0.000000       0.000000  
1 1 1 22 44 1  o 2.577000  0.4385000     2.200000  0.6723000     2.953000  0.5633000     -0.7531000     0.8771000 
1 1 1 22 44 2  o 3.985000  0.3160000     4.107000  0.4229000     3.863000  0.4697000     0.2445000      0.6320000 
1 1 1 22 44 3  o 5.920000  0.2368000     6.137000  0.3200000     5.703000  0.3491000     0.4341000      0.4736000 
1 1 1 22 44 4  o 1.688000  0.4716000     1.892000  0.6831000     1.483000  0.6503000     0.4091000      0.9431000 
1 1 1 22 44 5  o 1.445000  0.4487000     1.411000  0.6102000     1.479000  0.6579000     -0.6823000E-01 0.8973000 
1 1 1 22 44 6  o 1.603000  0.4478000     1.930000  0.6846000     1.276000  0.5774000     0.6535000      0.8956000 
1 1 1 22 44 7  o 2.183000  0.4557000     3.139000  0.7122000     1.227000  0.5688000     1.912000       0.9115000 
1 1 1 22 44 8  o 2.196000  0.5070000     1.569000  0.6864000     2.824000  0.7463000     -1.255000      1.014000  
1 1 1 22 44 9  o 2.713000  0.4913000     2.796000  0.6531000     2.631000  0.7342000     0.1651000      0.9826000 
1 1 1 22 44 10 o 1.635000  0.4804000     1.273000  0.5828000     1.996000  0.7639000     -0.7226000     0.9609000 
1 1 1 22 44 11 o 1.378000  0.4293000     1.250000  0.5831000     1.506000  0.6303000     -0.2556000     0.8587000 
1 1 1 22 44 12 o 1.592000  0.4544000     1.311000  0.5871000     1.873000  0.6937000     -0.5618000     0.9088000 
1 1 1 22 44 13 o 2.096000  0.4833000     2.019000  0.6731000     2.172000  0.6938000     -0.1523000     0.9666000 
1 1 1 22 44 14 o 2.670000  0.4496000     2.359000  0.6800000     2.981000  0.5884000     -0.6220000     0.8992000 
1 1 1 22 45 0  o 5.833000  0.3311000     5.833000  0.3311000     5.833000  0.3311000     0.000000       0.000000  
1 1 1 22 45 1  o 4.230000  0.3043000     4.408000  0.4222000     4.053000  0.4383000     0.3558000      0.6086000 
1 1 1 22 45 2  o 5.358000  0.2563000     5.396000  0.3566000     5.319000  0.3681000     0.7685000E-01  0.5125000 
1 1 1 22 45 3  o 4.377000  0.3219000     4.083000  0.4374000     4.672000  0.4723000     -0.5887000     0.6437000 
1 1 1 22 45 4  o 2.410000  0.5073000     2.423000  0.6619000     2.398000  0.7688000     0.2526000E-01  1.015000  
1 1 1 22 45 5  o 8.384000  0.2237000     8.271000  0.2861000     8.498000  0.3439000     -0.2268000     0.4473000 
1 1 1 22 45 6  o 4.037000  0.3602000     4.031000  0.5655000     4.042000  0.4463000     -0.1135000E-01 0.7204000 
1 1 1 22 45 7  o 3.260000  0.5021000     3.182000  0.7220000     3.338000  0.6980000     -0.1557000     1.004000  
1 1 1 22 45 8  o 2.122000  0.4623000     2.790000  0.6635000     1.454000  0.6441000     1.336000       0.9247000 
1 1 1 22 45 9  o 2.697000  0.4978000     2.095000  0.7245000     3.299000  0.6827000     -1.204000      0.9955000 
1 1 1 22 45 10 o 1.511000  0.4560000     1.592000  0.6746000     1.429000  0.6135000     0.1630000      0.9119000 
1 1 1 22 45 11 f 1.675000  0.4638000     1.791000  0.6616000     1.560000  0.6501000     0.2304000      0.9276000 
1 1 1 22 45 12 o 2.950000  0.4207000     3.263000  0.5359000     2.637000  0.6486000     0.6259000      0.8413000 
1 1 1 22 45 13 o 1.732000  0.4575000     2.098000  0.6897000     1.365000  0.6014000     0.7331000      0.9151000 
1 1 1 22 45 14 o 1.416000  0.4352000     1.327000  0.5937000     1.505000  0.6366000     -0.1777000     0.8705000 
1 1 1 22 46 0  o 0.8393000 0.5790000     0.8393000 0.5790000     0.8393000 0.5790000     0.000000       0.000000  
1 1 1 22 46 1  o 2.920000  0.4248000     3.243000  0.5454000     2.596000  0.6514000     0.6471000      0.8496000 
1 1 1 22 46 2  o 1.778000  0.4810000     1.800000  0.6737000     1.757000  0.6868000     0.4258000E-01  0.9620000 
1 1 1 22 46 3  o 2.189000  0.4985000     1.671000  0.6596000     2.707000  0.7475000     -1.036000      0.9969000 
1 1 1 22 46 4  o 3.665000  0.3858000     3.439000  0.5379000     3.892000  0.5533000     -0.4525000     0.7716000 
1 1 1 22 46 5  o 2.318000  0.5478000     2.703000  0.8212000     1.934000  0.7254000     0.7696000      1.096000  
1 1 1 22 46 6  o 4.347000  0.3926000     4.649000  0.4686000     4.046000  0.6299000     0.6029000      0.7851000 
1 1 1 22 46 7  o 1.785000  0.4924000     1.982000  0.7129000     1.587000  0.6793000     0.3946000      0.9848000 
1 1 1 22 46 8  o 5.089000  0.3215000     4.919000  0.4304000     5.259000  0.4778000     -0.3394000     0.6431000 
1 1 1 22 46 9  o 4.036000  0.3546000     4.131000  0.5261000     3.941000  0.4755000     0.1893000      0.7091000 
1 1 1 22 46 10 o 1.269000  0.4086000     1.187000  0.5510000     1.351000  0.6037000     -0.1644000     0.8173000 
1 1 1 22 46 11 o 2.170000  0.4819000     2.082000  0.6791000     2.259000  0.6838000     -0.1774000     0.9638000 
1 1 1 22 46 12 o 1.241000  0.4052000     1.245000  0.5729000     1.237000  0.5731000     0.8307000E-02  0.8104000 
1 1 1 22 46 13 o 2.908000  0.4443000     3.002000  0.5880000     2.813000  0.6663000     0.1891000      0.8886000 
1 1 1 22 47 0  o 1.809000  0.8392000     1.809000  0.8392000     1.809000  0.8392000     0.000000       0.000000  
1 1 1 22 47 1  f 1.464000  0.4340000     1.205000  0.5598000     1.724000  0.6632000     -0.5187000     0.8679000 
1 1 1 22 47 2  o 4.006000  0.3384000     4.074000  0.4696000     3.937000  0.4875000     0.1371000      0.6769000 
1 1 1 22 47 3  o 5.285000  0.3123000     5.252000  0.4422000     5.317000  0.4410000     -0.6459000E-01 0.6245000 
1 1 1 22 47 4  o 1.962000  0.5631000     2.142000  0.8340000     1.782000  0.7568000     0.3608000      1.126000  
1 1 1 22 47 5  o 2.389000  0.5810000     2.290000  0.6945000     2.487000  0.9316000     -0.1966000     1.162000  
1 1 1 22 47 6  o 1.355000  0.4417000     1.469000  0.6428000     1.240000  0.6058000     0.2297000      0.8833000 
1 1 1 22 47 7  o 1.765000  0.5147000     1.794000  0.7391000     1.736000  0.7164000     0.5795000E-01  1.029000  
1 1 1 22 47 8  o 4.836000  0.3414000     4.903000  0.5423000     4.770000  0.4148000     0.1328000      0.6827000 
1 1 1 22 47 9  o 1.687000  0.4451000     1.233000  0.5645000     2.141000  0.6884000     -0.9082000     0.8903000 
1 1 1 22 47 10 o 1.772000  0.4722000     1.571000  0.6384000     1.973000  0.6960000     -0.4021000     0.9445000 
1 1 1 22 47 11 o 1.682000  0.4683000     1.600000  0.6544000     1.764000  0.6700000     -0.1643000     0.9366000 
1 1 1 22 47 12 o 1.430000  0.4363000     1.430000  0.6153000     1.429000  0.6188000     0.5041000E-03  0.8727000 
1 1 1 22 47 13 o 1.451000  0.4987000     1.185000  0.5766000     1.718000  0.8138000     -0.5329000     0.9974000 
1 1 1 22 48 0  o 1.594000  0.8857000     1.594000  0.8857000     1.594000  0.8857000     0.000000       0.000000  
1 1 1 22 48 1  o 4.782000  0.3474000     4.786000  0.4971000     4.779000  0.4854000     0.6969000E-02  0.6948000 
1 1 1 22 48 2  o 2.378000  0.6446000     2.198000  0.8352000     2.558000  0.9821000     -0.3598000     1.289000  
1 1 1 22 48 3  o 6.087000  0.4051000     6.087000  0.4051000     ?         ?             ?              ?         
1 1 1 22 48 4  o 4.308000  0.5414000     4.686000  0.4600000     3.930000  0.9801000     0.7558000      1.083000  
1 1 1 22 48 5  f 1.461000  0.4570000     1.287000  0.5904000     1.636000  0.6977000     -0.3483000     0.9139000 
1 1 1 22 48 6  o 2.568000  0.4368000     1.647000  0.6971000     3.490000  0.5265000     -1.843000      0.8736000 
1 1 1 22 48 7  o 2.550000  0.5031000     2.684000  0.7399000     2.415000  0.6821000     0.2698000      1.006000  
1 1 1 22 48 8  o 3.270000  0.4151000     3.366000  0.5820000     3.174000  0.5920000     0.1926000      0.8301000 
1 1 1 22 48 9  o 1.731000  0.4638000     2.028000  0.6874000     1.435000  0.6228000     0.5928000      0.9276000 
1 1 1 22 48 10 o 1.388000  0.4288000     1.270000  0.5749000     1.507000  0.6362000     -0.2371000     0.8575000 
1 1 1 22 48 11 o 2.861000  0.4254000     3.437000  0.5170000     2.285000  0.6758000     1.152000       0.8508000 
1 1 1 22 48 12 f 1.351000  0.4207000     1.139000  0.5411000     1.562000  0.6444000     -0.4229000     0.8415000 
1 1 1 22 49 0  o 5.715000  0.7164000     5.715000  0.7164000     5.715000  0.7164000     0.000000       0.000000  
1 1 1 22 49 1  o 2.423000  0.6064000     2.901000  0.8467000     1.944000  0.8682000     0.9565000      1.213000  
1 1 1 22 49 2  o 1.313000  0.4436000     1.233000  0.5936000     1.393000  0.6593000     -0.1598000     0.8872000 
1 1 1 22 49 3  o 1.337000  0.4404000     1.507000  0.6808000     1.167000  0.5589000     0.3401000      0.8809000 
1 1 1 22 49 4  o 1.391000  0.4368000     1.625000  0.6819000     1.157000  0.5462000     0.4674000      0.8737000 
1 1 1 22 49 5  o 1.991000  0.5009000     1.822000  0.7239000     2.160000  0.6926000     -0.3373000     1.002000  
1 1 1 22 49 6  o 1.590000  0.4634000     1.581000  0.6567000     1.599000  0.6539000     -0.1783000E-01 0.9267000 
1 1 1 22 49 7  o 6.756000  0.2513000     6.808000  0.3707000     6.705000  0.3395000     0.1027000      0.5027000 
1 1 1 22 49 8  o 3.365000  0.4074000     3.789000  0.5375000     2.941000  0.6125000     0.8473000      0.8148000 
1 1 1 22 49 9  o 2.742000  0.4270000     1.834000  0.6796000     3.649000  0.5173000     -1.815000      0.8540000 
1 1 1 22 49 10 o 1.739000  0.4282000     2.332000  0.6641000     1.146000  0.5407000     1.186000       0.8564000 
1 1 1 22 49 11 o 1.236000  0.3997000     1.367000  0.6013000     1.104000  0.5266000     0.2635000      0.7993000 
1 1 1 22 50 0  o 1.866000  0.8694000     1.866000  0.8694000     1.866000  0.8694000     0.000000       0.000000  
1 1 1 22 50 1  o 6.442000  0.2484000     6.583000  0.3446000     6.300000  0.3579000     0.2830000      0.4969000 
1 1 1 22 50 2  o 2.257000  0.5081000     2.474000  0.6801000     2.040000  0.7550000     0.4335000      1.016000  
1 1 1 22 50 3  o 1.979000  0.5081000     1.964000  0.6842000     1.995000  0.7514000     -0.3136000E-01 1.016000  
1 1 1 22 50 4  o 5.585000  0.2638000     5.500000  0.3732000     5.670000  0.3730000     -0.1698000     0.5276000 
1 1 1 22 50 5  o 1.375000  0.4221000     1.102000  0.5247000     1.649000  0.6614000     -0.5467000     0.8443000 
1 1 1 22 50 6  o 2.009000  0.4418000     1.273000  0.5922000     2.745000  0.6559000     -1.473000      0.8837000 
1 1 1 22 50 7  o 3.482000  0.4107000     2.892000  0.6744000     4.072000  0.4687000     -1.179000      0.8213000 
1 1 1 22 50 8  o 2.657000  0.4673000     2.768000  0.6449000     2.546000  0.6763000     0.2224000      0.9345000 
1 1 1 22 50 9  f 2.172000  0.4781000     1.837000  0.6807000     2.507000  0.6716000     -0.6701000     0.9562000 
1 1 1 22 50 10 o 1.856000  0.4429000     2.456000  0.6720000     1.256000  0.5772000     1.199000       0.8859000 
1 1 1 22 51 0  o 1.025000  0.6709000     1.025000  0.6709000     1.025000  0.6709000     0.000000       0.000000  
1 1 1 22 51 1  o 5.158000  0.3085000     4.993000  0.4073000     5.322000  0.4634000     -0.3290000     0.6169000 
1 1 1 22 51 2  o 2.388000  0.5192000     2.623000  0.6910000     2.153000  0.7752000     0.4702000      1.038000  
1 1 1 22 51 3  o 1.807000  0.4974000     1.585000  0.6506000     2.028000  0.7526000     -0.4430000     0.9949000 
1 1 1 22 51 4  o 2.909000  0.4271000     2.042000  0.6937000     3.776000  0.4984000     -1.734000      0.8541000 
1 1 1 22 51 5  o 1.404000  0.4348000     1.454000  0.6236000     1.355000  0.6060000     0.9926000E-01  0.8696000 
1 1 1 22 51 6  o 1.187000  0.3947000     1.320000  0.6048000     1.054000  0.5074000     0.2653000      0.7894000 
1 1 1 22 51 7  o 1.784000  0.4829000     1.995000  0.7145000     1.574000  0.6499000     0.4215000      0.9658000 
1 1 1 22 51 8  o 1.763000  0.4764000     1.999000  0.7022000     1.528000  0.6440000     0.4712000      0.9528000 
1 1 1 22 51 9  o 1.740000  0.4574000     2.166000  0.6950000     1.315000  0.5950000     0.8512000      0.9149000 
1 1 1 22 51 10 o 1.402000  0.4446000     1.456000  0.6320000     1.347000  0.6255000     0.1099000      0.8892000 
1 1 1 22 52 0  f 2.073000  0.8623000     2.073000  0.8623000     2.073000  0.8623000     0.000000       0.000000  
1 1 1 22 52 1  o 1.682000  0.4850000     1.542000  0.6482000     1.823000  0.7216000     -0.2808000     0.9699000 
1 1 1 22 52 2  o 4.193000  0.3575000     4.181000  0.4587000     4.205000  0.5484000     -0.2410000E-01 0.7149000 
1 1 1 22 52 3  o 1.304000  0.4112000     1.040000  0.5034000     1.568000  0.6505000     -0.5279000     0.8225000 
1 1 1 22 52 4  o 1.656000  0.4673000     1.461000  0.6263000     1.851000  0.6938000     -0.3900000     0.9347000 
1 1 1 22 52 5  o 1.477000  0.4378000     1.172000  0.5491000     1.782000  0.6819000     -0.6099000     0.8755000 
1 1 1 22 52 6  o 1.438000  0.4442000     1.681000  0.6893000     1.195000  0.5603000     0.4859000      0.8883000 
1 1 1 22 52 7  o 4.163000  0.3621000     3.960000  0.5582000     4.365000  0.4614000     -0.4052000     0.7242000 
1 1 1 22 52 8  o 1.360000  0.4307000     1.378000  0.6151000     1.342000  0.6029000     0.3598000E-01  0.8613000 
1 1 1 22 52 9  o 2.168000  0.4386000     1.322000  0.5978000     3.014000  0.6420000     -1.692000      0.8773000 
1 1 1 22 53 0  o 1.925000  0.9269000     1.925000  0.9269000     1.925000  0.9269000     0.000000       0.000000  
1 1 1 22 53 1  o 3.071000  0.4694000     3.116000  0.6234000     3.026000  0.7019000     0.8950000E-01  0.9388000 
1 1 1 22 53 2  f 1.593000  0.4774000     1.577000  0.6586000     1.609000  0.6912000     -0.3173000E-01 0.9548000 
1 1 1 22 53 3  o 2.742000  0.4325000     1.871000  0.6965000     3.613000  0.5128000     -1.742000      0.8649000 
1 1 1 22 53 4  o 1.432000  0.4336000     1.153000  0.5420000     1.712000  0.6771000     -0.5591000     0.8673000 
1 1 1 22 53 5  f 2.955000  0.4445000     3.110000  0.6050000     2.799000  0.6515000     0.3105000      0.8891000 
1 1 1 22 53 6  o 1.327000  0.4177000     0.9934000 0.4928000     1.660000  0.6745000     -0.6668000     0.8354000 
1 1 1 22 53 7  o 1.244000  0.4078000     1.570000  0.6760000     0.9172000 0.4565000     0.6530000      0.8157000 
1 1 1 22 53 8  o 2.050000  0.4533000     1.383000  0.6184000     2.717000  0.6628000     -1.334000      0.9065000 
1 1 1 22 54 0  o 0.8037000 0.5724000     0.8037000 0.5724000     0.8037000 0.5724000     0.000000       0.000000  
1 1 1 22 54 1  o 3.774000  0.4000000     3.828000  0.5077000     3.719000  0.6184000     0.1085000      0.8001000 
1 1 1 22 54 2  o 2.706000  0.4385000     3.627000  0.5193000     1.786000  0.7068000     1.841000       0.8771000 
1 1 1 22 54 3  o 1.407000  0.4322000     1.599000  0.6550000     1.215000  0.5641000     0.3834000      0.8644000 
1 1 1 22 54 4  o 1.332000  0.4208000     1.570000  0.6580000     1.094000  0.5246000     0.4755000      0.8415000 
1 1 1 22 54 5  o 3.499000  0.4320000     3.180000  0.6986000     3.818000  0.5084000     -0.6377000     0.8640000 
1 1 1 22 54 6  o 2.620000  0.5145000     2.492000  0.7713000     2.748000  0.6811000     -0.2569000     1.029000  
1 1 1 22 55 0  o 1.147000  0.7437000     1.147000  0.7437000     1.147000  0.7437000     0.000000       0.000000  
1 1 1 22 55 1  o 1.691000  0.4991000     1.845000  0.7314000     1.537000  0.6795000     0.3083000      0.9983000 
1 1 1 22 55 2  f 3.168000  0.4393000     3.594000  0.5535000     2.742000  0.6824000     0.8521000      0.8786000 
1 1 1 22 55 3  o 2.160000  0.4952000     2.489000  0.6958000     1.832000  0.7049000     0.6568000      0.9905000 
1 1 1 22 55 4  o 1.480000  0.4442000     1.687000  0.6695000     1.272000  0.5839000     0.4149000      0.8884000 
1 1 1 22 55 5  o 1.782000  0.4816000     1.411000  0.6385000     2.152000  0.7213000     -0.7418000     0.9633000 
1 1 1 22 56 0  o 5.234000  0.4722000     5.234000  0.4722000     5.234000  0.4722000     0.000000       0.000000  
1 1 1 22 56 1  o 4.552000  0.3777000     4.775000  0.5060000     4.329000  0.5610000     0.4461000      0.7555000 
1 1 1 22 56 2  o 1.814000  0.4946000     1.622000  0.6762000     2.005000  0.7220000     -0.3829000     0.9892000 
1 1 1 22 56 3  o 1.650000  0.4907000     1.295000  0.6094000     2.004000  0.7694000     -0.7084000     0.9815000 
1 1 1 23 0  1  o 5.130000  0.2211000     5.130000  0.2211000     5.130000  0.2211000     0.000000       0.000000  
1 1 1 23 0  2  o 7.446000  0.1790000     7.446000  0.1790000     7.446000  0.1790000     0.000000       0.000000  
1 1 1 23 0  3  o 4.349000  0.2111000     4.349000  0.2111000     4.349000  0.2111000     -0.000000      0.000000  
1 1 1 23 0  4  o 2.428000  0.2244000     2.428000  0.2244000     2.428000  0.2244000     0.000000       0.000000  
1 1 1 23 0  5  o 16.38000  0.2101000     16.38000  0.2101000     16.38000  0.2101000     0.000000       0.000000  
1 1 1 23 0  6  o 23.48000  0.2844000     23.48000  0.2844000     23.48000  0.2844000     0.000000       0.000000  
1 1 1 23 0  7  o 14.94000  0.2662000     14.94000  0.2662000     14.94000  0.2662000     -0.000000      0.000000  
1 1 1 23 0  8  o 5.193000  0.3520000     5.193000  0.3520000     5.193000  0.3520000     -0.000000      0.000000  
1 1 1 23 0  9  o 6.447000  0.3647000     6.447000  0.3647000     6.447000  0.3647000     0.000000       0.000000  
1 1 1 23 0  10 o 5.463000  0.4322000     5.463000  0.4322000     5.463000  0.4322000     0.000000       0.000000  
1 1 1 23 0  11 o 4.362000  0.5627000     4.362000  0.5627000     4.362000  0.5627000     0.000000       0.000000  
1 1 1 23 0  12 o 6.717000  0.4818000     6.717000  0.4818000     6.717000  0.4818000     0.000000       0.000000  
1 1 1 23 0  13 o 2.320000  1.058000      2.320000  1.058000      2.320000  1.058000      0.000000       0.000000  
1 1 1 23 0  14 o 1.654000  1.013000      1.654000  1.013000      1.654000  1.013000      0.000000       0.000000  
1 1 1 23 0  15 o 1.622000  0.9407000     1.622000  0.9407000     1.622000  0.9407000     0.000000       0.000000  
1 1 1 23 0  16 o 6.096000  0.4324000     6.096000  0.4324000     6.096000  0.4324000     0.000000       0.000000  
1 1 1 23 0  17 o 1.481000  0.9192000     1.481000  0.9192000     1.481000  0.9192000     0.000000       0.000000  
1 1 1 23 0  18 o 1.503000  0.8489000     1.503000  0.8489000     1.503000  0.8489000     0.000000       0.000000  
1 1 1 23 0  19 o 1.819000  0.9497000     1.819000  0.9497000     1.819000  0.9497000     0.000000       0.000000  
1 1 1 23 0  20 o 3.720000  0.5972000     3.720000  0.5972000     3.720000  0.5972000     0.000000       0.000000  
1 1 1 23 0  21 o 1.227000  0.7642000     1.227000  0.7642000     1.227000  0.7642000     0.000000       0.000000  
1 1 1 23 0  22 f 0.9484000 0.6487000     0.9484000 0.6487000     0.9484000 0.6487000     0.000000       0.000000  
1 1 1 23 0  23 o 0.7844000 0.5687000     0.7844000 0.5687000     0.7844000 0.5687000     0.000000       0.000000  
1 1 1 23 1  1  o 8.233000  0.1397000     8.166000  0.2281000     8.300000  0.1615000     -0.1342000     0.2795000 
1 1 1 23 1  2  o 16.63000  0.1960000     16.52000  0.2745000     16.75000  0.2797000     -0.2331000     0.3919000 
1 1 1 23 1  3  o 12.48000  0.2089000     12.54000  0.3677000     12.43000  0.1983000     0.1019000      0.4177000 
1 1 1 23 1  4  o 9.411000  0.1125000     9.395000  0.1603000     9.428000  0.1579000     -0.3316000E-01 0.2250000 
1 1 1 23 1  5  o 6.481000  0.1450000     6.673000  0.1647000     6.289000  0.2387000     0.3841000      0.2900000 
1 1 1 23 1  6  o 20.38000  0.1874000     20.47000  0.2254000     20.29000  0.2993000     0.1776000      0.3747000 
1 1 1 23 1  7  o 9.303000  0.1855000     9.429000  0.2641000     9.178000  0.2606000     0.2516000      0.3710000 
1 1 1 23 1  8  o 3.277000  0.3914000     2.870000  0.6315000     3.684000  0.4625000     -0.8140000     0.7828000 
1 1 1 23 1  9  f 8.347000  0.2222000     8.164000  0.3236000     8.530000  0.3048000     -0.3663000     0.4445000 
1 1 1 23 1  10 o 2.288000  0.5462000     2.255000  0.7902000     2.321000  0.7542000     -0.6647000E-01 1.092000  
1 1 1 23 1  11 o 10.84000  0.2081000     10.62000  0.3017000     11.06000  0.2868000     -0.4336000     0.4162000 
1 1 1 23 1  12 o 3.722000  0.5676000     4.012000  0.7682000     3.431000  0.8357000     0.5809000      1.135000  
1 1 1 23 1  13 f 12.78000  0.2176000     12.56000  0.3125000     13.00000  0.3030000     -0.4417000     0.4353000 
1 1 1 23 1  14 o 1.646000  0.5413000     1.485000  0.7097000     1.807000  0.8176000     -0.3217000     1.083000  
1 1 1 23 1  15 o 4.122000  0.4946000     5.635000  0.5025000     2.609000  0.8520000     3.026000       0.9892000 
1 1 1 23 1  16 o 1.695000  0.5201000     1.846000  0.7687000     1.544000  0.7009000     0.3015000      1.040000  
1 1 1 23 1  17 o 2.018000  0.5807000     2.267000  0.8610000     1.768000  0.7794000     0.4985000      1.161000  
1 1 1 23 1  18 o 1.789000  0.5070000     1.772000  0.7186000     1.807000  0.7155000     -0.3535000E-01 1.014000  
1 1 1 23 1  19 o 3.768000  0.4521000     3.832000  0.6466000     3.705000  0.6321000     0.1271000      0.9042000 
1 1 1 23 1  20 o 1.439000  0.4533000     1.651000  0.6972000     1.228000  0.5796000     0.4235000      0.9067000 
1 1 1 23 1  21 o 1.524000  0.4674000     1.726000  0.7102000     1.321000  0.6078000     0.4050000      0.9348000 
1 1 1 23 1  22 f 1.108000  0.3819000     1.103000  0.5404000     1.113000  0.5398000     -0.9792000E-02 0.7638000 
1 1 1 23 1  23 o 1.368000  0.4622000     1.393000  0.6623000     1.342000  0.6450000     0.5184000E-01  0.9245000 
1 1 1 23 2  1  o 9.057000  0.1191000     9.084000  0.1622000     9.031000  0.1744000     0.5292000E-01  0.2381000 
1 1 1 23 2  2  o 8.288000  0.1628000     8.130000  0.2821000     8.445000  0.1626000     -0.3156000     0.3256000 
1 1 1 23 2  3  o 8.294000  0.1768000     8.540000  0.3361000     8.049000  0.1101000     0.4916000      0.3536000 
1 1 1 23 2  4  o 6.555000  0.1146000     6.669000  0.1588000     6.442000  0.1652000     0.2268000      0.2291000 
1 1 1 23 2  5  o 5.583000  0.1506000     5.721000  0.1721000     5.445000  0.2471000     0.2760000      0.3011000 
1 1 1 23 2  6  o 19.96000  0.1844000     20.13000  0.2232000     19.79000  0.2937000     0.3414000      0.3689000 
1 1 1 23 2  7  o 24.81000  0.2487000     24.88000  0.3520000     24.75000  0.3513000     0.1300000      0.4973000 
1 1 1 23 2  8  o 5.853000  0.2227000     5.853000  0.3214000     5.853000  0.3084000     0.4802000E-03  0.4454000 
1 1 1 23 2  9  o 4.056000  0.3821000     3.968000  0.5694000     4.145000  0.5096000     -0.1766000     0.7641000 
1 1 1 23 2  10 o 5.401000  0.3185000     5.814000  0.4487000     4.987000  0.4521000     0.8273000      0.6370000 
1 1 1 23 2  11 o 9.588000  0.2189000     9.764000  0.3101000     9.412000  0.3091000     0.3519000      0.4378000 
1 1 1 23 2  12 o 5.446000  0.3997000     4.948000  0.6223000     5.944000  0.5017000     -0.9958000     0.7994000 
1 1 1 23 2  13 o 5.865000  0.3439000     5.364000  0.5277000     6.365000  0.4413000     -1.001000      0.6879000 
1 1 1 23 2  14 o 2.180000  0.6182000     1.848000  0.8162000     2.512000  0.9288000     -0.6645000     1.236000  
1 1 1 23 2  15 o 4.470000  0.4441000     3.825000  0.7176000     5.115000  0.5235000     -1.291000      0.8883000 
1 1 1 23 2  16 o 2.846000  0.5532000     3.184000  0.7477000     2.507000  0.8156000     0.6769000      1.106000  
1 1 1 23 2  17 o 2.372000  0.6481000     2.159000  0.8574000     2.584000  0.9721000     -0.4245000     1.296000  
1 1 1 23 2  18 o 1.490000  0.4614000     1.276000  0.6008000     1.703000  0.7006000     -0.4275000     0.9229000 
1 1 1 23 2  19 o 2.003000  0.5470000     1.951000  0.7655000     2.055000  0.7815000     -0.1039000     1.094000  
1 1 1 23 2  20 o 2.570000  0.4328000     1.459000  0.6517000     3.680000  0.5698000     -2.221000      0.8656000 
1 1 1 23 2  21 o 1.340000  0.4341000     1.435000  0.6413000     1.246000  0.5852000     0.1886000      0.8682000 
1 1 1 23 2  22 o 1.319000  0.4310000     1.461000  0.6524000     1.176000  0.5634000     0.2850000      0.8620000 
1 1 1 23 2  23 o 1.023000  0.3650000     1.049000  0.5280000     0.9966000 0.5040000     0.5209000E-01  0.7299000 
1 1 1 23 3  1  o 26.68000  0.3445000     26.89000  0.5988000     26.48000  0.3407000     0.4055000      0.6890000 
1 1 1 23 3  2  o 19.24000  0.2612000     19.40000  0.4543000     19.09000  0.2579000     0.3113000      0.5224000 
1 1 1 23 3  3  o 9.539000  0.1041000     9.507000  0.1498000     9.570000  0.1447000     -0.6338000E-01 0.2083000 
1 1 1 23 3  4  o 4.866000  0.1421000     4.861000  0.1724000     4.872000  0.2260000     -0.1156000E-01 0.2842000 
1 1 1 23 3  5  o 2.515000  0.2355000     2.716000  0.2836000     2.314000  0.3761000     0.4024000      0.4710000 
1 1 1 23 3  6  o 17.96000  0.1728000     18.01000  0.2073000     17.91000  0.2766000     0.1048000      0.3457000 
1 1 1 23 3  7  o 7.195000  0.1899000     7.342000  0.2448000     7.048000  0.2903000     0.2938000      0.3797000 
1 1 1 23 3  8  o 2.113000  0.4379000     1.813000  0.5068000     2.414000  0.7142000     -0.6014000     0.8757000 
1 1 1 23 3  9  o 7.040000  0.2417000     6.977000  0.3531000     7.103000  0.3301000     -0.1265000     0.4834000 
1 1 1 23 3  10 f 4.090000  0.3756000     4.445000  0.4862000     3.735000  0.5726000     0.7098000      0.7511000 
1 1 1 23 3  11 f 8.881000  0.2216000     9.225000  0.3107000     8.536000  0.3160000     0.6889000      0.4432000 
1 1 1 23 3  12 o 8.155000  0.2861000     8.398000  0.4024000     7.911000  0.4068000     0.4864000      0.5722000 
1 1 1 23 3  13 o 4.457000  0.4346000     4.558000  0.6189000     4.357000  0.6103000     0.2006000      0.8692000 
1 1 1 23 3  14 o 2.476000  0.6482000     2.595000  0.9251000     2.357000  0.9082000     0.2371000      1.296000  
1 1 1 23 3  15 o 3.020000  0.5771000     3.087000  0.8054000     2.953000  0.8266000     0.1344000      1.154000  
1 1 1 23 3  16 o 2.637000  0.5699000     2.696000  0.8035000     2.578000  0.8085000     0.1182000      1.140000  
1 1 1 23 3  17 o 3.240000  0.6024000     3.039000  0.8098000     3.440000  0.8922000     -0.4007000     1.205000  
1 1 1 23 3  18 o 1.540000  0.4661000     1.271000  0.5988000     1.808000  0.7144000     -0.5368000     0.9322000 
1 1 1 23 3  19 o 1.702000  0.5271000     1.503000  0.6957000     1.900000  0.7919000     -0.3979000     1.054000  
1 1 1 23 3  20 o 1.507000  0.4466000     1.120000  0.5441000     1.894000  0.7083000     -0.7735000     0.8931000 
1 1 1 23 3  21 o 1.598000  0.4690000     1.333000  0.6111000     1.864000  0.7116000     -0.5307000     0.9380000 
1 1 1 23 3  22 o 0.9292000 0.3301000     0.8753000 0.4427000     0.9830000 0.4897000     -0.1077000     0.6601000 
1 1 1 23 3  23 o 1.141000  0.4005000     1.087000  0.5444000     1.195000  0.5877000     -0.1078000     0.8011000 
1 1 1 23 4  0  o 7.856000  0.2280000     7.856000  0.2280000     7.856000  0.2280000     0.000000       0.000000  
1 1 1 23 4  1  o 10.44000  0.1558000     10.31000  0.2636000     10.57000  0.1660000     -0.2620000     0.3115000 
1 1 1 23 4  2  f 18.19000  0.2407000     18.27000  0.4320000     18.11000  0.2124000     0.1532000      0.4814000 
1 1 1 23 4  3  o 2.364000  0.1544000     2.516000  0.1914000     2.212000  0.2423000     0.3046000      0.3087000 
1 1 1 23 4  4  o 10.86000  0.1751000     10.76000  0.2022000     10.97000  0.2859000     -0.2096000     0.3502000 
1 1 1 23 4  5  o 6.253000  0.1275000     6.331000  0.1797000     6.174000  0.1808000     0.1569000      0.2549000 
1 1 1 23 4  6  o 1.523000  0.3412000     1.183000  0.4628000     1.863000  0.5015000     -0.6795000     0.6824000 
1 1 1 23 4  7  o 8.272000  0.1610000     8.134000  0.1798000     8.409000  0.2671000     -0.2746000     0.3220000 
1 1 1 23 4  8  o 14.30000  0.1718000     14.41000  0.1998000     14.20000  0.2796000     0.2160000      0.3437000 
1 1 1 23 4  9  o 13.27000  0.2147000     13.38000  0.2478000     13.15000  0.3507000     0.2350000      0.4294000 
1 1 1 23 4  10 o 10.34000  0.1964000     10.29000  0.2776000     10.40000  0.2778000     -0.1108000     0.3927000 
1 1 1 23 4  11 o 10.24000  0.2062000     9.996000  0.2964000     10.49000  0.2868000     -0.4897000     0.4125000 
1 1 1 23 4  12 o 7.450000  0.2839000     7.348000  0.3839000     7.552000  0.4183000     -0.2039000     0.5678000 
1 1 1 23 4  13 o 5.122000  0.3905000     4.425000  0.6116000     5.819000  0.4856000     -1.393000      0.7809000 
1 1 1 23 4  14 o 7.709000  0.3287000     7.299000  0.4814000     8.120000  0.4476000     -0.8210000     0.6574000 
1 1 1 23 4  15 o 5.261000  0.3724000     5.035000  0.5529000     5.487000  0.4991000     -0.4514000     0.7449000 
1 1 1 23 4  16 o 2.063000  0.5598000     1.895000  0.7782000     2.230000  0.8049000     -0.3348000     1.120000  
1 1 1 23 4  17 o 2.441000  0.5154000     3.278000  0.7002000     1.604000  0.7564000     1.674000       1.031000  
1 1 1 23 4  18 o 2.007000  0.5222000     2.155000  0.7531000     1.860000  0.7236000     0.2943000      1.044000  
1 1 1 23 4  19 o 2.463000  0.6044000     2.539000  0.8626000     2.387000  0.8469000     0.1524000      1.209000  
1 1 1 23 4  20 o 1.434000  0.4527000     1.347000  0.6168000     1.521000  0.6629000     -0.1738000     0.9055000 
1 1 1 23 4  21 o 1.890000  0.4746000     2.387000  0.7146000     1.392000  0.6249000     0.9951000      0.9493000 
1 1 1 23 4  22 o 1.297000  0.4253000     1.208000  0.5758000     1.386000  0.6260000     -0.1787000     0.8506000 
1 1 1 23 4  23 o 1.489000  0.5170000     1.704000  0.8093000     1.274000  0.6435000     0.4304000      1.034000  
1 1 1 23 5  0  o 5.475000  0.1134000     5.475000  0.1134000     5.475000  0.1134000     0.000000       0.000000  
1 1 1 23 5  1  o 5.226000  0.9837000E-01 5.328000  0.1572000     5.123000  0.1183000     0.2048000      0.1967000 
1 1 1 23 5  2  o 5.606000  0.9303000E-01 5.857000  0.1358000     5.355000  0.1272000     0.5017000      0.1861000 
1 1 1 23 5  3  o 7.093000  0.9723000E-01 7.072000  0.1327000     7.113000  0.1421000     -0.4120000E-01 0.1945000 
1 1 1 23 5  4  o 7.920000  0.1386000     7.843000  0.1683000     7.996000  0.2201000     -0.1532000     0.2771000 
1 1 1 23 5  5  o 6.604000  0.1295000     6.638000  0.1865000     6.569000  0.1797000     0.6880000E-01  0.2590000 
1 1 1 23 5  6  o 9.720000  0.1482000     9.859000  0.1823000     9.581000  0.2337000     0.2788000      0.2964000 
1 1 1 23 5  7  o 7.480000  0.1716000     7.860000  0.1966000     7.100000  0.2812000     0.7605000      0.3431000 
1 1 1 23 5  8  o 8.379000  0.1789000     8.284000  0.1954000     8.475000  0.2998000     -0.1913000     0.3578000 
1 1 1 23 5  9  o 7.029000  0.3036000     7.450000  0.2423000     6.608000  0.5567000     0.8428000      0.6071000 
1 1 1 23 5  10 o 15.23000  0.1920000     15.48000  0.2244000     14.99000  0.3115000     0.4860000      0.3839000 
1 1 1 23 5  11 o 7.899000  0.2379000     7.961000  0.3316000     7.837000  0.3413000     0.1241000      0.4758000 
1 1 1 23 5  12 o 7.947000  0.2517000     8.029000  0.3520000     7.865000  0.3597000     0.1641000      0.5033000 
1 1 1 23 5  13 o 3.296000  0.5636000     3.461000  0.7826000     3.131000  0.8114000     0.3293000      1.127000  
1 1 1 23 5  14 o 7.482000  0.3723000     7.110000  0.5927000     7.854000  0.4506000     -0.7443000     0.7445000 
1 1 1 23 5  15 o 1.732000  0.5245000     1.428000  0.6688000     2.035000  0.8082000     -0.6064000     1.049000  
1 1 1 23 5  16 o 2.053000  0.5541000     2.187000  0.8008000     1.920000  0.7660000     0.2668000      1.108000  
1 1 1 23 5  17 o 1.308000  0.4518000     1.074000  0.5278000     1.541000  0.7335000     -0.4670000     0.9037000 
1 1 1 23 5  18 o 1.669000  0.4889000     1.640000  0.6878000     1.697000  0.6951000     -0.5681000E-01 0.9779000 
1 1 1 23 5  19 o 1.323000  0.4506000     1.406000  0.6670000     1.241000  0.6060000     0.1644000      0.9012000 
1 1 1 23 5  20 o 1.332000  0.4279000     1.101000  0.5333000     1.563000  0.6692000     -0.4612000     0.8557000 
1 1 1 23 5  21 o 1.476000  0.4515000     1.250000  0.5853000     1.703000  0.6877000     -0.4526000     0.9030000 
1 1 1 23 5  22 f 1.762000  0.4882000     1.438000  0.6386000     2.085000  0.7386000     -0.6475000     0.9764000 
1 1 1 23 6  0  o 7.905000  0.1258000     7.905000  0.1258000     7.905000  0.1258000     0.000000       0.000000  
1 1 1 23 6  1  o 2.818000  0.1220000     2.991000  0.1957000     2.646000  0.1457000     0.3452000      0.2440000 
1 1 1 23 6  2  o 3.996000  0.1077000     4.148000  0.1475000     3.844000  0.1569000     0.3040000      0.2154000 
1 1 1 23 6  3  f 7.332000  0.1020000     7.295000  0.1407000     7.369000  0.1477000     -0.7405000E-01 0.2040000 
1 1 1 23 6  4  o 25.08000  0.2352000     25.00000  0.3307000     25.16000  0.3345000     -0.1596000     0.4704000 
1 1 1 23 6  5  o 6.013000  0.1358000     6.107000  0.1921000     5.919000  0.1920000     0.1881000      0.2716000 
1 1 1 23 6  6  o 1.568000  0.3976000     1.445000  0.5055000     1.692000  0.6137000     -0.2468000     0.7951000 
1 1 1 23 6  7  o 6.204000  0.1596000     6.240000  0.2115000     6.169000  0.2391000     0.7134000E-01  0.3192000 
1 1 1 23 6  8  o 16.27000  0.1673000     16.21000  0.2332000     16.33000  0.2399000     -0.1131000     0.3346000 
1 1 1 23 6  9  o 6.765000  0.2601000     6.869000  0.2563000     6.661000  0.4527000     0.2074000      0.5203000 
1 1 1 23 6  10 o 2.228000  0.4975000     1.632000  0.5920000     2.824000  0.7996000     -1.192000      0.9949000 
1 1 1 23 6  11 o 9.742000  0.2081000     9.355000  0.2314000     10.13000  0.3459000     -0.7735000     0.4162000 
1 1 1 23 6  12 f 3.097000  0.5427000     2.633000  0.8265000     3.560000  0.7035000     -0.9267000     1.085000  
1 1 1 23 6  13 o 2.153000  0.5872000     2.231000  0.8405000     2.075000  0.8203000     0.1562000      1.174000  
1 1 1 23 6  14 o 4.645000  0.5916000     4.884000  0.8068000     4.406000  0.8655000     0.4784000      1.183000  
1 1 1 23 6  15 o 2.130000  0.5197000     1.427000  0.6745000     2.833000  0.7909000     -1.406000      1.039000  
1 1 1 23 6  16 o 1.563000  0.4911000     1.669000  0.7164000     1.458000  0.6719000     0.2103000      0.9822000 
1 1 1 23 6  17 o 3.586000  0.4481000     4.210000  0.5154000     2.963000  0.7332000     1.246000       0.8962000 
1 1 1 23 6  18 o 2.276000  0.5041000     1.957000  0.7253000     2.594000  0.7002000     -0.6364000     1.008000  
1 1 1 23 6  19 o 1.309000  0.4389000     1.289000  0.6163000     1.329000  0.6250000     -0.3996000E-01 0.8777000 
1 1 1 23 6  20 o 2.099000  0.5076000     2.224000  0.7163000     1.975000  0.7194000     0.2491000      1.015000  
1 1 1 23 6  21 o 0.9665000 0.3395000     1.054000  0.5144000     0.8786000 0.4432000     0.1758000      0.6790000 
1 1 1 23 6  22 o 1.347000  0.4342000     1.233000  0.5800000     1.460000  0.6463000     -0.2279000     0.8684000 
1 1 1 23 7  0  o 7.640000  0.1212000     7.640000  0.1212000     7.640000  0.1212000     0.000000       0.000000  
1 1 1 23 7  1  o 15.10000  0.1325000     15.03000  0.2084000     15.17000  0.1637000     -0.1449000     0.2650000 
1 1 1 23 7  2  o 5.551000  0.9859000E-01 5.400000  0.1573000     5.702000  0.1189000     -0.3020000     0.1972000 
1 1 1 23 7  3  o 1.136000  0.2945000     1.067000  0.4075000     1.205000  0.4251000     -0.1379000     0.5889000 
1 1 1 23 7  4  o 2.366000  0.2405000     2.810000  0.2905000     1.922000  0.3835000     0.8880000      0.4810000 
1 1 1 23 7  5  o 13.46000  0.1474000     13.65000  0.2197000     13.27000  0.1966000     0.3824000      0.2948000 
1 1 1 23 7  6  o 6.787000  0.2773000     7.067000  0.5125000     6.506000  0.2119000     0.5608000      0.5546000 
1 1 1 23 7  7  o 20.19000  0.1836000     20.03000  0.2553000     20.35000  0.2639000     -0.3182000     0.3671000 
1 1 1 23 7  8  o 6.562000  0.1738000     6.580000  0.2323000     6.545000  0.2587000     0.3494000E-01  0.3477000 
1 1 1 23 7  9  o 8.890000  0.2226000     9.001000  0.2299000     8.778000  0.3812000     0.2232000      0.4452000 
1 1 1 23 7  10 o 9.995000  0.1659000     9.845000  0.2186000     10.14000  0.2497000     -0.2995000     0.3318000 
1 1 1 23 7  11 o 13.22000  0.2371000     13.48000  0.2271000     12.97000  0.4163000     0.5109000      0.4742000 
1 1 1 23 7  12 o 8.200000  0.2461000     8.494000  0.2616000     7.905000  0.4170000     0.5898000      0.4923000 
1 1 1 23 7  13 o 7.970000  0.2899000     8.484000  0.3643000     7.456000  0.4509000     1.028000       0.5797000 
1 1 1 23 7  14 f 4.956000  0.5671000     4.266000  0.9079000     5.645000  0.6798000     -1.379000      1.134000  
1 1 1 23 7  15 o 2.748000  0.5738000     2.631000  0.8224000     2.866000  0.8006000     -0.2350000     1.148000  
1 1 1 23 7  16 o 3.409000  0.4974000     3.293000  0.6853000     3.525000  0.7211000     -0.2315000     0.9948000 
1 1 1 23 7  17 o 1.663000  0.4990000     1.572000  0.6800000     1.754000  0.7305000     -0.1828000     0.9980000 
1 1 1 23 7  18 o 1.758000  0.4612000     1.165000  0.5583000     2.351000  0.7342000     -1.186000      0.9224000 
1 1 1 23 7  19 o 2.652000  0.5505000     2.694000  0.7988000     2.611000  0.7577000     0.8274000E-01  1.101000  
1 1 1 23 7  20 f 1.483000  0.4569000     1.479000  0.6460000     1.487000  0.6464000     -0.8179000E-02 0.9138000 
1 1 1 23 7  21 o 1.278000  0.4216000     1.320000  0.6030000     1.236000  0.5895000     0.8467000E-01  0.8433000 
1 1 1 23 7  22 o 1.101000  0.3787000     1.094000  0.5325000     1.108000  0.5387000     -0.1433000E-01 0.7574000 
1 1 1 23 8  0  o 1.081000  0.4430000     1.081000  0.4430000     1.081000  0.4430000     0.000000       0.000000  
1 1 1 23 8  1  o 5.031000  0.9354000E-01 5.127000  0.1354000     4.934000  0.1291000     0.1933000      0.1871000 
1 1 1 23 8  2  o 7.856000  0.1007000     7.924000  0.1589000     7.788000  0.1238000     0.1358000      0.2014000 
1 1 1 23 8  3  o 8.950000  0.1520000     8.887000  0.2050000     9.014000  0.2244000     -0.1274000     0.3040000 
1 1 1 23 8  4  o 12.51000  0.1370000     12.42000  0.2024000     12.59000  0.1846000     -0.1728000     0.2739000 
1 1 1 23 8  5  o 10.08000  0.1341000     10.15000  0.1962000     10.02000  0.1827000     0.1265000      0.2681000 
1 1 1 23 8  6  o 7.471000  0.1912000     7.357000  0.2905000     7.585000  0.2487000     -0.2274000     0.3824000 
1 1 1 23 8  7  o 8.699000  0.1943000     8.620000  0.2781000     8.777000  0.2716000     -0.1577000     0.3887000 
1 1 1 23 8  8  o 1.587000  0.4013000     1.179000  0.5163000     1.995000  0.6145000     -0.8160000     0.8026000 
1 1 1 23 8  9  f 5.320000  0.2388000     5.687000  0.2782000     4.954000  0.3883000     0.7329000      0.4777000 
1 1 1 23 8  10 o 2.064000  0.4534000     2.296000  0.6155000     1.832000  0.6659000     0.4638000      0.9068000 
1 1 1 23 8  11 o 12.94000  0.2000000     13.02000  0.2752000     12.87000  0.2903000     0.1439000      0.4000000 
1 1 1 23 8  12 o 9.323000  0.2245000     9.314000  0.2448000     9.333000  0.3764000     -0.1906000E-01 0.4490000 
1 1 1 23 8  13 o 7.722000  0.2653000     8.078000  0.2751000     7.366000  0.4537000     0.7126000      0.5306000 
1 1 1 23 8  14 o 1.575000  0.4943000     1.666000  0.6719000     1.485000  0.7252000     0.1810000      0.9887000 
1 1 1 23 8  15 o 5.094000  0.3521000     5.134000  0.4987000     5.054000  0.4972000     0.7976000E-01  0.7042000 
1 1 1 23 8  16 o 2.236000  0.5889000     2.154000  0.7970000     2.319000  0.8671000     -0.1650000     1.178000  
1 1 1 23 8  17 o 2.237000  0.4877000     1.588000  0.6771000     2.886000  0.7022000     -1.298000      0.9755000 
1 1 1 23 8  18 o 2.091000  0.4782000     2.717000  0.7018000     1.466000  0.6496000     1.251000       0.9563000 
1 1 1 23 8  19 f 2.949000  0.5382000     3.312000  0.7284000     2.585000  0.7925000     0.7270000      1.076000  
1 1 1 23 8  20 o 2.316000  0.5073000     2.328000  0.7230000     2.304000  0.7117000     0.2387000E-01  1.015000  
1 1 1 23 8  21 o 1.262000  0.4214000     1.270000  0.5971000     1.253000  0.5948000     0.1714000E-01  0.8428000 
1 1 1 23 8  22 o 1.315000  0.4274000     1.210000  0.5720000     1.421000  0.6351000     -0.2108000     0.8547000 
1 1 1 23 9  0  o 1.837000  0.3402000     1.837000  0.3402000     1.837000  0.3402000     0.000000       0.000000  
1 1 1 23 9  1  o 6.719000  0.1035000     6.557000  0.1599000     6.881000  0.1316000     -0.3237000     0.2071000 
1 1 1 23 9  2  o 11.09000  0.1087000     11.12000  0.1545000     11.06000  0.1531000     0.6292000E-01  0.2175000 
1 1 1 23 9  3  o 2.938000  0.2234000     2.952000  0.2887000     2.924000  0.3410000     0.2772000E-01  0.4468000 
1 1 1 23 9  4  o 3.749000  0.1850000     3.722000  0.2835000     3.777000  0.2376000     -0.5496000E-01 0.3699000 
1 1 1 23 9  5  o 5.710000  0.1703000     6.103000  0.2079000     5.317000  0.2699000     0.7857000      0.3407000 
1 1 1 23 9  6  o 9.110000  0.1375000     8.981000  0.1924000     9.239000  0.1965000     -0.2582000     0.2750000 
1 1 1 23 9  7  o 15.64000  0.1625000     15.49000  0.2265000     15.80000  0.2330000     -0.3104000     0.3250000 
1 1 1 23 9  8  o 5.694000  0.2185000     6.000000  0.2456000     5.389000  0.3614000     0.6112000      0.4370000 
1 1 1 23 9  9  o 10.48000  0.1672000     10.52000  0.2282000     10.45000  0.2445000     0.7396000E-01  0.3345000 
1 1 1 23 9  10 o 13.28000  0.1730000     13.14000  0.2421000     13.42000  0.2471000     -0.2830000     0.3460000 
1 1 1 23 9  11 f 3.390000  0.4489000     2.658000  0.7402000     4.121000  0.5080000     -1.463000      0.8977000 
1 1 1 23 9  12 o 4.619000  0.3045000     4.717000  0.4127000     4.521000  0.4479000     0.1960000      0.6091000 
1 1 1 23 9  13 f 3.731000  0.4945000     4.750000  0.3859000     2.712000  0.9105000     2.038000       0.9889000 
1 1 1 23 9  14 o 2.903000  0.5724000     3.325000  0.5874000     2.482000  0.9825000     0.8436000      1.145000  
1 1 1 23 9  15 f 2.097000  0.4616000     2.773000  0.6224000     1.421000  0.6819000     1.352000       0.9233000 
1 1 1 23 9  16 o 2.231000  0.6362000     1.843000  0.7985000     2.619000  0.9907000     -0.7765000     1.272000  
1 1 1 23 9  17 o 2.015000  0.5300000     1.894000  0.7390000     2.136000  0.7601000     -0.2412000     1.060000  
1 1 1 23 9  18 o 1.393000  0.4395000     1.593000  0.6723000     1.192000  0.5662000     0.4008000      0.8789000 
1 1 1 23 9  19 o 1.528000  0.4703000     1.941000  0.7681000     1.116000  0.5429000     0.8247000      0.9406000 
1 1 1 23 9  20 o 1.752000  0.4939000     1.787000  0.7037000     1.718000  0.6932000     0.6876000E-01  0.9878000 
1 1 1 23 9  21 f 1.629000  0.4847000     1.896000  0.7400000     1.362000  0.6260000     0.5336000      0.9693000 
1 1 1 23 9  22 o 1.801000  0.4479000     1.112000  0.5393000     2.489000  0.7153000     -1.377000      0.8958000 
1 1 1 23 10 0  o 8.332000  0.1394000     8.332000  0.1394000     8.332000  0.1394000     0.000000       0.000000  
1 1 1 23 10 1  o 6.456000  0.9789000E-01 6.390000  0.1398000     6.523000  0.1371000     -0.1323000     0.1958000 
1 1 1 23 10 2  o 3.971000  0.1500000     4.138000  0.2404000     3.804000  0.1794000     0.3335000      0.2999000 
1 1 1 23 10 3  o 8.105000  0.1232000     8.017000  0.1814000     8.193000  0.1668000     -0.1753000     0.2464000 
1 1 1 23 10 4  o 17.68000  0.1918000     17.67000  0.3092000     17.70000  0.2272000     -0.2166000E-01 0.3836000 
1 1 1 23 10 5  o 9.936000  0.2196000     9.842000  0.3961000     10.03000  0.1897000     -0.1869000     0.4392000 
1 1 1 23 10 6  o 7.363000  0.1437000     7.228000  0.1999000     7.498000  0.2066000     -0.2692000     0.2875000 
1 1 1 23 10 7  o 8.679000  0.1502000     8.759000  0.2045000     8.600000  0.2199000     0.1590000      0.3003000 
1 1 1 23 10 8  o 26.75000  0.2477000     26.57000  0.3235000     26.93000  0.3751000     -0.3635000     0.4954000 
1 1 1 23 10 9  o 12.81000  0.1688000     12.91000  0.2356000     12.71000  0.2419000     0.2047000      0.3376000 
1 1 1 23 10 10 o 4.848000  0.2573000     4.673000  0.3577000     5.023000  0.3700000     -0.3502000     0.5147000 
1 1 1 23 10 11 o 3.101000  0.7009000     4.167000  1.139000      2.035000  0.8167000     2.132000       1.402000  
1 1 1 23 10 12 o 3.161000  0.4387000     3.767000  0.5034000     2.555000  0.7186000     1.212000       0.8774000 
1 1 1 23 10 13 o 7.635000  0.2223000     7.356000  0.3102000     7.915000  0.3186000     -0.5592000     0.4446000 
1 1 1 23 10 14 o 3.661000  0.5763000     4.107000  0.4966000     3.215000  1.040000      0.8925000      1.153000  
1 1 1 23 10 15 o 2.486000  0.5446000     2.679000  0.6502000     2.294000  0.8740000     0.3857000      1.089000  
1 1 1 23 10 16 o 1.706000  0.5257000     1.684000  0.6689000     1.728000  0.8112000     -0.4380000E-01 1.051000  
1 1 1 23 10 17 o 3.552000  0.4411000     3.615000  0.4572000     3.488000  0.7544000     0.1270000      0.8821000 
1 1 1 23 10 18 o 1.640000  0.4832000     1.525000  0.6601000     1.755000  0.7059000     -0.2293000     0.9665000 
1 1 1 23 10 19 o 1.087000  0.3771000     1.029000  0.5079000     1.146000  0.5576000     -0.1176000     0.7542000 
1 1 1 23 10 20 o 1.622000  0.4725000     1.458000  0.6376000     1.787000  0.6975000     -0.3291000     0.9450000 
1 1 1 23 10 21 o 1.804000  0.5159000     1.847000  0.7383000     1.761000  0.7206000     0.8595000E-01  1.032000  
1 1 1 23 10 22 o 1.069000  0.3693000     0.9509000 0.4776000     1.186000  0.5635000     -0.2355000     0.7386000 
1 1 1 23 11 0  o 3.266000  0.2009000     3.266000  0.2009000     3.266000  0.2009000     0.000000       0.000000  
1 1 1 23 11 1  o 16.30000  0.1530000     16.32000  0.2316000     16.28000  0.1999000     0.4156000E-01  0.3060000 
1 1 1 23 11 2  o 9.838000  0.1340000     10.07000  0.1757000     9.608000  0.2024000     0.4605000      0.2680000 
1 1 1 23 11 3  o 1.398000  0.3028000     1.648000  0.3993000     1.148000  0.4553000     0.5003000      0.6056000 
1 1 1 23 11 4  o 3.979000  0.2218000     4.249000  0.2708000     3.710000  0.3513000     0.5389000      0.4436000 
1 1 1 23 11 5  o 10.39000  0.2224000     10.21000  0.4141000     10.57000  0.1622000     -0.3609000     0.4448000 
1 1 1 23 11 6  o 14.93000  0.1544000     14.88000  0.2149000     14.98000  0.2218000     -0.9346000E-01 0.3089000 
1 1 1 23 11 7  o 10.64000  0.1484000     10.70000  0.2061000     10.58000  0.2137000     0.1238000      0.2969000 
1 1 1 23 11 8  o 8.846000  0.2087000     8.539000  0.2378000     9.152000  0.3431000     -0.6129000     0.4175000 
1 1 1 23 11 9  o 4.408000  0.2569000     4.623000  0.3322000     4.193000  0.3919000     0.4294000      0.5138000 
1 1 1 23 11 10 o 7.077000  0.1974000     6.847000  0.2748000     7.307000  0.2833000     -0.4604000     0.3947000 
1 1 1 23 11 11 o 4.820000  0.4695000     4.165000  0.8623000     5.475000  0.3718000     -1.310000      0.9390000 
1 1 1 23 11 12 o 10.89000  0.1919000     10.69000  0.2699000     11.08000  0.2728000     -0.3862000     0.3837000 
1 1 1 23 11 13 o 7.160000  0.2294000     7.468000  0.3085000     6.852000  0.3395000     0.6158000      0.4587000 
1 1 1 23 11 14 o 6.394000  0.2503000     6.630000  0.3269000     6.158000  0.3793000     0.4711000      0.5007000 
1 1 1 23 11 15 o 4.179000  0.3567000     3.803000  0.5392000     4.555000  0.4671000     -0.7520000     0.7134000 
1 1 1 23 11 16 o 2.574000  0.5874000     3.021000  0.7496000     2.128000  0.9044000     0.8932000      1.175000  
1 1 1 23 11 17 o 1.351000  0.4299000     1.444000  0.6066000     1.257000  0.6094000     0.1869000      0.8598000 
1 1 1 23 11 18 f 3.029000  0.4621000     3.817000  0.4092000     2.240000  0.8287000     1.577000       0.9243000 
1 1 1 23 11 19 o 1.123000  0.3896000     0.9073000 0.4474000     1.339000  0.6378000     -0.4316000     0.7791000 
1 1 1 23 11 20 o 1.398000  0.4400000     1.492000  0.6493000     1.304000  0.5941000     0.1885000      0.8801000 
1 1 1 23 11 21 f 1.120000  0.3875000     1.006000  0.5068000     1.235000  0.5864000     -0.2288000     0.7750000 
1 1 1 23 11 22 o 1.213000  0.4057000     1.302000  0.6033000     1.124000  0.5425000     0.1782000      0.8113000 
1 1 1 23 12 0  o 30.13000  0.3915000     30.13000  0.3915000     30.13000  0.3915000     0.000000       0.000000  
1 1 1 23 12 1  o 1.908000  0.2810000     2.098000  0.3618000     1.719000  0.4300000     0.3786000      0.5620000 
1 1 1 23 12 2  o 7.831000  0.1445000     7.777000  0.1518000     7.884000  0.2460000     -0.1075000     0.2891000 
1 1 1 23 12 3  o 1.912000  0.3172000     2.369000  0.3032000     1.455000  0.5571000     0.9138000      0.6343000 
1 1 1 23 12 4  o 6.981000  0.1573000     6.994000  0.2387000     6.968000  0.2051000     0.2606000E-01  0.3147000 
1 1 1 23 12 5  o 12.03000  0.1541000     12.20000  0.2583000     11.86000  0.1681000     0.3439000      0.3082000 
1 1 1 23 12 6  o 7.644000  0.1483000     7.580000  0.2078000     7.708000  0.2117000     -0.1279000     0.2966000 
1 1 1 23 12 7  o 7.298000  0.1648000     7.571000  0.2217000     7.025000  0.2439000     0.5466000      0.3296000 
1 1 1 23 12 8  o 11.99000  0.2430000     12.28000  0.2456000     11.71000  0.4194000     0.5695000      0.4860000 
1 1 1 23 12 9  o 7.776000  0.1831000     7.720000  0.2465000     7.833000  0.2709000     -0.1129000     0.3662000 
1 1 1 23 12 10 o 11.85000  0.1767000     11.67000  0.2439000     12.04000  0.2559000     -0.3688000     0.3535000 
1 1 1 23 12 11 o 7.183000  0.2172000     7.458000  0.2940000     6.907000  0.3199000     0.5509000      0.4345000 
1 1 1 23 12 12 o 4.106000  0.3500000     4.569000  0.4131000     3.643000  0.5650000     0.9253000      0.7000000 
1 1 1 23 12 13 o 2.316000  0.5247000     2.578000  0.7124000     2.054000  0.7706000     0.5239000      1.049000  
1 1 1 23 12 14 o 4.281000  0.3519000     3.519000  0.5570000     5.043000  0.4303000     -1.523000      0.7039000 
1 1 1 23 12 15 o 5.775000  0.3603000     6.748000  0.3252000     4.802000  0.6430000     1.945000       0.7205000 
1 1 1 23 12 16 o 3.047000  0.6085000     2.471000  1.073000      3.622000  0.5738000     -1.150000      1.217000  
1 1 1 23 12 17 o 4.339000  0.2985000     3.922000  0.4247000     4.756000  0.4195000     -0.8332000     0.5969000 
1 1 1 23 12 18 o 4.231000  0.3637000     4.142000  0.3837000     4.320000  0.6179000     -0.1782000     0.7274000 
1 1 1 23 12 19 o 4.305000  0.3729000     4.600000  0.3496000     4.011000  0.6588000     0.5896000      0.7458000 
1 1 1 23 12 20 o 1.555000  0.4545000     1.696000  0.6312000     1.413000  0.6542000     0.2823000      0.9091000 
1 1 1 23 12 21 o 1.290000  0.4379000     1.346000  0.6429000     1.235000  0.5949000     0.1108000      0.8759000 
1 1 1 23 12 22 o 1.370000  0.4497000     1.349000  0.6169000     1.391000  0.6544000     -0.4208000E-01 0.8994000 
1 1 1 23 13 0  o 15.96000  0.3895000     15.96000  0.3895000     15.96000  0.3895000     0.000000       0.000000  
1 1 1 23 13 1  o 11.79000  0.1962000     12.02000  0.1931000     11.55000  0.3415000     0.4716000      0.3923000 
1 1 1 23 13 2  o 14.56000  0.1565000     14.55000  0.2170000     14.58000  0.2255000     -0.2954000E-01 0.3129000 
1 1 1 23 13 3  o 10.44000  0.1537000     10.28000  0.2332000     10.60000  0.2003000     -0.3198000     0.3074000 
1 1 1 23 13 4  o 5.502000  0.1522000     5.567000  0.1993000     5.437000  0.2302000     0.1299000      0.3045000 
1 1 1 23 13 5  o 12.78000  0.1589000     12.51000  0.2641000     13.05000  0.1768000     -0.5469000     0.3178000 
1 1 1 23 13 6  o 8.440000  0.1419000     8.416000  0.2246000     8.465000  0.1735000     -0.4877000E-01 0.2838000 
1 1 1 23 13 7  o 15.48000  0.1643000     15.54000  0.2301000     15.41000  0.2346000     0.1279000      0.3286000 
1 1 1 23 13 8  o 7.289000  0.2378000     7.493000  0.2409000     7.085000  0.4102000     0.4074000      0.4757000 
1 1 1 23 13 9  o 15.41000  0.1759000     15.38000  0.2456000     15.43000  0.2518000     -0.5516000E-01 0.3518000 
1 1 1 23 13 10 o 2.513000  0.5098000     2.337000  0.6949000     2.689000  0.7461000     -0.3518000     1.020000  
1 1 1 23 13 11 o 2.984000  0.4320000     2.919000  0.5986000     3.049000  0.6231000     -0.1291000     0.8641000 
1 1 1 23 13 12 f 8.006000  0.2158000     7.905000  0.3013000     8.108000  0.3092000     -0.2032000     0.4317000 
1 1 1 23 13 13 o 2.617000  0.5183000     2.139000  0.7573000     3.095000  0.7078000     -0.9562000     1.037000  
1 1 1 23 13 14 o 1.784000  0.4510000     1.046000  0.5120000     2.523000  0.7426000     -1.477000      0.9020000 
1 1 1 23 13 15 o 2.003000  0.5158000     2.120000  0.7214000     1.887000  0.7375000     0.2334000      1.032000  
1 1 1 23 13 16 o 2.186000  0.5746000     1.919000  0.8704000     2.453000  0.7504000     -0.5333000     1.149000  
1 1 1 23 13 17 o 1.452000  0.4447000     1.547000  0.6434000     1.356000  0.6141000     0.1909000      0.8894000 
1 1 1 23 13 18 o 2.631000  0.4981000     2.730000  0.6778000     2.531000  0.7300000     0.1987000      0.9962000 
1 1 1 23 13 19 o 2.669000  0.4200000     2.263000  0.6050000     3.075000  0.5826000     -0.8123000     0.8399000 
1 1 1 23 13 20 f 1.781000  0.4906000     1.733000  0.6345000     1.829000  0.7484000     -0.9588000E-01 0.9812000 
1 1 1 23 13 21 o 1.174000  0.4039000     1.147000  0.5590000     1.202000  0.5831000     -0.5502000E-01 0.8078000 
1 1 1 23 13 22 o 1.070000  0.3665000     1.070000  0.5049000     1.069000  0.5314000     0.1279000E-02  0.7330000 
1 1 1 23 14 0  o 26.84000  0.3529000     26.84000  0.3529000     26.84000  0.3529000     0.000000       0.000000  
1 1 1 23 14 1  o 20.30000  0.1850000     20.40000  0.2804000     20.19000  0.2414000     0.2052000      0.3700000 
1 1 1 23 14 2  o 12.48000  0.1476000     12.30000  0.2052000     12.65000  0.2121000     -0.3550000     0.2951000 
1 1 1 23 14 3  f 4.869000  0.1520000     4.741000  0.1959000     4.997000  0.2325000     -0.2557000     0.3040000 
1 1 1 23 14 4  o 14.23000  0.1490000     14.23000  0.2221000     14.23000  0.1988000     0.7978000E-02  0.2981000 
1 1 1 23 14 5  o 13.92000  0.1494000     13.86000  0.2234000     13.97000  0.1984000     -0.1108000     0.2988000 
1 1 1 23 14 6  o 8.634000  0.1450000     8.424000  0.2280000     8.844000  0.1793000     -0.4200000     0.2900000 
1 1 1 23 14 7  o 9.998000  0.1564000     9.677000  0.2416000     10.32000  0.1987000     -0.6416000     0.3128000 
1 1 1 23 14 8  o 17.58000  0.1801000     17.52000  0.2517000     17.64000  0.2576000     -0.1175000     0.3601000 
1 1 1 23 14 9  o 5.751000  0.2191000     5.967000  0.2809000     5.534000  0.3364000     0.4335000      0.4383000 
1 1 1 23 14 10 o 11.27000  0.2141000     11.53000  0.3348000     11.00000  0.2668000     0.5360000      0.4281000 
1 1 1 23 14 11 o 5.872000  0.2451000     6.156000  0.3163000     5.587000  0.3746000     0.5695000      0.4903000 
1 1 1 23 14 12 o 8.746000  0.2089000     8.578000  0.2948000     8.914000  0.2962000     -0.3357000     0.4178000 
1 1 1 23 14 13 o 2.081000  0.5837000     1.512000  0.6663000     2.651000  0.9584000     -1.139000      1.167000  
1 1 1 23 14 14 o 3.873000  0.3830000     3.466000  0.5697000     4.281000  0.5119000     -0.8155000     0.7659000 
1 1 1 23 14 15 f 1.179000  0.3979000     0.9929000 0.4881000     1.365000  0.6286000     -0.3724000     0.7959000 
1 1 1 23 14 16 o 3.994000  0.4460000     4.202000  0.6959000     3.786000  0.5581000     0.4157000      0.8920000 
1 1 1 23 14 17 o 1.519000  0.4463000     1.170000  0.5506000     1.868000  0.7026000     -0.6981000     0.8926000 
1 1 1 23 14 18 o 2.911000  0.4722000     2.827000  0.6671000     2.996000  0.6685000     -0.1692000     0.9444000 
1 1 1 23 14 19 o 1.180000  0.3873000     1.168000  0.5420000     1.192000  0.5534000     -0.2452000E-01 0.7746000 
1 1 1 23 14 20 o 1.407000  0.4246000     1.144000  0.5381000     1.671000  0.6569000     -0.5273000     0.8491000 
1 1 1 23 14 21 o 1.411000  0.4432000     1.327000  0.6208000     1.495000  0.6326000     -0.1679000     0.8863000 
1 1 1 23 14 22 o 1.554000  0.4779000     1.238000  0.5544000     1.869000  0.7786000     -0.6314000     0.9558000 
1 1 1 23 15 0  o 10.52000  0.1671000     10.52000  0.1671000     10.52000  0.1671000     0.000000       0.000000  
1 1 1 23 15 1  o 28.85000  0.2322000     28.75000  0.3269000     28.95000  0.3298000     -0.2016000     0.4643000 
1 1 1 23 15 2  o 17.67000  0.1697000     17.78000  0.2209000     17.57000  0.2576000     0.2181000      0.3394000 
1 1 1 23 15 3  o 11.26000  0.1384000     11.26000  0.1770000     11.26000  0.2128000     -0.1261000E-02 0.2768000 
1 1 1 23 15 4  o 10.69000  0.1346000     10.66000  0.1989000     10.71000  0.1814000     -0.5694000E-01 0.2691000 
1 1 1 23 15 5  o 12.71000  0.1450000     12.67000  0.2166000     12.75000  0.1928000     -0.8256000E-01 0.2899000 
1 1 1 23 15 6  o 17.34000  0.1640000     17.38000  0.2328000     17.30000  0.2311000     0.7599000E-01  0.3280000 
1 1 1 23 15 7  o 4.141000  0.2527000     4.075000  0.3847000     4.207000  0.3276000     -0.1328000     0.5053000 
1 1 1 23 15 8  o 8.682000  0.1712000     8.554000  0.2387000     8.810000  0.2456000     -0.2560000     0.3425000 
1 1 1 23 15 9  o 6.030000  0.2067000     6.064000  0.2802000     5.996000  0.3041000     0.6770000E-01  0.4135000 
1 1 1 23 15 10 o 4.411000  0.5005000     3.579000  0.9287000     5.243000  0.3732000     -1.663000      1.001000  
1 1 1 23 15 11 o 4.996000  0.2849000     5.286000  0.3586000     4.707000  0.4426000     0.5788000      0.5697000 
1 1 1 23 15 12 o 2.520000  0.4835000     3.020000  0.6182000     2.021000  0.7434000     0.9992000      0.9669000 
1 1 1 23 15 13 o 2.316000  0.6076000     1.960000  0.7487000     2.673000  0.9571000     -0.7122000     1.215000  
1 1 1 23 15 14 o 3.265000  0.4364000     3.339000  0.5787000     3.192000  0.6532000     0.1461000      0.8727000 
1 1 1 23 15 15 o 4.038000  0.3893000     4.028000  0.4892000     4.049000  0.6057000     -0.2162000E-01 0.7786000 
1 1 1 23 15 16 o 4.321000  0.3472000     4.969000  0.3917000     3.673000  0.5733000     1.295000       0.6943000 
1 1 1 23 15 17 o 3.551000  0.4081000     4.511000  0.4262000     2.590000  0.6962000     1.921000       0.8162000 
1 1 1 23 15 18 o 1.858000  0.5439000     1.519000  0.6495000     2.197000  0.8727000     -0.6786000     1.088000  
1 1 1 23 15 19 o 2.356000  0.4803000     2.540000  0.6676000     2.172000  0.6907000     0.3680000      0.9606000 
1 1 1 23 15 20 o 3.211000  0.3855000     3.248000  0.5268000     3.175000  0.5630000     0.7319000E-01  0.7710000 
1 1 1 23 15 21 o 1.250000  0.4038000     1.195000  0.5557000     1.306000  0.5860000     -0.1108000     0.8076000 
1 1 1 23 15 22 o 1.359000  0.4259000     1.492000  0.6327000     1.225000  0.5705000     0.2678000      0.8519000 
1 1 1 23 16 0  o 6.740000  0.1691000     6.740000  0.1691000     6.740000  0.1691000     0.000000       0.000000  
1 1 1 23 16 1  o 12.42000  0.1282000     12.54000  0.1812000     12.29000  0.1815000     0.2491000      0.2565000 
1 1 1 23 16 2  o 10.39000  0.1332000     10.38000  0.1706000     10.40000  0.2046000     -0.2707000E-01 0.2664000 
1 1 1 23 16 3  o 6.198000  0.1467000     6.169000  0.1879000     6.227000  0.2253000     -0.5720000E-01 0.2934000 
1 1 1 23 16 4  o 23.86000  0.2157000     24.01000  0.3265000     23.70000  0.2821000     0.3124000      0.4314000 
1 1 1 23 16 5  o 1.413000  0.3632000     1.518000  0.5279000     1.308000  0.4989000     0.2098000      0.7264000 
1 1 1 23 16 6  o 14.38000  0.1493000     14.27000  0.2114000     14.48000  0.2109000     -0.2097000     0.2986000 
1 1 1 23 16 7  o 16.13000  0.2124000     16.19000  0.3268000     16.06000  0.2713000     0.1362000      0.4247000 
1 1 1 23 16 8  o 11.28000  0.1628000     11.21000  0.2576000     11.35000  0.1992000     -0.1388000     0.3256000 
1 1 1 23 16 9  o 10.14000  0.1944000     9.902000  0.2469000     10.38000  0.3005000     -0.4817000     0.3889000 
1 1 1 23 16 10 o 1.570000  0.4605000     1.574000  0.6471000     1.565000  0.6553000     0.9539000E-02  0.9210000 
1 1 1 23 16 11 o 9.807000  0.1952000     9.828000  0.2658000     9.786000  0.2858000     0.4235000E-01  0.3903000 
1 1 1 23 16 12 o 6.507000  0.2522000     6.317000  0.3514000     6.697000  0.3619000     -0.3799000     0.5044000 
1 1 1 23 16 13 o 4.176000  0.4084000     4.565000  0.4487000     3.788000  0.6826000     0.7771000      0.8168000 
1 1 1 23 16 14 o 1.495000  0.4600000     1.360000  0.6079000     1.630000  0.6905000     -0.2692000     0.9200000 
1 1 1 23 16 15 o 4.969000  0.3403000     4.606000  0.4944000     5.333000  0.4678000     -0.7271000     0.6806000 
1 1 1 23 16 16 o 3.463000  0.4107000     3.969000  0.4823000     2.957000  0.6648000     1.012000       0.8213000 
1 1 1 23 16 17 o 1.598000  0.4641000     1.474000  0.6264000     1.722000  0.6849000     -0.2488000     0.9282000 
1 1 1 23 16 18 o 2.042000  0.5987000     1.815000  0.7051000     2.269000  0.9677000     -0.4533000     1.197000  
1 1 1 23 16 19 o 1.859000  0.4792000     1.757000  0.6742000     1.960000  0.6811000     -0.2030000     0.9584000 
1 1 1 23 16 20 o 1.225000  0.4014000     1.173000  0.5465000     1.278000  0.5881000     -0.1042000     0.8028000 
1 1 1 23 16 21 o 1.769000  0.4734000     1.964000  0.6825000     1.575000  0.6561000     0.3890000      0.9468000 
1 1 1 23 16 22 o 1.387000  0.4746000     1.340000  0.6545000     1.434000  0.6876000     -0.9427000E-01 0.9493000 
1 1 1 23 17 0  o 9.632000  0.1710000     9.632000  0.1710000     9.632000  0.1710000     0.000000       0.000000  
1 1 1 23 17 1  o 13.20000  0.1332000     13.26000  0.1877000     13.14000  0.1889000     0.1183000      0.2663000 
1 1 1 23 17 2  o 17.06000  0.1681000     17.10000  0.2190000     17.01000  0.2551000     0.9041000E-01  0.3362000 
1 1 1 23 17 3  o 4.279000  0.1868000     4.336000  0.2499000     4.222000  0.2777000     0.1133000      0.3736000 
1 1 1 23 17 4  o 18.00000  0.1754000     18.02000  0.2632000     17.98000  0.2320000     0.4305000E-01  0.3509000 
1 1 1 23 17 5  o 10.57000  0.1415000     10.52000  0.2115000     10.61000  0.1881000     -0.9408000E-01 0.2831000 
1 1 1 23 17 6  f 5.447000  0.1831000     5.558000  0.2800000     5.337000  0.2359000     0.2213000      0.3662000 
1 1 1 23 17 7  o 2.747000  0.3104000     2.521000  0.4461000     2.973000  0.4319000     -0.4518000     0.6209000 
1 1 1 23 17 8  o 8.513000  0.1712000     8.499000  0.2690000     8.528000  0.2119000     -0.2948000E-01 0.3425000 
1 1 1 23 17 9  o 6.575000  0.2322000     6.769000  0.3383000     6.382000  0.3180000     0.3875000      0.4643000 
1 1 1 23 17 10 o 10.74000  0.1806000     10.96000  0.2524000     10.52000  0.2585000     0.4378000      0.3613000 
1 1 1 23 17 11 f 5.323000  0.2735000     5.464000  0.3535000     5.183000  0.4173000     0.2807000      0.5469000 
1 1 1 23 17 12 o 2.843000  0.5651000     2.884000  0.6526000     2.803000  0.9228000     0.8046000E-01  1.130000  
1 1 1 23 17 13 o 2.851000  0.4886000     3.319000  0.5901000     2.383000  0.7790000     0.9365000      0.9773000 
1 1 1 23 17 14 o 2.422000  0.5178000     2.398000  0.7165000     2.446000  0.7477000     -0.4782000E-01 1.036000  
1 1 1 23 17 15 f 4.528000  0.4116000     4.159000  0.6477000     4.898000  0.5081000     -0.7384000     0.8232000 
1 1 1 23 17 16 o 4.659000  0.3009000     4.736000  0.4063000     4.582000  0.4438000     0.1543000      0.6017000 
1 1 1 23 17 17 o 2.130000  0.5032000     2.060000  0.7053000     2.201000  0.7179000     -0.1409000     1.006000  
1 1 1 23 17 18 f 2.429000  0.5366000     2.741000  0.6463000     2.116000  0.8567000     0.6250000      1.073000  
1 1 1 23 17 19 o 1.381000  0.4274000     1.509000  0.6304000     1.254000  0.5772000     0.2549000      0.8548000 
1 1 1 23 17 20 o 1.471000  0.4319000     1.089000  0.5162000     1.853000  0.6926000     -0.7636000     0.8638000 
1 1 1 23 17 21 o 1.220000  0.3980000     1.027000  0.4974000     1.412000  0.6214000     -0.3856000     0.7960000 
1 1 1 23 18 0  o 2.724000  0.3298000     2.724000  0.3298000     2.724000  0.3298000     0.000000       0.000000  
1 1 1 23 18 1  f 5.809000  0.1350000     5.721000  0.1883000     5.897000  0.1935000     -0.1766000     0.2700000 
1 1 1 23 18 2  o 5.644000  0.1526000     5.485000  0.1984000     5.804000  0.2318000     -0.3184000     0.3051000 
1 1 1 23 18 3  o 7.577000  0.1512000     7.552000  0.2036000     7.603000  0.2236000     -0.5047000E-01 0.3024000 
1 1 1 23 18 4  o 18.06000  0.1769000     17.96000  0.2639000     18.15000  0.2356000     -0.1947000     0.3538000 
1 1 1 23 18 5  o 15.85000  0.1663000     15.76000  0.2483000     15.93000  0.2212000     -0.1743000     0.3325000 
1 1 1 23 18 6  o 9.670000  0.1833000     9.846000  0.2847000     9.494000  0.2311000     0.3522000      0.3667000 
1 1 1 23 18 7  o 13.35000  0.1530000     13.33000  0.2166000     13.38000  0.2161000     -0.5109000E-01 0.3060000 
1 1 1 23 18 8  o 14.58000  0.1822000     14.34000  0.2756000     14.82000  0.2384000     -0.4865000     0.3644000 
1 1 1 23 18 9  o 7.111000  0.2751000     7.055000  0.4939000     7.168000  0.2424000     -0.1135000     0.5502000 
1 1 1 23 18 10 o 8.800000  0.1942000     8.813000  0.2660000     8.787000  0.2831000     0.2578000E-01  0.3885000 
1 1 1 23 18 11 o 4.582000  0.3087000     4.397000  0.4379000     4.767000  0.4353000     -0.3698000     0.6175000 
1 1 1 23 18 12 o 3.756000  0.4400000     2.553000  0.7399000     4.959000  0.4766000     -2.406000      0.8801000 
1 1 1 23 18 13 o 4.445000  0.3429000     4.759000  0.4312000     4.131000  0.5332000     0.6281000      0.6857000 
1 1 1 23 18 14 o 4.357000  0.3438000     4.520000  0.4463000     4.193000  0.5230000     0.3270000      0.6875000 
1 1 1 23 18 15 o 3.821000  0.5433000     2.243000  1.007000      5.399000  0.4090000     -3.156000      1.087000  
1 1 1 23 18 16 o 4.236000  0.3266000     4.047000  0.4614000     4.424000  0.4624000     -0.3772000     0.6532000 
1 1 1 23 18 17 o 3.586000  0.3737000     3.282000  0.5461000     3.891000  0.5104000     -0.6085000     0.7475000 
1 1 1 23 18 18 o 1.954000  0.5067000     1.778000  0.6847000     2.131000  0.7472000     -0.3536000     1.013000  
1 1 1 23 18 19 o 1.351000  0.4238000     1.226000  0.5622000     1.477000  0.6342000     -0.2508000     0.8475000 
1 1 1 23 18 20 o 1.607000  0.4783000     1.510000  0.6741000     1.704000  0.6787000     -0.1931000     0.9566000 
1 1 1 23 18 21 o 1.981000  0.4330000     1.310000  0.5854000     2.652000  0.6382000     -1.342000      0.8660000 
1 1 1 23 19 0  o 3.722000  0.2534000     3.722000  0.2534000     3.722000  0.2534000     0.000000       0.000000  
1 1 1 23 19 1  o 5.048000  0.1630000     4.964000  0.2093000     5.133000  0.2499000     -0.1689000     0.3260000 
1 1 1 23 19 2  o 5.053000  0.1686000     5.152000  0.2087000     4.954000  0.2649000     0.1988000      0.3372000 
1 1 1 23 19 3  f 6.744000  0.1594000     6.807000  0.2116000     6.681000  0.2385000     0.1261000      0.3188000 
1 1 1 23 19 4  o 6.110000  0.1568000     6.320000  0.2285000     5.900000  0.2147000     0.4201000      0.3135000 
1 1 1 23 19 5  o 9.848000  0.1676000     9.869000  0.2716000     9.826000  0.1966000     0.4347000E-01  0.3353000 
1 1 1 23 19 6  o 11.69000  0.1538000     11.60000  0.2087000     11.78000  0.2259000     -0.1845000     0.3076000 
1 1 1 23 19 7  o 6.579000  0.1639000     6.729000  0.2277000     6.429000  0.2357000     0.2998000      0.3277000 
1 1 1 23 19 8  o 10.42000  0.2078000     10.68000  0.2371000     10.16000  0.3414000     0.5246000      0.4157000 
1 1 1 23 19 9  o 10.92000  0.1759000     10.89000  0.2781000     10.95000  0.2155000     -0.5573000E-01 0.3518000 
1 1 1 23 19 10 o 8.723000  0.2057000     8.634000  0.2970000     8.812000  0.2846000     -0.1779000     0.4114000 
1 1 1 23 19 11 o 4.092000  0.3489000     3.790000  0.5115000     4.393000  0.4747000     -0.6030000     0.6978000 
1 1 1 23 19 12 o 5.466000  0.3858000     5.475000  0.4134000     5.456000  0.6516000     0.1915000E-01  0.7716000 
1 1 1 23 19 13 o 4.286000  0.3561000     3.652000  0.5440000     4.920000  0.4597000     -1.268000      0.7122000 
1 1 1 23 19 14 o 2.131000  0.4951000     2.415000  0.6702000     1.846000  0.7288000     0.5691000      0.9901000 
1 1 1 23 19 15 o 3.081000  0.5095000     2.464000  0.8652000     3.698000  0.5385000     -1.234000      1.019000  
1 1 1 23 19 16 o 2.420000  0.4515000     1.633000  0.6686000     3.207000  0.6070000     -1.574000      0.9031000 
1 1 1 23 19 17 o 1.413000  0.4399000     1.383000  0.6087000     1.442000  0.6352000     -0.5921000E-01 0.8798000 
1 1 1 23 19 18 o 1.525000  0.4371000     1.871000  0.6769000     1.179000  0.5533000     0.6923000      0.8742000 
1 1 1 23 19 19 o 2.011000  0.4595000     2.420000  0.6459000     1.603000  0.6536000     0.8169000      0.9189000 
1 1 1 23 19 20 o 1.747000  0.5115000     1.555000  0.7601000     1.939000  0.6849000     -0.3839000     1.023000  
1 1 1 23 19 21 o 1.237000  0.4051000     1.229000  0.5687000     1.245000  0.5772000     -0.1612000E-01 0.8103000 
1 1 1 23 20 0  o 5.616000  0.2062000     5.616000  0.2062000     5.616000  0.2062000     0.000000       0.000000  
1 1 1 23 20 1  o 5.381000  0.1648000     5.458000  0.2059000     5.305000  0.2573000     0.1526000      0.3295000 
1 1 1 23 20 2  o 16.61000  0.1701000     16.69000  0.2216000     16.53000  0.2581000     0.1600000      0.3402000 
1 1 1 23 20 3  o 11.66000  0.1577000     11.49000  0.2161000     11.84000  0.2297000     -0.3485000     0.3154000 
1 1 1 23 20 4  o 15.38000  0.1639000     15.40000  0.2449000     15.35000  0.2179000     0.5884000E-01  0.3278000 
1 1 1 23 20 5  o 13.20000  0.2279000     13.10000  0.3852000     13.31000  0.2438000     -0.2076000     0.4559000 
1 1 1 23 20 6  o 8.175000  0.1471000     8.291000  0.2104000     8.058000  0.2056000     0.2324000      0.2941000 
1 1 1 23 20 7  o 6.532000  0.1834000     6.735000  0.2380000     6.329000  0.2791000     0.4062000      0.3668000 
1 1 1 23 20 8  o 2.561000  0.5089000     2.106000  0.6952000     3.016000  0.7436000     -0.9098000     1.018000  
1 1 1 23 20 9  o 20.13000  0.1850000     20.36000  0.2751000     19.90000  0.2473000     0.4575000      0.3700000 
1 1 1 23 20 10 o 6.620000  0.2138000     6.744000  0.3284000     6.497000  0.2739000     0.2475000      0.4277000 
1 1 1 23 20 11 o 1.434000  0.4443000     1.512000  0.6409000     1.357000  0.6154000     0.1550000      0.8885000 
1 1 1 23 20 12 o 1.618000  0.5164000     1.458000  0.6385000     1.779000  0.8117000     -0.3204000     1.033000  
1 1 1 23 20 13 o 4.131000  0.3764000     4.769000  0.4236000     3.494000  0.6222000     1.275000       0.7527000 
1 1 1 23 20 14 o 2.547000  0.5202000     2.108000  0.7137000     2.986000  0.7571000     -0.8787000     1.040000  
1 1 1 23 20 15 f 5.362000  0.2661000     5.718000  0.3334000     5.005000  0.4148000     0.7132000      0.5322000 
1 1 1 23 20 16 f 3.446000  0.4094000     4.077000  0.4779000     2.816000  0.6650000     1.261000       0.8189000 
1 1 1 23 20 17 o 3.591000  0.4105000     3.643000  0.5342000     3.539000  0.6233000     0.1039000      0.8209000 
1 1 1 23 20 18 o 1.821000  0.4891000     1.685000  0.6776000     1.957000  0.7055000     -0.2717000     0.9782000 
1 1 1 23 20 19 o 2.020000  0.4776000     1.724000  0.6694000     2.315000  0.6813000     -0.5913000     0.9551000 
1 1 1 23 20 20 o 1.446000  0.4682000     1.548000  0.7213000     1.344000  0.5972000     0.2044000      0.9364000 
1 1 1 23 20 21 o 1.301000  0.4145000     1.395000  0.6087000     1.208000  0.5628000     0.1866000      0.8290000 
1 1 1 23 21 0  o 1.061000  0.5918000     1.061000  0.5918000     1.061000  0.5918000     0.000000       0.000000  
1 1 1 23 21 1  o 5.138000  0.1717000     4.844000  0.2276000     5.431000  0.2571000     -0.5872000     0.3434000 
1 1 1 23 21 2  o 6.851000  0.1526000     6.733000  0.1972000     6.969000  0.2329000     -0.2353000     0.3052000 
1 1 1 23 21 3  o 9.829000  0.1452000     9.834000  0.2133000     9.824000  0.1970000     0.9972000E-02  0.2903000 
1 1 1 23 21 4  o 9.179000  0.1707000     8.950000  0.2782000     9.409000  0.1980000     -0.4583000     0.3415000 
1 1 1 23 21 5  o 8.380000  0.1537000     8.413000  0.2088000     8.347000  0.2256000     0.6605000E-01  0.3074000 
1 1 1 23 21 6  o 12.33000  0.1506000     12.32000  0.2140000     12.34000  0.2118000     -0.1925000E-01 0.3011000 
1 1 1 23 21 7  o 16.82000  0.2255000     16.59000  0.2699000     17.05000  0.3614000     -0.4517000     0.4511000 
1 1 1 23 21 8  o 10.40000  0.1573000     10.37000  0.2228000     10.44000  0.2222000     -0.6845000E-01 0.3147000 
1 1 1 23 21 9  o 2.747000  0.3822000     2.728000  0.5389000     2.766000  0.5421000     -0.3813000E-01 0.7644000 
1 1 1 23 21 10 o 5.179000  0.2564000     4.992000  0.4124000     5.366000  0.3049000     -0.3744000     0.5129000 
1 1 1 23 21 11 o 1.786000  0.4948000     1.590000  0.6691000     1.983000  0.7292000     -0.3928000     0.9897000 
1 1 1 23 21 12 o 4.670000  0.3256000     4.302000  0.4445000     5.038000  0.4758000     -0.7358000     0.6512000 
1 1 1 23 21 13 o 2.485000  0.5082000     2.392000  0.7034000     2.579000  0.7336000     -0.1868000     1.016000  
1 1 1 23 21 14 o 3.429000  0.4647000     3.592000  0.6350000     3.267000  0.6786000     0.3247000      0.9294000 
1 1 1 23 21 15 o 3.191000  0.4272000     3.013000  0.6112000     3.369000  0.5969000     -0.3565000     0.8544000 
1 1 1 23 21 16 o 2.875000  0.4627000     2.897000  0.6463000     2.853000  0.6622000     0.4347000E-01  0.9254000 
1 1 1 23 21 17 o 2.225000  0.5431000     1.307000  0.5979000     3.143000  0.9069000     -1.836000      1.086000  
1 1 1 23 21 18 o 2.075000  0.4857000     2.017000  0.6796000     2.134000  0.6941000     -0.1162000     0.9714000 
1 1 1 23 21 19 o 1.602000  0.4381000     1.954000  0.6650000     1.250000  0.5704000     0.7041000      0.8761000 
1 1 1 23 21 20 o 1.604000  0.4739000     1.505000  0.6768000     1.702000  0.6635000     -0.1974000     0.9478000 
1 1 1 23 21 21 o 1.194000  0.3889000     0.8332000 0.4193000     1.555000  0.6551000     -0.7215000     0.7778000 
1 1 1 23 22 0  o 9.367000  0.1907000     9.367000  0.1907000     9.367000  0.1907000     0.000000       0.000000  
1 1 1 23 22 1  o 5.801000  0.1682000     5.560000  0.2167000     6.042000  0.2573000     -0.4813000     0.3364000 
1 1 1 23 22 2  o 17.44000  0.1792000     17.18000  0.2308000     17.69000  0.2742000     -0.5180000     0.3584000 
1 1 1 23 22 3  o 2.581000  0.3638000     2.607000  0.5811000     2.554000  0.4377000     0.5281000E-01  0.7275000 
1 1 1 23 22 4  o 2.865000  0.3510000     2.577000  0.5471000     3.153000  0.4400000     -0.5755000     0.7021000 
1 1 1 23 22 5  o 7.395000  0.1543000     7.483000  0.2171000     7.308000  0.2195000     0.1745000      0.3087000 
1 1 1 23 22 6  o 8.174000  0.1787000     8.111000  0.2400000     8.237000  0.2647000     -0.1256000     0.3573000 
1 1 1 23 22 7  o 8.205000  0.1849000     8.078000  0.2917000     8.332000  0.2271000     -0.2540000     0.3697000 
1 1 1 23 22 8  o 6.605000  0.1819000     6.680000  0.2533000     6.530000  0.2612000     0.1493000      0.3639000 
1 1 1 23 22 9  o 8.806000  0.1688000     8.731000  0.2366000     8.882000  0.2408000     -0.1514000     0.3376000 
1 1 1 23 22 10 f 2.652000  0.4125000     2.487000  0.6050000     2.817000  0.5610000     -0.3296000     0.8251000 
1 1 1 23 22 11 o 4.956000  0.3178000     5.178000  0.4474000     4.733000  0.4514000     0.4452000      0.6355000 
1 1 1 23 22 12 o 6.266000  0.2519000     6.475000  0.3304000     6.058000  0.3802000     0.4173000      0.5037000 
1 1 1 23 22 13 o 1.402000  0.4408000     1.130000  0.5414000     1.673000  0.6957000     -0.5433000     0.8815000 
1 1 1 23 22 14 o 2.433000  0.6160000     2.275000  1.022000      2.590000  0.6882000     -0.3153000     1.232000  
1 1 1 23 22 15 o 3.131000  0.4392000     2.523000  0.6933000     3.739000  0.5393000     -1.216000      0.8783000 
1 1 1 23 22 16 o 1.337000  0.4184000     1.612000  0.6561000     1.063000  0.5194000     0.5492000      0.8368000 
1 1 1 23 22 17 o 1.999000  0.5622000     1.640000  0.6828000     2.358000  0.8934000     -0.7185000     1.124000  
1 1 1 23 22 18 o 1.562000  0.4571000     1.373000  0.6073000     1.750000  0.6834000     -0.3768000     0.9142000 
1 1 1 23 22 19 o 1.383000  0.4352000     1.311000  0.5892000     1.455000  0.6406000     -0.1440000     0.8704000 
1 1 1 23 22 20 o 1.339000  0.4222000     1.288000  0.5823000     1.389000  0.6114000     -0.1004000     0.8443000 
1 1 1 23 22 21 o 1.335000  0.4229000     1.232000  0.5637000     1.439000  0.6306000     -0.2065000     0.8458000 
1 1 1 23 23 0  o 11.47000  0.1990000     11.47000  0.1990000     11.47000  0.1990000     0.000000       0.000000  
1 1 1 23 23 1  o 11.63000  0.1524000     11.63000  0.1964000     11.62000  0.2332000     0.1116000E-01  0.3049000 
1 1 1 23 23 2  o 7.692000  0.1702000     7.422000  0.2459000     7.962000  0.2355000     -0.5398000     0.3404000 
1 1 1 23 23 3  o 7.460000  0.1826000     7.647000  0.2741000     7.274000  0.2412000     0.3724000      0.3651000 
1 1 1 23 23 4  o 5.717000  0.1852000     5.591000  0.2658000     5.843000  0.2579000     -0.2517000     0.3703000 
1 1 1 23 23 5  o 6.036000  0.1968000     6.054000  0.2655000     6.018000  0.2905000     0.3546000E-01  0.3935000 
1 1 1 23 23 6  o 3.694000  0.3464000     4.236000  0.4471000     3.152000  0.5294000     1.083000       0.6929000 
1 1 1 23 23 7  o 8.488000  0.1598000     8.524000  0.2262000     8.452000  0.2256000     0.7176000E-01  0.3195000 
1 1 1 23 23 8  o 12.43000  0.1619000     12.43000  0.2293000     12.43000  0.2287000     -0.3251000E-02 0.3239000 
1 1 1 23 23 9  o 3.598000  0.3081000     3.672000  0.4179000     3.524000  0.4527000     0.1483000      0.6161000 
1 1 1 23 23 10 o 2.793000  0.4373000     2.940000  0.5678000     2.646000  0.6652000     0.2945000      0.8746000 
1 1 1 23 23 11 o 2.301000  0.4639000     1.421000  0.6500000     3.182000  0.6619000     -1.761000      0.9277000 
1 1 1 23 23 12 o 1.702000  0.4921000     1.840000  0.7190000     1.564000  0.6721000     0.2766000      0.9842000 
1 1 1 23 23 13 o 1.902000  0.5122000     2.010000  0.7045000     1.795000  0.7438000     0.2151000      1.024000  
1 1 1 23 23 14 o 2.022000  0.4788000     2.491000  0.7031000     1.552000  0.6500000     0.9390000      0.9575000 
1 1 1 23 23 15 o 2.650000  0.4393000     1.778000  0.6847000     3.522000  0.5505000     -1.744000      0.8786000 
1 1 1 23 23 16 o 1.212000  0.4021000     1.228000  0.5720000     1.197000  0.5654000     0.3118000E-01  0.8043000 
1 1 1 23 23 17 o 1.713000  0.4776000     1.928000  0.6889000     1.498000  0.6616000     0.4299000      0.9552000 
1 1 1 23 23 18 o 1.707000  0.4638000     2.071000  0.6988000     1.343000  0.6101000     0.7277000      0.9277000 
1 1 1 23 23 19 o 3.091000  0.4813000     3.233000  0.6906000     2.949000  0.6705000     0.2844000      0.9626000 
1 1 1 23 23 20 o 2.219000  0.5023000     2.378000  0.7206000     2.060000  0.6999000     0.3186000      1.005000  
1 1 1 23 24 0  o 12.58000  0.3012000     12.58000  0.3012000     12.58000  0.3012000     0.000000       0.000000  
1 1 1 23 24 1  o 14.02000  0.1780000     13.91000  0.2500000     14.13000  0.2534000     -0.2173000     0.3559000 
1 1 1 23 24 2  o 3.008000  0.4736000     3.621000  0.3856000     2.394000  0.8651000     1.227000       0.9472000 
1 1 1 23 24 3  o 13.24000  0.1890000     13.34000  0.2384000     13.14000  0.2933000     0.1961000      0.3780000 
1 1 1 23 24 4  o 20.16000  0.2430000     20.11000  0.2972000     20.21000  0.3846000     -0.9507000E-01 0.4861000 
1 1 1 23 24 5  o 15.25000  0.2101000     15.30000  0.3196000     15.19000  0.2726000     0.1100000      0.4201000 
1 1 1 23 24 6  o 11.97000  0.1548000     11.91000  0.2178000     12.02000  0.2201000     -0.1083000     0.3097000 
1 1 1 23 24 7  o 1.530000  0.4175000     1.543000  0.5893000     1.517000  0.5916000     0.2528000E-01  0.8350000 
1 1 1 23 24 8  o 6.067000  0.1983000     5.982000  0.2853000     6.151000  0.2756000     -0.1694000     0.3967000 
1 1 1 23 24 9  o 8.191000  0.1755000     8.278000  0.2449000     8.104000  0.2515000     0.1735000      0.3511000 
1 1 1 23 24 10 o 3.625000  0.3558000     4.064000  0.4861000     3.185000  0.5196000     0.8790000      0.7115000 
1 1 1 23 24 11 o 2.647000  0.4481000     2.941000  0.5716000     2.353000  0.6904000     0.5882000      0.8963000 
1 1 1 23 24 12 o 6.416000  0.2335000     6.611000  0.3685000     6.221000  0.2867000     0.3903000      0.4669000 
1 1 1 23 24 13 o 1.275000  0.4285000     1.247000  0.5952000     1.304000  0.6164000     -0.5691000E-01 0.8569000 
1 1 1 23 24 14 o 2.527000  0.4814000     2.907000  0.6436000     2.148000  0.7160000     0.7594000      0.9627000 
1 1 1 23 24 15 o 5.778000  0.2475000     5.862000  0.3341000     5.694000  0.3651000     0.1679000      0.4949000 
1 1 1 23 24 16 o 1.606000  0.4273000     2.113000  0.6698000     1.099000  0.5309000     1.014000       0.8547000 
1 1 1 23 24 17 o 1.862000  0.4754000     1.687000  0.6420000     2.036000  0.7012000     -0.3496000     0.9507000 
1 1 1 23 24 18 o 2.882000  0.4494000     3.117000  0.5948000     2.647000  0.6738000     0.4697000      0.8988000 
1 1 1 23 24 19 o 1.770000  0.5648000     2.066000  0.9290000     1.474000  0.6427000     0.5912000      1.130000  
1 1 1 23 24 20 o 1.622000  0.4529000     1.214000  0.5667000     2.030000  0.7068000     -0.8154000     0.9059000 
1 1 1 23 25 0  o 3.529000  0.4832000     3.529000  0.4832000     3.529000  0.4832000     0.000000       0.000000  
1 1 1 23 25 1  o 7.726000  0.2802000     7.726000  0.2802000     ?         ?             ?              ?         
1 1 1 23 25 2  o 9.049000  0.2411000     9.155000  0.2278000     8.943000  0.4249000     0.2116000      0.4821000 
1 1 1 23 25 3  o 6.621000  0.1881000     6.214000  0.2653000     7.028000  0.2667000     -0.8140000     0.3762000 
1 1 1 23 25 4  o 4.155000  0.2659000     4.102000  0.4270000     4.207000  0.3170000     -0.1051000     0.5318000 
1 1 1 23 25 5  o 7.580000  0.1636000     7.533000  0.2332000     7.628000  0.2295000     -0.9515000E-01 0.3272000 
1 1 1 23 25 6  o 7.561000  0.1657000     7.365000  0.2340000     7.757000  0.2345000     -0.3918000     0.3313000 
1 1 1 23 25 7  o 3.546000  0.2811000     3.609000  0.3851000     3.482000  0.4096000     0.1274000      0.5622000 
1 1 1 23 25 8  o 8.152000  0.1744000     8.321000  0.2470000     7.983000  0.2462000     0.3385000      0.3487000 
1 1 1 23 25 9  o 5.232000  0.2252000     5.256000  0.3114000     5.207000  0.3255000     0.4926000E-01  0.4505000 
1 1 1 23 25 10 o 3.200000  0.4411000     2.858000  0.6973000     3.541000  0.5405000     -0.6837000     0.8823000 
1 1 1 23 25 11 o 1.683000  0.4577000     1.765000  0.6531000     1.600000  0.6414000     0.1644000      0.9154000 
1 1 1 23 25 12 o 1.717000  0.4809000     1.780000  0.7142000     1.655000  0.6440000     0.1251000      0.9617000 
1 1 1 23 25 13 o 2.480000  0.6265000     2.460000  1.025000      2.500000  0.7213000     -0.4066000E-01 1.253000  
1 1 1 23 25 14 o 2.541000  0.4752000     2.537000  0.6632000     2.545000  0.6808000     -0.7402000E-02 0.9504000 
1 1 1 23 25 15 o 2.563000  0.4678000     2.804000  0.6112000     2.323000  0.7084000     0.4804000      0.9356000 
1 1 1 23 25 16 o 3.357000  0.4475000     3.428000  0.5822000     3.286000  0.6799000     0.1414000      0.8951000 
1 1 1 23 25 17 o 1.426000  0.4337000     1.618000  0.6512000     1.234000  0.5731000     0.3833000      0.8674000 
1 1 1 23 25 18 f 1.870000  0.4721000     1.557000  0.6433000     2.182000  0.6912000     -0.6243000     0.9442000 
1 1 1 23 25 19 o 1.676000  0.4879000     1.552000  0.7024000     1.800000  0.6774000     -0.2475000     0.9759000 
1 1 1 23 25 20 o 1.321000  0.4251000     1.475000  0.6421000     1.168000  0.5572000     0.3065000      0.8502000 
1 1 1 23 26 0  o 4.695000  0.3872000     4.695000  0.3872000     4.695000  0.3872000     0.000000       0.000000  
1 1 1 23 26 1  o 7.618000  0.1765000     7.715000  0.2472000     7.521000  0.2519000     0.1943000      0.3530000 
1 1 1 23 26 2  o 15.04000  0.1737000     15.19000  0.2631000     14.90000  0.2270000     0.2927000      0.3475000 
1 1 1 23 26 3  o 7.721000  0.1876000     7.494000  0.3053000     7.948000  0.2179000     -0.4542000     0.3751000 
1 1 1 23 26 4  o 12.75000  0.1635000     12.57000  0.2429000     12.92000  0.2191000     -0.3458000     0.3271000 
1 1 1 23 26 5  o 8.539000  0.1598000     8.452000  0.2251000     8.625000  0.2267000     -0.1726000     0.3195000 
1 1 1 23 26 6  o 9.099000  0.1615000     8.953000  0.2283000     9.245000  0.2284000     -0.2923000     0.3229000 
1 1 1 23 26 7  f 5.940000  0.1961000     5.963000  0.2773000     5.917000  0.2774000     0.4548000E-01  0.3922000 
1 1 1 23 26 8  o 5.068000  0.2263000     5.309000  0.3037000     4.828000  0.3356000     0.4814000      0.4526000 
1 1 1 23 26 9  o 6.249000  0.2040000     6.314000  0.2819000     6.184000  0.2948000     0.1294000      0.4080000 
1 1 1 23 26 10 o 6.450000  0.2441000     6.604000  0.3092000     6.297000  0.3777000     0.3071000      0.4881000 
1 1 1 23 26 11 o 4.069000  0.3039000     4.431000  0.3873000     3.707000  0.4683000     0.7235000      0.6077000 
1 1 1 23 26 12 o 4.562000  0.3005000     4.493000  0.4025000     4.632000  0.4464000     -0.1394000     0.6011000 
1 1 1 23 26 13 o 5.619000  0.2568000     5.791000  0.3946000     5.447000  0.3286000     0.3436000      0.5135000 
1 1 1 23 26 14 o 1.417000  0.4397000     1.467000  0.6321000     1.367000  0.6114000     0.9984000E-01  0.8795000 
1 1 1 23 26 15 o 1.312000  0.4175000     1.438000  0.6171000     1.187000  0.5626000     0.2513000      0.8351000 
1 1 1 23 26 16 o 2.243000  0.6201000     2.030000  0.7072000     2.457000  1.019000      -0.4270000     1.240000  
1 1 1 23 26 17 o 1.876000  0.4699000     1.566000  0.6404000     2.186000  0.6879000     -0.6194000     0.9398000 
1 1 1 23 26 18 o 1.605000  0.4723000     1.785000  0.6934000     1.425000  0.6413000     0.3598000      0.9445000 
1 1 1 23 26 19 o 1.617000  0.4568000     1.967000  0.7051000     1.266000  0.5808000     0.7015000      0.9135000 
1 1 1 23 26 20 o 1.328000  0.4269000     1.353000  0.6110000     1.303000  0.5964000     0.5000000E-01  0.8539000 
1 1 1 23 27 0  o 12.35000  0.2443000     12.35000  0.2443000     12.35000  0.2443000     0.000000       0.000000  
1 1 1 23 27 1  o 7.322000  0.1703000     7.369000  0.2209000     7.275000  0.2591000     0.9349000E-01  0.3405000 
1 1 1 23 27 2  o 9.691000  0.1508000     9.528000  0.2132000     9.853000  0.2134000     -0.3255000     0.3017000 
1 1 1 23 27 3  o 4.589000  0.2227000     4.413000  0.3384000     4.765000  0.2895000     -0.3526000     0.4453000 
1 1 1 23 27 4  o 5.794000  0.1976000     5.776000  0.2991000     5.811000  0.2581000     -0.3487000E-01 0.3951000 
1 1 1 23 27 5  o 10.38000  0.1567000     10.16000  0.2216000     10.60000  0.2216000     -0.4346000     0.3134000 
1 1 1 23 27 6  o 8.307000  0.1658000     8.644000  0.2299000     7.970000  0.2391000     0.6743000      0.3317000 
1 1 1 23 27 7  o 12.74000  0.1641000     12.73000  0.2328000     12.76000  0.2314000     -0.2660000E-01 0.3283000 
1 1 1 23 27 8  o 1.601000  0.4352000     1.864000  0.6457000     1.338000  0.5838000     0.5267000      0.8704000 
1 1 1 23 27 9  o 5.368000  0.2604000     5.265000  0.4045000     5.471000  0.3280000     -0.2056000     0.5208000 
1 1 1 23 27 10 o 7.072000  0.2006000     7.111000  0.2775000     7.034000  0.2897000     0.7768000E-01  0.4012000 
1 1 1 23 27 11 o 1.730000  0.4549000     1.918000  0.6477000     1.542000  0.6390000     0.3762000      0.9098000 
1 1 1 23 27 12 o 2.607000  0.5395000     3.079000  0.7516000     2.135000  0.7742000     0.9431000      1.079000  
1 1 1 23 27 13 o 3.884000  0.3546000     3.824000  0.5704000     3.944000  0.4215000     -0.1197000     0.7093000 
1 1 1 23 27 14 o 3.006000  0.4557000     3.202000  0.6405000     2.810000  0.6482000     0.3921000      0.9113000 
1 1 1 23 27 15 o 2.233000  0.4779000     2.516000  0.6536000     1.950000  0.6973000     0.5662000      0.9558000 
1 1 1 23 27 16 o 1.300000  0.4184000     1.372000  0.6072000     1.229000  0.5758000     0.1423000      0.8368000 
1 1 1 23 27 17 o 1.629000  0.4665000     1.558000  0.6457000     1.699000  0.6736000     -0.1411000     0.9331000 
1 1 1 23 27 18 o 1.579000  0.4910000     1.692000  0.7316000     1.467000  0.6550000     0.2254000      0.9820000 
1 1 1 23 27 19 o 2.553000  0.4718000     2.088000  0.7140000     3.017000  0.6171000     -0.9291000     0.9437000 
1 1 1 23 27 20 o 1.666000  0.4743000     1.406000  0.6407000     1.926000  0.6995000     -0.5199000     0.9486000 
1 1 1 23 28 0  o 0.8106000 0.5500000     0.8106000 0.5500000     0.8106000 0.5500000     0.000000       0.000000  
1 1 1 23 28 1  f 4.077000  0.2661000     4.129000  0.3666000     4.025000  0.3859000     0.1037000      0.5323000 
1 1 1 23 28 2  o 11.41000  0.1638000     11.17000  0.2435000     11.65000  0.2193000     -0.4787000     0.3277000 
1 1 1 23 28 3  o 1.961000  0.4151000     1.705000  0.6123000     2.218000  0.5607000     -0.5136000     0.8302000 
1 1 1 23 28 4  o 10.96000  0.1644000     10.96000  0.2439000     10.97000  0.2204000     -0.1641000E-01 0.3288000 
1 1 1 23 28 5  o 2.801000  0.3522000     2.900000  0.4779000     2.701000  0.5175000     0.1995000      0.7044000 
1 1 1 23 28 6  o 1.455000  0.4135000     1.381000  0.5681000     1.530000  0.6009000     -0.1493000     0.8269000 
1 1 1 23 28 7  o 9.815000  0.1654000     10.17000  0.2334000     9.459000  0.2345000     0.7130000      0.3309000 
1 1 1 23 28 8  o 5.226000  0.2326000     4.816000  0.3454000     5.636000  0.3116000     -0.8205000     0.4652000 
1 1 1 23 28 9  o 4.135000  0.3417000     3.821000  0.4628000     4.450000  0.5027000     -0.6283000     0.6834000 
1 1 1 23 28 10 o 5.722000  0.2238000     5.919000  0.3088000     5.526000  0.3241000     0.3929000      0.4476000 
1 1 1 23 28 11 o 3.037000  0.4169000     2.739000  0.5834000     3.335000  0.5956000     -0.5968000     0.8337000 
1 1 1 23 28 12 o 4.740000  0.3012000     5.158000  0.4294000     4.322000  0.4226000     0.8351000      0.6025000 
1 1 1 23 28 13 o 4.910000  0.2592000     4.932000  0.3600000     4.887000  0.3729000     0.4509000E-01  0.5184000 
1 1 1 23 28 14 o 3.751000  0.3657000     3.734000  0.5982000     3.767000  0.4207000     -0.3269000E-01 0.7313000 
1 1 1 23 28 15 o 1.507000  0.4624000     1.442000  0.6199000     1.572000  0.6862000     -0.1301000     0.9247000 
1 1 1 23 28 16 o 3.638000  0.3491000     3.564000  0.4970000     3.713000  0.4903000     -0.1490000     0.6981000 
1 1 1 23 28 17 o 1.826000  0.4790000     2.016000  0.6880000     1.636000  0.6666000     0.3801000      0.9579000 
1 1 1 23 28 18 o 1.333000  0.4645000     1.614000  0.7791000     1.052000  0.5060000     0.5624000      0.9290000 
1 1 1 23 28 19 f 1.306000  0.4222000     1.491000  0.6504000     1.122000  0.5385000     0.3687000      0.8444000 
1 1 1 23 29 0  o 1.403000  0.7436000     1.403000  0.7436000     1.403000  0.7436000     0.000000       0.000000  
1 1 1 23 29 1  o 16.10000  0.1943000     16.23000  0.2750000     15.97000  0.2746000     0.2631000      0.3886000 
1 1 1 23 29 2  o 8.995000  0.1679000     9.133000  0.2462000     8.858000  0.2284000     0.2753000      0.3359000 
1 1 1 23 29 3  o 3.256000  0.3181000     2.833000  0.5179000     3.679000  0.3696000     -0.8459000     0.6362000 
1 1 1 23 29 4  o 5.422000  0.2105000     5.475000  0.3095000     5.370000  0.2855000     0.1047000      0.4210000 
1 1 1 23 29 5  o 3.337000  0.3010000     3.316000  0.4266000     3.358000  0.4247000     -0.4208000E-01 0.6019000 
1 1 1 23 29 6  o 5.910000  0.1990000     6.015000  0.2747000     5.806000  0.2879000     0.2092000      0.3980000 
1 1 1 23 29 7  o 6.953000  0.1928000     6.687000  0.2776000     7.220000  0.2676000     -0.5334000     0.3856000 
1 1 1 23 29 8  o 2.836000  0.4307000     2.253000  0.7207000     3.418000  0.4718000     -1.165000      0.8614000 
1 1 1 23 29 9  o 4.833000  0.2648000     4.545000  0.3736000     5.120000  0.3754000     -0.5744000     0.5296000 
1 1 1 23 29 10 o 5.507000  0.2340000     5.825000  0.3149000     5.189000  0.3462000     0.6358000      0.4680000 
1 1 1 23 29 11 o 2.144000  0.4528000     2.812000  0.6233000     1.476000  0.6569000     1.336000       0.9056000 
1 1 1 23 29 12 o 3.358000  0.3646000     3.702000  0.4344000     3.013000  0.5858000     0.6892000      0.7293000 
1 1 1 23 29 13 o 3.816000  0.3287000     3.734000  0.4701000     3.899000  0.4597000     -0.1651000     0.6575000 
1 1 1 23 29 14 o 1.681000  0.4686000     2.035000  0.7433000     1.327000  0.5708000     0.7084000      0.9372000 
1 1 1 23 29 15 o 1.886000  0.5369000     1.881000  0.6956000     1.891000  0.8179000     -0.1011000E-01 1.074000  
1 1 1 23 29 16 o 1.224000  0.3991000     1.305000  0.5871000     1.143000  0.5406000     0.1621000      0.7981000 
1 1 1 23 29 17 o 1.754000  0.4670000     1.934000  0.6721000     1.575000  0.6486000     0.3584000      0.9340000 
1 1 1 23 29 18 o 1.913000  0.5177000     2.080000  0.7805000     1.745000  0.6803000     0.3341000      1.035000  
1 1 1 23 29 19 o 1.319000  0.4208000     1.162000  0.5519000     1.475000  0.6353000     -0.3128000     0.8416000 
1 1 1 23 30 0  o 10.11000  0.2502000     10.11000  0.2502000     10.11000  0.2502000     0.000000       0.000000  
1 1 1 23 30 1  o 9.885000  0.2033000     9.896000  0.3114000     9.873000  0.2614000     0.2338000E-01  0.4066000 
1 1 1 23 30 2  o 8.902000  0.1685000     8.902000  0.2483000     8.902000  0.2278000     -0.3290000E-03 0.3370000 
1 1 1 23 30 3  o 3.121000  0.3264000     3.194000  0.4741000     3.048000  0.4486000     0.1458000      0.6527000 
1 1 1 23 30 4  o 2.865000  0.3748000     2.774000  0.5722000     2.956000  0.4841000     -0.1820000     0.7495000 
1 1 1 23 30 5  o 4.714000  0.2338000     4.734000  0.3248000     4.693000  0.3363000     0.4160000E-01  0.4675000 
1 1 1 23 30 6  o 4.606000  0.2457000     4.215000  0.3633000     4.997000  0.3307000     -0.7828000     0.4913000 
1 1 1 23 30 7  o 5.157000  0.2333000     5.031000  0.3305000     5.282000  0.3294000     -0.2509000     0.4666000 
1 1 1 23 30 8  o 5.700000  0.2679000     5.692000  0.3396000     5.708000  0.4145000     -0.1576000E-01 0.5358000 
1 1 1 23 30 9  o 7.664000  0.1937000     7.671000  0.2745000     7.656000  0.2733000     0.1502000E-01  0.3874000 
1 1 1 23 30 10 o 2.572000  0.4838000     2.541000  0.6518000     2.602000  0.7150000     -0.6062000E-01 0.9676000 
1 1 1 23 30 11 o 1.164000  0.3879000     1.160000  0.5561000     1.168000  0.5410000     -0.8645000E-02 0.7758000 
1 1 1 23 30 12 o 5.587000  0.2354000     5.698000  0.3182000     5.476000  0.3469000     0.2218000      0.4707000 
1 1 1 23 30 13 o 2.693000  0.4422000     2.522000  0.6282000     2.865000  0.6225000     -0.3428000     0.8844000 
1 1 1 23 30 14 o 5.017000  0.2356000     5.202000  0.3378000     4.832000  0.3286000     0.3707000      0.4712000 
1 1 1 23 30 15 f 1.924000  0.5039000     1.790000  0.7128000     2.057000  0.7125000     -0.2672000     1.008000  
1 1 1 23 30 16 o 1.346000  0.4258000     1.435000  0.6259000     1.257000  0.5776000     0.1786000      0.8517000 
1 1 1 23 30 17 o 1.796000  0.4937000     1.742000  0.6776000     1.849000  0.7184000     -0.1069000     0.9875000 
1 1 1 23 30 18 o 1.544000  0.4381000     1.133000  0.5347000     1.955000  0.6941000     -0.8221000     0.8762000 
1 1 1 23 30 19 o 1.204000  0.3951000     1.366000  0.6056000     1.043000  0.5076000     0.3228000      0.7902000 
1 1 1 23 31 0  o 9.140000  0.2587000     9.140000  0.2587000     9.140000  0.2587000     0.000000       0.000000  
1 1 1 23 31 1  o 3.845000  0.2786000     3.793000  0.4186000     3.897000  0.3678000     -0.1038000     0.5572000 
1 1 1 23 31 2  o 11.82000  0.1696000     11.89000  0.2544000     11.75000  0.2243000     0.1354000      0.3392000 
1 1 1 23 31 3  o 6.874000  0.1873000     6.990000  0.2734000     6.757000  0.2560000     0.2327000      0.3745000 
1 1 1 23 31 4  o 2.886000  0.3610000     2.593000  0.5530000     3.179000  0.4642000     -0.5866000     0.7220000 
1 1 1 23 31 5  o 7.064000  0.1860000     7.422000  0.2496000     6.705000  0.2759000     0.7164000      0.3720000 
1 1 1 23 31 6  o 5.637000  0.2130000     5.638000  0.2978000     5.635000  0.3047000     0.3569000E-02  0.4260000 
1 1 1 23 31 7  f 1.724000  0.4896000     1.635000  0.6974000     1.813000  0.6875000     -0.1782000     0.9793000 
1 1 1 23 31 8  o 2.681000  0.4270000     2.880000  0.5485000     2.481000  0.6545000     0.3993000      0.8539000 
1 1 1 23 31 9  o 6.177000  0.2366000     5.773000  0.3160000     6.582000  0.3521000     -0.8086000     0.4732000 
1 1 1 23 31 10 o 1.889000  0.5217000     1.708000  0.7266000     2.070000  0.7488000     -0.3623000     1.043000  
1 1 1 23 31 11 o 1.431000  0.4296000     1.271000  0.5720000     1.590000  0.6411000     -0.3192000     0.8592000 
1 1 1 23 31 12 o 4.276000  0.2954000     4.669000  0.3696000     3.883000  0.4609000     0.7860000      0.5908000 
1 1 1 23 31 13 o 4.265000  0.3034000     3.766000  0.4607000     4.765000  0.3951000     -0.9991000     0.6069000 
1 1 1 23 31 14 o 1.487000  0.4444000     1.423000  0.6377000     1.550000  0.6190000     -0.1276000     0.8887000 
1 1 1 23 31 15 o 2.015000  0.4931000     1.917000  0.7333000     2.113000  0.6594000     -0.1956000     0.9862000 
1 1 1 23 31 16 o 2.750000  0.4459000     2.960000  0.6017000     2.541000  0.6582000     0.4190000      0.8918000 
1 1 1 23 31 17 o 1.374000  0.4584000     1.396000  0.6874000     1.353000  0.6066000     0.4345000E-01  0.9167000 
1 1 1 23 31 18 o 1.364000  0.4297000     1.324000  0.5947000     1.405000  0.6203000     -0.8139000E-01 0.8593000 
1 1 1 23 31 19 o 1.220000  0.4062000     1.181000  0.5653000     1.260000  0.5835000     -0.7932000E-01 0.8124000 
1 1 1 23 32 0  o 4.417000  0.3826000     4.417000  0.3826000     4.417000  0.3826000     0.000000       0.000000  
1 1 1 23 32 1  o 7.914000  0.1823000     7.925000  0.2748000     7.903000  0.2396000     0.2257000E-01  0.3646000 
1 1 1 23 32 2  o 1.596000  0.4196000     2.146000  0.6801000     1.045000  0.4918000     1.101000       0.8393000 
1 1 1 23 32 3  o 3.712000  0.2950000     3.521000  0.4501000     3.903000  0.3814000     -0.3814000     0.5900000 
1 1 1 23 32 4  o 1.621000  0.4304000     1.438000  0.5915000     1.805000  0.6253000     -0.3666000     0.8607000 
1 1 1 23 32 5  o 9.104000  0.1723000     9.167000  0.2408000     9.042000  0.2466000     0.1253000      0.3447000 
1 1 1 23 32 6  f 4.787000  0.2708000     4.694000  0.4198000     4.880000  0.3423000     -0.1855000     0.5417000 
1 1 1 23 32 7  o 2.510000  0.4853000     2.175000  0.6554000     2.845000  0.7159000     -0.6695000     0.9706000 
1 1 1 23 32 8  o 4.147000  0.2989000     4.545000  0.3785000     3.748000  0.4628000     0.7966000      0.5978000 
1 1 1 23 32 9  o 5.058000  0.3625000     5.429000  0.3590000     4.687000  0.6298000     0.7426000      0.7250000 
1 1 1 23 32 10 o 3.574000  0.3848000     4.335000  0.4927000     2.813000  0.5913000     1.522000       0.7697000 
1 1 1 23 32 11 o 4.143000  0.2972000     4.439000  0.3951000     3.847000  0.4441000     0.5924000      0.5944000 
1 1 1 23 32 12 f 4.264000  0.2945000     4.263000  0.4093000     4.264000  0.4236000     -0.1221000E-02 0.5891000 
1 1 1 23 32 13 o 2.658000  0.4355000     2.778000  0.5690000     2.537000  0.6596000     0.2407000      0.8711000 
1 1 1 23 32 14 o 1.826000  0.5131000     1.854000  0.7372000     1.798000  0.7140000     0.5609000E-01  1.026000  
1 1 1 23 32 15 f 2.453000  0.4752000     2.983000  0.7175000     1.923000  0.6234000     1.060000       0.9505000 
1 1 1 23 32 16 o 1.515000  0.4387000     1.265000  0.5917000     1.765000  0.6479000     -0.4999000     0.8774000 
1 1 1 23 32 17 o 1.480000  0.4536000     1.876000  0.7424000     1.084000  0.5214000     0.7927000      0.9072000 
1 1 1 23 32 18 o 1.375000  0.4288000     1.539000  0.6436000     1.211000  0.5668000     0.3277000      0.8576000 
1 1 1 23 33 0  f 4.932000  0.3773000     4.932000  0.3773000     4.932000  0.3773000     0.000000       0.000000  
1 1 1 23 33 1  o 4.795000  0.2498000     4.578000  0.3855000     5.012000  0.3178000     -0.4339000     0.4996000 
1 1 1 23 33 2  o 6.808000  0.2181000     6.642000  0.3495000     6.974000  0.2611000     -0.3318000     0.4363000 
1 1 1 23 33 3  o 3.375000  0.3377000     3.625000  0.4686000     3.124000  0.4865000     0.5015000      0.6755000 
1 1 1 23 33 4  o 3.018000  0.3564000     3.017000  0.5043000     3.019000  0.5036000     -0.1418000E-02 0.7127000 
1 1 1 23 33 5  o 2.145000  0.4626000     1.870000  0.6964000     2.420000  0.6090000     -0.5501000     0.9251000 
1 1 1 23 33 6  o 2.808000  0.4769000     2.508000  0.6694000     3.108000  0.6796000     -0.6000000     0.9539000 
1 1 1 23 33 7  o 3.180000  0.3760000     2.736000  0.5928000     3.623000  0.4626000     -0.8869000     0.7519000 
1 1 1 23 33 8  o 3.990000  0.4247000     4.091000  0.4409000     3.889000  0.7260000     0.2019000      0.8494000 
1 1 1 23 33 9  o 4.040000  0.3474000     4.659000  0.4629000     3.420000  0.5180000     1.239000       0.6947000 
1 1 1 23 33 10 o 5.920000  0.2240000     5.955000  0.3157000     5.885000  0.3179000     0.6958000E-01  0.4480000 
1 1 1 23 33 11 o 5.616000  0.2403000     5.520000  0.3421000     5.711000  0.3375000     -0.1912000     0.4806000 
1 1 1 23 33 12 o 2.123000  0.4283000     2.819000  0.5953000     1.428000  0.6159000     1.391000       0.8566000 
1 1 1 23 33 13 o 4.746000  0.2679000     5.102000  0.3573000     4.390000  0.3994000     0.7116000      0.5359000 
1 1 1 23 33 14 o 2.305000  0.5101000     2.033000  0.6634000     2.577000  0.7750000     -0.5441000     1.020000  
1 1 1 23 33 15 o 1.663000  0.4484000     1.818000  0.6450000     1.508000  0.6229000     0.3105000      0.8967000 
1 1 1 23 33 16 o 1.974000  0.5168000     2.600000  0.8295000     1.349000  0.6167000     1.250000       1.034000  
1 1 1 23 33 17 o 2.181000  0.4794000     2.120000  0.6731000     2.243000  0.6828000     -0.1236000     0.9588000 
1 1 1 23 33 18 o 1.233000  0.4034000     1.037000  0.5034000     1.430000  0.6306000     -0.3937000     0.8068000 
1 1 1 23 34 0  o 9.945000  0.2405000     9.945000  0.2405000     9.945000  0.2405000     0.000000       0.000000  
1 1 1 23 34 1  o 1.683000  0.4507000     1.855000  0.6733000     1.511000  0.5991000     0.3440000      0.9013000 
1 1 1 23 34 2  o 2.507000  0.4182000     3.441000  0.5648000     1.573000  0.6169000     1.869000       0.8364000 
1 1 1 23 34 3  o 6.356000  0.2117000     6.056000  0.3256000     6.655000  0.2707000     -0.5987000     0.4234000 
1 1 1 23 34 4  o 4.108000  0.3078000     3.981000  0.4827000     4.235000  0.3819000     -0.2540000     0.6155000 
1 1 1 23 34 5  o 7.226000  0.2199000     7.075000  0.3109000     7.378000  0.3110000     -0.3038000     0.4398000 
1 1 1 23 34 6  o 4.506000  0.2822000     4.581000  0.3688000     4.431000  0.4273000     0.1499000      0.5645000 
1 1 1 23 34 7  o 3.081000  0.4325000     3.945000  0.4540000     2.216000  0.7364000     1.729000       0.8651000 
1 1 1 23 34 8  o 2.774000  0.5080000     2.929000  0.6846000     2.619000  0.7507000     0.3098000      1.016000  
1 1 1 23 34 9  o 5.374000  0.2449000     5.420000  0.3325000     5.328000  0.3595000     0.9228000E-01  0.4897000 
1 1 1 23 34 10 o 3.622000  0.3307000     3.846000  0.4358000     3.399000  0.4975000     0.4468000      0.6614000 
1 1 1 23 34 11 o 1.799000  0.4625000     1.958000  0.6573000     1.639000  0.6508000     0.3198000      0.9250000 
1 1 1 23 34 12 o 3.566000  0.3368000     3.516000  0.4891000     3.615000  0.4632000     -0.9882000E-01 0.6736000 
1 1 1 23 34 13 o 4.557000  0.3656000     4.068000  0.6336000     5.046000  0.3647000     -0.9778000     0.7311000 
1 1 1 23 34 14 o 1.438000  0.4309000     1.493000  0.6147000     1.384000  0.6041000     0.1083000      0.8619000 
1 1 1 23 34 15 o 2.418000  0.4973000     2.602000  0.7465000     2.235000  0.6573000     0.3665000      0.9947000 
1 1 1 23 34 16 o 1.674000  0.4722000     1.289000  0.6470000     2.060000  0.6880000     -0.7712000     0.9444000 
1 1 1 23 34 17 o 2.029000  0.5034000     1.825000  0.7314000     2.234000  0.6918000     -0.4084000     1.007000  
1 1 1 23 34 18 f 1.344000  0.4303000     1.295000  0.5929000     1.394000  0.6239000     -0.9886000E-01 0.8607000 
1 1 1 23 35 0  o 1.062000  0.6660000     1.062000  0.6660000     1.062000  0.6660000     0.000000       0.000000  
1 1 1 23 35 1  o 6.440000  0.2315000     6.173000  0.3763000     6.707000  0.2697000     -0.5342000     0.4630000 
1 1 1 23 35 2  o 6.849000  0.2261000     6.763000  0.3604000     6.935000  0.2731000     -0.1710000     0.4522000 
1 1 1 23 35 3  o 5.004000  0.3644000     4.840000  0.6481000     5.168000  0.3331000     -0.3280000     0.7287000 
1 1 1 23 35 4  f 5.632000  0.2510000     5.313000  0.3660000     5.952000  0.3436000     -0.6387000     0.5020000 
1 1 1 23 35 5  o 2.251000  0.4983000     1.912000  0.6456000     2.589000  0.7592000     -0.6767000     0.9966000 
1 1 1 23 35 6  o 7.044000  0.2773000     7.474000  0.3029000     6.614000  0.4645000     0.8598000      0.5545000 
1 1 1 23 35 7  o 5.362000  0.3156000     4.952000  0.4931000     5.772000  0.3941000     -0.8202000     0.6312000 
1 1 1 23 35 8  o 3.773000  0.3264000     3.389000  0.4940000     4.156000  0.4267000     -0.7673000     0.6528000 
1 1 1 23 35 9  o 2.413000  0.4275000     1.778000  0.6545000     3.047000  0.5502000     -1.268000      0.8550000 
1 1 1 23 35 10 o 2.401000  0.4433000     1.820000  0.6623000     2.981000  0.5894000     -1.161000      0.8866000 
1 1 1 23 35 11 o 1.796000  0.4687000     1.859000  0.6560000     1.733000  0.6696000     0.1258000      0.9374000 
1 1 1 23 35 12 o 2.006000  0.4735000     1.833000  0.6742000     2.178000  0.6650000     -0.3453000     0.9470000 
1 1 1 23 35 13 o 1.247000  0.4114000     0.9756000 0.4805000     1.518000  0.6679000     -0.5424000     0.8228000 
1 1 1 23 35 14 o 1.830000  0.4567000     1.472000  0.6121000     2.189000  0.6779000     -0.7165000     0.9133000 
1 1 1 23 35 15 o 2.950000  0.4206000     2.943000  0.5523000     2.956000  0.6346000     -0.1287000E-01 0.8413000 
1 1 1 23 35 16 o 1.719000  0.4606000     2.114000  0.7136000     1.325000  0.5824000     0.7893000      0.9211000 
1 1 1 23 35 17 o 1.445000  0.4147000     1.111000  0.5404000     1.779000  0.6293000     -0.6680000     0.8295000 
1 1 1 23 36 0  o 7.942000  0.3076000     7.942000  0.3076000     7.942000  0.3076000     0.000000       0.000000  
1 1 1 23 36 1  o 1.518000  0.4864000     2.021000  0.8412000     1.016000  0.4887000     1.005000       0.9729000 
1 1 1 23 36 2  o 6.520000  0.3453000     6.212000  0.5633000     6.829000  0.3996000     -0.6165000     0.6907000 
1 1 1 23 36 3  f 5.828000  0.3549000     5.785000  0.3989000     5.871000  0.5871000     -0.8579000E-01 0.7097000 
1 1 1 23 36 4  o 1.730000  0.4576000     2.060000  0.6509000     1.400000  0.6434000     0.6604000      0.9152000 
1 1 1 23 36 5  o 4.152000  0.3320000     3.594000  0.4877000     4.711000  0.4507000     -1.117000      0.6641000 
1 1 1 23 36 6  o 3.100000  0.4357000     3.214000  0.6456000     2.986000  0.5852000     0.2283000      0.8714000 
1 1 1 23 36 7  o 3.768000  0.3205000     3.524000  0.4761000     4.012000  0.4290000     -0.4873000     0.6409000 
1 1 1 23 36 8  o 1.899000  0.4478000     2.286000  0.6367000     1.512000  0.6300000     0.7742000      0.8957000 
1 1 1 23 36 9  o 1.952000  0.4696000     2.162000  0.6692000     1.742000  0.6590000     0.4195000      0.9392000 
1 1 1 23 36 10 o 1.524000  0.4450000     1.423000  0.6082000     1.625000  0.6498000     -0.2020000     0.8900000 
1 1 1 23 36 11 o 2.458000  0.4496000     2.733000  0.6016000     2.183000  0.6683000     0.5493000      0.8992000 
1 1 1 23 36 12 o 2.264000  0.5068000     2.539000  0.7560000     1.989000  0.6752000     0.5502000      1.014000  
1 1 1 23 36 13 o 1.373000  0.4230000     1.451000  0.6115000     1.295000  0.5846000     0.1562000      0.8460000 
1 1 1 23 36 14 o 1.396000  0.4217000     1.233000  0.5563000     1.558000  0.6340000     -0.3253000     0.8434000 
1 1 1 23 36 15 o 0.9946000 0.3485000     0.8788000 0.4371000     1.110000  0.5428000     -0.2316000     0.6969000 
1 1 1 23 36 16 o 1.472000  0.4138000     1.842000  0.6445000     1.101000  0.5193000     0.7415000      0.8277000 
1 1 1 23 36 17 o 1.095000  0.3706000     1.148000  0.5525000     1.041000  0.4942000     0.1068000      0.7412000 
1 1 1 23 37 0  o 6.027000  0.4150000     6.027000  0.4150000     6.027000  0.4150000     0.000000       0.000000  
1 1 1 23 37 1  o 7.963000  0.3517000     7.963000  0.3517000     ?         ?             ?              ?         
1 1 1 23 37 2  o 4.139000  0.3891000     4.115000  0.5191000     4.163000  0.5797000     -0.4711000E-01 0.7781000 
1 1 1 23 37 3  o 4.566000  0.3338000     4.306000  0.5005000     4.826000  0.4419000     -0.5202000     0.6676000 
1 1 1 23 37 4  o 3.667000  0.4342000     3.238000  0.7054000     4.096000  0.5067000     -0.8580000     0.8685000 
1 1 1 23 37 5  o 4.289000  0.3099000     4.229000  0.4680000     4.349000  0.4062000     -0.1202000     0.6197000 
1 1 1 23 37 6  o 5.260000  0.2450000     5.481000  0.3302000     5.039000  0.3621000     0.4418000      0.4901000 
1 1 1 23 37 7  o 2.726000  0.4170000     2.729000  0.5654000     2.724000  0.6130000     0.5520000E-02  0.8339000 
1 1 1 23 37 8  o 2.975000  0.3991000     3.066000  0.5351000     2.883000  0.5922000     0.1830000      0.7982000 
1 1 1 23 37 9  o 5.248000  0.2537000     5.739000  0.3266000     4.758000  0.3884000     0.9811000      0.5075000 
1 1 1 23 37 10 o 3.340000  0.3669000     3.206000  0.5253000     3.473000  0.5125000     -0.2679000     0.7339000 
1 1 1 23 37 11 o 1.487000  0.4367000     1.643000  0.6423000     1.331000  0.5919000     0.3126000      0.8734000 
1 1 1 23 37 12 o 2.537000  0.4941000     2.734000  0.6737000     2.340000  0.7230000     0.3944000      0.9883000 
1 1 1 23 37 13 o 1.192000  0.3886000     1.161000  0.5385000     1.224000  0.5604000     -0.6286000E-01 0.7772000 
1 1 1 23 37 14 o 1.582000  0.4567000     1.652000  0.6466000     1.513000  0.6450000     0.1397000      0.9133000 
1 1 1 23 37 15 o 1.315000  0.4027000     1.044000  0.5028000     1.586000  0.6293000     -0.5426000     0.8055000 
1 1 1 23 37 16 o 1.148000  0.3791000     1.137000  0.5316000     1.159000  0.5406000     -0.2189000E-01 0.7582000 
1 1 1 23 37 17 o 1.969000  0.4084000     1.246000  0.5714000     2.693000  0.5838000     -1.446000      0.8169000 
1 1 1 23 38 0  o 4.817000  0.4105000     4.817000  0.4105000     4.817000  0.4105000     0.000000       0.000000  
1 1 1 23 38 1  o 4.786000  0.3131000     4.411000  0.5279000     5.161000  0.3368000     -0.7504000     0.6261000 
1 1 1 23 38 2  o 6.951000  0.2912000     7.078000  0.5078000     6.825000  0.2850000     0.2526000      0.5823000 
1 1 1 23 38 3  o 8.839000  0.2299000     8.408000  0.3800000     9.269000  0.2588000     -0.8612000     0.4597000 
1 1 1 23 38 4  o 6.121000  0.2308000     6.153000  0.3448000     6.089000  0.3069000     0.6477000E-01  0.4616000 
1 1 1 23 38 5  o 3.332000  0.3530000     3.180000  0.5158000     3.483000  0.4821000     -0.3030000     0.7060000 
1 1 1 23 38 6  o 2.996000  0.3901000     3.284000  0.5072000     2.708000  0.5928000     0.5762000      0.7801000 
1 1 1 23 38 7  o 1.458000  0.4174000     1.060000  0.5038000     1.855000  0.6658000     -0.7950000     0.8349000 
1 1 1 23 38 8  o 5.726000  0.2337000     5.902000  0.3173000     5.550000  0.3433000     0.3522000      0.4675000 
1 1 1 23 38 9  o 3.773000  0.3327000     3.453000  0.5065000     4.093000  0.4317000     -0.6398000     0.6655000 
1 1 1 23 38 10 o 1.838000  0.4558000     2.179000  0.6639000     1.496000  0.6246000     0.6825000      0.9116000 
1 1 1 23 38 11 o 3.904000  0.3832000     3.419000  0.6529000     4.389000  0.4015000     -0.9697000     0.7665000 
1 1 1 23 38 12 o 2.413000  0.4597000     2.281000  0.6433000     2.546000  0.6569000     -0.2651000     0.9195000 
1 1 1 23 38 13 f 1.758000  0.4607000     1.559000  0.6354000     1.958000  0.6673000     -0.3989000     0.9214000 
1 1 1 23 38 14 f 1.915000  0.4811000     2.250000  0.6737000     1.580000  0.6871000     0.6701000      0.9623000 
1 1 1 23 38 15 o 1.787000  0.4382000     2.195000  0.6420000     1.379000  0.5967000     0.8161000      0.8765000 
1 1 1 23 38 16 o 1.453000  0.4292000     1.344000  0.5829000     1.562000  0.6302000     -0.2177000     0.8585000 
1 1 1 23 39 0  o 1.026000  0.6540000     1.026000  0.6540000     1.026000  0.6540000     0.000000       0.000000  
1 1 1 23 39 1  f 9.152000  0.1931000     9.000000  0.2905000     9.304000  0.2544000     -0.3043000     0.3861000 
1 1 1 23 39 2  o 8.335000  0.2192000     8.339000  0.3496000     8.331000  0.2645000     0.8735000E-02  0.4384000 
1 1 1 23 39 3  o 1.764000  0.4623000     2.159000  0.7088000     1.369000  0.5936000     0.7898000      0.9245000 
1 1 1 23 39 4  o 2.685000  0.4451000     3.091000  0.6036000     2.280000  0.6544000     0.8105000      0.8903000 
1 1 1 23 39 5  o 1.848000  0.4633000     2.071000  0.6669000     1.625000  0.6433000     0.4466000      0.9266000 
1 1 1 23 39 6  o 3.972000  0.3070000     4.299000  0.3949000     3.646000  0.4701000     0.6533000      0.6140000 
1 1 1 23 39 7  o 4.959000  0.2608000     5.300000  0.3487000     4.619000  0.3879000     0.6811000      0.5216000 
1 1 1 23 39 8  o 2.886000  0.4099000     2.783000  0.5851000     2.989000  0.5742000     -0.2056000     0.8198000 
1 1 1 23 39 9  f 3.814000  0.3206000     4.015000  0.4162000     3.613000  0.4878000     0.4015000      0.6412000 
1 1 1 23 39 10 o 3.195000  0.3839000     3.250000  0.5227000     3.140000  0.5624000     0.1094000      0.7678000 
1 1 1 23 39 11 o 3.231000  0.4992000     3.454000  0.6931000     3.009000  0.7185000     0.4442000      0.9983000 
1 1 1 23 39 12 o 2.103000  0.3892000     3.016000  0.5587000     1.189000  0.5421000     1.826000       0.7785000 
1 1 1 23 39 13 o 1.153000  0.3846000     0.9941000 0.4819000     1.313000  0.5996000     -0.3184000     0.7693000 
1 1 1 23 39 14 o 1.440000  0.4352000     1.704000  0.6802000     1.175000  0.5432000     0.5292000      0.8705000 
1 1 1 23 39 15 o 1.181000  0.3865000     1.054000  0.5046000     1.307000  0.5856000     -0.2531000     0.7730000 
1 1 1 23 39 16 o 1.667000  0.4354000     2.125000  0.6676000     1.209000  0.5593000     0.9167000      0.8709000 
1 1 1 23 40 0  o 1.180000  0.7309000     1.180000  0.7309000     1.180000  0.7309000     0.000000       0.000000  
1 1 1 23 40 1  o 4.097000  0.3066000     4.561000  0.4132000     3.634000  0.4530000     0.9271000      0.6132000 
1 1 1 23 40 2  o 4.108000  0.3416000     3.898000  0.5583000     4.317000  0.3937000     -0.4191000     0.6832000 
1 1 1 23 40 3  o 5.152000  0.2593000     5.507000  0.3682000     4.797000  0.3653000     0.7097000      0.5187000 
1 1 1 23 40 4  o 5.852000  0.2436000     5.900000  0.3638000     5.804000  0.3240000     0.9589000E-01  0.4872000 
1 1 1 23 40 5  o 5.851000  0.2319000     5.687000  0.3364000     6.015000  0.3193000     -0.3273000     0.4639000 
1 1 1 23 40 6  o 2.490000  0.4590000     2.545000  0.6434000     2.436000  0.6549000     0.1094000      0.9181000 
1 1 1 23 40 7  o 4.354000  0.2899000     3.999000  0.4370000     4.708000  0.3810000     -0.7094000     0.5797000 
1 1 1 23 40 8  o 1.244000  0.3939000     0.9322000 0.4590000     1.555000  0.6402000     -0.6230000     0.7877000 
1 1 1 23 40 9  o 1.954000  0.4471000     1.425000  0.6079000     2.483000  0.6557000     -1.059000      0.8942000 
1 1 1 23 40 10 o 2.283000  0.5246000     2.796000  0.8087000     1.770000  0.6684000     1.027000       1.049000  
1 1 1 23 40 11 o 1.423000  0.4309000     1.523000  0.6241000     1.322000  0.5944000     0.2013000      0.8619000 
1 1 1 23 40 12 o 2.215000  0.4569000     1.739000  0.6576000     2.692000  0.6345000     -0.9529000     0.9138000 
1 1 1 23 40 13 o 1.847000  0.5137000     1.985000  0.7376000     1.709000  0.7153000     0.2766000      1.027000  
1 1 1 23 40 14 o 1.369000  0.4182000     1.246000  0.5617000     1.492000  0.6198000     -0.2459000     0.8364000 
1 1 1 23 40 15 o 1.443000  0.4347000     1.306000  0.5802000     1.581000  0.6475000     -0.2751000     0.8694000 
1 1 1 23 41 0  o 1.706000  0.8292000     1.706000  0.8292000     1.706000  0.8292000     0.000000       0.000000  
1 1 1 23 41 1  o 5.139000  0.2617000     4.597000  0.4158000     5.681000  0.3180000     -1.084000      0.5234000 
1 1 1 23 41 2  o 5.528000  0.2464000     5.343000  0.3737000     5.712000  0.3212000     -0.3688000     0.4928000 
1 1 1 23 41 3  o 5.105000  0.2658000     5.056000  0.3979000     5.153000  0.3527000     -0.9658000E-01 0.5317000 
1 1 1 23 41 4  o 2.544000  0.4576000     2.251000  0.7013000     2.836000  0.5881000     -0.5846000     0.9153000 
1 1 1 23 41 5  o 2.028000  0.4789000     2.315000  0.6992000     1.741000  0.6546000     0.5740000      0.9578000 
1 1 1 23 41 6  o 1.063000  0.3599000     1.224000  0.5646000     0.9028000 0.4467000     0.3212000      0.7199000 
1 1 1 23 41 7  o 2.802000  0.4282000     2.868000  0.6103000     2.736000  0.6008000     0.1324000      0.8564000 
1 1 1 23 41 8  o 1.536000  0.4428000     1.735000  0.6604000     1.337000  0.5901000     0.3983000      0.8856000 
1 1 1 23 41 9  o 1.882000  0.4600000     1.447000  0.6456000     2.317000  0.6554000     -0.8697000     0.9200000 
1 1 1 23 41 10 o 1.639000  0.4800000     1.428000  0.6257000     1.850000  0.7280000     -0.4221000     0.9599000 
1 1 1 23 41 11 o 2.784000  0.4323000     2.520000  0.6497000     3.048000  0.5704000     -0.5280000     0.8646000 
1 1 1 23 41 12 o 2.971000  0.4879000     3.920000  0.5118000     2.022000  0.8307000     1.898000       0.9758000 
1 1 1 23 41 13 o 2.128000  0.4559000     1.649000  0.6642000     2.608000  0.6245000     -0.9589000     0.9117000 
1 1 1 23 41 14 o 1.152000  0.3786000     1.182000  0.5440000     1.123000  0.5268000     0.5895000E-01  0.7572000 
1 1 1 23 41 15 o 1.600000  0.4531000     1.687000  0.6493000     1.513000  0.6321000     0.1739000      0.9062000 
1 1 1 23 42 0  o 6.733000  0.3339000     6.733000  0.3339000     6.733000  0.3339000     0.000000       0.000000  
1 1 1 23 42 1  o 5.607000  0.2470000     5.740000  0.3592000     5.473000  0.3392000     0.2678000      0.4940000 
1 1 1 23 42 2  o 5.760000  0.2364000     5.807000  0.3325000     5.713000  0.3361000     0.9352000E-01  0.4728000 
1 1 1 23 42 3  o 5.808000  0.2500000     5.757000  0.3765000     5.859000  0.3290000     -0.1015000     0.4999000 
1 1 1 23 42 4  o 1.704000  0.4711000     1.586000  0.6643000     1.822000  0.6682000     -0.2356000     0.9422000 
1 1 1 23 42 5  o 2.409000  0.4776000     2.586000  0.6829000     2.232000  0.6680000     0.3541000      0.9553000 
1 1 1 23 42 6  o 1.377000  0.4199000     1.146000  0.5379000     1.608000  0.6450000     -0.4623000     0.8398000 
1 1 1 23 42 7  o 3.512000  0.3544000     3.623000  0.4897000     3.401000  0.5124000     0.2227000      0.7088000 
1 1 1 23 42 8  o 3.282000  0.3804000     3.545000  0.4942000     3.019000  0.5784000     0.5258000      0.7608000 
1 1 1 23 42 9  o 1.983000  0.5387000     2.264000  0.8219000     1.702000  0.6965000     0.5616000      1.077000  
1 1 1 23 42 10 o 1.675000  0.4526000     1.467000  0.6105000     1.883000  0.6685000     -0.4159000     0.9053000 
1 1 1 23 42 11 o 2.420000  0.4847000     2.680000  0.6444000     2.159000  0.7243000     0.5213000      0.9694000 
1 1 1 23 42 12 o 2.216000  0.5067000     2.206000  0.7328000     2.226000  0.7000000     -0.2079000E-01 1.013000  
1 1 1 23 42 13 o 2.131000  0.4725000     2.009000  0.6613000     2.252000  0.6752000     -0.2422000     0.9451000 
1 1 1 23 42 14 o 1.572000  0.4395000     1.228000  0.5581000     1.916000  0.6791000     -0.6880000     0.8790000 
1 1 1 23 42 15 o 1.354000  0.6656000     1.354000  0.6656000     ?         ?             ?              ?         
1 1 1 23 43 0  o 1.386000  0.7944000     1.386000  0.7944000     1.386000  0.7944000     0.000000       0.000000  
1 1 1 23 43 1  o 2.587000  0.4485000     3.227000  0.5882000     1.947000  0.6773000     1.280000       0.8970000 
1 1 1 23 43 2  o 2.754000  0.4499000     2.666000  0.6687000     2.842000  0.6019000     -0.1762000     0.8997000 
1 1 1 23 43 3  o 2.521000  0.4250000     1.921000  0.6589000     3.122000  0.5371000     -1.201000      0.8500000 
1 1 1 23 43 4  o 1.814000  0.4819000     1.737000  0.6871000     1.890000  0.6757000     -0.1534000     0.9637000 
1 1 1 23 43 5  o 2.213000  0.4759000     1.981000  0.6901000     2.446000  0.6555000     -0.4646000     0.9518000 
1 1 1 23 43 6  o 1.494000  0.4504000     1.479000  0.6398000     1.509000  0.6341000     -0.2994000E-01 0.9008000 
1 1 1 23 43 7  o 1.171000  0.3870000     1.101000  0.5265000     1.240000  0.5673000     -0.1389000     0.7740000 
1 1 1 23 43 8  o 3.255000  0.4967000     3.385000  0.7621000     3.126000  0.6373000     0.2594000      0.9935000 
1 1 1 23 43 9  o 1.076000  0.3652000     0.9249000 0.4566000     1.228000  0.5699000     -0.3031000     0.7303000 
1 1 1 23 43 10 o 1.817000  0.4848000     1.805000  0.6651000     1.829000  0.7054000     -0.2364000E-01 0.9695000 
1 1 1 23 43 11 o 1.994000  0.5380000     1.892000  0.7566000     2.096000  0.7649000     -0.2038000     1.076000  
1 1 1 23 43 12 o 1.251000  0.3991000     1.101000  0.5187000     1.401000  0.6068000     -0.2993000     0.7983000 
1 1 1 23 43 13 o 1.603000  0.4434000     1.250000  0.5652000     1.957000  0.6834000     -0.7068000     0.8869000 
1 1 1 23 43 14 o 2.075000  0.4808000     2.080000  0.6728000     2.071000  0.6870000     0.8277000E-02  0.9616000 
1 1 1 23 44 0  o 1.124000  0.7113000     1.124000  0.7113000     1.124000  0.7113000     0.000000       0.000000  
1 1 1 23 44 1  o 4.520000  0.3168000     4.361000  0.4633000     4.679000  0.4324000     -0.3185000     0.6337000 
1 1 1 23 44 2  o 5.795000  0.2404000     5.620000  0.3435000     5.970000  0.3365000     -0.3498000     0.4809000 
1 1 1 23 44 3  o 2.189000  0.4710000     2.025000  0.6772000     2.352000  0.6549000     -0.3272000     0.9421000 
1 1 1 23 44 4  o 1.574000  0.4627000     1.554000  0.6686000     1.594000  0.6398000     -0.3980000E-01 0.9254000 
1 1 1 23 44 5  o 2.070000  0.4814000     2.510000  0.7042000     1.631000  0.6565000     0.8781000      0.9627000 
1 1 1 23 44 6  o 4.051000  0.3400000     3.559000  0.5550000     4.543000  0.3927000     -0.9846000     0.6799000 
1 1 1 23 44 7  o 3.308000  0.4326000     3.105000  0.7059000     3.511000  0.5002000     -0.4058000     0.8652000 
1 1 1 23 44 8  o 1.391000  0.4429000     1.306000  0.5912000     1.476000  0.6596000     -0.1699000     0.8858000 
1 1 1 23 44 9  o 1.229000  0.3954000     1.465000  0.6204000     0.9935000 0.4903000     0.4714000      0.7908000 
1 1 1 23 44 10 o 2.800000  0.5060000     3.158000  0.6396000     2.442000  0.7843000     0.7159000      1.012000  
1 1 1 23 44 11 o 1.408000  0.4338000     1.654000  0.6756000     1.161000  0.5445000     0.4928000      0.8677000 
1 1 1 23 44 12 o 2.271000  0.4646000     2.122000  0.6625000     2.421000  0.6516000     -0.2992000     0.9292000 
1 1 1 23 44 13 o 2.006000  0.4622000     2.407000  0.6627000     1.604000  0.6446000     0.8037000      0.9245000 
1 1 1 23 45 0  o 4.385000  0.4636000     4.385000  0.4636000     4.385000  0.4636000     0.000000       0.000000  
1 1 1 23 45 1  o 3.166000  0.4268000     2.726000  0.6750000     3.605000  0.5225000     -0.8792000     0.8536000 
1 1 1 23 45 2  f 4.274000  0.3057000     3.979000  0.4565000     4.570000  0.4066000     -0.5909000     0.6113000 
1 1 1 23 45 3  o 3.840000  0.3289000     3.925000  0.4509000     3.755000  0.4789000     0.1698000      0.6577000 
1 1 1 23 45 4  o 3.856000  0.3568000     3.978000  0.5237000     3.734000  0.4848000     0.2445000      0.7136000 
1 1 1 23 45 5  o 5.439000  0.2698000     5.482000  0.4020000     5.396000  0.3600000     0.8598000E-01  0.5397000 
1 1 1 23 45 6  o 1.746000  0.5103000     1.909000  0.7910000     1.583000  0.6450000     0.3256000      1.021000  
1 1 1 23 45 7  o 1.836000  0.5162000     1.696000  0.6935000     1.977000  0.7649000     -0.2809000     1.032000  
1 1 1 23 45 8  o 2.255000  0.4475000     2.923000  0.5870000     1.588000  0.6756000     1.336000       0.8950000 
1 1 1 23 45 9  o 1.689000  0.4929000     1.631000  0.6718000     1.747000  0.7216000     -0.1156000     0.9859000 
1 1 1 23 45 10 o 1.956000  0.4687000     2.461000  0.7037000     1.451000  0.6194000     1.010000       0.9374000 
1 1 1 23 45 11 o 2.265000  0.4718000     2.046000  0.6818000     2.483000  0.6523000     -0.4372000     0.9436000 
1 1 1 23 45 12 o 1.430000  0.4326000     1.640000  0.6557000     1.219000  0.5643000     0.4209000      0.8651000 
1 1 1 23 45 13 o 2.012000  0.4520000     1.402000  0.6122000     2.621000  0.6652000     -1.219000      0.9041000 
1 1 1 23 46 0  f 4.773000  0.4282000     4.773000  0.4282000     4.773000  0.4282000     0.000000       0.000000  
1 1 1 23 46 1  o 4.272000  0.3206000     4.300000  0.4221000     4.243000  0.4827000     0.5667000E-01  0.6412000 
1 1 1 23 46 2  o 2.516000  0.4584000     2.698000  0.6262000     2.335000  0.6697000     0.3632000      0.9169000 
1 1 1 23 46 3  o 1.408000  0.4308000     1.466000  0.6218000     1.350000  0.5965000     0.1156000      0.8616000 
1 1 1 23 46 4  o 4.034000  0.3585000     3.959000  0.5644000     4.109000  0.4423000     -0.1500000     0.7170000 
1 1 1 23 46 5  o 1.978000  0.4762000     1.338000  0.6365000     2.618000  0.7085000     -1.280000      0.9524000 
1 1 1 23 46 6  o 2.400000  0.5311000     2.131000  0.7381000     2.669000  0.7638000     -0.5376000     1.062000  
1 1 1 23 46 7  o 3.265000  0.4524000     3.609000  0.5800000     2.921000  0.6945000     0.6878000      0.9049000 
1 1 1 23 46 8  o 3.404000  0.4616000     3.622000  0.5857000     3.186000  0.7137000     0.4361000      0.9232000 
1 1 1 23 46 9  o 1.792000  0.4784000     2.121000  0.7273000     1.463000  0.6217000     0.6581000      0.9568000 
1 1 1 23 46 10 o 1.345000  0.4149000     1.104000  0.5243000     1.587000  0.6432000     -0.4829000     0.8299000 
1 1 1 23 46 11 o 1.575000  0.4471000     1.466000  0.6176000     1.684000  0.6468000     -0.2186000     0.8943000 
1 1 1 23 46 12 o 1.063000  0.3609000     0.9982000 0.4876000     1.129000  0.5322000     -0.1305000     0.7218000 
1 1 1 23 47 0  o 1.138000  0.7228000     1.138000  0.7228000     1.138000  0.7228000     0.000000       0.000000  
1 1 1 23 47 1  o 5.166000  0.2865000     4.978000  0.3917000     5.354000  0.4183000     -0.3758000     0.5730000 
1 1 1 23 47 2  o 4.802000  0.2915000     4.664000  0.4228000     4.940000  0.4013000     -0.2752000     0.5829000 
1 1 1 23 47 3  o 5.630000  0.2792000     5.375000  0.4361000     5.886000  0.3486000     -0.5105000     0.5583000 
1 1 1 23 47 4  o 5.118000  0.3733000     4.699000  0.6244000     5.538000  0.4094000     -0.8391000     0.7467000 
1 1 1 23 47 5  o 1.862000  0.5235000     1.906000  0.7231000     1.819000  0.7572000     0.8677000E-01  1.047000  
1 1 1 23 47 6  o 2.474000  0.5469000     3.095000  0.7561000     1.853000  0.7905000     1.241000       1.094000  
1 1 1 23 47 7  o 2.043000  0.5096000     2.771000  0.8141000     1.314000  0.6132000     1.457000       1.019000  
1 1 1 23 47 8  o 1.367000  0.4398000     1.425000  0.6523000     1.309000  0.5902000     0.1166000      0.8797000 
1 1 1 23 47 9  f 1.592000  0.4202000     2.122000  0.6664000     1.062000  0.5120000     1.060000       0.8403000 
1 1 1 23 47 10 o 2.773000  0.4455000     2.585000  0.6501000     2.960000  0.6094000     -0.3746000     0.8910000 
1 1 1 23 47 11 o 1.270000  0.4069000     1.318000  0.5893000     1.222000  0.5612000     0.9656000E-01  0.8138000 
1 1 1 23 47 12 o 2.608000  0.4775000     2.130000  0.7100000     3.087000  0.6386000     -0.9570000     0.9549000 
1 1 1 23 48 0  o 1.210000  0.7883000     1.210000  0.7883000     1.210000  0.7883000     0.000000       0.000000  
1 1 1 23 48 1  o 1.353000  0.4476000     1.190000  0.5719000     1.515000  0.6887000     -0.3255000     0.8952000 
1 1 1 23 48 2  o 2.612000  0.5809000     3.146000  0.8379000     2.078000  0.8048000     1.068000       1.162000  
1 1 1 23 48 3  o 3.937000  0.5503000     4.596000  0.4794000     3.278000  0.9907000     1.318000       1.101000  
1 1 1 23 48 4  o 1.519000  0.4863000     1.608000  0.6723000     1.430000  0.7029000     0.1778000      0.9727000 
1 1 1 23 48 5  o 4.318000  0.3628000     4.489000  0.4788000     4.146000  0.5452000     0.3434000      0.7256000 
1 1 1 23 48 6  o 1.435000  0.4638000     1.783000  0.7670000     1.088000  0.5218000     0.6949000      0.9277000 
1 1 1 23 48 7  f 2.539000  0.5199000     2.393000  0.8157000     2.684000  0.6447000     -0.2912000     1.040000  
1 1 1 23 48 8  o 1.609000  0.4629000     1.389000  0.6202000     1.828000  0.6875000     -0.4397000     0.9259000 
1 1 1 23 48 9  o 2.148000  0.4871000     1.847000  0.7006000     2.449000  0.6769000     -0.6027000     0.9742000 
1 1 1 23 48 10 o 1.673000  0.4253000     1.070000  0.5136000     2.277000  0.6779000     -1.207000      0.8505000 
1 1 1 23 48 11 o 1.688000  0.4563000     1.322000  0.5934000     2.055000  0.6932000     -0.7333000     0.9125000 
1 1 1 23 49 0  o 2.015000  1.095000      2.015000  1.095000      2.015000  1.095000      0.000000       0.000000  
1 1 1 23 49 1  o 5.158000  0.5523000     4.885000  0.8125000     5.430000  0.7485000     -0.5455000     1.105000  
1 1 1 23 49 2  o 2.961000  0.6459000     2.539000  0.8120000     3.382000  1.005000      -0.8430000     1.292000  
1 1 1 23 49 3  o 2.511000  0.5315000     2.075000  0.7890000     2.947000  0.7124000     -0.8716000     1.063000  
1 1 1 23 49 4  o 3.108000  0.4602000     3.229000  0.6654000     2.987000  0.6360000     0.2424000      0.9204000 
1 1 1 23 49 5  f 2.161000  0.4869000     1.687000  0.7073000     2.636000  0.6694000     -0.9488000     0.9738000 
1 1 1 23 49 6  o 1.686000  0.4792000     1.950000  0.7265000     1.422000  0.6250000     0.5287000      0.9583000 
1 1 1 23 49 7  o 1.910000  0.4920000     2.217000  0.7346000     1.602000  0.6546000     0.6154000      0.9839000 
1 1 1 23 49 8  o 1.538000  0.4553000     1.304000  0.6018000     1.772000  0.6833000     -0.4683000     0.9105000 
1 1 1 23 49 9  o 2.020000  0.4920000     2.320000  0.7165000     1.720000  0.6746000     0.6000000      0.9841000 
1 1 1 23 49 10 o 1.196000  0.3947000     1.238000  0.5709000     1.154000  0.5451000     0.8408000E-01  0.7893000 
1 1 1 23 50 0  o 6.892000  0.3355000     6.892000  0.3355000     6.892000  0.3355000     0.000000       0.000000  
1 1 1 23 50 1  o 1.518000  0.4595000     1.568000  0.6485000     1.469000  0.6511000     0.9831000E-01  0.9190000 
1 1 1 23 50 2  o 3.263000  0.4460000     4.019000  0.4527000     2.507000  0.7686000     1.512000       0.8920000 
1 1 1 23 50 3  o 1.377000  0.4301000     1.312000  0.5910000     1.442000  0.6250000     -0.1300000     0.8602000 
1 1 1 23 50 4  o 3.835000  0.3602000     4.381000  0.4309000     3.288000  0.5774000     1.093000       0.7205000 
1 1 1 23 50 5  o 1.485000  0.4461000     1.553000  0.6399000     1.418000  0.6217000     0.1344000      0.8922000 
1 1 1 23 50 6  o 1.345000  0.4226000     1.374000  0.6045000     1.317000  0.5906000     0.5753000E-01  0.8452000 
1 1 1 23 50 7  o 1.562000  0.4259000     1.056000  0.5160000     2.067000  0.6778000     -1.011000      0.8519000 
1 1 1 23 50 8  f 1.483000  0.4540000     1.690000  0.6986000     1.277000  0.5800000     0.4127000      0.9080000 
1 1 1 23 50 9  o 1.512000  0.4367000     1.117000  0.5391000     1.907000  0.6872000     -0.7904000     0.8734000 
1 1 1 23 51 0  o 3.470000  0.5959000     3.470000  0.5959000     3.470000  0.5959000     0.000000       0.000000  
1 1 1 23 51 1  f 2.428000  0.5073000     2.581000  0.6785000     2.274000  0.7543000     0.3072000      1.015000  
1 1 1 23 51 2  o 3.092000  0.4523000     3.371000  0.5359000     2.812000  0.7287000     0.5592000      0.9045000 
1 1 1 23 51 3  o 1.998000  0.5119000     1.904000  0.6968000     2.092000  0.7500000     -0.1881000     1.024000  
1 1 1 23 51 4  o 6.506000  0.2445000     6.557000  0.3374000     6.455000  0.3540000     0.1016000      0.4890000 
1 1 1 23 51 5  o 1.784000  0.4748000     1.553000  0.6469000     2.016000  0.6952000     -0.4629000     0.9496000 
1 1 1 23 51 6  o 2.015000  0.4517000     2.592000  0.6519000     1.438000  0.6256000     1.154000       0.9035000 
1 1 1 23 51 7  o 1.299000  0.4155000     1.612000  0.6747000     0.9865000 0.4853000     0.6254000      0.8311000 
1 1 1 23 51 8  o 1.189000  0.3977000     1.256000  0.5886000     1.123000  0.5351000     0.1331000      0.7955000 
1 1 1 23 52 0  o 1.194000  0.7318000     1.194000  0.7318000     1.194000  0.7318000     0.000000       0.000000  
1 1 1 23 52 1  o 2.834000  0.4791000     3.064000  0.6065000     2.603000  0.7418000     0.4605000      0.9582000 
1 1 1 23 52 2  o 1.691000  0.4860000     1.694000  0.6680000     1.689000  0.7061000     0.4318000E-02  0.9720000 
1 1 1 23 52 3  o 1.893000  0.4987000     1.941000  0.6874000     1.846000  0.7228000     0.9545000E-01  0.9975000 
1 1 1 23 52 4  o 1.312000  0.4162000     1.434000  0.6197000     1.189000  0.5558000     0.2441000      0.8325000 
1 1 1 23 52 5  o 2.679000  0.4538000     2.127000  0.6983000     3.230000  0.5797000     -1.103000      0.9075000 
1 1 1 23 52 6  o 4.161000  0.3369000     4.164000  0.4721000     4.159000  0.4807000     0.5292000E-02  0.6737000 
1 1 1 23 52 7  o 1.790000  0.4611000     2.265000  0.7050000     1.315000  0.5944000     0.9502000      0.9221000 
1 1 1 23 53 0  o 1.438000  0.8061000     1.438000  0.8061000     1.438000  0.8061000     -0.000000      0.000000  
1 1 1 23 53 1  o 1.994000  0.4979000     2.082000  0.7026000     1.907000  0.7058000     0.1751000      0.9959000 
1 1 1 23 53 2  o 1.573000  0.4518000     1.091000  0.5219000     2.056000  0.7377000     -0.9641000     0.9037000 
1 1 1 23 53 3  o 1.165000  0.3934000     0.9658000 0.4759000     1.365000  0.6265000     -0.3991000     0.7867000 
1 1 1 23 53 4  o 1.728000  0.4887000     1.622000  0.6598000     1.834000  0.7212000     -0.2125000     0.9775000 
1 1 1 23 53 5  o 2.053000  0.4949000     1.795000  0.6901000     2.312000  0.7096000     -0.5165000     0.9898000 
1 1 1 23 53 6  o 1.106000  0.3736000     1.147000  0.5417000     1.064000  0.5146000     0.8350000E-01  0.7472000 
1 1 1 23 54 0  o 0.9994000 0.6549000     0.9994000 0.6549000     0.9994000 0.6549000     -0.000000      0.000000  
1 1 1 23 54 1  o 1.598000  0.4582000     1.869000  0.6954000     1.326000  0.5969000     0.5427000      0.9164000 
1 1 1 23 54 2  o 1.453000  0.4511000     1.314000  0.5955000     1.592000  0.6776000     -0.2774000     0.9021000 
1 1 1 23 54 3  o 3.066000  0.4587000     2.292000  0.7134000     3.840000  0.5768000     -1.548000      0.9174000 
1 1 1 23 54 4  o 2.440000  0.5093000     2.394000  0.6926000     2.486000  0.7470000     -0.9285000E-01 1.019000  
1 1 1 23 54 5  o 2.217000  0.5209000     1.595000  0.6869000     2.840000  0.7834000     -1.245000      1.042000  
1 1 1 23 55 0  o 2.144000  0.8534000     2.144000  0.8534000     2.144000  0.8534000     0.000000       0.000000  
1 1 1 23 55 1  o 1.210000  0.3997000     1.216000  0.5663000     1.203000  0.5642000     0.1286000E-01  0.7994000 
1 1 1 23 55 2  o 2.135000  0.5092000     1.709000  0.6751000     2.561000  0.7624000     -0.8522000     1.018000  
1 1 1 23 55 3  o 1.081000  0.5541000     1.081000  0.5541000     ?         ?             ?              ?         
1 1 1 24 0  3  o 6.543000  0.2124000     6.543000  0.2124000     6.543000  0.2124000     -0.000000      0.000000  
1 1 1 24 0  4  o 11.94000  0.1804000     11.94000  0.1804000     11.94000  0.1804000     0.000000       0.000000  
1 1 1 24 0  5  o 7.620000  0.1666000     7.620000  0.1666000     7.620000  0.1666000     0.000000       0.000000  
1 1 1 24 0  6  o 8.375000  0.2309000     8.375000  0.2309000     8.375000  0.2309000     -0.000000      0.000000  
1 1 1 24 0  7  o 10.18000  0.2685000     10.18000  0.2685000     10.18000  0.2685000     -0.000000      0.000000  
1 1 1 24 0  8  o 12.77000  0.2360000     12.77000  0.2360000     12.77000  0.2360000     -0.000000      0.000000  
1 1 1 24 0  9  o 8.546000  0.3128000     8.546000  0.3128000     8.546000  0.3128000     0.000000       0.000000  
1 1 1 24 0  10 o 6.723000  0.3662000     6.723000  0.3662000     6.723000  0.3662000     0.000000       0.000000  
1 1 1 24 0  11 f 1.634000  0.9286000     1.634000  0.9286000     1.634000  0.9286000     0.000000       0.000000  
1 1 1 24 0  12 o 2.324000  1.114000      2.324000  1.114000      2.324000  1.114000      0.000000       0.000000  
1 1 1 24 0  13 o 1.051000  0.7275000     1.051000  0.7275000     1.051000  0.7275000     0.000000       0.000000  
1 1 1 24 0  14 o 5.161000  0.6236000     5.161000  0.6236000     5.161000  0.6236000     0.000000       0.000000  
1 1 1 24 0  15 o 2.107000  0.9976000     2.107000  0.9976000     2.107000  0.9976000     0.000000       0.000000  
1 1 1 24 0  16 o 1.138000  0.7468000     1.138000  0.7468000     1.138000  0.7468000     0.000000       0.000000  
1 1 1 24 0  17 o 1.683000  0.9276000     1.683000  0.9276000     1.683000  0.9276000     0.000000       0.000000  
1 1 1 24 0  18 o 0.8494000 0.5942000     0.8494000 0.5942000     0.8494000 0.5942000     0.000000       0.000000  
1 1 1 24 0  19 o 2.006000  1.017000      2.006000  1.017000      2.006000  1.017000      -0.000000      0.000000  
1 1 1 24 0  20 o 1.005000  0.6724000     1.005000  0.6724000     1.005000  0.6724000     0.000000       0.000000  
1 1 1 24 0  21 o 1.235000  0.7711000     1.235000  0.7711000     1.235000  0.7711000     0.000000       0.000000  
1 1 1 24 0  22 o 1.827000  0.9163000     1.827000  0.9163000     1.827000  0.9163000     0.000000       0.000000  
1 1 1 24 1  2  o 6.249000  0.1274000     6.212000  0.1756000     6.287000  0.1846000     -0.7491000E-01 0.2548000 
1 1 1 24 1  3  o 15.66000  0.2387000     16.19000  0.4219000     15.14000  0.2234000     1.054000       0.4774000 
1 1 1 24 1  4  o 12.71000  0.1430000     12.85000  0.2175000     12.56000  0.1858000     0.2897000      0.2860000 
1 1 1 24 1  5  o 12.40000  0.1573000     12.38000  0.1728000     12.42000  0.2630000     -0.4130000E-01 0.3146000 
1 1 1 24 1  6  o 18.80000  0.2082000     18.70000  0.2324000     18.89000  0.3454000     -0.1945000     0.4163000 
1 1 1 24 1  7  o 19.71000  0.2164000     19.66000  0.3056000     19.76000  0.3064000     -0.9520000E-01 0.4328000 
1 1 1 24 1  8  o 16.86000  0.1781000     16.78000  0.2533000     16.93000  0.2505000     -0.1503000     0.3563000 
1 1 1 24 1  9  o 2.560000  0.5471000     2.747000  0.7819000     2.373000  0.7656000     0.3741000      1.094000  
1 1 1 24 1  10 o 8.354000  0.2252000     8.297000  0.3273000     8.412000  0.3094000     -0.1150000     0.4504000 
1 1 1 24 1  11 o 4.598000  0.4180000     4.454000  0.5815000     4.743000  0.6006000     -0.2887000     0.8360000 
1 1 1 24 1  12 o 3.995000  0.5406000     3.585000  0.8621000     4.405000  0.6525000     -0.8203000     1.081000  
1 1 1 24 1  13 o 6.560000  0.3113000     6.830000  0.4349000     6.290000  0.4456000     0.5398000      0.6226000 
1 1 1 24 1  14 o 2.754000  0.6176000     2.207000  0.8634000     3.301000  0.8834000     -1.094000      1.235000  
1 1 1 24 1  15 o 4.510000  0.4136000     4.490000  0.5982000     4.530000  0.5714000     -0.4046000E-01 0.8273000 
1 1 1 24 1  16 o 3.565000  0.4649000     3.768000  0.6314000     3.363000  0.6825000     0.4049000      0.9298000 
1 1 1 24 1  17 o 2.176000  0.5554000     2.572000  0.8217000     1.781000  0.7474000     0.7907000      1.111000  
1 1 1 24 1  18 o 1.806000  0.5012000     1.593000  0.6865000     2.019000  0.7306000     -0.4257000     1.002000  
1 1 1 24 1  19 o 1.413000  0.4760000     1.418000  0.6749000     1.408000  0.6715000     0.9678000E-02  0.9520000 
1 1 1 24 1  20 o 1.613000  0.4838000     1.605000  0.6857000     1.622000  0.6826000     -0.1631000E-01 0.9676000 
1 1 1 24 1  21 o 1.425000  0.4505000     1.358000  0.6235000     1.491000  0.6504000     -0.1330000     0.9010000 
1 1 1 24 1  22 o 1.120000  0.3849000     1.028000  0.5072000     1.212000  0.5791000     -0.1848000     0.7698000 
1 1 1 24 2  2  f 10.41000  0.1895000     10.43000  0.3024000     10.40000  0.2286000     0.2653000E-01  0.3791000 
1 1 1 24 2  3  o 8.619000  0.2208000     8.692000  0.3512000     8.546000  0.2679000     0.1455000      0.4417000 
1 1 1 24 2  4  o 23.97000  0.2494000     23.93000  0.3093000     24.02000  0.3914000     -0.8957000E-01 0.4988000 
1 1 1 24 2  5  o 4.886000  0.1761000     5.003000  0.1743000     4.768000  0.3060000     0.2353000      0.3521000 
1 1 1 24 2  6  o 23.74000  0.2462000     23.68000  0.2783000     23.80000  0.4062000     -0.1159000     0.4924000 
1 1 1 24 2  7  o 13.26000  0.2059000     13.38000  0.3176000     13.15000  0.2620000     0.2314000      0.4117000 
1 1 1 24 2  8  o 4.508000  0.2829000     4.563000  0.4089000     4.453000  0.3910000     0.1103000      0.5658000 
1 1 1 24 2  9  o 20.51000  0.2289000     20.34000  0.3245000     20.68000  0.3230000     -0.3387000     0.4579000 
1 1 1 24 2  10 o 10.99000  0.1945000     11.27000  0.2772000     10.71000  0.2730000     0.5583000      0.3891000 
1 1 1 24 2  11 o 4.775000  0.3670000     4.605000  0.5453000     4.944000  0.4913000     -0.3392000     0.7340000 
1 1 1 24 2  12 o 7.832000  0.3005000     7.467000  0.4533000     8.196000  0.3947000     -0.7282000     0.6011000 
1 1 1 24 2  13 o 3.218000  0.5596000     3.808000  0.7172000     2.628000  0.8593000     1.180000       1.119000  
1 1 1 24 2  14 o 2.403000  0.6251000     2.298000  0.8768000     2.507000  0.8913000     -0.2082000     1.250000  
1 1 1 24 2  15 o 6.317000  0.3031000     6.015000  0.4462000     6.619000  0.4105000     -0.6039000     0.6063000 
1 1 1 24 2  16 o 3.003000  0.5079000     2.886000  0.7510000     3.120000  0.6839000     -0.2339000     1.016000  
1 1 1 24 2  17 o 4.583000  0.3856000     4.661000  0.5364000     4.504000  0.5542000     0.1572000      0.7713000 
1 1 1 24 2  18 o 1.626000  0.4825000     1.832000  0.7236000     1.420000  0.6384000     0.4125000      0.9650000 
1 1 1 24 2  19 o 1.676000  0.5200000     1.373000  0.6587000     1.979000  0.8048000     -0.6060000     1.040000  
1 1 1 24 2  20 o 2.067000  0.5078000     2.454000  0.7402000     1.680000  0.6953000     0.7740000      1.016000  
1 1 1 24 2  21 o 2.070000  0.4947000     2.577000  0.7289000     1.563000  0.6692000     1.014000       0.9895000 
1 1 1 24 2  22 o 1.338000  0.4325000     1.570000  0.6774000     1.106000  0.5379000     0.4646000      0.8650000 
1 1 1 24 3  1  o 15.21000  0.2081000     ?         ?             15.21000  0.2081000     ?              ?         
1 1 1 24 3  2  o 7.423000  0.1622000     7.402000  0.2771000     7.444000  0.1688000     -0.4249000E-01 0.3245000 
1 1 1 24 3  3  o 6.086000  0.2035000     6.115000  0.3867000     6.058000  0.1270000     0.5672000E-01  0.4070000 
1 1 1 24 3  4  o 16.11000  0.2170000     16.16000  0.2201000     16.07000  0.3740000     0.9336000E-01  0.4340000 
1 1 1 24 3  5  o 8.747000  0.1510000     8.670000  0.1764000     8.823000  0.2453000     -0.1531000     0.3021000 
1 1 1 24 3  6  o 10.23000  0.1659000     10.52000  0.1823000     9.947000  0.2773000     0.5710000      0.3319000 
1 1 1 24 3  7  o 9.234000  0.2095000     9.385000  0.3186000     9.083000  0.2721000     0.3019000      0.4190000 
1 1 1 24 3  8  o 1.609000  0.4243000     1.703000  0.5391000     1.515000  0.6553000     0.1876000      0.8486000 
1 1 1 24 3  9  o 7.248000  0.2479000     7.201000  0.3675000     7.295000  0.3329000     -0.9480000E-01 0.4958000 
1 1 1 24 3  10 o 9.062000  0.2124000     8.822000  0.3071000     9.302000  0.2935000     -0.4793000     0.4247000 
1 1 1 24 3  11 f 4.117000  0.4220000     4.524000  0.5362000     3.709000  0.6519000     0.8143000      0.8440000 
1 1 1 24 3  12 o 8.968000  0.2728000     8.779000  0.3971000     9.157000  0.3740000     -0.3773000     0.5455000 
1 1 1 24 3  13 o 5.776000  0.3441000     5.754000  0.4936000     5.798000  0.4796000     -0.4324000E-01 0.6883000 
1 1 1 24 3  14 o 5.900000  0.3831000     4.960000  0.6062000     6.839000  0.4687000     -1.879000      0.7662000 
1 1 1 24 3  15 o 1.970000  0.5475000     2.332000  0.8274000     1.608000  0.7172000     0.7242000      1.095000  
1 1 1 24 3  16 o 2.475000  0.5375000     2.700000  0.7670000     2.250000  0.7532000     0.4497000      1.075000  
1 1 1 24 3  17 o 1.792000  0.5210000     1.513000  0.6864000     2.072000  0.7841000     -0.5588000     1.042000  
1 1 1 24 3  18 o 1.597000  0.4790000     1.683000  0.6977000     1.511000  0.6564000     0.1715000      0.9580000 
1 1 1 24 3  19 o 2.306000  0.5955000     2.529000  0.8687000     2.084000  0.8147000     0.4442000      1.191000  
1 1 1 24 3  20 o 1.545000  0.4647000     1.777000  0.7063000     1.312000  0.6040000     0.4654000      0.9293000 
1 1 1 24 3  21 o 1.371000  0.4336000     1.144000  0.5477000     1.597000  0.6724000     -0.4526000     0.8672000 
1 1 1 24 3  22 o 1.189000  0.4005000     1.151000  0.5549000     1.227000  0.5778000     -0.7667000E-01 0.8011000 
1 1 1 24 4  1  o 9.924000  0.1516000     9.916000  0.2564000     9.932000  0.1619000     -0.1573000E-01 0.3033000 
1 1 1 24 4  2  o 7.754000  0.1671000     7.734000  0.2885000     7.773000  0.1689000     -0.3909000E-01 0.3343000 
1 1 1 24 4  3  o 15.70000  0.1456000     15.59000  0.2148000     15.81000  0.1966000     -0.2193000     0.2912000 
1 1 1 24 4  4  o 9.364000  0.1530000     9.216000  0.1606000     9.512000  0.2605000     -0.2968000     0.3060000 
1 1 1 24 4  5  o 6.887000  0.1519000     6.826000  0.1754000     6.948000  0.2482000     -0.1220000     0.3039000 
1 1 1 24 4  6  o 8.362000  0.1685000     8.162000  0.1890000     8.563000  0.2790000     -0.4006000     0.3370000 
1 1 1 24 4  7  o 11.07000  0.1678000     11.18000  0.2586000     10.96000  0.2140000     0.2151000      0.3356000 
1 1 1 24 4  8  o 15.46000  0.1782000     15.58000  0.2092000     15.35000  0.2886000     0.2296000      0.3564000 
1 1 1 24 4  9  o 4.674000  0.3868000     3.868000  0.3792000     5.480000  0.6744000     -1.613000      0.7737000 
1 1 1 24 4  10 o 2.074000  0.5465000     1.795000  0.7331000     2.353000  0.8107000     -0.5582000     1.093000  
1 1 1 24 4  11 o 4.122000  0.4135000     4.269000  0.5656000     3.975000  0.6034000     0.2936000      0.8270000 
1 1 1 24 4  12 o 8.007000  0.2930000     7.868000  0.4232000     8.146000  0.4053000     -0.2788000     0.5860000 
1 1 1 24 4  13 f 8.092000  0.2621000     8.416000  0.3596000     7.768000  0.3814000     0.6476000      0.5242000 
1 1 1 24 4  14 o 4.695000  0.4920000     4.942000  0.7120000     4.448000  0.6791000     0.4943000      0.9839000 
1 1 1 24 4  15 o 7.091000  0.2749000     6.833000  0.4053000     7.349000  0.3716000     -0.5165000     0.5499000 
1 1 1 24 4  16 f 2.351000  0.5389000     2.260000  0.7655000     2.443000  0.7587000     -0.1826000     1.078000  
1 1 1 24 4  17 o 3.608000  0.4749000     3.734000  0.6461000     3.481000  0.6962000     0.2534000      0.9498000 
1 1 1 24 4  18 o 4.582000  0.3307000     3.915000  0.5272000     5.249000  0.3993000     -1.334000      0.6614000 
1 1 1 24 4  19 o 1.499000  0.4887000     1.655000  0.7371000     1.343000  0.6420000     0.3117000      0.9775000 
1 1 1 24 4  20 o 1.328000  0.4284000     1.202000  0.5686000     1.454000  0.6408000     -0.2519000     0.8567000 
1 1 1 24 4  21 f 1.609000  0.4633000     1.285000  0.5959000     1.933000  0.7097000     -0.6479000     0.9266000 
1 1 1 24 4  22 o 1.201000  0.4028000     1.460000  0.6537000     0.9418000 0.4708000     0.5178000      0.8056000 
1 1 1 24 5  0  o 20.59000  0.4682000     20.59000  0.4682000     20.59000  0.4682000     0.000000       0.000000  
1 1 1 24 5  1  o 12.96000  0.1849000     13.12000  0.3166000     12.79000  0.1911000     0.3298000      0.3698000 
1 1 1 24 5  2  o 6.127000  0.1623000     6.222000  0.2996000     6.032000  0.1246000     0.1907000      0.3245000 
1 1 1 24 5  3  o 12.41000  0.1174000     12.33000  0.1603000     12.49000  0.1717000     -0.1523000     0.2348000 
1 1 1 24 5  4  o 5.118000  0.1515000     5.186000  0.1734000     5.050000  0.2485000     0.1362000      0.3030000 
1 1 1 24 5  5  o 8.951000  0.1524000     8.808000  0.1792000     9.094000  0.2465000     -0.2858000     0.3048000 
1 1 1 24 5  6  o 10.90000  0.1707000     10.84000  0.2005000     10.95000  0.2762000     -0.1053000     0.3413000 
1 1 1 24 5  7  o 10.86000  0.1516000     10.81000  0.2154000     10.91000  0.2133000     -0.1032000     0.3032000 
1 1 1 24 5  8  f 15.04000  0.1632000     15.11000  0.2266000     14.96000  0.2350000     0.1438000      0.3265000 
1 1 1 24 5  9  o 6.371000  0.3240000     6.927000  0.2638000     5.816000  0.5918000     1.111000       0.6479000 
1 1 1 24 5  10 o 3.224000  0.4354000     3.015000  0.4749000     3.434000  0.7299000     -0.4190000     0.8708000 
1 1 1 24 5  11 o 8.483000  0.2526000     8.860000  0.3231000     8.107000  0.3883000     0.7529000      0.5052000 
1 1 1 24 5  12 o 5.207000  0.3960000     5.727000  0.4683000     4.687000  0.6387000     1.040000       0.7920000 
1 1 1 24 5  13 o 1.905000  0.5438000     1.321000  0.6338000     2.489000  0.8839000     -1.168000      1.088000  
1 1 1 24 5  14 o 4.616000  0.5334000     4.938000  0.7339000     4.293000  0.7744000     0.6445000      1.067000  
1 1 1 24 5  15 o 2.527000  0.5721000     2.781000  0.8030000     2.272000  0.8152000     0.5095000      1.144000  
1 1 1 24 5  16 o 5.527000  0.2965000     5.669000  0.4040000     5.385000  0.4341000     0.2840000      0.5930000 
1 1 1 24 5  17 o 3.753000  0.4546000     3.518000  0.6525000     3.987000  0.6331000     -0.4684000     0.9092000 
1 1 1 24 5  18 o 1.393000  0.4424000     1.304000  0.6006000     1.482000  0.6498000     -0.1786000     0.8848000 
1 1 1 24 5  19 f 1.765000  0.5209000     1.951000  0.7746000     1.579000  0.6968000     0.3718000      1.042000  
1 1 1 24 5  20 o 2.449000  0.4893000     2.858000  0.6640000     2.039000  0.7188000     0.8188000      0.9786000 
1 1 1 24 5  21 f 1.480000  0.4562000     1.540000  0.6587000     1.419000  0.6312000     0.1208000      0.9123000 
1 1 1 24 5  22 o 1.133000  0.3852000     1.250000  0.5848000     1.016000  0.5016000     0.2345000      0.7704000 
1 1 1 24 6  0  o 2.426000  0.2090000     2.426000  0.2090000     2.426000  0.2090000     -0.000000      0.000000  
1 1 1 24 6  1  o 8.800000  0.9946000E-01 9.005000  0.1482000     8.594000  0.1327000     0.4108000      0.1989000 
1 1 1 24 6  2  o 8.560000  0.1142000     8.566000  0.1313000     8.554000  0.1869000     0.1155000E-01  0.2284000 
1 1 1 24 6  3  o 3.810000  0.1256000     3.786000  0.1760000     3.833000  0.1794000     -0.4717000E-01 0.2513000 
1 1 1 24 6  4  o 8.034000  0.1495000     8.213000  0.1563000     7.856000  0.2549000     0.3570000      0.2990000 
1 1 1 24 6  5  o 4.040000  0.2069000     4.133000  0.2332000     3.946000  0.3418000     0.1878000      0.4138000 
1 1 1 24 6  6  o 3.246000  0.4851000     3.716000  0.2823000     2.776000  0.9283000     0.9399000      0.9703000 
1 1 1 24 6  7  o 9.424000  0.1522000     9.645000  0.2150000     9.203000  0.2156000     0.4420000      0.3045000 
1 1 1 24 6  8  f 1.940000  0.4258000     1.910000  0.5665000     1.970000  0.6357000     -0.6045000E-01 0.8515000 
1 1 1 24 6  9  o 11.10000  0.2137000     10.47000  0.2249000     11.72000  0.3635000     -1.250000      0.4275000 
1 1 1 24 6  10 o 8.428000  0.2111000     8.391000  0.2285000     8.466000  0.3550000     -0.7487000E-01 0.4221000 
1 1 1 24 6  11 o 8.170000  0.2344000     8.748000  0.2405000     7.592000  0.4024000     1.155000       0.4688000 
1 1 1 24 6  12 o 8.135000  0.2441000     8.126000  0.2663000     8.144000  0.4092000     -0.1786000E-01 0.4883000 
1 1 1 24 6  13 o 5.009000  0.3740000     4.986000  0.5384000     5.032000  0.5194000     -0.4603000E-01 0.7481000 
1 1 1 24 6  14 o 2.156000  0.6259000     2.312000  0.9169000     2.001000  0.8522000     0.3108000      1.252000  
1 1 1 24 6  15 o 4.885000  0.3618000     5.180000  0.4796000     4.590000  0.5418000     0.5904000      0.7236000 
1 1 1 24 6  16 o 1.935000  0.5381000     1.870000  0.7440000     2.000000  0.7775000     -0.1300000     1.076000  
1 1 1 24 6  17 o 1.851000  0.5180000     1.656000  0.6851000     2.046000  0.7771000     -0.3903000     1.036000  
1 1 1 24 6  18 o 2.045000  0.5102000     1.938000  0.7130000     2.152000  0.7299000     -0.2147000     1.020000  
1 1 1 24 6  19 f 2.176000  0.5547000     2.320000  0.8012000     2.032000  0.7672000     0.2876000      1.109000  
1 1 1 24 6  20 o 1.312000  0.4234000     1.479000  0.6437000     1.145000  0.5502000     0.3339000      0.8468000 
1 1 1 24 6  21 o 1.063000  0.3665000     1.032000  0.5064000     1.094000  0.5299000     -0.6283000E-01 0.7330000 
1 1 1 24 6  22 o 1.412000  0.4472000     1.415000  0.6360000     1.410000  0.6288000     0.5064000E-02  0.8944000 
1 1 1 24 7  0  f 8.249000  0.1231000     8.249000  0.1231000     8.249000  0.1231000     0.000000       0.000000  
1 1 1 24 7  1  o 8.202000  0.1016000     8.256000  0.1499000     8.148000  0.1371000     0.1089000      0.2031000 
1 1 1 24 7  2  o 6.977000  0.9711000E-01 6.911000  0.1551000     7.042000  0.1168000     -0.1317000     0.1942000 
1 1 1 24 7  3  o 9.443000  0.1148000     9.343000  0.1508000     9.544000  0.1732000     -0.2014000     0.2296000 
1 1 1 24 7  4  o 21.42000  0.2205000     21.38000  0.2532000     21.46000  0.3610000     -0.7766000E-01 0.4410000 
1 1 1 24 7  5  o 11.54000  0.1657000     11.60000  0.2047000     11.48000  0.2606000     0.1208000      0.3314000 
1 1 1 24 7  6  o 14.04000  0.2911000     13.99000  0.3493000     14.08000  0.4657000     -0.9598000E-01 0.5821000 
1 1 1 24 7  7  o 7.031000  0.1654000     6.874000  0.2315000     7.188000  0.2364000     -0.3133000     0.3308000 
1 1 1 24 7  8  o 3.618000  0.2804000     3.230000  0.4027000     4.005000  0.3902000     -0.7752000     0.5607000 
1 1 1 24 7  9  o 4.804000  0.3237000     4.558000  0.3183000     5.051000  0.5637000     -0.4934000     0.6473000 
1 1 1 24 7  10 o 4.493000  0.2684000     4.543000  0.3521000     4.443000  0.4052000     0.1007000      0.5368000 
1 1 1 24 7  11 o 3.348000  0.4494000     2.718000  0.5850000     3.978000  0.6822000     -1.260000      0.8987000 
1 1 1 24 7  12 o 4.011000  0.4050000     3.814000  0.4517000     4.207000  0.6723000     -0.3939000     0.8100000 
1 1 1 24 7  13 o 2.708000  0.5457000     2.183000  0.6838000     3.232000  0.8505000     -1.049000      1.091000  
1 1 1 24 7  14 o 6.099000  0.3480000     6.290000  0.4938000     5.909000  0.4905000     0.3813000      0.6961000 
1 1 1 24 7  15 o 1.529000  0.4846000     1.291000  0.6182000     1.767000  0.7465000     -0.4752000     0.9693000 
1 1 1 24 7  16 o 5.755000  0.2976000     5.624000  0.4138000     5.886000  0.4279000     -0.2627000     0.5953000 
1 1 1 24 7  17 o 3.117000  0.4387000     2.996000  0.6294000     3.239000  0.6114000     -0.2432000     0.8774000 
1 1 1 24 7  18 o 1.995000  0.5087000     1.973000  0.7141000     2.017000  0.7246000     -0.4394000E-01 1.017000  
1 1 1 24 7  19 o 2.563000  0.5453000     2.751000  0.7845000     2.374000  0.7578000     0.3769000      1.091000  
1 1 1 24 7  20 o 1.753000  0.4898000     1.896000  0.7100000     1.609000  0.6749000     0.2866000      0.9796000 
1 1 1 24 7  21 o 1.478000  0.4557000     1.398000  0.6250000     1.557000  0.6633000     -0.1591000     0.9114000 
1 1 1 24 7  22 o 1.352000  0.4301000     1.100000  0.5320000     1.604000  0.6760000     -0.5047000     0.8602000 
1 1 1 24 8  0  o 11.15000  0.1730000     11.15000  0.1730000     11.15000  0.1730000     -0.000000      0.000000  
1 1 1 24 8  1  o 3.637000  0.1116000     3.594000  0.1678000     3.681000  0.1473000     -0.8690000E-01 0.2233000 
1 1 1 24 8  2  o 7.747000  0.1022000     7.680000  0.1609000     7.815000  0.1260000     -0.1345000     0.2044000 
1 1 1 24 8  3  o 5.273000  0.1518000     5.239000  0.2048000     5.308000  0.2240000     -0.6930000E-01 0.3035000 
1 1 1 24 8  4  o 8.966000  0.1413000     8.967000  0.1648000     8.966000  0.2295000     0.1835000E-02  0.2826000 
1 1 1 24 8  5  o 4.463000  0.1971000     4.455000  0.2400000     4.471000  0.3126000     -0.1566000E-01 0.3941000 
1 1 1 24 8  6  o 14.56000  0.3023000     ?         ?             14.56000  0.3023000     ?              ?         
1 1 1 24 8  7  o 12.05000  0.1583000     12.17000  0.2309000     11.93000  0.2165000     0.2332000      0.3165000 
1 1 1 24 8  8  o 8.950000  0.1625000     9.022000  0.2224000     8.878000  0.2370000     0.1438000      0.3250000 
1 1 1 24 8  9  o 5.849000  0.2233000     6.158000  0.2665000     5.540000  0.3584000     0.6184000      0.4466000 
1 1 1 24 8  10 o 2.415000  0.4481000     2.552000  0.5989000     2.278000  0.6668000     0.2743000      0.8963000 
1 1 1 24 8  11 o 7.690000  0.2201000     7.525000  0.2788000     7.856000  0.3406000     -0.3316000     0.4401000 
1 1 1 24 8  12 o 6.712000  0.2665000     6.809000  0.2887000     6.615000  0.4480000     0.1939000      0.5330000 
1 1 1 24 8  13 o 3.331000  0.4961000     3.259000  0.5391000     3.403000  0.8331000     -0.1444000     0.9923000 
1 1 1 24 8  14 o 5.614000  0.3855000     5.771000  0.3497000     5.458000  0.6870000     0.3130000      0.7709000 
1 1 1 24 8  15 o 2.959000  0.4882000     3.757000  0.4574000     2.161000  0.8627000     1.596000       0.9765000 
1 1 1 24 8  16 o 2.744000  0.5442000     2.948000  0.7330000     2.541000  0.8045000     0.4076000      1.088000  
1 1 1 24 8  17 o 3.682000  0.3831000     3.642000  0.5527000     3.722000  0.5306000     -0.8016000E-01 0.7662000 
1 1 1 24 8  18 o 1.932000  0.5000000     2.181000  0.7272000     1.683000  0.6864000     0.4972000      1.000000  
1 1 1 24 8  19 o 2.929000  0.5353000     2.912000  0.7891000     2.946000  0.7235000     -0.3431000E-01 1.071000  
1 1 1 24 8  20 o 1.177000  0.3941000     1.071000  0.5208000     1.282000  0.5918000     -0.2111000     0.7883000 
1 1 1 24 8  21 o 1.098000  0.3782000     1.087000  0.5279000     1.109000  0.5417000     -0.2254000E-01 0.7564000 
1 1 1 24 8  22 o 1.449000  0.4527000     1.449000  0.6377000     1.450000  0.6427000     -0.1102000E-02 0.9054000 
1 1 1 24 9  0  o 11.13000  0.1510000     11.13000  0.1510000     11.13000  0.1510000     -0.000000      0.000000  
1 1 1 24 9  1  o 2.562000  0.1574000     2.577000  0.2313000     2.548000  0.2135000     0.2946000E-01  0.3148000 
1 1 1 24 9  2  o 9.750000  0.1097000     9.685000  0.1721000     9.814000  0.1360000     -0.1293000     0.2194000 
1 1 1 24 9  3  o 10.15000  0.1404000     9.918000  0.2156000     10.38000  0.1801000     -0.4624000     0.2809000 
1 1 1 24 9  4  o 3.466000  0.2058000     3.275000  0.2571000     3.657000  0.3213000     -0.3822000     0.4115000 
1 1 1 24 9  5  o 13.75000  0.2583000     13.71000  0.2213000     13.79000  0.4667000     -0.7554000E-01 0.5165000 
1 1 1 24 9  6  o 6.174000  0.2481000     6.076000  0.3871000     6.271000  0.3105000     -0.1952000     0.4963000 
1 1 1 24 9  7  o 10.14000  0.1562000     9.971000  0.2254000     10.32000  0.2163000     -0.3456000     0.3124000 
1 1 1 24 9  8  o 8.502000  0.1705000     8.571000  0.2406000     8.433000  0.2417000     0.1383000      0.3410000 
1 1 1 24 9  9  o 15.90000  0.1753000     15.95000  0.2448000     15.84000  0.2510000     0.1093000      0.3506000 
1 1 1 24 9  10 o 3.220000  0.3803000     2.725000  0.5812000     3.716000  0.4906000     -0.9917000     0.7606000 
1 1 1 24 9  11 o 2.482000  0.5043000     2.585000  0.6829000     2.379000  0.7423000     0.2058000      1.009000  
1 1 1 24 9  12 o 5.384000  0.2675000     5.673000  0.3474000     5.095000  0.4069000     0.5781000      0.5350000 
1 1 1 24 9  13 o 3.630000  0.3857000     3.019000  0.5859000     4.240000  0.5018000     -1.220000      0.7714000 
1 1 1 24 9  14 o 1.974000  0.5576000     1.987000  0.7052000     1.962000  0.8640000     0.2495000E-01  1.115000  
1 1 1 24 9  15 o 1.932000  0.5420000     1.524000  0.6400000     2.340000  0.8748000     -0.8161000     1.084000  
1 1 1 24 9  16 o 3.347000  0.5432000     3.574000  0.4915000     3.120000  0.9688000     0.4534000      1.086000  
1 1 1 24 9  17 o 2.362000  0.4527000     1.493000  0.6541000     3.232000  0.6259000     -1.740000      0.9053000 
1 1 1 24 9  18 o 2.015000  0.4830000     2.493000  0.7053000     1.537000  0.6600000     0.9560000      0.9659000 
1 1 1 24 9  19 o 2.417000  0.5155000     3.089000  0.7443000     1.745000  0.7136000     1.345000       1.031000  
1 1 1 24 9  20 o 2.014000  0.4893000     1.636000  0.6823000     2.392000  0.7016000     -0.7561000     0.9786000 
1 1 1 24 9  21 o 1.342000  0.4319000     1.051000  0.5186000     1.633000  0.6908000     -0.5817000     0.8638000 
1 1 1 24 9  22 o 1.187000  0.3946000     0.9630000 0.4803000     1.412000  0.6262000     -0.4489000     0.7892000 
1 1 1 24 10 0  o 1.066000  0.4860000     1.066000  0.4860000     1.066000  0.4860000     0.000000       0.000000  
1 1 1 24 10 1  o 15.83000  0.1365000     15.75000  0.1920000     15.91000  0.1941000     -0.1591000     0.2730000 
1 1 1 24 10 2  o 2.760000  0.1843000     2.772000  0.2895000     2.748000  0.2283000     0.2412000E-01  0.3687000 
1 1 1 24 10 3  o 3.520000  0.2314000     3.141000  0.4257000     3.899000  0.1816000     -0.7578000     0.4628000 
1 1 1 24 10 4  f 4.184000  0.1634000     4.354000  0.2378000     4.015000  0.2241000     0.3389000      0.3268000 
1 1 1 24 10 5  o 10.37000  0.2018000     10.36000  0.3007000     10.39000  0.2692000     -0.2676000E-01 0.4036000 
1 1 1 24 10 6  o 12.91000  0.1866000     13.05000  0.2281000     12.77000  0.2954000     0.2792000      0.3732000 
1 1 1 24 10 7  o 8.165000  0.1662000     8.362000  0.2333000     7.969000  0.2367000     0.3924000      0.3324000 
1 1 1 24 10 8  o 5.556000  0.2142000     5.702000  0.2780000     5.411000  0.3260000     0.2914000      0.4284000 
1 1 1 24 10 9  o 1.452000  0.4198000     1.202000  0.5309000     1.702000  0.6504000     -0.4995000     0.8396000 
1 1 1 24 10 10 o 9.965000  0.1800000     9.913000  0.2461000     10.02000  0.2627000     -0.1053000     0.3600000 
1 1 1 24 10 11 o 5.717000  0.5188000     5.767000  0.9485000     5.666000  0.4205000     0.1007000      1.038000  
1 1 1 24 10 12 o 2.792000  0.4521000     2.343000  0.6758000     3.242000  0.6006000     -0.8993000     0.9041000 
1 1 1 24 10 13 f 3.019000  0.4440000     3.238000  0.5754000     2.801000  0.6762000     0.4378000      0.8879000 
1 1 1 24 10 14 o 7.329000  0.2274000     7.260000  0.3023000     7.397000  0.3397000     -0.1377000     0.4547000 
1 1 1 24 10 15 o 2.659000  0.5229000     3.021000  0.5674000     2.298000  0.8784000     0.7230000      1.046000  
1 1 1 24 10 16 o 3.767000  0.5407000     4.205000  0.4383000     3.328000  0.9886000     0.8766000      1.081000  
1 1 1 24 10 17 o 4.121000  0.3566000     3.856000  0.4103000     4.385000  0.5834000     -0.5287000     0.7132000 
1 1 1 24 10 18 o 2.653000  0.4744000     3.123000  0.4977000     2.183000  0.8078000     0.9394000      0.9488000 
1 1 1 24 10 19 o 1.419000  0.4417000     1.653000  0.6833000     1.185000  0.5599000     0.4687000      0.8834000 
1 1 1 24 10 20 f 1.765000  0.4642000     2.253000  0.7162000     1.278000  0.5906000     0.9750000      0.9283000 
1 1 1 24 10 21 o 1.407000  0.4542000     1.504000  0.6733000     1.309000  0.6097000     0.1945000      0.9084000 
1 1 1 24 10 22 o 1.245000  0.4126000     1.276000  0.5947000     1.213000  0.5720000     0.6262000E-01  0.8251000 
1 1 1 24 11 0  o 15.24000  0.1897000     15.24000  0.1897000     15.24000  0.1897000     0.000000       0.000000  
1 1 1 24 11 1  o 27.20000  0.2353000     27.21000  0.3562000     27.19000  0.3076000     0.2049000E-01  0.4706000 
1 1 1 24 11 2  o 19.21000  0.2046000     19.13000  0.2611000     19.29000  0.3151000     -0.1519000     0.4093000 
1 1 1 24 11 3  o 3.936000  0.1397000     3.910000  0.1983000     3.961000  0.1970000     -0.5097000E-01 0.2795000 
1 1 1 24 11 4  o 5.145000  0.1782000     5.080000  0.2323000     5.210000  0.2704000     -0.1301000     0.3565000 
1 1 1 24 11 5  o 9.143000  0.2561000     9.159000  0.4376000     9.126000  0.2660000     0.3348000E-01  0.5122000 
1 1 1 24 11 6  o 0.8850000 0.3070000     0.7812000 0.3827000     0.9887000 0.4802000     -0.2075000     0.6140000 
1 1 1 24 11 7  o 3.783000  0.2629000     3.574000  0.3687000     3.992000  0.3750000     -0.4182000     0.5259000 
1 1 1 24 11 8  o 5.050000  0.3112000     5.686000  0.3004000     4.414000  0.5452000     1.273000       0.6225000 
1 1 1 24 11 9  o 10.15000  0.1727000     10.20000  0.2406000     10.10000  0.2477000     0.1033000      0.3453000 
1 1 1 24 11 10 o 9.832000  0.1801000     9.967000  0.2470000     9.698000  0.2622000     0.2694000      0.3602000 
1 1 1 24 11 11 o 7.459000  0.3228000     6.995000  0.5736000     7.923000  0.2963000     -0.9272000     0.6456000 
1 1 1 24 11 12 o 7.135000  0.2177000     7.117000  0.3009000     7.152000  0.3146000     -0.3506000E-01 0.4354000 
1 1 1 24 11 13 o 2.485000  0.5073000     2.127000  0.7258000     2.842000  0.7091000     -0.7149000     1.015000  
1 1 1 24 11 14 o 6.414000  0.2454000     6.472000  0.3296000     6.356000  0.3636000     0.1166000      0.4908000 
1 1 1 24 11 15 o 4.609000  0.3221000     4.453000  0.4408000     4.764000  0.4698000     -0.3117000     0.6442000 
1 1 1 24 11 16 o 4.431000  0.3427000     3.882000  0.5083000     4.981000  0.4598000     -1.099000      0.6854000 
1 1 1 24 11 17 o 1.405000  0.4291000     1.580000  0.6180000     1.231000  0.5954000     0.3494000      0.8581000 
1 1 1 24 11 18 o 2.325000  0.5110000     1.951000  0.6215000     2.699000  0.8113000     -0.7480000     1.022000  
1 1 1 24 11 19 o 2.765000  0.4922000     2.728000  0.5696000     2.802000  0.8028000     -0.7412000E-01 0.9843000 
1 1 1 24 11 20 o 1.477000  0.4405000     1.652000  0.6231000     1.301000  0.6229000     0.3505000      0.8811000 
1 1 1 24 11 21 o 1.207000  0.4148000     1.304000  0.6304000     1.110000  0.5394000     0.1936000      0.8296000 
1 1 1 24 11 22 o 1.352000  0.4441000     1.174000  0.5681000     1.529000  0.6828000     -0.3552000     0.8883000 
1 1 1 24 12 0  o 9.466000  0.1807000     9.466000  0.1807000     9.466000  0.1807000     -0.000000      0.000000  
1 1 1 24 12 1  o 7.742000  0.1206000     7.662000  0.1710000     7.821000  0.1702000     -0.1592000     0.2413000 
1 1 1 24 12 2  o 15.56000  0.1402000     15.60000  0.1970000     15.53000  0.1994000     0.6927000E-01  0.2803000 
1 1 1 24 12 3  o 5.513000  0.1337000     5.576000  0.1703000     5.450000  0.2061000     0.1263000      0.2674000 
1 1 1 24 12 4  o 4.537000  0.3177000     4.462000  0.5580000     4.611000  0.3037000     -0.1494000     0.6353000 
1 1 1 24 12 5  o 15.72000  0.1745000     15.79000  0.2531000     15.66000  0.2402000     0.1314000      0.3489000 
1 1 1 24 12 6  o 14.89000  0.1995000     15.09000  0.2494000     14.69000  0.3116000     0.4021000      0.3991000 
1 1 1 24 12 7  o 7.544000  0.1826000     7.844000  0.2420000     7.243000  0.2735000     0.6018000      0.3652000 
1 1 1 24 12 8  o 8.579000  0.2253000     8.524000  0.2460000     8.635000  0.3775000     -0.1103000     0.4506000 
1 1 1 24 12 9  o 10.67000  0.1730000     10.60000  0.2405000     10.74000  0.2486000     -0.1376000     0.3459000 
1 1 1 24 12 10 o 15.26000  0.1819000     15.15000  0.2543000     15.37000  0.2603000     -0.2230000     0.3639000 
1 1 1 24 12 11 o 6.708000  0.2902000     6.429000  0.4857000     6.988000  0.3178000     -0.5589000     0.5804000 
1 1 1 24 12 12 o 4.845000  0.3077000     4.912000  0.4312000     4.777000  0.4391000     0.1355000      0.6155000 
1 1 1 24 12 13 o 6.526000  0.2566000     6.410000  0.3563000     6.642000  0.3693000     -0.2319000     0.5132000 
1 1 1 24 12 14 o 3.762000  0.3934000     4.187000  0.4564000     3.336000  0.6410000     0.8505000      0.7868000 
1 1 1 24 12 15 o 1.878000  0.4890000     2.269000  0.7236000     1.487000  0.6579000     0.7819000      0.9779000 
1 1 1 24 12 16 o 1.746000  0.5848000     2.274000  1.019000      1.219000  0.5744000     1.055000       1.170000  
1 1 1 24 12 17 o 2.840000  0.4437000     2.808000  0.6127000     2.872000  0.6419000     -0.6335000E-01 0.8874000 
1 1 1 24 12 18 o 2.262000  0.4496000     1.921000  0.6350000     2.602000  0.6366000     -0.6813000     0.8992000 
1 1 1 24 12 19 o 3.724000  0.3953000     3.447000  0.4528000     4.000000  0.6481000     -0.5529000     0.7906000 
1 1 1 24 12 20 f 1.496000  0.4659000     1.209000  0.5448000     1.782000  0.7560000     -0.5724000     0.9318000 
1 1 1 24 12 21 o 1.235000  0.4238000     1.263000  0.6112000     1.207000  0.5873000     0.5589000E-01  0.8476000 
1 1 1 24 12 22 o 1.036000  0.5293000     1.036000  0.5293000     ?         ?             ?              ?         
1 1 1 24 13 1  o 2.220000  0.3550000     2.659000  0.3092000     1.781000  0.6391000     0.8777000      0.7100000 
1 1 1 24 13 2  o 18.83000  0.2126000     18.74000  0.2600000     18.91000  0.3366000     -0.1764000     0.4253000 
1 1 1 24 13 3  o 13.93000  0.1738000     14.05000  0.2663000     13.81000  0.2233000     0.2392000      0.3475000 
1 1 1 24 13 4  o 11.52000  0.1370000     11.67000  0.1828000     11.37000  0.2040000     0.2990000      0.2739000 
1 1 1 24 13 5  o 13.00000  0.1604000     13.20000  0.2335000     12.79000  0.2199000     0.4142000      0.3208000 
1 1 1 24 13 6  o 3.088000  0.2982000     3.540000  0.3832000     2.635000  0.4570000     0.9055000      0.5964000 
1 1 1 24 13 7  o 4.993000  0.2185000     4.701000  0.3086000     5.285000  0.3094000     -0.5842000     0.4370000 
1 1 1 24 13 8  o 8.274000  0.1944000     8.241000  0.2658000     8.306000  0.2837000     -0.6572000E-01 0.3887000 
1 1 1 24 13 9  o 3.893000  0.2934000     3.767000  0.3840000     4.018000  0.4436000     -0.2510000     0.5867000 
1 1 1 24 13 10 o 1.736000  0.4624000     2.010000  0.6472000     1.462000  0.6606000     0.5475000      0.9248000 
1 1 1 24 13 11 o 9.082000  0.1921000     9.063000  0.2636000     9.102000  0.2794000     -0.3889000E-01 0.3841000 
1 1 1 24 13 12 o 2.928000  0.4659000     3.416000  0.5651000     2.440000  0.7409000     0.9759000      0.9319000 
1 1 1 24 13 13 o 2.892000  0.4952000     2.467000  0.7139000     3.317000  0.6864000     -0.8498000     0.9904000 
1 1 1 24 13 14 o 4.974000  0.3006000     4.752000  0.4111000     5.196000  0.4387000     -0.4447000     0.6012000 
1 1 1 24 13 15 o 5.851000  0.2675000     6.043000  0.3566000     5.659000  0.3987000     0.3841000      0.5349000 
1 1 1 24 13 16 o 3.142000  0.5953000     2.515000  1.088000      3.769000  0.4827000     -1.254000      1.191000  
1 1 1 24 13 17 o 1.417000  0.4385000     1.271000  0.5824000     1.562000  0.6557000     -0.2912000     0.8769000 
1 1 1 24 13 18 o 1.680000  0.4548000     2.175000  0.7144000     1.185000  0.5630000     0.9899000      0.9096000 
1 1 1 24 13 19 f 1.214000  0.3946000     1.091000  0.5168000     1.337000  0.5964000     -0.2455000     0.7891000 
1 1 1 24 13 20 o 1.568000  0.4392000     1.632000  0.6208000     1.504000  0.6215000     0.1273000      0.8784000 
1 1 1 24 13 21 o 1.312000  0.4450000     1.300000  0.6305000     1.324000  0.6281000     -0.2411000E-01 0.8899000 
1 1 1 24 14 0  o 18.44000  0.2575000     18.44000  0.2575000     18.44000  0.2575000     0.000000       0.000000  
1 1 1 24 14 1  o 4.383000  0.1487000     4.550000  0.2188000     4.217000  0.2015000     0.3333000      0.2974000 
1 1 1 24 14 2  o 15.50000  0.1544000     15.51000  0.2336000     15.49000  0.2018000     0.2021000E-01  0.3087000 
1 1 1 24 14 3  o 11.11000  0.1233000     11.13000  0.1737000     11.09000  0.1750000     0.3582000E-01  0.2465000 
1 1 1 24 14 4  o 6.529000  0.1368000     6.728000  0.1797000     6.329000  0.2062000     0.3993000      0.2735000 
1 1 1 24 14 5  o 17.35000  0.1734000     17.21000  0.2266000     17.50000  0.2624000     -0.2877000     0.3468000 
1 1 1 24 14 6  o 12.36000  0.1798000     12.27000  0.2774000     12.45000  0.2290000     -0.1876000     0.3597000 
1 1 1 24 14 7  o 15.48000  0.2453000     15.46000  0.3575000     15.49000  0.3360000     -0.2665000E-01 0.4906000 
1 1 1 24 14 8  o 4.564000  0.2557000     4.465000  0.3582000     4.662000  0.3649000     -0.1973000     0.5114000 
1 1 1 24 14 9  o 9.227000  0.1863000     9.042000  0.2731000     9.413000  0.2536000     -0.3711000     0.3727000 
1 1 1 24 14 10 o 4.975000  0.3100000     4.656000  0.4202000     5.295000  0.4558000     -0.6389000     0.6200000 
1 1 1 24 14 11 o 3.778000  0.3741000     3.264000  0.5845000     4.293000  0.4671000     -1.029000      0.7483000 
1 1 1 24 14 12 o 1.812000  0.4970000     1.869000  0.7009000     1.754000  0.7048000     0.1145000      0.9940000 
1 1 1 24 14 13 o 1.414000  0.4872000     1.144000  0.5476000     1.685000  0.8060000     -0.5416000     0.9745000 
1 1 1 24 14 14 o 2.523000  0.5071000     2.595000  0.6812000     2.451000  0.7513000     0.1439000      1.014000  
1 1 1 24 14 15 o 1.782000  0.4938000     1.597000  0.6603000     1.967000  0.7346000     -0.3703000     0.9877000 
1 1 1 24 14 16 o 1.691000  0.4969000     1.613000  0.7192000     1.770000  0.6860000     -0.1567000     0.9939000 
1 1 1 24 14 17 o 1.407000  0.4324000     1.251000  0.5702000     1.562000  0.6502000     -0.3103000     0.8648000 
1 1 1 24 14 18 o 2.564000  0.5748000     2.438000  0.6954000     2.689000  0.9154000     -0.2514000     1.150000  
1 1 1 24 14 19 o 1.786000  0.4667000     1.591000  0.6407000     1.981000  0.6788000     -0.3899000     0.9334000 
1 1 1 24 14 20 o 2.137000  0.4561000     2.602000  0.6340000     1.672000  0.6558000     0.9296000      0.9122000 
1 1 1 24 14 21 o 1.475000  0.4818000     1.618000  0.7561000     1.331000  0.5975000     0.2866000      0.9636000 
1 1 1 24 15 0  o 11.26000  0.1711000     11.26000  0.1711000     11.26000  0.1711000     -0.000000      0.000000  
1 1 1 24 15 1  o 7.427000  0.1148000     7.565000  0.1611000     7.289000  0.1636000     0.2763000      0.2296000 
1 1 1 24 15 2  o 2.073000  0.2798000     1.937000  0.4205000     2.210000  0.3693000     -0.2732000     0.5597000 
1 1 1 24 15 3  o 2.304000  0.2653000     2.393000  0.3622000     2.215000  0.3878000     0.1786000      0.5306000 
1 1 1 24 15 4  o 13.63000  0.1625000     13.84000  0.2351000     13.42000  0.2243000     0.4157000      0.3249000 
1 1 1 24 15 5  f 17.47000  0.1750000     17.64000  0.2311000     17.29000  0.2629000     0.3476000      0.3501000 
1 1 1 24 15 6  o 6.168000  0.1950000     6.055000  0.2983000     6.281000  0.2512000     -0.2261000     0.3900000 
1 1 1 24 15 7  o 3.168000  0.3297000     3.090000  0.4990000     3.246000  0.4310000     -0.1560000     0.6594000 
1 1 1 24 15 8  o 4.836000  0.2457000     5.154000  0.3228000     4.518000  0.3705000     0.6364000      0.4914000 
1 1 1 24 15 9  o 12.04000  0.1831000     12.04000  0.2694000     12.03000  0.2481000     0.4634000E-02  0.3662000 
1 1 1 24 15 10 o 6.597000  0.4978000     5.963000  0.9490000     7.230000  0.3006000     -1.267000      0.9955000 
1 1 1 24 15 11 o 6.881000  0.2294000     6.923000  0.3063000     6.840000  0.3415000     0.8302000E-01  0.4587000 
1 1 1 24 15 12 o 8.210000  0.2124000     7.983000  0.2950000     8.438000  0.3058000     -0.4552000     0.4249000 
1 1 1 24 15 13 o 8.227000  0.2901000     8.166000  0.2954000     8.288000  0.4993000     -0.1218000     0.5802000 
1 1 1 24 15 14 o 5.133000  0.2934000     5.581000  0.3574000     4.686000  0.4653000     0.8951000      0.5867000 
1 1 1 24 15 15 o 2.403000  0.4560000     3.059000  0.5746000     1.746000  0.7082000     1.314000       0.9120000 
1 1 1 24 15 16 f 3.316000  0.4058000     3.705000  0.4906000     2.928000  0.6464000     0.7769000      0.8115000 
1 1 1 24 15 17 o 3.275000  0.4064000     3.454000  0.5396000     3.097000  0.6078000     0.3571000      0.8128000 
1 1 1 24 15 18 f 1.959000  0.5865000     1.741000  0.6809000     2.178000  0.9551000     -0.4371000     1.173000  
1 1 1 24 15 19 o 1.141000  0.3793000     0.9656000 0.4727000     1.317000  0.5934000     -0.3517000     0.7587000 
1 1 1 24 15 20 o 1.337000  0.4155000     1.533000  0.6317000     1.140000  0.5397000     0.3924000      0.8309000 
1 1 1 24 15 21 o 1.491000  0.4612000     1.339000  0.6350000     1.642000  0.6689000     -0.3028000     0.9223000 
1 1 1 24 16 0  o 10.71000  0.1713000     10.71000  0.1713000     10.71000  0.1713000     -0.000000      0.000000  
1 1 1 24 16 1  o 9.961000  0.1195000     9.979000  0.1676000     9.943000  0.1703000     0.3555000E-01  0.2389000 
1 1 1 24 16 2  o 16.89000  0.1529000     16.86000  0.2154000     16.92000  0.2169000     -0.5623000E-01 0.3057000 
1 1 1 24 16 3  o 5.374000  0.1407000     5.576000  0.1948000     5.173000  0.2031000     0.4034000      0.2814000 
1 1 1 24 16 4  o 14.51000  0.1554000     14.62000  0.2049000     14.39000  0.2337000     0.2324000      0.3108000 
1 1 1 24 16 5  o 14.82000  0.1619000     14.90000  0.2131000     14.73000  0.2437000     0.1637000      0.3237000 
1 1 1 24 16 6  o 4.261000  0.2218000     4.002000  0.3098000     4.520000  0.3175000     -0.5183000     0.4436000 
1 1 1 24 16 7  o 9.948000  0.1860000     10.14000  0.2808000     9.756000  0.2441000     0.3828000      0.3720000 
1 1 1 24 16 8  o 2.077000  0.4701000     2.063000  0.6674000     2.092000  0.6623000     -0.2877000E-01 0.9403000 
1 1 1 24 16 9  o 9.707000  0.2070000     9.562000  0.2714000     9.852000  0.3127000     -0.2904000     0.4141000 
1 1 1 24 16 10 o 11.96000  0.2152000     12.01000  0.3435000     11.91000  0.2593000     0.9959000E-01  0.4304000 
1 1 1 24 16 11 o 6.940000  0.2267000     6.893000  0.3084000     6.987000  0.3324000     -0.9390000E-01 0.4534000 
1 1 1 24 16 12 o 6.070000  0.2561000     6.053000  0.3397000     6.087000  0.3832000     -0.3459000E-01 0.5121000 
1 1 1 24 16 13 o 4.360000  0.3445000     4.270000  0.4462000     4.450000  0.5251000     -0.1792000     0.6890000 
1 1 1 24 16 14 o 5.692000  0.2648000     5.608000  0.3542000     5.776000  0.3937000     -0.1681000     0.5296000 
1 1 1 24 16 15 o 2.711000  0.4648000     1.724000  0.6749000     3.699000  0.6394000     -1.975000      0.9297000 
1 1 1 24 16 16 o 1.311000  0.4170000     1.345000  0.5913000     1.276000  0.5881000     0.6937000E-01  0.8340000 
1 1 1 24 16 17 o 1.652000  0.4560000     2.025000  0.6963000     1.279000  0.5890000     0.7454000      0.9120000 
1 1 1 24 16 18 o 1.830000  0.4763000     2.314000  0.6926000     1.345000  0.6539000     0.9691000      0.9526000 
1 1 1 24 16 19 o 1.622000  0.4419000     1.226000  0.5612000     2.017000  0.6827000     -0.7916000     0.8837000 
1 1 1 24 16 20 o 1.515000  0.4341000     1.192000  0.5510000     1.838000  0.6708000     -0.6452000     0.8681000 
1 1 1 24 16 21 o 1.449000  0.4044000     1.999000  0.6735000     0.9001000 0.4479000     1.099000       0.8089000 
1 1 1 24 17 0  o 7.079000  0.1745000     7.079000  0.1745000     7.079000  0.1745000     0.000000       0.000000  
1 1 1 24 17 1  o 9.301000  0.1209000     9.229000  0.1694000     9.373000  0.1725000     -0.1440000     0.2418000 
1 1 1 24 17 2  o 4.287000  0.1611000     4.392000  0.2214000     4.183000  0.2340000     0.2093000      0.3222000 
1 1 1 24 17 3  o 5.467000  0.1516000     5.187000  0.2096000     5.747000  0.2190000     -0.5599000     0.3031000 
1 1 1 24 17 4  o 9.686000  0.1405000     9.574000  0.1831000     9.799000  0.2131000     -0.2254000     0.2810000 
1 1 1 24 17 5  o 9.706000  0.1467000     9.966000  0.1926000     9.446000  0.2215000     0.5204000      0.2935000 
1 1 1 24 17 6  o 3.028000  0.3150000     3.317000  0.4168000     2.740000  0.4724000     0.5764000      0.6300000 
1 1 1 24 17 7  o 6.506000  0.1848000     6.532000  0.2457000     6.480000  0.2762000     0.5166000E-01  0.3697000 
1 1 1 24 17 8  o 7.430000  0.1928000     7.794000  0.3108000     7.066000  0.2284000     0.7281000      0.3857000 
1 1 1 24 17 9  o 7.226000  0.2572000     7.372000  0.3690000     7.080000  0.3584000     0.2925000      0.5144000 
1 1 1 24 17 10 o 4.565000  0.2911000     4.736000  0.3878000     4.394000  0.4343000     0.3416000      0.5822000 
1 1 1 24 17 11 o 7.792000  0.2146000     7.641000  0.2985000     7.942000  0.3084000     -0.3012000     0.4292000 
1 1 1 24 17 12 o 4.523000  0.3231000     4.160000  0.4594000     4.885000  0.4543000     -0.7249000     0.6461000 
1 1 1 24 17 13 f 3.650000  0.3999000     3.933000  0.4979000     3.368000  0.6258000     0.5651000      0.7997000 
1 1 1 24 17 14 o 2.554000  0.4879000     2.068000  0.7069000     3.041000  0.6728000     -0.9731000     0.9758000 
1 1 1 24 17 15 o 2.322000  0.5345000     2.616000  0.7631000     2.029000  0.7488000     0.5875000      1.069000  
1 1 1 24 17 16 o 3.233000  0.4019000     2.808000  0.6148000     3.657000  0.5179000     -0.8492000     0.8038000 
1 1 1 24 17 17 o 2.387000  0.4806000     2.713000  0.6347000     2.061000  0.7219000     0.6517000      0.9612000 
1 1 1 24 17 18 o 1.170000  0.4009000     1.177000  0.5513000     1.164000  0.5821000     0.1277000E-01  0.8017000 
1 1 1 24 17 19 o 1.414000  0.4312000     1.300000  0.5792000     1.528000  0.6389000     -0.2284000     0.8624000 
1 1 1 24 17 20 o 1.339000  0.4266000     1.322000  0.5952000     1.355000  0.6113000     -0.3292000E-01 0.8532000 
1 1 1 24 17 21 o 1.453000  0.4265000     1.787000  0.6668000     1.119000  0.5318000     0.6683000      0.8529000 
1 1 1 24 18 0  o 8.657000  0.1732000     8.657000  0.1732000     8.657000  0.1732000     -0.000000      0.000000  
1 1 1 24 18 1  o 14.83000  0.1430000     14.78000  0.2016000     14.89000  0.2029000     -0.1100000     0.2861000 
1 1 1 24 18 2  o 8.020000  0.1264000     8.044000  0.1767000     7.996000  0.1808000     0.4728000E-01  0.2528000 
1 1 1 24 18 3  f 5.077000  0.1565000     5.081000  0.2228000     5.074000  0.2198000     0.6110000E-02  0.3129000 
1 1 1 24 18 4  o 12.04000  0.1607000     11.93000  0.2297000     12.14000  0.2249000     -0.2142000     0.3215000 
1 1 1 24 18 5  o 5.857000  0.1710000     6.146000  0.2141000     5.568000  0.2668000     0.5783000      0.3421000 
1 1 1 24 18 6  o 2.557000  0.3665000     2.533000  0.5182000     2.582000  0.5185000     -0.4938000E-01 0.7331000 
1 1 1 24 18 7  o 4.580000  0.2325000     4.354000  0.3171000     4.806000  0.3401000     -0.4522000     0.4650000 
1 1 1 24 18 8  o 6.840000  0.2029000     7.154000  0.3256000     6.526000  0.2421000     0.6288000      0.4057000 
1 1 1 24 18 9  o 4.629000  0.4047000     ?         ?             4.629000  0.4047000     ?              ?         
1 1 1 24 18 10 o 5.220000  0.2679000     5.232000  0.3819000     5.208000  0.3757000     0.2392000E-01  0.5357000 
1 1 1 24 18 11 o 3.236000  0.4319000     3.131000  0.6108000     3.341000  0.6109000     -0.2107000     0.8639000 
1 1 1 24 18 12 o 5.348000  0.3027000     4.597000  0.4522000     6.098000  0.4024000     -1.501000      0.6053000 
1 1 1 24 18 13 o 2.797000  0.4871000     2.585000  0.6916000     3.010000  0.6861000     -0.4244000     0.9742000 
1 1 1 24 18 14 o 3.649000  0.3882000     4.007000  0.4528000     3.290000  0.6308000     0.7161000      0.7765000 
1 1 1 24 18 15 o 6.153000  0.5139000     5.728000  0.9723000     6.578000  0.3332000     -0.8506000     1.028000  
1 1 1 24 18 16 o 2.839000  0.4499000     3.054000  0.5894000     2.623000  0.6798000     0.4308000      0.8997000 
1 1 1 24 18 17 o 1.764000  0.4758000     1.840000  0.6624000     1.687000  0.6832000     0.1524000      0.9516000 
1 1 1 24 18 18 o 2.191000  0.4991000     2.226000  0.6921000     2.157000  0.7192000     0.6837000E-01  0.9982000 
1 1 1 24 18 19 o 2.328000  0.4021000     1.351000  0.5894000     3.305000  0.5471000     -1.954000      0.8042000 
1 1 1 24 18 20 o 1.135000  0.3799000     1.335000  0.5998000     0.9346000 0.4663000     0.4009000      0.7598000 
1 1 1 24 18 21 o 1.352000  0.4181000     1.057000  0.5091000     1.648000  0.6634000     -0.5917000     0.8362000 
1 1 1 24 19 0  o 2.140000  0.4646000     2.140000  0.4646000     2.140000  0.4646000     0.000000       0.000000  
1 1 1 24 19 1  o 14.34000  0.1427000     14.44000  0.2018000     14.25000  0.2017000     0.1859000      0.2853000 
1 1 1 24 19 2  o 3.034000  0.2256000     3.087000  0.3120000     2.981000  0.3258000     0.1060000      0.4511000 
1 1 1 24 19 3  o 13.99000  0.1447000     14.00000  0.2043000     13.98000  0.2049000     0.1475000E-01  0.2894000 
1 1 1 24 19 4  o 5.985000  0.1653000     5.944000  0.2177000     6.026000  0.2487000     -0.8192000E-01 0.3306000 
1 1 1 24 19 5  o 8.802000  0.1677000     8.882000  0.2409000     8.721000  0.2333000     0.1606000      0.3353000 
1 1 1 24 19 6  o 7.451000  0.1928000     7.216000  0.2736000     7.685000  0.2717000     -0.4684000     0.3856000 
1 1 1 24 19 7  o 8.123000  0.1778000     8.346000  0.2404000     7.901000  0.2620000     0.4446000      0.3556000 
1 1 1 24 19 8  o 7.173000  0.2419000     7.655000  0.2774000     6.690000  0.3964000     0.9654000      0.4838000 
1 1 1 24 19 9  o 3.752000  0.3279000     3.728000  0.5330000     3.775000  0.3821000     -0.4740000E-01 0.6558000 
1 1 1 24 19 10 o 1.517000  0.4458000     1.150000  0.5472000     1.884000  0.7038000     -0.7335000     0.8915000 
1 1 1 24 19 11 o 7.208000  0.2264000     7.370000  0.3059000     7.046000  0.3339000     0.3239000      0.4528000 
1 1 1 24 19 12 o 4.233000  0.5591000     4.576000  0.4584000     3.889000  1.020000      0.6871000      1.118000  
1 1 1 24 19 13 o 2.248000  0.4572000     1.434000  0.6212000     3.061000  0.6709000     -1.627000      0.9143000 
1 1 1 24 19 14 o 2.402000  0.4909000     2.724000  0.6360000     2.079000  0.7481000     0.6448000      0.9819000 
1 1 1 24 19 15 o 1.561000  0.4837000     1.646000  0.7238000     1.476000  0.6419000     0.1698000      0.9675000 
1 1 1 24 19 16 o 2.387000  0.4949000     2.320000  0.6930000     2.455000  0.7067000     -0.1350000     0.9898000 
1 1 1 24 19 17 o 1.851000  0.4414000     1.162000  0.5419000     2.540000  0.6968000     -1.378000      0.8827000 
1 1 1 24 19 18 o 1.637000  0.4436000     1.160000  0.5447000     2.114000  0.7003000     -0.9539000     0.8872000 
1 1 1 24 19 19 f 1.151000  0.3831000     1.205000  0.5578000     1.097000  0.5251000     0.1074000      0.7661000 
1 1 1 24 19 20 f 1.258000  0.4362000     1.324000  0.6676000     1.191000  0.5614000     0.1337000      0.8723000 
1 1 1 24 19 21 o 1.300000  0.4222000     0.9991000 0.4907000     1.600000  0.6872000     -0.6011000     0.8444000 
1 1 1 24 20 0  o 10.93000  0.1863000     10.93000  0.1863000     10.93000  0.1863000     0.000000       0.000000  
1 1 1 24 20 1  o 6.208000  0.1412000     6.165000  0.1972000     6.251000  0.2023000     -0.8596000E-01 0.2825000 
1 1 1 24 20 2  o 3.749000  0.1993000     4.139000  0.2551000     3.358000  0.3064000     0.7811000      0.3987000 
1 1 1 24 20 3  o 6.630000  0.1460000     6.566000  0.2053000     6.695000  0.2076000     -0.1284000     0.2920000 
1 1 1 24 20 4  o 9.114000  0.1409000     9.113000  0.1971000     9.115000  0.2014000     -0.1688000E-02 0.2818000 
1 1 1 24 20 5  o 5.266000  0.2308000     5.202000  0.3601000     5.330000  0.2887000     -0.1275000     0.4616000 
1 1 1 24 20 6  o 5.292000  0.2033000     5.425000  0.2681000     5.159000  0.3057000     0.2663000      0.4066000 
1 1 1 24 20 7  o 12.95000  0.1992000     13.06000  0.2450000     12.84000  0.3143000     0.2220000      0.3985000 
1 1 1 24 20 8  o 9.547000  0.2367000     9.885000  0.3845000     9.210000  0.2762000     0.6756000      0.4735000 
1 1 1 24 20 9  o 3.110000  0.4097000     2.255000  0.7303000     3.965000  0.3716000     -1.709000      0.8194000 
1 1 1 24 20 10 o 9.111000  0.2060000     9.400000  0.3388000     8.823000  0.2345000     0.5762000      0.4120000 
1 1 1 24 20 11 o 6.778000  0.2381000     7.123000  0.3161000     6.433000  0.3561000     0.6893000      0.4761000 
1 1 1 24 20 12 o 5.372000  0.3750000     4.690000  0.4044000     6.055000  0.6316000     -1.364000      0.7500000 
1 1 1 24 20 13 o 2.386000  0.4874000     2.742000  0.6396000     2.029000  0.7357000     0.7134000      0.9748000 
1 1 1 24 20 14 o 2.547000  0.5098000     2.729000  0.6363000     2.364000  0.7968000     0.3648000      1.020000  
1 1 1 24 20 15 o 3.285000  0.4002000     3.474000  0.5248000     3.096000  0.6042000     0.3782000      0.8003000 
1 1 1 24 20 16 o 1.359000  0.4271000     1.579000  0.6575000     1.140000  0.5454000     0.4388000      0.8542000 
1 1 1 24 20 17 o 1.202000  0.4028000     1.236000  0.5722000     1.167000  0.5670000     0.6856000E-01  0.8055000 
1 1 1 24 20 18 o 2.473000  0.4857000     2.378000  0.6936000     2.568000  0.6801000     -0.1901000     0.9714000 
1 1 1 24 20 19 o 1.450000  0.4432000     1.449000  0.6242000     1.452000  0.6292000     -0.2708000E-02 0.8863000 
1 1 1 24 20 20 o 1.560000  0.5142000     1.713000  0.8229000     1.407000  0.6166000     0.3063000      1.028000  
1 1 1 24 21 0  o 2.724000  0.3892000     2.724000  0.3892000     2.724000  0.3892000     -0.000000      0.000000  
1 1 1 24 21 1  o 9.695000  0.1336000     9.949000  0.1881000     9.442000  0.1899000     0.5063000      0.2673000 
1 1 1 24 21 2  o 9.339000  0.1350000     9.166000  0.1899000     9.513000  0.1921000     -0.3468000     0.2701000 
1 1 1 24 21 3  o 4.021000  0.2020000     3.873000  0.2933000     4.170000  0.2780000     -0.2967000     0.4041000 
1 1 1 24 21 4  o 10.47000  0.1555000     10.49000  0.2358000     10.44000  0.2028000     0.5670000E-01  0.3110000 
1 1 1 24 21 5  o 4.959000  0.2343000     4.476000  0.3454000     5.441000  0.3166000     -0.9651000     0.4685000 
1 1 1 24 21 6  o 8.066000  0.1686000     8.017000  0.2195000     8.115000  0.2560000     -0.9814000E-01 0.3372000 
1 1 1 24 21 7  o 2.677000  0.6051000     2.228000  0.6064000     3.125000  1.047000      -0.8965000     1.210000  
1 1 1 24 21 8  o 10.36000  0.1692000     10.56000  0.2509000     10.16000  0.2271000     0.4008000      0.3384000 
1 1 1 24 21 9  o 3.566000  0.3128000     4.089000  0.3946000     3.043000  0.4854000     1.046000       0.6256000 
1 1 1 24 21 10 o 3.423000  0.4127000     2.971000  0.7178000     3.874000  0.4077000     -0.9026000     0.8255000 
1 1 1 24 21 11 o 5.639000  0.2783000     5.568000  0.3800000     5.709000  0.4066000     -0.1407000     0.5565000 
1 1 1 24 21 12 o 3.463000  0.3956000     3.495000  0.5222000     3.430000  0.5945000     0.6504000E-01  0.7913000 
1 1 1 24 21 13 o 3.248000  0.4124000     3.412000  0.5476000     3.084000  0.6168000     0.3281000      0.8248000 
1 1 1 24 21 14 o 2.908000  0.5140000     3.351000  0.6725000     2.464000  0.7776000     0.8869000      1.028000  
1 1 1 24 21 15 o 2.343000  0.4991000     2.074000  0.7085000     2.612000  0.7030000     -0.5379000     0.9981000 
1 1 1 24 21 16 o 3.485000  0.3851000     3.420000  0.5427000     3.551000  0.5465000     -0.1306000     0.7702000 
1 1 1 24 21 17 o 1.989000  0.5817000     1.613000  0.6514000     2.365000  0.9640000     -0.7519000     1.163000  
1 1 1 24 21 18 o 1.513000  0.4713000     1.536000  0.6958000     1.490000  0.6359000     0.4591000E-01  0.9427000 
1 1 1 24 21 19 o 1.556000  0.4533000     1.593000  0.6421000     1.518000  0.6400000     0.7455000E-01  0.9066000 
1 1 1 24 21 20 o 1.272000  0.4211000     1.248000  0.5991000     1.296000  0.5920000     -0.4838000E-01 0.8423000 
1 1 1 24 22 0  o 21.22000  0.2643000     21.22000  0.2643000     21.22000  0.2643000     -0.000000      0.000000  
1 1 1 24 22 1  o 7.988000  0.1386000     8.111000  0.1924000     7.864000  0.1995000     0.2471000      0.2772000 
1 1 1 24 22 2  f 6.319000  0.1526000     6.534000  0.2120000     6.105000  0.2196000     0.4290000      0.3052000 
1 1 1 24 22 3  o 11.82000  0.1567000     11.76000  0.2393000     11.88000  0.2023000     -0.1262000     0.3133000 
1 1 1 24 22 4  o 6.058000  0.1972000     5.981000  0.2585000     6.136000  0.2978000     -0.1549000     0.3944000 
1 1 1 24 22 5  o 6.153000  0.1795000     6.216000  0.2361000     6.091000  0.2704000     0.1247000      0.3589000 
1 1 1 24 22 6  o 2.566000  0.4205000     2.827000  0.4533000     2.304000  0.7083000     0.5236000      0.8409000 
1 1 1 24 22 7  o 5.110000  0.2598000     4.822000  0.3907000     5.397000  0.3426000     -0.5745000     0.5196000 
1 1 1 24 22 8  o 6.386000  0.1916000     6.498000  0.2759000     6.275000  0.2659000     0.2233000      0.3832000 
1 1 1 24 22 9  o 7.133000  0.1921000     7.212000  0.2824000     7.055000  0.2604000     0.1565000      0.3842000 
1 1 1 24 22 10 o 7.023000  0.2280000     6.995000  0.3739000     7.052000  0.2610000     -0.5624000E-01 0.4559000 
1 1 1 24 22 11 o 2.337000  0.5206000     2.538000  0.7452000     2.136000  0.7271000     0.4027000      1.041000  
1 1 1 24 22 12 o 3.501000  0.4154000     4.043000  0.4569000     2.960000  0.6939000     1.083000       0.8308000 
1 1 1 24 22 13 o 3.201000  0.4230000     3.073000  0.6093000     3.329000  0.5868000     -0.2567000     0.8459000 
1 1 1 24 22 14 o 2.138000  0.6356000     2.811000  1.099000      1.464000  0.6380000     1.346000       1.271000  
1 1 1 24 22 15 o 2.366000  0.4978000     2.253000  0.6938000     2.478000  0.7139000     -0.2254000     0.9955000 
1 1 1 24 22 16 o 3.064000  0.4309000     3.136000  0.5851000     2.992000  0.6328000     0.1436000      0.8618000 
1 1 1 24 22 17 o 1.275000  0.4226000     1.301000  0.5854000     1.248000  0.6096000     0.5338000E-01  0.8451000 
1 1 1 24 22 18 o 1.868000  0.4794000     2.121000  0.6956000     1.616000  0.6599000     0.5058000      0.9588000 
1 1 1 24 22 19 o 1.503000  0.4344000     1.915000  0.6883000     1.091000  0.5301000     0.8240000      0.8687000 
1 1 1 24 22 20 o 1.534000  0.4516000     1.538000  0.6358000     1.530000  0.6416000     0.8089000E-02  0.9033000 
1 1 1 24 23 0  o 8.622000  0.1976000     8.622000  0.1976000     8.622000  0.1976000     -0.000000      0.000000  
1 1 1 24 23 1  o 6.011000  0.1580000     6.042000  0.2180000     5.981000  0.2289000     0.6007000E-01  0.3161000 
1 1 1 24 23 2  o 6.197000  0.1738000     6.226000  0.2643000     6.168000  0.2259000     0.5853000E-01  0.3476000 
1 1 1 24 23 3  o 6.817000  0.1754000     6.625000  0.2490000     7.009000  0.2470000     -0.3834000     0.3508000 
1 1 1 24 23 4  o 9.539000  0.1543000     9.655000  0.2059000     9.423000  0.2298000     0.2315000      0.3085000 
1 1 1 24 23 5  o 6.293000  0.2212000     6.715000  0.2305000     5.870000  0.3775000     0.8453000      0.4423000 
1 1 1 24 23 6  o 6.420000  0.2696000     6.895000  0.3409000     5.944000  0.4176000     0.9508000      0.5391000 
1 1 1 24 23 7  o 5.870000  0.2077000     5.794000  0.2763000     5.946000  0.3103000     -0.1521000     0.4155000 
1 1 1 24 23 8  o 9.235000  0.1740000     9.180000  0.2564000     9.290000  0.2353000     -0.1098000     0.3480000 
1 1 1 24 23 9  f 7.699000  0.1873000     7.956000  0.2720000     7.443000  0.2576000     0.5137000      0.3746000 
1 1 1 24 23 10 o 3.457000  0.3390000     4.012000  0.4159000     2.901000  0.5356000     1.111000       0.6781000 
1 1 1 24 23 11 o 2.055000  0.5144000     1.823000  0.7180000     2.287000  0.7369000     -0.4648000     1.029000  
1 1 1 24 23 12 o 1.403000  0.4406000     1.578000  0.6645000     1.227000  0.5789000     0.3514000      0.8813000 
1 1 1 24 23 13 o 2.524000  0.4458000     3.398000  0.5476000     1.650000  0.7035000     1.748000       0.8916000 
1 1 1 24 23 14 o 1.453000  0.4574000     1.414000  0.6526000     1.491000  0.6411000     -0.7725000E-01 0.9148000 
1 1 1 24 23 15 o 1.129000  0.3783000     1.070000  0.5117000     1.187000  0.5573000     -0.1175000     0.7566000 
1 1 1 24 23 16 o 2.413000  0.4515000     3.103000  0.5823000     1.723000  0.6901000     1.380000       0.9029000 
1 1 1 24 23 17 o 3.711000  0.3784000     3.120000  0.5709000     4.303000  0.4968000     -1.183000      0.7568000 
1 1 1 24 23 18 o 1.524000  0.4484000     1.306000  0.5858000     1.743000  0.6792000     -0.4375000     0.8969000 
1 1 1 24 23 19 o 2.064000  0.5160000     2.092000  0.7294000     2.036000  0.7300000     0.5629000E-01  1.032000  
1 1 1 24 23 20 o 1.687000  0.4708000     1.467000  0.6285000     1.907000  0.7012000     -0.4393000     0.9416000 
1 1 1 24 24 0  o 2.739000  0.5766000     2.739000  0.5766000     2.739000  0.5766000     0.000000       0.000000  
1 1 1 24 24 1  o 6.225000  0.1782000     6.383000  0.2655000     6.067000  0.2378000     0.3160000      0.3564000 
1 1 1 24 24 2  o 5.748000  0.2191000     5.864000  0.2647000     5.632000  0.3491000     0.2317000      0.4381000 
1 1 1 24 24 3  o 4.703000  0.2371000     4.727000  0.2753000     4.680000  0.3861000     0.4750000E-01  0.4742000 
1 1 1 24 24 4  o 2.195000  0.4310000     2.279000  0.5609000     2.110000  0.6546000     0.1692000      0.8621000 
1 1 1 24 24 5  o 14.80000  0.2311000     14.67000  0.3146000     14.93000  0.3387000     -0.2627000     0.4623000 
1 1 1 24 24 6  o 9.610000  0.1685000     9.615000  0.2224000     9.605000  0.2532000     0.1026000E-01  0.3370000 
1 1 1 24 24 7  o 7.164000  0.1873000     7.186000  0.2478000     7.143000  0.2810000     0.4346000E-01  0.3747000 
1 1 1 24 24 8  o 3.579000  0.3301000     3.368000  0.4559000     3.791000  0.4775000     -0.4236000     0.6602000 
1 1 1 24 24 9  o 1.553000  0.4288000     1.857000  0.6488000     1.249000  0.5610000     0.6081000      0.8577000 
1 1 1 24 24 10 o 6.942000  0.2294000     6.823000  0.3747000     7.060000  0.2649000     -0.2369000     0.4589000 
1 1 1 24 24 11 o 6.812000  0.2436000     6.690000  0.3976000     6.933000  0.2817000     -0.2426000     0.4873000 
1 1 1 24 24 12 o 5.444000  0.2805000     5.688000  0.4489000     5.201000  0.3365000     0.4872000      0.5611000 
1 1 1 24 24 13 f 3.053000  0.5068000     3.088000  0.7166000     3.017000  0.7169000     0.7120000E-01  1.014000  
1 1 1 24 24 14 o 3.037000  0.4136000     3.079000  0.5456000     2.996000  0.6217000     0.8349000E-01  0.8272000 
1 1 1 24 24 15 o 1.211000  0.3992000     1.142000  0.5403000     1.279000  0.5878000     -0.1378000     0.7983000 
1 1 1 24 24 16 o 4.442000  0.3304000     4.495000  0.4109000     4.389000  0.5175000     0.1062000      0.6608000 
1 1 1 24 24 17 o 1.460000  0.4371000     1.311000  0.5777000     1.609000  0.6560000     -0.2977000     0.8741000 
1 1 1 24 24 18 o 1.473000  0.4503000     1.466000  0.6329000     1.479000  0.6407000     -0.1297000E-01 0.9006000 
1 1 1 24 24 19 o 1.707000  0.5481000     1.916000  0.8902000     1.498000  0.6398000     0.4172000      1.096000  
1 1 1 24 24 20 o 1.323000  0.4160000     1.090000  0.5225000     1.557000  0.6476000     -0.4674000     0.8321000 
1 1 1 24 25 1  o 1.875000  0.6394000     1.875000  0.6394000     ?         ?             ?              ?         
1 1 1 24 25 2  o 2.642000  0.4418000     3.339000  0.3999000     1.945000  0.7879000     1.395000       0.8836000 
1 1 1 24 25 3  o 5.533000  0.2111000     5.488000  0.2864000     5.578000  0.3101000     -0.8982000E-01 0.4221000 
1 1 1 24 25 4  o 1.106000  0.3671000     1.215000  0.5545000     0.9964000 0.4812000     0.2184000      0.7342000 
1 1 1 24 25 5  o 10.31000  0.1656000     10.26000  0.2183000     10.37000  0.2491000     -0.1153000     0.3312000 
1 1 1 24 25 6  f 2.778000  0.3797000     2.888000  0.4704000     2.667000  0.5961000     0.2212000      0.7594000 
1 1 1 24 25 7  o 4.484000  0.2553000     4.467000  0.3335000     4.500000  0.3865000     -0.3260000E-01 0.5105000 
1 1 1 24 25 8  o 6.202000  0.2201000     6.251000  0.2860000     6.153000  0.3346000     0.9705000E-01  0.4402000 
1 1 1 24 25 9  o 7.114000  0.1945000     7.210000  0.2827000     7.017000  0.2672000     0.1936000      0.3889000 
1 1 1 24 25 10 o 2.913000  0.4756000     2.519000  0.7475000     3.307000  0.5881000     -0.7883000     0.9512000 
1 1 1 24 25 11 o 4.717000  0.2665000     4.726000  0.3864000     4.708000  0.3670000     0.1826000E-01  0.5329000 
1 1 1 24 25 12 o 2.074000  0.4779000     1.720000  0.7068000     2.428000  0.6434000     -0.7081000     0.9558000 
1 1 1 24 25 13 o 1.437000  0.6302000     ?         ?             1.437000  0.6302000     ?              ?         
1 1 1 24 25 14 o 1.641000  0.4401000     2.075000  0.6737000     1.207000  0.5664000     0.8689000      0.8802000 
1 1 1 24 25 15 o 4.117000  0.3338000     3.345000  0.5320000     4.889000  0.4034000     -1.544000      0.6676000 
1 1 1 24 25 16 o 1.680000  0.5159000     1.417000  0.6186000     1.942000  0.8257000     -0.5258000     1.032000  
1 1 1 24 25 17 o 3.228000  0.4357000     2.870000  0.6311000     3.585000  0.6009000     -0.7153000     0.8715000 
1 1 1 24 25 18 o 1.885000  0.4890000     1.991000  0.6826000     1.778000  0.7005000     0.2121000      0.9780000 
1 1 1 24 25 19 f 1.320000  0.4431000     1.406000  0.6794000     1.234000  0.5691000     0.1712000      0.8862000 
1 1 1 24 25 20 o 1.283000  0.4596000     1.219000  0.6167000     1.346000  0.6816000     -0.1268000     0.9192000 
1 1 1 24 26 0  o 9.304000  0.2382000     9.304000  0.2382000     9.304000  0.2382000     0.000000       0.000000  
1 1 1 24 26 1  o 3.334000  0.2864000     3.223000  0.4345000     3.446000  0.3734000     -0.2227000     0.5728000 
1 1 1 24 26 2  o 10.49000  0.1598000     10.66000  0.2418000     10.32000  0.2090000     0.3408000      0.3196000 
1 1 1 24 26 3  o 7.424000  0.1726000     7.667000  0.2585000     7.182000  0.2288000     0.4842000      0.3453000 
1 1 1 24 26 4  o 10.65000  0.1534000     10.73000  0.2179000     10.57000  0.2158000     0.1647000      0.3067000 
1 1 1 24 26 5  o 2.104000  0.4372000     1.899000  0.6001000     2.310000  0.6359000     -0.4109000     0.8743000 
1 1 1 24 26 6  o 5.983000  0.2086000     5.912000  0.2681000     6.055000  0.3196000     -0.1433000     0.4172000 
1 1 1 24 26 7  o 5.772000  0.2234000     5.860000  0.2835000     5.683000  0.3454000     0.1770000      0.4468000 
1 1 1 24 26 8  o 6.764000  0.2108000     6.582000  0.2858000     6.946000  0.3099000     -0.3636000     0.4216000 
1 1 1 24 26 9  o 2.618000  0.4300000     2.797000  0.6071000     2.439000  0.6090000     0.3578000      0.8599000 
1 1 1 24 26 10 o 2.243000  0.4992000     2.424000  0.6496000     2.061000  0.7582000     0.3633000      0.9984000 
1 1 1 24 26 11 o 3.143000  0.3837000     3.341000  0.5273000     2.946000  0.5576000     0.3947000      0.7675000 
1 1 1 24 26 12 o 5.285000  0.3119000     4.829000  0.5133000     5.742000  0.3546000     -0.9132000     0.6239000 
1 1 1 24 26 13 o 3.051000  0.6349000     3.474000  1.136000      2.628000  0.5666000     0.8464000      1.270000  
1 1 1 24 26 14 o 3.651000  0.3513000     3.471000  0.4991000     3.831000  0.4946000     -0.3599000     0.7027000 
1 1 1 24 26 15 o 2.506000  0.4776000     2.510000  0.6459000     2.502000  0.7036000     0.7609000E-02  0.9551000 
1 1 1 24 26 16 o 2.482000  0.5612000     2.480000  0.7041000     2.485000  0.8741000     -0.4691000E-02 1.122000  
1 1 1 24 26 17 o 2.158000  0.4651000     2.622000  0.6432000     1.694000  0.6719000     0.9276000      0.9301000 
1 1 1 24 26 18 o 2.315000  0.4633000     2.898000  0.6049000     1.731000  0.7019000     1.167000       0.9266000 
1 1 1 24 26 19 o 1.724000  0.4832000     1.904000  0.7115000     1.545000  0.6540000     0.3582000      0.9664000 
1 1 1 24 27 0  f 1.735000  0.6912000     1.735000  0.6912000     1.735000  0.6912000     0.000000       0.000000  
1 1 1 24 27 1  o 6.823000  0.1655000     6.905000  0.2317000     6.742000  0.2365000     0.1626000      0.3310000 
1 1 1 24 27 2  o 6.606000  0.1678000     6.398000  0.2394000     6.813000  0.2351000     -0.4149000     0.3355000 
1 1 1 24 27 3  o 10.78000  0.1523000     10.81000  0.2151000     10.75000  0.2158000     0.6049000E-01  0.3047000 
1 1 1 24 27 4  o 2.787000  0.3410000     2.947000  0.4523000     2.628000  0.5104000     0.3190000      0.6819000 
1 1 1 24 27 5  o 2.222000  0.4164000     2.182000  0.5805000     2.262000  0.5971000     -0.7987000E-01 0.8327000 
1 1 1 24 27 6  o 15.40000  0.1840000     15.38000  0.2383000     15.42000  0.2803000     -0.3642000E-01 0.3679000 
1 1 1 24 27 7  o 9.614000  0.1800000     9.695000  0.2351000     9.533000  0.2726000     0.1627000      0.3599000 
1 1 1 24 27 8  o 5.964000  0.2262000     5.961000  0.2938000     5.968000  0.3439000     -0.6291000E-02 0.4523000 
1 1 1 24 27 9  o 5.071000  0.2880000     5.463000  0.4437000     4.680000  0.3674000     0.7832000      0.5761000 
1 1 1 24 27 10 o 4.178000  0.2960000     4.339000  0.4144000     4.018000  0.4229000     0.3214000      0.5921000 
1 1 1 24 27 11 f 6.025000  0.2270000     6.484000  0.3140000     5.567000  0.3278000     0.9176000      0.4539000 
1 1 1 24 27 12 o 1.316000  0.4310000     1.179000  0.5577000     1.453000  0.6573000     -0.2737000     0.8621000 
1 1 1 24 27 13 o 2.302000  0.4977000     2.499000  0.7608000     2.104000  0.6418000     0.3948000      0.9953000 
1 1 1 24 27 14 o 3.564000  0.3726000     3.717000  0.5205000     3.411000  0.5334000     0.3055000      0.7453000 
1 1 1 24 27 15 f 2.418000  0.4432000     3.005000  0.5557000     1.831000  0.6906000     1.174000       0.8865000 
1 1 1 24 27 16 o 1.323000  0.4222000     1.349000  0.5984000     1.297000  0.5958000     0.5162000E-01  0.8444000 
1 1 1 24 27 17 o 1.581000  0.4463000     1.882000  0.6765000     1.281000  0.5821000     0.6016000      0.8925000 
1 1 1 24 27 18 o 0.9932000 0.3491000     1.079000  0.5283000     0.9075000 0.4564000     0.1714000      0.6982000 
1 1 1 24 27 19 o 1.370000  0.4220000     0.9896000 0.4864000     1.750000  0.6899000     -0.7609000     0.8441000 
1 1 1 24 28 0  o 5.172000  0.2755000     5.172000  0.2755000     5.172000  0.2755000     -0.000000      0.000000  
1 1 1 24 28 1  o 9.571000  0.1521000     9.810000  0.2149000     9.332000  0.2152000     0.4775000      0.3041000 
1 1 1 24 28 2  o 5.403000  0.1922000     5.505000  0.2669000     5.300000  0.2766000     0.2053000      0.3844000 
1 1 1 24 28 3  o 3.693000  0.2630000     3.802000  0.3607000     3.583000  0.3829000     0.2190000      0.5261000 
1 1 1 24 28 4  f 4.496000  0.2308000     4.652000  0.3159000     4.340000  0.3366000     0.3117000      0.4616000 
1 1 1 24 28 5  o 2.775000  0.3597000     2.638000  0.5216000     2.912000  0.4954000     -0.2737000     0.7193000 
1 1 1 24 28 6  o 9.937000  0.1788000     10.23000  0.2335000     9.646000  0.2709000     0.5815000      0.3576000 
1 1 1 24 28 7  o 6.564000  0.2085000     6.621000  0.2684000     6.507000  0.3192000     0.1147000      0.4170000 
1 1 1 24 28 8  o 6.489000  0.2152000     6.763000  0.2707000     6.215000  0.3346000     0.5477000      0.4303000 
1 1 1 24 28 9  o 4.767000  0.2990000     4.720000  0.3856000     4.815000  0.4571000     -0.9469000E-01 0.5980000 
1 1 1 24 28 10 o 2.362000  0.4506000     2.759000  0.6054000     1.966000  0.6675000     0.7926000      0.9012000 
1 1 1 24 28 11 o 1.570000  0.4548000     1.749000  0.6586000     1.392000  0.6275000     0.3572000      0.9097000 
1 1 1 24 28 12 o 2.634000  0.5055000     2.753000  0.7681000     2.514000  0.6574000     0.2388000      1.011000  
1 1 1 24 28 13 o 2.650000  0.4752000     3.469000  0.7029000     1.831000  0.6396000     1.638000       0.9503000 
1 1 1 24 28 14 o 1.928000  0.4314000     1.371000  0.6389000     2.484000  0.5799000     -1.113000      0.8628000 
1 1 1 24 28 15 o 1.730000  0.4868000     1.624000  0.6536000     1.836000  0.7216000     -0.2121000     0.9736000 
1 1 1 24 28 16 o 3.151000  0.4712000     3.434000  0.5298000     2.868000  0.7793000     0.5659000      0.9423000 
1 1 1 24 28 17 f 1.290000  0.4104000     1.442000  0.6180000     1.137000  0.5403000     0.3049000      0.8209000 
1 1 1 24 28 18 o 2.166000  0.6262000     2.799000  1.072000      1.534000  0.6482000     1.265000       1.252000  
1 1 1 24 28 19 o 1.347000  0.4253000     1.246000  0.5718000     1.448000  0.6298000     -0.2014000     0.8506000 
1 1 1 24 29 0  o 0.8505000 0.5601000     0.8505000 0.5601000     0.8505000 0.5601000     0.000000       0.000000  
1 1 1 24 29 1  f 6.121000  0.1813000     6.357000  0.2488000     5.886000  0.2638000     0.4703000      0.3627000 
1 1 1 24 29 2  o 9.700000  0.1572000     9.725000  0.2210000     9.675000  0.2236000     0.5005000E-01  0.3144000 
1 1 1 24 29 3  o 7.957000  0.1651000     8.107000  0.2303000     7.807000  0.2366000     0.3005000      0.3302000 
1 1 1 24 29 4  o 12.15000  0.1599000     11.96000  0.2244000     12.35000  0.2278000     -0.3899000     0.3197000 
1 1 1 24 29 5  o 7.001000  0.1824000     7.004000  0.2577000     6.998000  0.2584000     0.5991000E-02  0.3649000 
1 1 1 24 29 6  f 9.964000  0.1769000     9.912000  0.2313000     10.02000  0.2676000     -0.1043000     0.3537000 
1 1 1 24 29 7  o 2.393000  0.4472000     2.551000  0.5766000     2.235000  0.6838000     0.3164000      0.8944000 
1 1 1 24 29 8  f 2.421000  0.5162000     2.521000  0.7557000     2.320000  0.7034000     0.2010000      1.032000  
1 1 1 24 29 9  o 4.822000  0.2966000     5.108000  0.3375000     4.536000  0.4878000     0.5726000      0.5932000 
1 1 1 24 29 10 o 2.693000  0.4401000     2.695000  0.6311000     2.691000  0.6136000     0.4166000E-02  0.8802000 
1 1 1 24 29 11 o 2.726000  0.4966000     2.635000  0.6727000     2.816000  0.7307000     -0.1812000     0.9932000 
1 1 1 24 29 12 o 1.273000  0.3977000     0.9733000 0.4764000     1.573000  0.6369000     -0.5998000     0.7954000 
1 1 1 24 29 13 f 1.042000  0.3536000     1.206000  0.5566000     0.8792000 0.4363000     0.3266000      0.7072000 
1 1 1 24 29 14 f 3.041000  0.4540000     3.041000  0.7599000     3.042000  0.4969000     -0.9110000E-03 0.9079000 
1 1 1 24 29 15 o 2.379000  0.5024000     2.957000  0.6122000     1.801000  0.7967000     1.156000       1.005000  
1 1 1 24 29 16 o 2.692000  0.4662000     2.892000  0.6329000     2.492000  0.6848000     0.3998000      0.9325000 
1 1 1 24 29 17 o 1.477000  0.4439000     1.538000  0.6316000     1.415000  0.6239000     0.1229000      0.8878000 
1 1 1 24 29 18 o 1.240000  0.4078000     1.031000  0.5154000     1.449000  0.6320000     -0.4185000     0.8155000 
1 1 1 24 29 19 o 1.830000  0.5766000     1.679000  0.7227000     1.980000  0.8986000     -0.3007000     1.153000  
1 1 1 24 30 0  o 0.6145000 0.4393000     0.6145000 0.4393000     0.6145000 0.4393000     0.000000       0.000000  
1 1 1 24 30 1  o 2.159000  0.4150000     2.000000  0.5974000     2.318000  0.5762000     -0.3178000     0.8300000 
1 1 1 24 30 2  o 1.562000  0.4041000     1.169000  0.5227000     1.955000  0.6164000     -0.7866000     0.8082000 
1 1 1 24 30 3  o 2.068000  0.4248000     1.928000  0.6105000     2.209000  0.5909000     -0.2811000     0.8496000 
1 1 1 24 30 4  o 1.470000  0.3991000     1.072000  0.5006000     1.868000  0.6217000     -0.7964000     0.7982000 
1 1 1 24 30 5  o 7.725000  0.1789000     7.535000  0.2557000     7.915000  0.2501000     -0.3802000     0.3577000 
1 1 1 24 30 6  o 7.111000  0.1981000     7.098000  0.2591000     7.124000  0.2997000     -0.2600000E-01 0.3962000 
1 1 1 24 30 7  o 7.247000  0.2062000     7.163000  0.2728000     7.331000  0.3093000     -0.1685000     0.4124000 
1 1 1 24 30 8  o 1.963000  0.4901000     2.248000  0.6896000     1.678000  0.6967000     0.5695000      0.9803000 
1 1 1 24 30 9  o 2.243000  0.4303000     2.897000  0.5485000     1.589000  0.6631000     1.307000       0.8605000 
1 1 1 24 30 10 o 5.178000  0.2745000     5.138000  0.3674000     5.218000  0.4080000     -0.7997000E-01 0.5491000 
1 1 1 24 30 11 o 3.467000  0.4294000     3.668000  0.6813000     3.266000  0.5227000     0.4015000      0.8587000 
1 1 1 24 30 12 o 1.940000  0.4650000     2.268000  0.6703000     1.612000  0.6447000     0.6567000      0.9300000 
1 1 1 24 30 13 o 1.912000  0.4640000     2.078000  0.6635000     1.746000  0.6489000     0.3321000      0.9281000 
1 1 1 24 30 14 o 1.774000  0.4838000     2.248000  0.7895000     1.300000  0.5595000     0.9487000      0.9677000 
1 1 1 24 30 15 o 2.105000  0.5103000     2.450000  0.7721000     1.760000  0.6674000     0.6903000      1.021000  
1 1 1 24 30 16 o 1.781000  0.4918000     1.924000  0.7272000     1.637000  0.6622000     0.2869000      0.9835000 
1 1 1 24 30 17 o 1.395000  0.4399000     1.146000  0.5413000     1.644000  0.6935000     -0.4986000     0.8797000 
1 1 1 24 30 18 o 1.936000  0.4878000     1.745000  0.6818000     2.128000  0.6979000     -0.3829000     0.9756000 
1 1 1 24 31 0  o 0.7375000 0.5151000     0.7375000 0.5151000     0.7375000 0.5151000     0.000000       0.000000  
1 1 1 24 31 1  o 5.304000  0.2057000     5.275000  0.2851000     5.333000  0.2965000     -0.5813000E-01 0.4113000 
1 1 1 24 31 2  o 5.808000  0.1981000     5.797000  0.2753000     5.819000  0.2849000     -0.2136000E-01 0.3962000 
1 1 1 24 31 3  o 4.417000  0.2458000     4.838000  0.3213000     3.996000  0.3721000     0.8413000      0.4917000 
1 1 1 24 31 4  o 2.757000  0.3697000     2.866000  0.5037000     2.648000  0.5413000     0.2182000      0.7394000 
1 1 1 24 31 5  o 11.66000  0.1658000     11.52000  0.2341000     11.80000  0.2348000     -0.2866000     0.3316000 
1 1 1 24 31 6  o 11.51000  0.1817000     11.63000  0.2350000     11.38000  0.2773000     0.2511000      0.3634000 
1 1 1 24 31 7  o 9.256000  0.2270000     9.377000  0.3496000     9.135000  0.2898000     0.2421000      0.4541000 
1 1 1 24 31 8  o 2.896000  0.4301000     3.111000  0.5097000     2.682000  0.6930000     0.4287000      0.8602000 
1 1 1 24 31 9  o 2.540000  0.4726000     1.977000  0.6382000     3.103000  0.6971000     -1.126000      0.9451000 
1 1 1 24 31 10 o 1.675000  0.4992000     1.660000  0.7098000     1.690000  0.7022000     -0.2983000E-01 0.9984000 
1 1 1 24 31 11 o 3.265000  0.3790000     3.447000  0.5107000     3.083000  0.5601000     0.3643000      0.7580000 
1 1 1 24 31 12 o 3.992000  0.3178000     4.157000  0.4359000     3.827000  0.4626000     0.3299000      0.6356000 
1 1 1 24 31 13 o 7.967000  0.2020000     7.886000  0.2925000     8.048000  0.2786000     -0.1621000     0.4039000 
1 1 1 24 31 14 o 1.702000  0.4938000     1.985000  0.7814000     1.418000  0.6039000     0.5673000      0.9876000 
1 1 1 24 31 15 o 1.296000  0.4207000     1.483000  0.6663000     1.109000  0.5138000     0.3733000      0.8414000 
1 1 1 24 31 16 o 1.215000  0.4127000     1.320000  0.6304000     1.109000  0.5329000     0.2109000      0.8254000 
1 1 1 24 31 17 f 1.972000  0.5194000     2.609000  0.8471000     1.335000  0.6014000     1.274000       1.039000  
1 1 1 24 31 18 o 1.064000  0.3639000     1.116000  0.5331000     1.012000  0.4955000     0.1047000      0.7278000 
1 1 1 24 32 0  o 8.475000  0.2336000     8.475000  0.2336000     8.475000  0.2336000     -0.000000      0.000000  
1 1 1 24 32 1  o 5.346000  0.2078000     5.480000  0.2819000     5.212000  0.3053000     0.2682000      0.4155000 
1 1 1 24 32 2  f 6.810000  0.1848000     6.659000  0.2633000     6.960000  0.2595000     -0.3005000     0.3697000 
1 1 1 24 32 3  o 5.980000  0.2002000     6.268000  0.2725000     5.693000  0.2934000     0.5746000      0.4004000 
1 1 1 24 32 4  o 4.349000  0.2476000     4.348000  0.3457000     4.350000  0.3546000     -0.1952000E-02 0.4952000 
1 1 1 24 32 5  o 2.631000  0.3884000     3.490000  0.4446000     1.771000  0.6370000     1.719000       0.7768000 
1 1 1 24 32 6  o 1.814000  0.4683000     1.569000  0.6652000     2.058000  0.6592000     -0.4887000     0.9365000 
1 1 1 24 32 7  o 2.999000  0.4214000     3.241000  0.4874000     2.757000  0.6875000     0.4848000      0.8427000 
1 1 1 24 32 8  o 5.449000  0.2469000     5.441000  0.3196000     5.458000  0.3765000     -0.1700000E-01 0.4939000 
1 1 1 24 32 9  o 4.737000  0.5611000     5.059000  0.3620000     4.416000  1.062000      0.6430000      1.122000  
1 1 1 24 32 10 o 3.346000  0.3916000     3.504000  0.5700000     3.189000  0.5372000     0.3155000      0.7832000 
1 1 1 24 32 11 f 3.394000  0.3446000     3.331000  0.4943000     3.457000  0.4802000     -0.1258000     0.6891000 
1 1 1 24 32 12 o 3.750000  0.3330000     3.593000  0.5042000     3.908000  0.4351000     -0.3146000     0.6660000 
1 1 1 24 32 13 o 3.070000  0.3877000     3.156000  0.5313000     2.984000  0.5647000     0.1716000      0.7753000 
1 1 1 24 32 14 o 1.502000  0.4400000     1.716000  0.6570000     1.288000  0.5855000     0.4283000      0.8800000 
1 1 1 24 32 15 o 1.568000  0.4628000     1.538000  0.6954000     1.599000  0.6108000     -0.6127000E-01 0.9255000 
1 1 1 24 32 16 o 1.399000  0.4492000     1.446000  0.6577000     1.352000  0.6120000     0.9492000E-01  0.8984000 
1 1 1 24 32 17 o 2.118000  0.5225000     1.786000  0.7758000     2.450000  0.7001000     -0.6645000     1.045000  
1 1 1 24 32 18 o 1.621000  0.4579000     1.955000  0.6979000     1.286000  0.5929000     0.6693000      0.9157000 
1 1 1 24 33 0  o 8.177000  0.2419000     8.177000  0.2419000     8.177000  0.2419000     0.000000       0.000000  
1 1 1 24 33 1  o 4.843000  0.2253000     4.693000  0.3295000     4.994000  0.3074000     -0.3005000     0.4507000 
1 1 1 24 33 2  o 1.793000  0.4338000     1.520000  0.6005000     2.066000  0.6262000     -0.5459000     0.8676000 
1 1 1 24 33 3  o 3.486000  0.3075000     3.345000  0.4390000     3.627000  0.4306000     -0.2822000     0.6149000 
1 1 1 24 33 4  o 3.128000  0.3413000     3.179000  0.4672000     3.077000  0.4976000     0.1029000      0.6826000 
1 1 1 24 33 5  o 2.563000  0.4071000     3.673000  0.5219000     1.453000  0.6248000     2.220000       0.8141000 
1 1 1 24 33 6  o 7.524000  0.2274000     7.646000  0.2977000     7.403000  0.3439000     0.2438000      0.4549000 
1 1 1 24 33 7  o 2.776000  0.4266000     3.267000  0.4862000     2.285000  0.7010000     0.9822000      0.8531000 
1 1 1 24 33 8  o 5.777000  0.2897000     5.836000  0.3305000     5.718000  0.4760000     0.1177000      0.5795000 
1 1 1 24 33 9  o 5.291000  0.2896000     4.991000  0.4248000     5.591000  0.3937000     -0.5999000     0.5792000 
1 1 1 24 33 10 o 1.534000  0.4501000     1.653000  0.6396000     1.415000  0.6334000     0.2384000      0.9002000 
1 1 1 24 33 11 o 2.019000  0.4610000     1.799000  0.6571000     2.240000  0.6469000     -0.4410000     0.9221000 
1 1 1 24 33 12 o 3.116000  0.4080000     2.714000  0.6521000     3.518000  0.4905000     -0.8042000     0.8159000 
1 1 1 24 33 13 o 1.796000  0.4655000     1.915000  0.6692000     1.678000  0.6471000     0.2369000      0.9309000 
1 1 1 24 33 14 o 2.090000  0.4850000     1.935000  0.6687000     2.245000  0.7027000     -0.3099000     0.9700000 
1 1 1 24 33 15 o 1.166000  0.3801000     1.313000  0.5838000     1.018000  0.4869000     0.2948000      0.7602000 
1 1 1 24 33 16 o 1.412000  0.4647000     1.353000  0.6568000     1.471000  0.6577000     -0.1186000     0.9295000 
1 1 1 24 33 17 o 1.510000  0.4595000     1.643000  0.6819000     1.377000  0.6163000     0.2659000      0.9191000 
1 1 1 24 34 0  o 1.965000  0.7489000     1.965000  0.7489000     1.965000  0.7489000     0.000000       0.000000  
1 1 1 24 34 1  o 5.410000  0.2138000     5.214000  0.3083000     5.607000  0.2961000     -0.3929000     0.4275000 
1 1 1 24 34 2  o 7.643000  0.1797000     7.930000  0.2468000     7.356000  0.2612000     0.5739000      0.3593000 
1 1 1 24 34 3  o 1.935000  0.4358000     1.570000  0.6163000     2.299000  0.6164000     -0.7292000     0.8717000 
1 1 1 24 34 4  o 7.342000  0.2069000     7.316000  0.3152000     7.368000  0.2680000     -0.5142000E-01 0.4138000 
1 1 1 24 34 5  o 9.605000  0.1995000     9.554000  0.2818000     9.657000  0.2824000     -0.1028000     0.3989000 
1 1 1 24 34 6  o 2.167000  0.4662000     2.184000  0.6356000     2.149000  0.6822000     0.3531000E-01  0.9324000 
1 1 1 24 34 7  o 2.703000  0.4894000     3.083000  0.5700000     2.322000  0.7958000     0.7612000      0.9789000 
1 1 1 24 34 8  o 2.405000  0.5124000     1.586000  0.6860000     3.225000  0.7612000     -1.639000      1.025000  
1 1 1 24 34 9  o 1.650000  0.4676000     1.496000  0.6173000     1.803000  0.7026000     -0.3074000     0.9352000 
1 1 1 24 34 10 o 1.812000  0.4607000     2.129000  0.6535000     1.496000  0.6495000     0.6324000      0.9214000 
1 1 1 24 34 11 o 1.632000  0.4546000     1.731000  0.6491000     1.532000  0.6366000     0.1988000      0.9092000 
1 1 1 24 34 12 o 2.871000  0.4078000     2.747000  0.5946000     2.995000  0.5581000     -0.2483000     0.8155000 
1 1 1 24 34 13 o 1.236000  0.4123000     1.213000  0.5829000     1.260000  0.5833000     -0.4692000E-01 0.8246000 
1 1 1 24 34 14 o 1.726000  0.4518000     1.528000  0.6246000     1.923000  0.6530000     -0.3956000     0.9037000 
1 1 1 24 34 15 o 1.529000  0.4235000     1.126000  0.5315000     1.931000  0.6594000     -0.8056000     0.8469000 
1 1 1 24 34 16 o 1.454000  0.6406000     ?         ?             1.454000  0.6406000     ?              ?         
1 1 1 24 34 17 o 1.992000  0.5020000     2.009000  0.7154000     1.975000  0.7044000     0.3376000E-01  1.004000  
1 1 1 24 35 0  o 8.153000  0.2493000     8.153000  0.2493000     8.153000  0.2493000     0.000000       0.000000  
1 1 1 24 35 1  o 6.900000  0.1908000     6.658000  0.2750000     7.141000  0.2645000     -0.4834000     0.3816000 
1 1 1 24 35 2  o 3.176000  0.3457000     2.896000  0.5175000     3.455000  0.4586000     -0.5591000     0.6914000 
1 1 1 24 35 3  o 9.119000  0.1926000     9.219000  0.2947000     9.019000  0.2481000     0.2006000      0.3852000 
1 1 1 24 35 4  o 1.531000  0.4488000     1.397000  0.6060000     1.665000  0.6621000     -0.2672000     0.8975000 
1 1 1 24 35 5  o 3.601000  0.3947000     3.717000  0.4308000     3.485000  0.6615000     0.2313000      0.7894000 
1 1 1 24 35 6  o 9.773000  0.2396000     9.914000  0.2802000     9.632000  0.3888000     0.2828000      0.4792000 
1 1 1 24 35 7  o 2.829000  0.5420000     2.438000  0.7815000     3.220000  0.7511000     -0.7813000     1.084000  
1 1 1 24 35 8  o 3.297000  0.3838000     3.217000  0.5138000     3.377000  0.5702000     -0.1604000     0.7676000 
1 1 1 24 35 9  o 4.284000  0.3108000     4.046000  0.4186000     4.521000  0.4596000     -0.4750000     0.6216000 
1 1 1 24 35 10 o 4.142000  0.3446000     4.796000  0.3596000     3.488000  0.5880000     1.308000       0.6892000 
1 1 1 24 35 11 o 2.137000  0.4410000     1.559000  0.6207000     2.714000  0.6267000     -1.155000      0.8820000 
1 1 1 24 35 12 o 1.443000  0.4329000     1.487000  0.6194000     1.400000  0.6049000     0.8684000E-01  0.8658000 
1 1 1 24 35 13 f 2.174000  0.5068000     2.131000  0.6696000     2.216000  0.7610000     -0.8501000E-01 1.014000  
1 1 1 24 35 14 o 2.344000  0.4477000     2.089000  0.6623000     2.600000  0.6027000     -0.5112000     0.8955000 
1 1 1 24 35 15 o 1.048000  0.3568000     1.054000  0.5047000     1.043000  0.5044000     0.1138000E-01  0.7136000 
1 1 1 24 35 16 o 1.936000  0.4694000     1.468000  0.7239000     2.403000  0.5976000     -0.9351000     0.9387000 
1 1 1 24 35 17 o 1.945000  0.5171000     1.978000  0.8064000     1.913000  0.6475000     0.6489000E-01  1.034000  
1 1 1 24 36 0  o 1.033000  0.6753000     1.033000  0.6753000     1.033000  0.6753000     -0.000000      0.000000  
1 1 1 24 36 1  o 1.316000  0.4187000     1.109000  0.5311000     1.524000  0.6476000     -0.4151000     0.8375000 
1 1 1 24 36 2  o 5.128000  0.3406000     5.097000  0.5016000     5.159000  0.4609000     -0.6147000E-01 0.6812000 
1 1 1 24 36 3  o 5.745000  0.3502000     5.623000  0.3539000     5.867000  0.6045000     -0.2443000     0.7005000 
1 1 1 24 36 4  o 2.917000  0.4607000     2.966000  0.5348000     2.869000  0.7504000     0.9657000E-01  0.9215000 
1 1 1 24 36 5  o 2.955000  0.4507000     3.235000  0.5552000     2.676000  0.7101000     0.5594000      0.9014000 
1 1 1 24 36 6  o 7.021000  0.2447000     6.786000  0.3499000     7.256000  0.3420000     -0.4697000     0.4893000 
1 1 1 24 36 7  o 1.660000  0.4390000     2.012000  0.6552000     1.307000  0.5844000     0.7052000      0.8780000 
1 1 1 24 36 8  o 1.206000  0.3969000     1.100000  0.5183000     1.313000  0.6013000     -0.2135000     0.7939000 
1 1 1 24 36 9  o 4.900000  0.2801000     4.680000  0.3799000     5.120000  0.4117000     -0.4394000     0.5602000 
1 1 1 24 36 10 o 4.076000  0.3324000     4.153000  0.4146000     4.000000  0.5198000     0.1525000      0.6649000 
1 1 1 24 36 11 o 1.616000  0.4487000     1.225000  0.5523000     2.006000  0.7074000     -0.7811000     0.8975000 
1 1 1 24 36 12 o 1.429000  0.4379000     1.251000  0.5895000     1.608000  0.6477000     -0.3572000     0.8758000 
1 1 1 24 36 13 o 1.846000  0.4547000     2.239000  0.6603000     1.454000  0.6252000     0.7857000      0.9094000 
1 1 1 24 36 14 o 2.310000  0.4670000     2.305000  0.6744000     2.315000  0.6461000     -0.1009000E-01 0.9340000 
1 1 1 24 36 15 o 1.473000  0.4598000     1.304000  0.5929000     1.641000  0.7030000     -0.3368000     0.9196000 
1 1 1 24 36 16 o 1.687000  0.4505000     1.344000  0.6010000     2.030000  0.6712000     -0.6862000     0.9010000 
1 1 1 24 37 0  o 0.7944000 0.5635000     0.7944000 0.5635000     0.7944000 0.5635000     0.000000       0.000000  
1 1 1 24 37 1  o 7.715000  0.3538000     7.715000  0.3538000     ?         ?             ?              ?         
1 1 1 24 37 2  o 2.001000  0.5197000     1.902000  0.6726000     2.099000  0.7924000     -0.1974000     1.039000  
1 1 1 24 37 3  o 7.787000  0.2184000     7.626000  0.3005000     7.948000  0.3170000     -0.3222000     0.4368000 
1 1 1 24 37 4  o 3.355000  0.4387000     3.200000  0.6963000     3.510000  0.5337000     -0.3093000     0.8773000 
1 1 1 24 37 5  o 5.029000  0.2698000     4.890000  0.4163000     5.167000  0.3435000     -0.2773000     0.5397000 
1 1 1 24 37 6  o 7.515000  0.2010000     7.381000  0.2854000     7.649000  0.2831000     -0.2679000     0.4020000 
1 1 1 24 37 7  o 2.577000  0.4306000     2.158000  0.6612000     2.997000  0.5517000     -0.8391000     0.8611000 
1 1 1 24 37 8  o 4.026000  0.3337000     4.236000  0.3930000     3.817000  0.5394000     0.4195000      0.6674000 
1 1 1 24 37 9  o 2.200000  0.4857000     2.301000  0.6559000     2.098000  0.7165000     0.2023000      0.9713000 
1 1 1 24 37 10 o 1.834000  0.4823000     1.576000  0.6355000     2.093000  0.7257000     -0.5165000     0.9646000 
1 1 1 24 37 11 o 2.069000  0.4350000     1.300000  0.5776000     2.839000  0.6506000     -1.539000      0.8700000 
1 1 1 24 37 12 o 2.134000  0.5122000     1.923000  0.6785000     2.345000  0.7674000     -0.4228000     1.024000  
1 1 1 24 37 13 o 1.450000  0.4315000     1.272000  0.5716000     1.627000  0.6464000     -0.3551000     0.8629000 
1 1 1 24 37 14 o 1.162000  0.3824000     1.264000  0.5667000     1.061000  0.5135000     0.2027000      0.7648000 
1 1 1 24 37 15 o 2.135000  0.5080000     2.229000  0.7584000     2.041000  0.6762000     0.1876000      1.016000  
1 1 1 24 37 16 o 2.677000  0.4499000     3.036000  0.6100000     2.318000  0.6616000     0.7178000      0.8999000 
1 1 1 24 38 0  o 1.394000  0.7938000     1.394000  0.7938000     1.394000  0.7938000     -0.000000      0.000000  
1 1 1 24 38 1  o 2.253000  0.4605000     1.925000  0.6905000     2.581000  0.6094000     -0.6561000     0.9209000 
1 1 1 24 38 2  o 4.016000  0.3222000     3.641000  0.5315000     4.391000  0.3645000     -0.7507000     0.6444000 
1 1 1 24 38 3  o 2.146000  0.4497000     1.652000  0.6685000     2.641000  0.6016000     -0.9881000     0.8993000 
1 1 1 24 38 4  o 2.490000  0.4118000     3.197000  0.5058000     1.783000  0.6500000     1.414000       0.8236000 
1 1 1 24 38 5  o 7.726000  0.1958000     7.957000  0.2709000     7.496000  0.2828000     0.4613000      0.3916000 
1 1 1 24 38 6  o 3.156000  0.3908000     3.879000  0.4361000     2.433000  0.6487000     1.446000       0.7817000 
1 1 1 24 38 7  o 2.705000  0.4434000     2.804000  0.6003000     2.607000  0.6528000     0.1967000      0.8869000 
1 1 1 24 38 8  o 1.727000  0.4640000     1.886000  0.6547000     1.568000  0.6578000     0.3180000      0.9281000 
1 1 1 24 38 9  o 5.841000  0.2486000     5.921000  0.3172000     5.761000  0.3829000     0.1604000      0.4972000 
1 1 1 24 38 10 o 1.596000  0.4448000     1.890000  0.6634000     1.302000  0.5926000     0.5884000      0.8895000 
1 1 1 24 38 11 o 1.149000  0.3834000     1.016000  0.5032000     1.282000  0.5787000     -0.2656000     0.7668000 
1 1 1 24 38 12 o 1.458000  0.4190000     1.005000  0.4861000     1.911000  0.6827000     -0.9061000     0.8380000 
1 1 1 24 38 13 o 2.403000  0.4481000     2.363000  0.6353000     2.444000  0.6320000     -0.8141000E-01 0.8961000 
1 1 1 24 38 14 o 1.807000  0.4409000     2.423000  0.6689000     1.190000  0.5746000     1.233000       0.8818000 
1 1 1 24 38 15 o 1.574000  0.4420000     1.492000  0.6111000     1.655000  0.6387000     -0.1622000     0.8839000 
1 1 1 24 38 16 o 1.466000  0.4765000     1.228000  0.5817000     1.704000  0.7548000     -0.4760000     0.9529000 
1 1 1 24 39 0  o 1.355000  0.7582000     1.355000  0.7582000     1.355000  0.7582000     -0.000000      0.000000  
1 1 1 24 39 1  o 1.387000  0.3907000     1.892000  0.6474000     0.8831000 0.4375000     1.009000       0.7814000 
1 1 1 24 39 2  o 5.619000  0.2299000     5.972000  0.3068000     5.265000  0.3426000     0.7062000      0.4599000 
1 1 1 24 39 3  o 3.518000  0.3324000     3.395000  0.4762000     3.641000  0.4638000     -0.2458000     0.6648000 
1 1 1 24 39 4  o 3.489000  0.3439000     3.784000  0.4375000     3.193000  0.5307000     0.5908000      0.6878000 
1 1 1 24 39 5  o 6.946000  0.2091000     6.958000  0.2932000     6.933000  0.2981000     0.2579000E-01  0.4181000 
1 1 1 24 39 6  o 2.109000  0.4670000     2.253000  0.6586000     1.965000  0.6623000     0.2879000      0.9341000 
1 1 1 24 39 7  o 2.228000  0.4572000     1.909000  0.6725000     2.547000  0.6197000     -0.6380000     0.9145000 
1 1 1 24 39 8  o 3.002000  0.4207000     3.307000  0.5081000     2.696000  0.6708000     0.6113000      0.8415000 
1 1 1 24 39 9  o 1.088000  0.3690000     0.9437000 0.4628000     1.231000  0.5747000     -0.2876000     0.7379000 
1 1 1 24 39 10 o 2.030000  0.4634000     2.384000  0.6388000     1.677000  0.6714000     0.7075000      0.9268000 
1 1 1 24 39 11 o 1.407000  0.4348000     1.595000  0.6516000     1.218000  0.5758000     0.3769000      0.8695000 
1 1 1 24 39 12 o 1.809000  0.4695000     1.992000  0.6629000     1.625000  0.6651000     0.3673000      0.9390000 
1 1 1 24 39 13 o 3.570000  0.3669000     3.112000  0.5322000     4.028000  0.5050000     -0.9156000     0.7337000 
1 1 1 24 39 14 o 1.470000  0.4413000     1.645000  0.6665000     1.295000  0.5787000     0.3492000      0.8826000 
1 1 1 24 39 15 o 2.006000  0.4773000     1.945000  0.6735000     2.067000  0.6766000     -0.1226000     0.9547000 
1 1 1 24 40 0  o 1.818000  0.7908000     1.818000  0.7908000     1.818000  0.7908000     0.000000       0.000000  
1 1 1 24 40 1  o 4.124000  0.2931000     4.471000  0.3802000     3.777000  0.4462000     0.6939000      0.5862000 
1 1 1 24 40 2  o 3.655000  0.3365000     3.223000  0.5225000     4.087000  0.4243000     -0.8648000     0.6730000 
1 1 1 24 40 3  o 3.454000  0.3453000     3.440000  0.4860000     3.467000  0.4906000     -0.2758000E-01 0.6906000 
1 1 1 24 40 4  o 4.541000  0.2782000     4.844000  0.3676000     4.238000  0.4177000     0.6058000      0.5564000 
1 1 1 24 40 5  o 1.642000  0.4473000     1.848000  0.6560000     1.436000  0.6082000     0.4126000      0.8946000 
1 1 1 24 40 6  o 2.075000  0.4586000     2.316000  0.6459000     1.833000  0.6511000     0.4828000      0.9172000 
1 1 1 24 40 7  f 5.172000  0.2670000     5.480000  0.3814000     4.864000  0.3739000     0.6160000      0.5341000 
1 1 1 24 40 8  o 1.730000  0.4613000     1.769000  0.6452000     1.692000  0.6596000     0.7661000E-01  0.9227000 
1 1 1 24 40 9  o 1.518000  0.4519000     1.366000  0.5931000     1.669000  0.6818000     -0.3037000     0.9037000 
1 1 1 24 40 10 o 1.974000  0.5355000     2.081000  0.8066000     1.867000  0.7047000     0.2136000      1.071000  
1 1 1 24 40 11 o 1.982000  0.5064000     1.984000  0.6735000     1.981000  0.7564000     0.2445000E-02  1.013000  
1 1 1 24 40 12 o 2.722000  0.4622000     2.621000  0.6014000     2.824000  0.7020000     -0.2035000     0.9243000 
1 1 1 24 40 13 o 1.533000  0.4695000     1.366000  0.6069000     1.700000  0.7166000     -0.3338000     0.9391000 
1 1 1 24 40 14 o 1.208000  0.3920000     1.292000  0.5804000     1.125000  0.5269000     0.1673000      0.7839000 
1 1 1 24 40 15 o 1.135000  0.3761000     0.9927000 0.4841000     1.277000  0.5757000     -0.2839000     0.7522000 
1 1 1 24 41 0  o 1.072000  0.6756000     1.072000  0.6756000     1.072000  0.6756000     0.000000       0.000000  
1 1 1 24 41 1  o 2.931000  0.4040000     2.853000  0.5822000     3.010000  0.5602000     -0.1562000     0.8080000 
1 1 1 24 41 2  o 2.537000  0.4365000     2.102000  0.6629000     2.973000  0.5681000     -0.8716000     0.8730000 
1 1 1 24 41 3  o 4.903000  0.2576000     4.913000  0.3602000     4.893000  0.3683000     0.2003000E-01  0.5152000 
1 1 1 24 41 4  o 1.632000  0.4445000     1.920000  0.6632000     1.344000  0.5920000     0.5766000      0.8890000 
1 1 1 24 41 5  o 1.547000  0.4386000     1.391000  0.5936000     1.703000  0.6459000     -0.3119000     0.8772000 
1 1 1 24 41 6  o 2.185000  0.4686000     2.107000  0.6741000     2.263000  0.6513000     -0.1561000     0.9373000 
1 1 1 24 41 7  o 1.598000  0.4484000     1.671000  0.6453000     1.526000  0.6227000     0.1449000      0.8967000 
1 1 1 24 41 8  o 3.313000  0.3653000     3.705000  0.4388000     2.920000  0.5842000     0.7854000      0.7307000 
1 1 1 24 41 9  o 1.273000  0.4163000     1.445000  0.6440000     1.100000  0.5278000     0.3450000      0.8327000 
1 1 1 24 41 10 o 1.336000  0.4234000     1.500000  0.6307000     1.172000  0.5651000     0.3283000      0.8469000 
1 1 1 24 41 11 o 2.873000  0.4246000     3.872000  0.4528000     1.874000  0.7184000     1.998000       0.8492000 
1 1 1 24 41 12 o 2.064000  0.6079000     1.775000  0.6787000     2.354000  1.009000      -0.5796000     1.216000  
1 1 1 24 41 13 o 2.703000  0.4805000     2.921000  0.6549000     2.484000  0.7034000     0.4376000      0.9611000 
1 1 1 24 41 14 o 1.759000  0.4666000     1.887000  0.6683000     1.631000  0.6513000     0.2554000      0.9332000 
1 1 1 24 42 0  f 2.462000  0.7375000     2.462000  0.7375000     2.462000  0.7375000     0.000000       0.000000  
1 1 1 24 42 1  o 1.337000  0.4109000     1.183000  0.5441000     1.490000  0.6158000     -0.3069000     0.8217000 
1 1 1 24 42 2  o 1.891000  0.4521000     2.263000  0.6517000     1.519000  0.6268000     0.7439000      0.9042000 
1 1 1 24 42 3  o 4.211000  0.2928000     4.332000  0.4065000     4.090000  0.4214000     0.2418000      0.5856000 
1 1 1 24 42 4  o 6.383000  0.2228000     6.353000  0.3168000     6.413000  0.3132000     -0.6030000E-01 0.4455000 
1 1 1 24 42 5  o 3.442000  0.3445000     3.711000  0.4372000     3.172000  0.5325000     0.5391000      0.6890000 
1 1 1 24 42 6  o 5.638000  0.2347000     5.804000  0.3232000     5.472000  0.3404000     0.3318000      0.4694000 
1 1 1 24 42 7  o 1.521000  0.4302000     1.820000  0.6547000     1.222000  0.5582000     0.5983000      0.8603000 
1 1 1 24 42 8  o 1.381000  0.4070000     1.756000  0.6502000     1.006000  0.4896000     0.7498000      0.8139000 
1 1 1 24 42 9  o 1.479000  0.4262000     0.9785000 0.4822000     1.980000  0.7029000     -1.001000      0.8524000 
1 1 1 24 42 10 o 1.577000  0.4511000     1.775000  0.6562000     1.379000  0.6192000     0.3966000      0.9022000 
1 1 1 24 42 11 o 1.661000  0.4871000     1.510000  0.6192000     1.813000  0.7520000     -0.3027000     0.9742000 
1 1 1 24 42 12 o 1.480000  0.4659000     1.578000  0.6568000     1.382000  0.6611000     0.1960000      0.9319000 
1 1 1 24 42 13 o 1.472000  0.4347000     1.093000  0.5167000     1.852000  0.6993000     -0.7594000     0.8695000 
1 1 1 24 42 14 o 1.562000  0.4525000     1.491000  0.6256000     1.633000  0.6539000     -0.1422000     0.9049000 
1 1 1 24 43 0  o 1.083000  0.6780000     1.083000  0.6780000     1.083000  0.6780000     0.000000       0.000000  
1 1 1 24 43 1  o 2.426000  0.4484000     2.271000  0.6505000     2.580000  0.6172000     -0.3090000     0.8967000 
1 1 1 24 43 2  o 2.113000  0.4610000     1.923000  0.6533000     2.304000  0.6507000     -0.3806000     0.9221000 
1 1 1 24 43 3  o 1.418000  0.4184000     1.159000  0.5380000     1.676000  0.6410000     -0.5179000     0.8369000 
1 1 1 24 43 4  o 4.828000  0.2705000     5.219000  0.3591000     4.436000  0.4045000     0.7831000      0.5409000 
1 1 1 24 43 5  o 5.301000  0.2469000     5.462000  0.3385000     5.140000  0.3595000     0.3211000      0.4938000 
1 1 1 24 43 6  o 2.627000  0.4282000     2.238000  0.6464000     3.017000  0.5617000     -0.7793000     0.8563000 
1 1 1 24 43 7  o 4.933000  0.2701000     4.976000  0.3704000     4.890000  0.3931000     0.8668000E-01  0.5401000 
1 1 1 24 43 8  o 3.409000  0.4790000     3.514000  0.7342000     3.303000  0.6153000     0.2110000      0.9579000 
1 1 1 24 43 9  o 2.117000  0.4953000     1.984000  0.6736000     2.251000  0.7264000     -0.2670000     0.9906000 
1 1 1 24 43 10 o 1.508000  0.4540000     1.263000  0.5696000     1.753000  0.7072000     -0.4894000     0.9080000 
1 1 1 24 43 11 o 1.438000  0.4671000     1.293000  0.5892000     1.583000  0.7249000     -0.2899000     0.9342000 
1 1 1 24 43 12 o 2.737000  0.4683000     2.237000  0.6716000     3.238000  0.6529000     -1.001000      0.9367000 
1 1 1 24 43 13 o 2.780000  0.4587000     3.099000  0.5793000     2.460000  0.7114000     0.6393000      0.9174000 
1 1 1 24 44 0  o 8.244000  0.2798000     8.244000  0.2798000     8.244000  0.2798000     -0.000000      0.000000  
1 1 1 24 44 1  o 3.944000  0.3088000     4.052000  0.4249000     3.837000  0.4484000     0.2143000      0.6177000 
1 1 1 24 44 2  o 5.269000  0.2486000     5.270000  0.3478000     5.268000  0.3552000     0.2780000E-02  0.4971000 
1 1 1 24 44 3  o 5.348000  0.2476000     5.596000  0.3377000     5.101000  0.3623000     0.4951000      0.4953000 
1 1 1 24 44 4  o 4.506000  0.2871000     4.049000  0.4380000     4.964000  0.3711000     -0.9150000     0.5741000 
1 1 1 24 44 5  o 2.372000  0.4464000     1.865000  0.6650000     2.879000  0.5957000     -1.015000      0.8928000 
1 1 1 24 44 6  o 1.389000  0.4236000     1.508000  0.6219000     1.271000  0.5753000     0.2376000      0.8471000 
1 1 1 24 44 7  o 1.861000  0.5217000     1.820000  0.7704000     1.902000  0.7037000     -0.8226000E-01 1.043000  
1 1 1 24 44 8  o 5.231000  0.2793000     5.175000  0.3609000     5.287000  0.4264000     -0.1126000     0.5587000 
1 1 1 24 44 9  o 2.525000  0.4671000     2.911000  0.5854000     2.139000  0.7279000     0.7727000      0.9341000 
1 1 1 24 44 10 o 2.995000  0.5296000     3.061000  0.6143000     2.930000  0.8628000     0.1311000      1.059000  
1 1 1 24 44 11 o 2.532000  0.4994000     2.942000  0.6662000     2.122000  0.7442000     0.8199000      0.9988000 
1 1 1 24 44 12 o 2.697000  0.4461000     3.223000  0.5254000     2.171000  0.7210000     1.052000       0.8921000 
1 1 1 24 44 13 o 2.013000  0.4815000     2.392000  0.6558000     1.633000  0.7051000     0.7588000      0.9629000 
1 1 1 24 45 0  o 1.152000  0.7069000     1.152000  0.7069000     1.152000  0.7069000     -0.000000      0.000000  
1 1 1 24 45 1  o 3.602000  0.3465000     3.591000  0.4817000     3.613000  0.4981000     -0.2203000E-01 0.6930000 
1 1 1 24 45 2  o 4.755000  0.2694000     4.931000  0.3689000     4.578000  0.3927000     0.3521000      0.5388000 
1 1 1 24 45 3  o 1.613000  0.4231000     1.086000  0.5143000     2.141000  0.6719000     -1.054000      0.8461000 
1 1 1 24 45 4  o 2.792000  0.4365000     2.700000  0.6197000     2.883000  0.6150000     -0.1826000     0.8731000 
1 1 1 24 45 5  o 3.887000  0.3214000     3.798000  0.4591000     3.977000  0.4499000     -0.1792000     0.6428000 
1 1 1 24 45 6  o 2.131000  0.5215000     2.813000  0.8256000     1.450000  0.6374000     1.363000       1.043000  
1 1 1 24 45 7  o 1.863000  0.5022000     2.110000  0.7160000     1.617000  0.7044000     0.4923000      1.004000  
1 1 1 24 45 8  o 0.9264000 0.3258000     0.9398000 0.4636000     0.9129000 0.4580000     0.2692000E-01  0.6517000 
1 1 1 24 45 9  o 4.311000  0.3611000     4.609000  0.4335000     4.014000  0.5776000     0.5945000      0.7222000 
1 1 1 24 45 10 o 2.761000  0.4437000     2.041000  0.7264000     3.482000  0.5096000     -1.441000      0.8873000 
1 1 1 24 45 11 o 2.317000  0.4848000     2.572000  0.6473000     2.063000  0.7218000     0.5081000      0.9695000 
1 1 1 24 45 12 o 1.183000  0.3936000     0.9841000 0.4808000     1.382000  0.6232000     -0.3982000     0.7871000 
1 1 1 24 46 0  o 3.107000  0.6048000     3.107000  0.6048000     3.107000  0.6048000     -0.000000      0.000000  
1 1 1 24 46 1  o 1.503000  0.4296000     1.857000  0.6661000     1.149000  0.5427000     0.7076000      0.8592000 
1 1 1 24 46 2  o 4.677000  0.2891000     5.222000  0.3647000     4.133000  0.4486000     1.089000       0.5781000 
1 1 1 24 46 3  o 1.624000  0.4492000     1.877000  0.6646000     1.371000  0.6044000     0.5054000      0.8984000 
1 1 1 24 46 4  o 2.349000  0.5056000     2.624000  0.7427000     2.074000  0.6861000     0.5500000      1.011000  
1 1 1 24 46 5  o 4.618000  0.3820000     4.653000  0.6089000     4.582000  0.4614000     0.7095000E-01  0.7640000 
1 1 1 24 46 6  o 1.776000  0.5075000     1.610000  0.6743000     1.943000  0.7587000     -0.3338000     1.015000  
1 1 1 24 46 7  o 2.570000  0.4835000     2.221000  0.6820000     2.920000  0.6855000     -0.6994000     0.9670000 
1 1 1 24 46 8  f 5.645000  0.2992000     5.535000  0.4026000     5.755000  0.4426000     -0.2204000     0.5983000 
1 1 1 24 46 9  o 1.993000  0.4955000     1.914000  0.7149000     2.072000  0.6863000     -0.1577000     0.9910000 
1 1 1 24 46 10 o 2.585000  0.4511000     2.292000  0.6717000     2.877000  0.6023000     -0.5849000     0.9022000 
1 1 1 24 46 11 o 0.9714000 0.3403000     0.8809000 0.4384000     1.062000  0.5207000     -0.1810000     0.6807000 
1 1 1 24 47 0  o 1.850000  0.8280000     1.850000  0.8280000     1.850000  0.8280000     -0.000000      0.000000  
1 1 1 24 47 1  o 6.063000  0.2401000     5.697000  0.3525000     6.428000  0.3261000     -0.7307000     0.4802000 
1 1 1 24 47 2  o 1.849000  0.4760000     2.395000  0.7509000     1.304000  0.5852000     1.091000       0.9520000 
1 1 1 24 47 3  o 1.407000  0.4418000     1.500000  0.6580000     1.314000  0.5898000     0.1859000      0.8837000 
1 1 1 24 47 4  o 3.765000  0.4059000     3.257000  0.6421000     4.273000  0.4965000     -1.017000      0.8117000 
1 1 1 24 47 5  o 1.383000  0.4475000     1.179000  0.5491000     1.587000  0.7068000     -0.4077000     0.8951000 
1 1 1 24 47 6  o 1.927000  0.4981000     2.264000  0.7219000     1.590000  0.6865000     0.6746000      0.9962000 
1 1 1 24 47 7  o 1.436000  0.4492000     1.621000  0.6743000     1.251000  0.5937000     0.3703000      0.8984000 
1 1 1 24 47 8  f 1.416000  0.4410000     1.472000  0.6497000     1.359000  0.5967000     0.1137000      0.8821000 
1 1 1 24 47 9  o 2.585000  0.4637000     2.420000  0.6652000     2.749000  0.6463000     -0.3283000     0.9275000 
1 1 1 24 47 10 o 1.446000  0.4362000     1.368000  0.5986000     1.524000  0.6346000     -0.1563000     0.8724000 
1 1 1 24 47 11 o 1.089000  0.3658000     1.235000  0.5627000     0.9436000 0.4677000     0.2913000      0.7317000 
1 1 1 24 48 0  o 1.185000  0.7555000     1.185000  0.7555000     1.185000  0.7555000     -0.000000      0.000000  
1 1 1 24 48 1  o 1.473000  0.4693000     1.507000  0.6666000     1.438000  0.6607000     0.6842000E-01  0.9385000 
1 1 1 24 48 2  o 1.569000  0.4806000     1.707000  0.6947000     1.431000  0.6642000     0.2758000      0.9611000 
1 1 1 24 48 3  o 1.491000  0.4724000     1.660000  0.6851000     1.322000  0.6506000     0.3389000      0.9448000 
1 1 1 24 48 4  f 1.454000  0.4866000     1.273000  0.5906000     1.634000  0.7734000     -0.3612000     0.9731000 
1 1 1 24 48 5  o 1.230000  0.4077000     0.9475000 0.4721000     1.513000  0.6647000     -0.5656000     0.8153000 
1 1 1 24 48 6  o 1.615000  0.4806000     1.460000  0.6431000     1.769000  0.7144000     -0.3090000     0.9612000 
1 1 1 24 48 7  o 1.583000  0.4654000     1.884000  0.7276000     1.281000  0.5805000     0.6024000      0.9308000 
1 1 1 24 48 8  o 5.388000  0.2653000     5.411000  0.3690000     5.366000  0.3811000     0.4476000E-01  0.5305000 
1 1 1 24 48 9  o 1.322000  0.4161000     1.436000  0.6176000     1.207000  0.5578000     0.2284000      0.8322000 
1 1 1 24 48 10 o 1.247000  0.3981000     1.016000  0.4941000     1.479000  0.6242000     -0.4629000     0.7961000 
1 1 1 24 49 0  o 1.236000  0.8325000     1.236000  0.8325000     1.236000  0.8325000     0.000000       0.000000  
1 1 1 24 49 1  o 5.787000  0.4585000     5.396000  0.7622000     6.179000  0.5100000     -0.7835000     0.9171000 
1 1 1 24 49 2  o 4.201000  0.4541000     4.476000  0.5870000     3.925000  0.6930000     0.5516000      0.9082000 
1 1 1 24 49 3  o 1.714000  0.5056000     1.912000  0.7579000     1.516000  0.6693000     0.3963000      1.011000  
1 1 1 24 49 4  o 2.347000  0.5082000     2.537000  0.7336000     2.157000  0.7036000     0.3800000      1.016000  
1 1 1 24 49 5  o 5.143000  0.2989000     4.703000  0.4738000     5.584000  0.3645000     -0.8815000     0.5978000 
1 1 1 24 49 6  o 1.022000  0.3486000     0.7877000 0.3983000     1.256000  0.5722000     -0.4684000     0.6972000 
1 1 1 24 49 7  o 3.932000  0.3425000     3.599000  0.5208000     4.266000  0.4449000     -0.6675000     0.6850000 
1 1 1 24 49 8  o 1.758000  0.4722000     1.976000  0.6863000     1.539000  0.6489000     0.4367000      0.9445000 
1 1 1 24 49 9  o 1.973000  0.4819000     1.719000  0.6638000     2.227000  0.6988000     -0.5086000     0.9638000 
1 1 1 24 50 0  o 0.8693000 0.5940000     0.8693000 0.5940000     0.8693000 0.5940000     0.000000       0.000000  
1 1 1 24 50 1  o 4.857000  0.2922000     4.629000  0.4251000     5.086000  0.4010000     -0.4574000     0.5844000 
1 1 1 24 50 2  o 3.195000  0.4097000     3.016000  0.6094000     3.374000  0.5477000     -0.3582000     0.8194000 
1 1 1 24 50 3  o 1.366000  0.4243000     1.522000  0.6353000     1.209000  0.5626000     0.3129000      0.8486000 
1 1 1 24 50 4  o 1.603000  0.4502000     1.897000  0.6756000     1.310000  0.5952000     0.5865000      0.9003000 
1 1 1 24 50 5  o 1.313000  0.4060000     1.639000  0.6515000     0.9867000 0.4848000     0.6523000      0.8121000 
1 1 1 24 50 6  o 2.538000  0.4659000     2.375000  0.6708000     2.701000  0.6467000     -0.3260000     0.9318000 
1 1 1 24 50 7  o 1.580000  0.4449000     1.215000  0.5640000     1.945000  0.6883000     -0.7294000     0.8899000 
1 1 1 24 50 8  o 1.390000  0.4261000     1.684000  0.6681000     1.097000  0.5289000     0.5876000      0.8521000 
1 1 1 24 51 0  o 0.9834000 0.6550000     0.9834000 0.6550000     0.9834000 0.6550000     0.000000       0.000000  
1 1 1 24 51 1  o 3.914000  0.3437000     4.106000  0.4552000     3.722000  0.5150000     0.3840000      0.6873000 
1 1 1 24 51 2  o 2.479000  0.4034000     3.555000  0.5180000     1.403000  0.6186000     2.152000       0.8068000 
1 1 1 24 51 3  o 2.686000  0.4648000     2.734000  0.6400000     2.639000  0.6742000     0.9451000E-01  0.9296000 
1 1 1 24 51 4  o 3.359000  0.3931000     3.658000  0.4981000     3.060000  0.6083000     0.5987000      0.7862000 
1 1 1 24 51 5  f 3.643000  0.3731000     4.068000  0.4671000     3.217000  0.5818000     0.8515000      0.7461000 
1 1 1 24 51 6  o 2.313000  0.4617000     2.812000  0.6158000     1.814000  0.6881000     0.9976000      0.9234000 
1 1 1 24 51 7  o 2.552000  0.4793000     2.784000  0.6533000     2.321000  0.7014000     0.4629000      0.9586000 
1 1 1 24 52 0  o 7.545000  0.3180000     7.545000  0.3180000     7.545000  0.3180000     0.000000       0.000000  
1 1 1 24 52 1  o 2.002000  0.4747000     2.471000  0.6893000     1.533000  0.6529000     0.9383000      0.9494000 
1 1 1 24 52 2  f 2.016000  0.4935000     2.167000  0.6996000     1.866000  0.6962000     0.3007000      0.9870000 
1 1 1 24 52 3  o 2.108000  0.4847000     2.052000  0.6790000     2.165000  0.6920000     -0.1127000     0.9695000 
1 1 1 24 52 4  o 1.761000  0.4809000     1.655000  0.6601000     1.867000  0.6996000     -0.2126000     0.9618000 
1 1 1 24 52 5  o 1.226000  0.4028000     1.278000  0.5861000     1.174000  0.5527000     0.1046000      0.8056000 
1 1 1 24 52 6  o 1.694000  0.4757000     1.658000  0.6666000     1.731000  0.6789000     -0.7283000E-01 0.9514000 
1 1 1 24 53 0  o 1.657000  0.8332000     1.657000  0.8332000     1.657000  0.8332000     -0.000000      0.000000  
1 1 1 24 53 1  o 1.766000  0.4599000     1.331000  0.5971000     2.201000  0.6997000     -0.8693000     0.9198000 
1 1 1 24 53 2  o 2.853000  0.4555000     2.562000  0.6796000     3.144000  0.6066000     -0.5818000     0.9110000 
1 1 1 24 53 3  o 1.300000  0.4159000     1.369000  0.6058000     1.232000  0.5701000     0.1370000      0.8318000 
1 1 1 24 53 4  o 2.252000  0.4998000     2.287000  0.6976000     2.217000  0.7161000     0.6995000E-01  0.9997000 
1 1 1 24 54 0  o 2.229000  0.8612000     2.229000  0.8612000     2.229000  0.8612000     0.000000       0.000000  
1 1 1 24 54 1  o 1.387000  0.4248000     1.675000  0.6645000     1.098000  0.5293000     0.5768000      0.8496000 
1 1 1 24 54 2  o 1.179000  0.4136000     0.9759000 0.4943000     1.383000  0.6634000     -0.4066000     0.8273000 
1 1 1 25 0  2  o 12.22000  0.2223000     12.22000  0.2223000     12.22000  0.2223000     -0.000000      0.000000  
1 1 1 25 0  3  o 5.018000  0.2274000     5.018000  0.2274000     5.018000  0.2274000     -0.000000      0.000000  
1 1 1 25 0  4  o 7.889000  0.2004000     7.889000  0.2004000     7.889000  0.2004000     0.000000       0.000000  
1 1 1 25 0  5  o 18.65000  0.2300000     18.65000  0.2300000     18.65000  0.2300000     0.000000       0.000000  
1 1 1 25 0  6  o 18.64000  0.2394000     18.64000  0.2394000     18.64000  0.2394000     0.000000       0.000000  
1 1 1 25 0  7  o 7.897000  0.4230000     7.897000  0.4230000     7.897000  0.4230000     -0.000000      0.000000  
1 1 1 25 0  8  f 0.9094000 0.6145000     0.9094000 0.6145000     0.9094000 0.6145000     -0.000000      0.000000  
1 1 1 25 0  9  o 4.787000  0.4948000     4.787000  0.4948000     4.787000  0.4948000     0.000000       0.000000  
1 1 1 25 0  10 o 14.59000  0.2675000     14.59000  0.2675000     14.59000  0.2675000     0.000000       0.000000  
1 1 1 25 0  11 o 6.461000  0.4013000     6.461000  0.4013000     6.461000  0.4013000     0.000000       0.000000  
1 1 1 25 0  12 o 5.323000  0.7988000     5.323000  0.7988000     5.323000  0.7988000     0.000000       0.000000  
1 1 1 25 0  13 o 4.653000  0.5966000     4.653000  0.5966000     4.653000  0.5966000     0.000000       0.000000  
1 1 1 25 0  14 o 1.159000  0.7839000     1.159000  0.7839000     1.159000  0.7839000     0.000000       0.000000  
1 1 1 25 0  15 o 2.827000  0.8567000     2.827000  0.8567000     2.827000  0.8567000     0.000000       0.000000  
1 1 1 25 0  16 o 5.298000  0.4156000     5.298000  0.4156000     5.298000  0.4156000     0.000000       0.000000  
1 1 1 25 0  17 o 2.404000  0.9971000     2.404000  0.9971000     2.404000  0.9971000     0.000000       0.000000  
1 1 1 25 0  18 o 1.200000  0.7624000     1.200000  0.7624000     1.200000  0.7624000     0.000000       0.000000  
1 1 1 25 0  19 o 2.978000  1.167000      2.978000  1.167000      2.978000  1.167000      0.000000       0.000000  
1 1 1 25 0  20 o 1.065000  0.7007000     1.065000  0.7007000     1.065000  0.7007000     0.000000       0.000000  
1 1 1 25 0  21 o 1.412000  0.8267000     1.412000  0.8267000     1.412000  0.8267000     0.000000       0.000000  
1 1 1 25 0  22 o 0.8118000 0.5983000     0.8118000 0.5983000     0.8118000 0.5983000     0.000000       0.000000  
1 1 1 25 1  2  o 21.96000  0.2493000     22.15000  0.3544000     21.77000  0.3508000     0.3754000      0.4986000 
1 1 1 25 1  3  o 12.10000  0.2068000     12.03000  0.3626000     12.18000  0.1989000     -0.1433000     0.4136000 
1 1 1 25 1  4  o 16.92000  0.1690000     16.89000  0.2719000     16.95000  0.2008000     -0.6151000E-01 0.3380000 
1 1 1 25 1  5  o 13.55000  0.1322000     13.70000  0.1877000     13.40000  0.1862000     0.3011000      0.2644000 
1 1 1 25 1  6  o 8.635000  0.1496000     8.745000  0.1645000     8.526000  0.2499000     0.2190000      0.2992000 
1 1 1 25 1  7  o 13.94000  0.2447000     13.44000  0.3390000     14.44000  0.3529000     -0.9943000     0.4893000 
1 1 1 25 1  8  o 1.492000  0.4458000     1.543000  0.6432000     1.440000  0.6174000     0.1026000      0.8916000 
1 1 1 25 1  9  o 6.750000  0.2615000     6.514000  0.3840000     6.986000  0.3551000     -0.4711000     0.5230000 
1 1 1 25 1  10 o 4.991000  0.3358000     5.178000  0.4676000     4.803000  0.4820000     0.3742000      0.6715000 
1 1 1 25 1  11 o 5.975000  0.3051000     6.522000  0.4088000     5.428000  0.4529000     1.095000       0.6101000 
1 1 1 25 1  12 o 5.630000  0.4560000     5.978000  0.6881000     5.283000  0.5985000     0.6955000      0.9120000 
1 1 1 25 1  13 o 2.147000  0.5771000     2.062000  0.8190000     2.233000  0.8133000     -0.1719000     1.154000  
1 1 1 25 1  14 o 4.744000  0.4261000     4.742000  0.6170000     4.747000  0.5878000     -0.4875000E-02 0.8522000 
1 1 1 25 1  15 o 4.107000  0.3902000     4.260000  0.5393000     3.954000  0.5641000     0.3062000      0.7804000 
1 1 1 25 1  16 o 2.477000  0.5206000     2.641000  0.7298000     2.314000  0.7427000     0.3269000      1.041000  
1 1 1 25 1  17 o 1.583000  0.4953000     1.440000  0.6664000     1.726000  0.7330000     -0.2852000     0.9907000 
1 1 1 25 1  18 o 1.772000  0.4787000     2.255000  0.7465000     1.289000  0.5995000     0.9667000      0.9575000 
1 1 1 25 1  19 o 1.895000  0.5906000     1.655000  0.7718000     2.135000  0.8942000     -0.4802000     1.181000  
1 1 1 25 1  20 o 2.288000  0.5142000     2.583000  0.7318000     1.993000  0.7227000     0.5904000      1.028000  
1 1 1 25 1  21 o 1.765000  0.5071000     1.712000  0.7154000     1.819000  0.7189000     -0.1075000     1.014000  
1 1 1 25 1  22 o 1.090000  0.3927000     1.089000  0.5553000     1.090000  0.5554000     -0.3539000E-03 0.7854000 
1 1 1 25 2  1  o 16.12000  0.2636000     ?         ?             16.12000  0.2636000     ?              ?         
1 1 1 25 2  2  o 13.43000  0.1976000     13.40000  0.3423000     13.47000  0.1977000     -0.6677000E-01 0.3953000 
1 1 1 25 2  3  o 4.522000  0.2608000     4.876000  0.4476000     4.168000  0.2679000     0.7085000      0.5217000 
1 1 1 25 2  4  o 5.854000  0.9779000E-01 5.897000  0.1517000     5.811000  0.1235000     0.8656000E-01  0.1956000 
1 1 1 25 2  5  o 13.69000  0.1344000     13.54000  0.1834000     13.83000  0.1967000     -0.2822000     0.2689000 
1 1 1 25 2  6  o 3.705000  0.2324000     3.530000  0.2563000     3.879000  0.3879000     -0.3486000     0.4649000 
1 1 1 25 2  7  o 3.405000  0.4586000     3.862000  0.6777000     2.947000  0.6180000     0.9149000      0.9171000 
1 1 1 25 2  8  o 11.88000  0.1697000     11.76000  0.1975000     12.00000  0.2759000     -0.2448000     0.3393000 
1 1 1 25 2  9  o 3.661000  0.4541000     3.868000  0.6392000     3.454000  0.6452000     0.4141000      0.9082000 
1 1 1 25 2  10 o 1.825000  0.5255000     1.873000  0.7613000     1.778000  0.7246000     0.9530000E-01  1.051000  
1 1 1 25 2  11 o 1.708000  0.5222000     1.669000  0.7348000     1.746000  0.7421000     -0.7696000E-01 1.044000  
1 1 1 25 2  12 o 2.304000  0.5782000     1.581000  0.7431000     3.027000  0.8859000     -1.447000      1.156000  
1 1 1 25 2  13 o 4.958000  0.3876000     5.341000  0.5012000     4.574000  0.5915000     0.7678000      0.7753000 
1 1 1 25 2  14 o 5.488000  0.3818000     5.198000  0.5650000     5.778000  0.5136000     -0.5800000     0.7635000 
1 1 1 25 2  15 o 1.733000  0.5055000     1.822000  0.7362000     1.645000  0.6928000     0.1771000      1.011000  
1 1 1 25 2  16 o 6.183000  0.2547000     6.655000  0.3437000     5.712000  0.3760000     0.9429000      0.5094000 
1 1 1 25 2  17 o 2.102000  0.5565000     2.312000  0.8133000     1.892000  0.7599000     0.4193000      1.113000  
1 1 1 25 2  18 o 1.475000  0.4510000     1.264000  0.5919000     1.686000  0.6807000     -0.4222000     0.9020000 
1 1 1 25 2  19 o 1.948000  0.5757000     1.644000  0.7675000     2.251000  0.8583000     -0.6068000     1.151000  
1 1 1 25 2  20 o 1.243000  0.4131000     1.244000  0.5864000     1.243000  0.5819000     0.5615000E-03  0.8261000 
1 1 1 25 2  21 o 1.292000  0.4221000     1.532000  0.6681000     1.052000  0.5160000     0.4799000      0.8441000 
1 1 1 25 2  22 o 1.200000  0.4297000     1.146000  0.5823000     1.254000  0.6320000     -0.1076000     0.8593000 
1 1 1 25 3  1  o 19.38000  0.1993000     19.27000  0.3047000     19.49000  0.2570000     -0.2193000     0.3986000 
1 1 1 25 3  2  o 12.76000  0.1917000     12.79000  0.3300000     12.74000  0.1951000     0.4741000E-01  0.3833000 
1 1 1 25 3  3  o 7.652000  0.1952000     7.509000  0.3418000     7.795000  0.1885000     -0.2865000     0.3903000 
1 1 1 25 3  4  o 13.85000  0.1906000     13.83000  0.1940000     13.87000  0.3281000     -0.4207000E-01 0.3812000 
1 1 1 25 3  5  o 18.49000  0.1620000     18.39000  0.2244000     18.59000  0.2337000     -0.1953000     0.3240000 
1 1 1 25 3  6  o 4.397000  0.1715000     4.205000  0.2359000     4.590000  0.2491000     -0.3850000     0.3431000 
1 1 1 25 3  7  o 7.789000  0.2085000     7.675000  0.3103000     7.902000  0.2785000     -0.2271000     0.4170000 
1 1 1 25 3  8  o 8.586000  0.1807000     8.690000  0.1952000     8.481000  0.3042000     0.2084000      0.3614000 
1 1 1 25 3  9  o 8.098000  0.2883000     7.916000  0.4012000     8.280000  0.4140000     -0.3640000     0.5765000 
1 1 1 25 3  10 f 16.48000  0.1926000     16.41000  0.2726000     16.55000  0.2722000     -0.1436000     0.3852000 
1 1 1 25 3  11 o 5.296000  0.3289000     5.107000  0.4810000     5.484000  0.4487000     -0.3767000     0.6578000 
1 1 1 25 3  12 o 5.311000  0.3976000     5.314000  0.5700000     5.309000  0.5546000     0.4585000E-02  0.7953000 
1 1 1 25 3  13 o 4.848000  0.3800000     4.848000  0.5477000     4.848000  0.5268000     -0.7453000E-03 0.7599000 
1 1 1 25 3  14 o 2.857000  0.6794000     3.040000  0.9480000     2.674000  0.9735000     0.3656000      1.359000  
1 1 1 25 3  15 o 4.421000  0.3579000     3.970000  0.5739000     4.871000  0.4278000     -0.9016000     0.7158000 
1 1 1 25 3  16 o 1.638000  0.4801000     1.765000  0.7039000     1.511000  0.6530000     0.2541000      0.9602000 
1 1 1 25 3  17 o 3.243000  0.5118000     3.269000  0.7268000     3.218000  0.7208000     0.5121000E-01  1.024000  
1 1 1 25 3  18 o 1.443000  0.4518000     1.423000  0.6340000     1.463000  0.6438000     -0.4034000E-01 0.9036000 
1 1 1 25 3  19 o 2.309000  0.6079000     2.088000  0.8585000     2.529000  0.8609000     -0.4404000     1.216000  
1 1 1 25 3  20 o 1.649000  0.4693000     2.005000  0.7242000     1.292000  0.5971000     0.7126000      0.9386000 
1 1 1 25 3  21 o 1.383000  0.4429000     1.284000  0.5984000     1.481000  0.6530000     -0.1968000     0.8857000 
1 1 1 25 3  22 o 1.118000  0.5706000     1.118000  0.5706000     ?         ?             ?              ?         
1 1 1 25 4  1  o 15.56000  0.2108000     15.75000  0.3638000     15.37000  0.2131000     0.3725000      0.4216000 
1 1 1 25 4  2  o 4.041000  0.2288000     3.680000  0.4077000     4.402000  0.2080000     -0.7228000     0.4577000 
1 1 1 25 4  3  o 4.431000  0.2164000     5.074000  0.4059000     3.787000  0.1500000     1.286000       0.4328000 
1 1 1 25 4  4  o 3.949000  0.1576000     3.683000  0.1927000     4.215000  0.2495000     -0.5321000     0.3152000 
1 1 1 25 4  5  o 2.991000  0.2863000     2.795000  0.4922000     3.187000  0.2925000     -0.3928000     0.5725000 
1 1 1 25 4  6  o 14.02000  0.1433000     14.10000  0.1993000     13.94000  0.2059000     0.1580000      0.2866000 
1 1 1 25 4  7  o 10.66000  0.1909000     10.64000  0.3191000     10.69000  0.2095000     -0.5618000E-01 0.3817000 
1 1 1 25 4  8  o 16.59000  0.1815000     16.70000  0.2138000     16.48000  0.2935000     0.2197000      0.3631000 
1 1 1 25 4  9  o 8.855000  0.2715000     8.913000  0.2372000     8.796000  0.4885000     0.1164000      0.5430000 
1 1 1 25 4  10 o 5.006000  0.3002000     4.940000  0.3050000     5.071000  0.5172000     -0.1306000     0.6005000 
1 1 1 25 4  11 o 9.239000  0.2253000     9.385000  0.3186000     9.094000  0.3187000     0.2911000      0.4506000 
1 1 1 25 4  12 o 3.261000  0.5918000     2.783000  0.8905000     3.738000  0.7795000     -0.9551000     1.184000  
1 1 1 25 4  13 o 2.104000  0.5619000     1.993000  0.7906000     2.215000  0.7987000     -0.2216000     1.124000  
1 1 1 25 4  14 o 3.090000  0.6490000     2.524000  0.9406000     3.656000  0.8944000     -1.132000      1.298000  
1 1 1 25 4  15 o 3.288000  0.4685000     3.582000  0.5963000     2.995000  0.7228000     0.5874000      0.9370000 
1 1 1 25 4  16 o 1.748000  0.4870000     1.479000  0.6488000     2.017000  0.7263000     -0.5382000     0.9739000 
1 1 1 25 4  17 o 2.104000  0.5470000     2.227000  0.7748000     1.981000  0.7723000     0.2457000      1.094000  
1 1 1 25 4  18 o 1.576000  0.4677000     1.760000  0.6955000     1.392000  0.6254000     0.3678000      0.9353000 
1 1 1 25 4  19 o 2.166000  0.6046000     2.192000  0.8748000     2.141000  0.8348000     0.5106000E-01  1.209000  
1 1 1 25 4  20 o 1.274000  0.4180000     1.423000  0.6362000     1.125000  0.5423000     0.2983000      0.8360000 
1 1 1 25 4  21 o 1.142000  0.3886000     1.135000  0.5477000     1.149000  0.5515000     -0.1413000E-01 0.7773000 
1 1 1 25 5  0  o 4.574000  0.1516000     4.574000  0.1516000     4.574000  0.1516000     -0.000000      0.000000  
1 1 1 25 5  1  o 7.070000  0.1405000     6.980000  0.2303000     7.160000  0.1609000     -0.1798000     0.2810000 
1 1 1 25 5  2  o 13.76000  0.1945000     13.75000  0.3479000     13.77000  0.1743000     -0.2067000E-01 0.3891000 
1 1 1 25 5  3  o 10.49000  0.1066000     10.36000  0.1426000     10.63000  0.1585000     -0.2723000     0.2132000 
1 1 1 25 5  4  o 8.041000  0.1301000     8.020000  0.1485000     8.062000  0.2138000     -0.4134000E-01 0.2603000 
1 1 1 25 5  5  o 9.796000  0.1225000     9.810000  0.1684000     9.782000  0.1779000     0.2767000E-01  0.2450000 
1 1 1 25 5  6  o 8.091000  0.1327000     7.859000  0.1819000     8.323000  0.1933000     -0.4640000     0.2655000 
1 1 1 25 5  7  o 13.25000  0.1697000     13.03000  0.2612000     13.48000  0.2167000     -0.4504000     0.3394000 
1 1 1 25 5  8  o 10.14000  0.1600000     10.06000  0.2273000     10.22000  0.2253000     -0.1545000     0.3201000 
1 1 1 25 5  9  o 12.19000  0.2216000     12.18000  0.2454000     12.20000  0.3690000     -0.1889000E-01 0.4431000 
1 1 1 25 5  10 o 8.285000  0.2168000     7.905000  0.2368000     8.666000  0.3632000     -0.7612000     0.4336000 
1 1 1 25 5  11 o 6.921000  0.2578000     7.033000  0.2657000     6.808000  0.4419000     0.2251000      0.5156000 
1 1 1 25 5  12 o 4.920000  0.4203000     4.569000  0.6479000     5.272000  0.5356000     -0.7026000     0.8406000 
1 1 1 25 5  13 o 4.270000  0.4162000     3.911000  0.6423000     4.630000  0.5296000     -0.7186000     0.8325000 
1 1 1 25 5  14 o 1.961000  0.5923000     1.758000  0.8059000     2.165000  0.8683000     -0.4076000     1.185000  
1 1 1 25 5  15 o 2.511000  0.5429000     2.617000  0.7360000     2.405000  0.7984000     0.2118000      1.086000  
1 1 1 25 5  16 o 2.635000  0.4705000     3.198000  0.6025000     2.072000  0.7229000     1.126000       0.9410000 
1 1 1 25 5  17 o 1.427000  0.4641000     1.455000  0.6635000     1.400000  0.6492000     0.5498000E-01  0.9282000 
1 1 1 25 5  18 o 1.866000  0.4515000     2.502000  0.6951000     1.230000  0.5763000     1.271000       0.9029000 
1 1 1 25 5  19 o 1.596000  0.5125000     1.613000  0.7321000     1.578000  0.7175000     0.3493000E-01  1.025000  
1 1 1 25 5  20 o 1.379000  0.4309000     1.084000  0.5263000     1.674000  0.6826000     -0.5900000     0.8619000 
1 1 1 25 5  21 o 1.218000  0.4048000     1.170000  0.5574000     1.266000  0.5871000     -0.9589000E-01 0.8096000 
1 1 1 25 6  0  o 15.37000  0.1818000     15.37000  0.1818000     15.37000  0.1818000     0.000000       0.000000  
1 1 1 25 6  1  o 9.676000  0.1031000     9.678000  0.1516000     9.674000  0.1398000     0.3422000E-02  0.2062000 
1 1 1 25 6  2  o 9.857000  0.1012000     9.627000  0.1353000     10.09000  0.1504000     -0.4598000     0.2023000 
1 1 1 25 6  3  o 19.79000  0.1646000     19.97000  0.2316000     19.62000  0.2341000     0.3527000      0.3293000 
1 1 1 25 6  4  o 3.375000  0.1634000     3.342000  0.2145000     3.408000  0.2466000     -0.6620000E-01 0.3269000 
1 1 1 25 6  5  o 14.65000  0.1422000     14.56000  0.1973000     14.75000  0.2048000     -0.1953000     0.2844000 
1 1 1 25 6  6  f 4.909000  0.1912000     4.760000  0.2201000     5.058000  0.3127000     -0.2979000     0.3824000 
1 1 1 25 6  7  o 7.011000  0.1569000     7.200000  0.2092000     6.822000  0.2339000     0.3774000      0.3138000 
1 1 1 25 6  8  o 7.253000  0.1687000     7.161000  0.2289000     7.344000  0.2480000     -0.1824000     0.3375000 
1 1 1 25 6  9  o 9.815000  0.2210000     9.606000  0.2313000     10.02000  0.3766000     -0.4185000     0.4420000 
1 1 1 25 6  10 o 4.612000  0.3209000     4.498000  0.3385000     4.725000  0.5454000     -0.2270000     0.6419000 
1 1 1 25 6  11 o 5.888000  0.2895000     5.807000  0.2960000     5.969000  0.4976000     -0.1620000     0.5790000 
1 1 1 25 6  12 o 9.654000  0.2470000     9.790000  0.3264000     9.518000  0.3707000     0.2719000      0.4939000 
1 1 1 25 6  13 o 2.984000  0.5804000     3.031000  0.7666000     2.938000  0.8718000     0.9249000E-01  1.161000  
1 1 1 25 6  14 o 4.471000  0.4619000     5.369000  0.5499000     3.574000  0.7424000     1.795000       0.9239000 
1 1 1 25 6  15 o 3.999000  0.4521000     3.657000  0.6220000     4.342000  0.6563000     -0.6842000     0.9042000 
1 1 1 25 6  16 f 2.980000  0.4509000     2.681000  0.6797000     3.279000  0.5925000     -0.5978000     0.9017000 
1 1 1 25 6  17 o 1.465000  0.4677000     1.600000  0.6934000     1.331000  0.6279000     0.2684000      0.9355000 
1 1 1 25 6  18 o 1.270000  0.4150000     1.372000  0.6168000     1.169000  0.5554000     0.2023000      0.8300000 
1 1 1 25 6  19 o 1.699000  0.5294000     1.768000  0.7730000     1.630000  0.7235000     0.1380000      1.059000  
1 1 1 25 6  20 o 1.208000  0.4030000     1.146000  0.5479000     1.269000  0.5912000     -0.1233000     0.8061000 
1 1 1 25 6  21 o 1.103000  0.3819000     1.219000  0.5878000     0.9881000 0.4879000     0.2306000      0.7639000 
1 1 1 25 7  0  o 4.332000  0.1508000     4.332000  0.1508000     4.332000  0.1508000     0.000000       0.000000  
1 1 1 25 7  1  o 8.944000  0.9766000E-01 8.854000  0.1530000     9.034000  0.1213000     -0.1806000     0.1953000 
1 1 1 25 7  2  o 4.819000  0.1441000     5.190000  0.1631000     4.447000  0.2375000     0.7430000      0.2881000 
1 1 1 25 7  3  o 5.342000  0.1168000     5.145000  0.1624000     5.538000  0.1680000     -0.3930000     0.2337000 
1 1 1 25 7  4  o 13.92000  0.1347000     14.16000  0.1884000     13.69000  0.1926000     0.4667000      0.2694000 
1 1 1 25 7  5  o 12.18000  0.1330000     12.35000  0.1860000     12.00000  0.1901000     0.3518000      0.2660000 
1 1 1 25 7  6  o 12.26000  0.1651000     12.22000  0.2233000     12.30000  0.2431000     -0.7794000E-01 0.3302000 
1 1 1 25 7  7  o 10.10000  0.1460000     10.08000  0.1996000     10.11000  0.2132000     -0.3195000E-01 0.2920000 
1 1 1 25 7  8  o 14.49000  0.1615000     14.34000  0.2213000     14.65000  0.2352000     -0.3054000     0.3229000 
1 1 1 25 7  9  o 9.467000  0.2230000     9.431000  0.2315000     9.503000  0.3811000     -0.7287000E-01 0.4459000 
1 1 1 25 7  10 o 7.326000  0.1952000     7.540000  0.2584000     7.112000  0.2926000     0.4277000      0.3903000 
1 1 1 25 7  11 o 2.561000  0.3937000     1.498000  0.6128000     3.624000  0.4944000     -2.126000      0.7874000 
1 1 1 25 7  12 o 5.378000  0.3152000     4.965000  0.3645000     5.790000  0.5143000     -0.8244000     0.6304000 
1 1 1 25 7  13 o 5.983000  0.3015000     6.255000  0.2984000     5.711000  0.5241000     0.5438000      0.6031000 
1 1 1 25 7  14 o 4.001000  0.5290000     5.056000  0.3865000     2.946000  0.9850000     2.110000       1.058000  
1 1 1 25 7  15 o 3.355000  0.4907000     2.987000  0.7480000     3.722000  0.6354000     -0.7346000     0.9815000 
1 1 1 25 7  16 o 2.223000  0.4371000     1.368000  0.6129000     3.078000  0.6233000     -1.710000      0.8741000 
1 1 1 25 7  17 o 2.792000  0.5154000     2.716000  0.6812000     2.868000  0.7736000     -0.1520000     1.031000  
1 1 1 25 7  18 o 1.898000  0.4793000     2.362000  0.7180000     1.435000  0.6352000     0.9279000      0.9586000 
1 1 1 25 7  19 o 1.682000  0.5305000     1.714000  0.7651000     1.650000  0.7352000     0.6453000E-01  1.061000  
1 1 1 25 7  20 o 1.324000  0.4279000     1.335000  0.6092000     1.313000  0.6012000     0.2249000E-01  0.8559000 
1 1 1 25 7  21 o 1.500000  0.4616000     1.542000  0.6612000     1.459000  0.6444000     0.8292000E-01  0.9232000 
1 1 1 25 8  0  o 18.26000  0.2112000     18.26000  0.2112000     18.26000  0.2112000     -0.000000      0.000000  
1 1 1 25 8  1  f 7.711000  0.9967000E-01 7.545000  0.1577000     7.877000  0.1219000     -0.3323000     0.1993000 
1 1 1 25 8  2  o 11.21000  0.1144000     11.21000  0.1794000     11.21000  0.1420000     -0.3779000E-02 0.2288000 
1 1 1 25 8  3  o 9.103000  0.1412000     9.176000  0.1727000     9.030000  0.2233000     0.1461000      0.2823000 
1 1 1 25 8  4  o 4.536000  0.1462000     4.689000  0.1983000     4.384000  0.2149000     0.3056000      0.2924000 
1 1 1 25 8  5  o 9.911000  0.1298000     9.922000  0.1810000     9.901000  0.1860000     0.2120000E-01  0.2595000 
1 1 1 25 8  6  o 3.834000  0.4779000     3.516000  0.8799000     4.153000  0.3734000     -0.6374000     0.9559000 
1 1 1 25 8  7  o 6.474000  0.1655000     6.408000  0.2236000     6.540000  0.2441000     -0.1316000     0.3310000 
1 1 1 25 8  8  o 5.182000  0.2095000     5.119000  0.2687000     5.245000  0.3216000     -0.1266000     0.4191000 
1 1 1 25 8  9  o 8.060000  0.2300000     7.973000  0.3541000     8.147000  0.2935000     -0.1738000     0.4599000 
1 1 1 25 8  10 o 2.700000  0.4267000     2.696000  0.5616000     2.705000  0.6426000     -0.8475000E-02 0.8534000 
1 1 1 25 8  11 o 1.904000  0.4815000     2.214000  0.6762000     1.594000  0.6858000     0.6192000      0.9631000 
1 1 1 25 8  12 o 3.029000  0.4350000     2.387000  0.6841000     3.670000  0.5375000     -1.283000      0.8700000 
1 1 1 25 8  13 o 2.724000  0.5321000     2.602000  0.6157000     2.847000  0.8681000     -0.2449000     1.064000  
1 1 1 25 8  14 o 2.337000  0.6020000     1.833000  0.6958000     2.842000  0.9826000     -1.009000      1.204000  
1 1 1 25 8  15 o 1.952000  0.5374000     1.581000  0.6426000     2.323000  0.8615000     -0.7422000     1.075000  
1 1 1 25 8  16 o 1.466000  0.4644000     1.112000  0.5350000     1.821000  0.7592000     -0.7095000     0.9287000 
1 1 1 25 8  17 o 1.812000  0.4959000     1.664000  0.6852000     1.959000  0.7171000     -0.2946000     0.9919000 
1 1 1 25 8  18 o 1.612000  0.4724000     1.403000  0.6293000     1.822000  0.7048000     -0.4187000     0.9449000 
1 1 1 25 8  19 f 2.008000  0.5748000     2.135000  0.8466000     1.881000  0.7779000     0.2537000      1.150000  
1 1 1 25 8  20 o 1.099000  0.3747000     1.303000  0.6007000     0.8950000 0.4480000     0.4082000      0.7494000 
1 1 1 25 8  21 o 1.230000  0.4121000     1.297000  0.6012000     1.162000  0.5638000     0.1351000      0.8242000 
1 1 1 25 9  0  o 5.647000  0.1697000     5.647000  0.1697000     5.647000  0.1697000     -0.000000      0.000000  
1 1 1 25 9  1  o 4.219000  0.1117000     4.238000  0.1644000     4.199000  0.1513000     0.3942000E-01  0.2234000 
1 1 1 25 9  2  o 11.08000  0.1158000     11.20000  0.1823000     10.97000  0.1429000     0.2262000      0.2316000 
1 1 1 25 9  3  o 7.157000  0.1318000     6.926000  0.2059000     7.389000  0.1647000     -0.4628000     0.2637000 
1 1 1 25 9  4  o 24.18000  0.2014000     24.32000  0.2838000     24.04000  0.2859000     0.2748000      0.4028000 
1 1 1 25 9  5  o 10.71000  0.1563000     10.56000  0.2053000     10.85000  0.2358000     -0.2860000     0.3126000 
1 1 1 25 9  6  o 5.765000  0.2060000     5.975000  0.3398000     5.555000  0.2328000     0.4197000      0.4119000 
1 1 1 25 9  7  o 10.69000  0.1508000     10.67000  0.2076000     10.71000  0.2189000     -0.4303000E-01 0.3016000 
1 1 1 25 9  8  o 4.499000  0.2323000     4.032000  0.3330000     4.965000  0.3240000     -0.9337000     0.4647000 
1 1 1 25 9  9  o 6.973000  0.2748000     6.925000  0.4707000     7.020000  0.2840000     -0.9527000E-01 0.5497000 
1 1 1 25 9  10 o 10.53000  0.1762000     10.52000  0.2402000     10.55000  0.2580000     -0.2235000E-01 0.3525000 
1 1 1 25 9  11 o 5.006000  0.2959000     4.982000  0.3725000     5.030000  0.4599000     -0.4847000E-01 0.5918000 
1 1 1 25 9  12 o 9.185000  0.1938000     9.190000  0.2681000     9.180000  0.2800000     0.1031000E-01  0.3877000 
1 1 1 25 9  13 o 3.419000  0.3959000     2.938000  0.6169000     3.899000  0.4963000     -0.9611000     0.7918000 
1 1 1 25 9  14 o 7.447000  0.3247000     7.979000  0.2634000     6.915000  0.5937000     1.064000       0.6495000 
1 1 1 25 9  15 o 2.163000  0.5445000     1.811000  0.6582000     2.515000  0.8675000     -0.7036000     1.089000  
1 1 1 25 9  16 o 2.185000  0.4976000     2.546000  0.5898000     1.825000  0.8017000     0.7207000      0.9953000 
1 1 1 25 9  17 o 2.671000  0.4739000     3.028000  0.4918000     2.314000  0.8101000     0.7146000      0.9478000 
1 1 1 25 9  18 o 1.165000  0.3950000     1.270000  0.5997000     1.059000  0.5141000     0.2114000      0.7899000 
1 1 1 25 9  19 o 1.384000  0.4450000     1.622000  0.6958000     1.146000  0.5549000     0.4756000      0.8900000 
1 1 1 25 9  20 o 1.202000  0.4001000     1.208000  0.5679000     1.196000  0.5637000     0.1215000E-01  0.8001000 
1 1 1 25 9  21 o 1.325000  0.4332000     1.369000  0.6190000     1.281000  0.6062000     0.8728000E-01  0.8664000 
1 1 1 25 10 0  o 4.076000  0.1716000     4.076000  0.1716000     4.076000  0.1716000     -0.000000      0.000000  
1 1 1 25 10 1  o 5.355000  0.1053000     5.268000  0.1524000     5.441000  0.1452000     -0.1734000     0.2105000 
1 1 1 25 10 2  o 7.644000  0.1125000     7.561000  0.1733000     7.726000  0.1437000     -0.1656000     0.2251000 
1 1 1 25 10 3  o 2.944000  0.1914000     2.726000  0.3182000     3.162000  0.2128000     -0.4362000     0.3827000 
1 1 1 25 10 4  o 1.792000  0.3323000     1.562000  0.4986000     2.022000  0.4395000     -0.4604000     0.6647000 
1 1 1 25 10 5  o 4.695000  0.2194000     4.900000  0.2697000     4.489000  0.3462000     0.4115000      0.4389000 
1 1 1 25 10 6  o 6.777000  0.1527000     6.772000  0.2110000     6.782000  0.2209000     -0.1002000E-01 0.3055000 
1 1 1 25 10 7  o 5.955000  0.1796000     6.325000  0.2420000     5.585000  0.2654000     0.7404000      0.3591000 
1 1 1 25 10 8  o 5.011000  0.2325000     5.091000  0.3050000     4.930000  0.3511000     0.1612000      0.4651000 
1 1 1 25 10 9  o 7.189000  0.1905000     6.972000  0.2587000     7.406000  0.2796000     -0.4334000     0.3809000 
1 1 1 25 10 10 o 5.262000  0.2477000     5.055000  0.3403000     5.469000  0.3599000     -0.4145000     0.4953000 
1 1 1 25 10 11 o 1.824000  0.5189000     1.823000  0.7296000     1.826000  0.7381000     -0.2869000E-02 1.038000  
1 1 1 25 10 12 o 4.523000  0.3038000     4.635000  0.4051000     4.410000  0.4530000     0.2245000      0.6077000 
1 1 1 25 10 13 o 5.081000  0.2754000     4.831000  0.3959000     5.330000  0.3829000     -0.4992000     0.5508000 
1 1 1 25 10 14 o 4.448000  0.3253000     4.880000  0.4017000     4.016000  0.5117000     0.8641000      0.6506000 
1 1 1 25 10 15 o 4.432000  0.3276000     4.786000  0.3993000     4.079000  0.5195000     0.7069000      0.6552000 
1 1 1 25 10 16 o 1.531000  0.4872000     1.168000  0.5331000     1.895000  0.8157000     -0.7266000     0.9745000 
1 1 1 25 10 17 o 1.265000  0.4091000     1.304000  0.5620000     1.226000  0.5947000     0.7725000E-01  0.8183000 
1 1 1 25 10 18 o 1.804000  0.5201000     1.843000  0.7320000     1.765000  0.7390000     0.7853000E-01  1.040000  
1 1 1 25 10 19 o 1.391000  0.4641000     1.296000  0.6072000     1.486000  0.7021000     -0.1900000     0.9282000 
1 1 1 25 10 20 o 1.909000  0.4956000     2.016000  0.7131000     1.803000  0.6884000     0.2134000      0.9912000 
1 1 1 25 10 21 o 1.295000  0.4293000     1.114000  0.5457000     1.477000  0.6628000     -0.3625000     0.8586000 
1 1 1 25 11 0  o 11.06000  0.1576000     11.06000  0.1576000     11.06000  0.1576000     -0.000000      0.000000  
1 1 1 25 11 1  o 8.410000  0.1136000     8.220000  0.1741000     8.599000  0.1459000     -0.3786000     0.2271000 
1 1 1 25 11 2  o 7.468000  0.1238000     7.582000  0.1675000     7.354000  0.1825000     0.2280000      0.2477000 
1 1 1 25 11 3  o 2.052000  0.2694000     2.457000  0.3606000     1.648000  0.4004000     0.8084000      0.5389000 
1 1 1 25 11 4  o 5.416000  0.1480000     5.482000  0.2157000     5.350000  0.2026000     0.1316000      0.2959000 
1 1 1 25 11 5  o 11.41000  0.2352000     11.14000  0.4170000     11.68000  0.2176000     -0.5346000     0.4703000 
1 1 1 25 11 6  o 11.93000  0.1454000     11.91000  0.2014000     11.95000  0.2097000     -0.3678000E-01 0.2908000 
1 1 1 25 11 7  o 13.86000  0.1587000     13.82000  0.2197000     13.91000  0.2292000     -0.9119000E-01 0.3174000 
1 1 1 25 11 8  o 10.11000  0.2099000     10.46000  0.2494000     9.769000  0.3378000     0.6903000      0.4199000 
1 1 1 25 11 9  o 1.214000  0.3902000     1.102000  0.5100000     1.325000  0.5905000     -0.2231000     0.7803000 
1 1 1 25 11 10 o 7.602000  0.1950000     7.861000  0.2569000     7.342000  0.2934000     0.5196000      0.3900000 
1 1 1 25 11 11 o 4.951000  0.5690000     4.731000  1.066000      5.171000  0.3991000     -0.4398000     1.138000  
1 1 1 25 11 12 o 1.781000  0.4832000     1.901000  0.6848000     1.661000  0.6818000     0.2401000      0.9663000 
1 1 1 25 11 13 o 1.687000  0.4846000     1.551000  0.6476000     1.823000  0.7210000     -0.2728000     0.9692000 
1 1 1 25 11 14 o 2.957000  0.4559000     3.129000  0.5983000     2.785000  0.6880000     0.3438000      0.9118000 
1 1 1 25 11 15 o 1.471000  0.4498000     1.233000  0.5737000     1.708000  0.6929000     -0.4756000     0.8996000 
1 1 1 25 11 16 o 1.774000  0.4755000     2.196000  0.7173000     1.351000  0.6244000     0.8445000      0.9510000 
1 1 1 25 11 17 o 1.483000  0.4586000     1.182000  0.5294000     1.783000  0.7491000     -0.6012000     0.9173000 
1 1 1 25 11 18 o 1.277000  0.4241000     1.525000  0.6730000     1.029000  0.5161000     0.4962000      0.8481000 
1 1 1 25 11 19 o 1.850000  0.5310000     1.200000  0.5767000     2.500000  0.8918000     -1.300000      1.062000  
1 1 1 25 11 20 o 1.471000  0.4598000     1.109000  0.5117000     1.832000  0.7640000     -0.7235000     0.9195000 
1 1 1 25 11 21 o 1.735000  0.4661000     2.079000  0.6519000     1.390000  0.6662000     0.6890000      0.9321000 
1 1 1 25 12 0  o 4.615000  0.2171000     4.615000  0.2171000     4.615000  0.2171000     -0.000000      0.000000  
1 1 1 25 12 1  o 18.31000  0.1802000     18.37000  0.2558000     18.24000  0.2538000     0.1358000      0.3604000 
1 1 1 25 12 2  o 10.83000  0.1210000     10.90000  0.1643000     10.76000  0.1778000     0.1426000      0.2421000 
1 1 1 25 12 3  o 6.267000  0.1298000     6.459000  0.1658000     6.076000  0.1999000     0.3831000      0.2597000 
1 1 1 25 12 4  o 3.127000  0.2570000     2.702000  0.4260000     3.552000  0.2874000     -0.8500000     0.5139000 
1 1 1 25 12 5  o 9.246000  0.1343000     9.290000  0.2123000     9.202000  0.1646000     0.8818000E-01  0.2686000 
1 1 1 25 12 6  o 6.846000  0.1587000     6.865000  0.2158000     6.826000  0.2328000     0.3981000E-01  0.3175000 
1 1 1 25 12 7  o 7.660000  0.1660000     7.551000  0.2263000     7.769000  0.2429000     -0.2187000     0.3320000 
1 1 1 25 12 8  o 7.042000  0.2467000     7.423000  0.2610000     6.661000  0.4186000     0.7621000      0.4933000 
1 1 1 25 12 9  o 4.544000  0.2626000     4.800000  0.3285000     4.288000  0.4099000     0.5122000      0.5253000 
1 1 1 25 12 10 o 4.718000  0.2754000     4.549000  0.3804000     4.886000  0.3983000     -0.3364000     0.5508000 
1 1 1 25 12 11 o 6.912000  0.2796000     6.825000  0.4673000     6.998000  0.3073000     -0.1729000     0.5592000 
1 1 1 25 12 12 o 4.333000  0.3181000     4.368000  0.4297000     4.297000  0.4692000     0.7182000E-01  0.6362000 
1 1 1 25 12 13 o 1.432000  0.4500000     1.592000  0.6723000     1.271000  0.5983000     0.3212000      0.9000000 
1 1 1 25 12 14 o 2.268000  0.5032000     2.461000  0.6953000     2.075000  0.7276000     0.3863000      1.006000  
1 1 1 25 12 15 o 1.562000  0.4681000     1.530000  0.6484000     1.594000  0.6753000     -0.6326000E-01 0.9362000 
1 1 1 25 12 16 o 2.460000  0.5973000     2.197000  0.9805000     2.723000  0.6824000     -0.5262000     1.195000  
1 1 1 25 12 17 o 2.388000  0.4568000     2.008000  0.6649000     2.768000  0.6264000     -0.7601000     0.9135000 
1 1 1 25 12 18 o 1.489000  0.4808000     1.474000  0.7146000     1.503000  0.6433000     -0.2873000E-01 0.9615000 
1 1 1 25 12 19 o 1.348000  0.4434000     1.303000  0.5819000     1.392000  0.6692000     -0.8849000E-01 0.8869000 
1 1 1 25 12 20 o 2.041000  0.5134000     1.986000  0.6334000     2.095000  0.8081000     -0.1087000     1.027000  
1 1 1 25 12 21 o 1.640000  0.5152000     2.019000  0.8233000     1.261000  0.6195000     0.7578000      1.030000  
1 1 1 25 13 0  o 7.276000  0.2200000     7.276000  0.2200000     7.276000  0.2200000     0.000000       0.000000  
1 1 1 25 13 1  o 10.62000  0.1475000     10.64000  0.1865000     10.61000  0.2285000     0.3770000E-01  0.2950000 
1 1 1 25 13 2  o 3.829000  0.1767000     3.596000  0.2502000     4.063000  0.2497000     -0.4678000     0.3535000 
1 1 1 25 13 3  o 8.191000  0.1354000     8.225000  0.1853000     8.157000  0.1975000     0.6806000E-01  0.2708000 
1 1 1 25 13 4  o 13.76000  0.1500000     13.89000  0.2313000     13.63000  0.1911000     0.2581000      0.3001000 
1 1 1 25 13 5  o 9.347000  0.1379000     9.554000  0.2175000     9.140000  0.1696000     0.4134000      0.2758000 
1 1 1 25 13 6  o 6.243000  0.1768000     6.266000  0.2521000     6.220000  0.2478000     0.4603000E-01  0.3535000 
1 1 1 25 13 7  o 2.886000  0.3404000     3.324000  0.3878000     2.447000  0.5595000     0.8771000      0.6807000 
1 1 1 25 13 8  o 9.974000  0.1759000     9.927000  0.2285000     10.02000  0.2676000     -0.9491000E-01 0.3518000 
1 1 1 25 13 9  o 1.684000  0.4437000     1.912000  0.6302000     1.456000  0.6246000     0.4562000      0.8873000 
1 1 1 25 13 10 o 2.878000  0.4578000     3.050000  0.5319000     2.706000  0.7453000     0.3446000      0.9157000 
1 1 1 25 13 11 o 2.980000  0.4418000     3.366000  0.5543000     2.593000  0.6881000     0.7733000      0.8836000 
1 1 1 25 13 12 o 2.882000  0.4652000     2.812000  0.6488000     2.953000  0.6670000     -0.1411000     0.9305000 
1 1 1 25 13 13 o 3.860000  0.4924000     3.854000  0.5164000     3.866000  0.8386000     -0.1221000E-01 0.9849000 
1 1 1 25 13 14 o 3.700000  0.3876000     3.915000  0.4776000     3.485000  0.6105000     0.4302000      0.7751000 
1 1 1 25 13 15 o 3.474000  0.3724000     3.171000  0.5460000     3.776000  0.5067000     -0.6051000     0.7449000 
1 1 1 25 13 16 o 1.727000  0.5088000     1.499000  0.7506000     1.955000  0.6872000     -0.4553000     1.018000  
1 1 1 25 13 17 o 1.316000  0.4163000     1.401000  0.6115000     1.231000  0.5651000     0.1697000      0.8326000 
1 1 1 25 13 18 o 1.793000  0.5596000     1.976000  0.8904000     1.611000  0.6780000     0.3655000      1.119000  
1 1 1 25 13 19 o 1.150000  0.3878000     1.114000  0.5342000     1.186000  0.5624000     -0.7227000E-01 0.7756000 
1 1 1 25 13 20 f 1.296000  0.4119000     1.185000  0.5469000     1.406000  0.6162000     -0.2211000     0.8239000 
1 1 1 25 13 21 o 1.382000  0.4627000     1.283000  0.6255000     1.480000  0.6820000     -0.1967000     0.9254000 
1 1 1 25 14 0  o 0.7358000 0.4743000     0.7358000 0.4743000     0.7358000 0.4743000     0.000000       0.000000  
1 1 1 25 14 1  o 8.807000  0.1334000     8.766000  0.1868000     8.848000  0.1904000     -0.8228000E-01 0.2667000 
1 1 1 25 14 2  o 23.05000  0.2228000     23.00000  0.3131000     23.10000  0.3170000     -0.1069000     0.4456000 
1 1 1 25 14 3  o 8.861000  0.1316000     8.888000  0.2028000     8.833000  0.1678000     0.5552000E-01  0.2632000 
1 1 1 25 14 4  o 6.446000  0.1318000     6.404000  0.1885000     6.487000  0.1842000     -0.8364000E-01 0.2636000 
1 1 1 25 14 5  o 9.277000  0.1412000     9.219000  0.2229000     9.335000  0.1732000     -0.1163000     0.2823000 
1 1 1 25 14 6  o 5.680000  0.1705000     5.512000  0.2699000     5.847000  0.2085000     -0.3356000     0.3411000 
1 1 1 25 14 7  o 9.576000  0.1737000     9.867000  0.2437000     9.284000  0.2476000     0.5827000      0.3474000 
1 1 1 25 14 8  o 5.172000  0.2307000     5.018000  0.3166000     5.326000  0.3358000     -0.3080000     0.4615000 
1 1 1 25 14 9  o 11.44000  0.1734000     11.41000  0.2402000     11.47000  0.2501000     -0.6612000E-01 0.3468000 
1 1 1 25 14 10 o 3.160000  0.4677000     3.029000  0.6226000     3.292000  0.6982000     -0.2633000     0.9355000 
1 1 1 25 14 11 o 3.247000  0.4059000     3.394000  0.5114000     3.100000  0.6305000     0.2942000      0.8118000 
1 1 1 25 14 12 o 4.438000  0.3148000     3.872000  0.4785000     5.004000  0.4091000     -1.132000      0.6296000 
1 1 1 25 14 13 o 5.637000  0.4758000     5.615000  0.3808000     5.658000  0.8721000     -0.4259000E-01 0.9516000 
1 1 1 25 14 14 o 4.261000  0.3383000     3.721000  0.5040000     4.800000  0.4513000     -1.079000      0.6765000 
1 1 1 25 14 15 f 1.931000  0.4945000     1.920000  0.6855000     1.941000  0.7129000     -0.2042000E-01 0.9890000 
1 1 1 25 14 16 o 2.686000  0.4906000     1.898000  0.8257000     3.474000  0.5298000     -1.576000      0.9811000 
1 1 1 25 14 17 o 2.484000  0.4679000     2.461000  0.6750000     2.507000  0.6480000     -0.4640000E-01 0.9357000 
1 1 1 25 14 18 o 2.628000  0.6481000     3.524000  1.037000      1.732000  0.7771000     1.792000       1.296000  
1 1 1 25 14 19 o 1.973000  0.4887000     2.079000  0.6771000     1.867000  0.7048000     0.2119000      0.9773000 
1 1 1 25 14 20 o 1.311000  0.4084000     1.058000  0.5078000     1.564000  0.6398000     -0.5067000     0.8168000 
1 1 1 25 14 21 o 1.281000  0.4338000     1.363000  0.6626000     1.198000  0.5602000     0.1645000      0.8677000 
1 1 1 25 15 0  o 2.208000  0.3962000     2.208000  0.3962000     2.208000  0.3962000     0.000000       0.000000  
1 1 1 25 15 1  o 8.919000  0.1163000     9.010000  0.1655000     8.828000  0.1636000     0.1817000      0.2327000 
1 1 1 25 15 2  o 9.911000  0.1210000     10.03000  0.1711000     9.792000  0.1712000     0.2388000      0.2421000 
1 1 1 25 15 3  o 9.383000  0.1217000     9.492000  0.1721000     9.274000  0.1721000     0.2177000      0.2433000 
1 1 1 25 15 4  f 15.56000  0.1487000     15.58000  0.2107000     15.53000  0.2099000     0.4896000E-01  0.2974000 
1 1 1 25 15 5  o 8.569000  0.1331000     8.658000  0.1885000     8.479000  0.1880000     0.1789000      0.2662000 
1 1 1 25 15 6  o 6.167000  0.1662000     6.127000  0.2621000     6.206000  0.2045000     -0.7914000E-01 0.3325000 
1 1 1 25 15 7  o 3.877000  0.2853000     3.877000  0.4195000     3.878000  0.3867000     -0.5410000E-03 0.5705000 
1 1 1 25 15 8  o 4.468000  0.2563000     4.525000  0.3341000     4.412000  0.3889000     0.1129000      0.5126000 
1 1 1 25 15 9  o 4.371000  0.2737000     4.172000  0.3797000     4.569000  0.3942000     -0.3965000     0.5473000 
1 1 1 25 15 10 f 2.852000  0.6368000     2.914000  1.094000      2.791000  0.6517000     0.1232000      1.274000  
1 1 1 25 15 11 o 7.797000  0.2116000     7.480000  0.2946000     8.114000  0.3038000     -0.6339000     0.4233000 
1 1 1 25 15 12 o 4.313000  0.3246000     4.584000  0.4101000     4.042000  0.5032000     0.5417000      0.6491000 
1 1 1 25 15 13 o 3.257000  0.4796000     4.547000  0.4335000     1.967000  0.8558000     2.580000       0.9593000 
1 1 1 25 15 14 o 2.433000  0.5005000     2.181000  0.7009000     2.686000  0.7145000     -0.5053000     1.001000  
1 1 1 25 15 15 o 1.212000  0.3988000     1.169000  0.5471000     1.255000  0.5805000     -0.8526000E-01 0.7976000 
1 1 1 25 15 16 o 1.959000  0.4864000     1.740000  0.6702000     2.178000  0.7052000     -0.4385000     0.9728000 
1 1 1 25 15 17 o 1.735000  0.4487000     1.287000  0.5791000     2.183000  0.6854000     -0.8962000     0.8973000 
1 1 1 25 15 18 o 2.289000  0.6785000     1.688000  0.7905000     2.890000  1.103000      -1.203000      1.357000  
1 1 1 25 15 19 o 1.697000  0.4721000     1.464000  0.6180000     1.930000  0.7139000     -0.4661000     0.9442000 
1 1 1 25 15 20 o 1.159000  0.3851000     1.127000  0.5300000     1.192000  0.5587000     -0.6563000E-01 0.7701000 
1 1 1 25 15 21 o 1.203000  0.4150000     1.239000  0.6115000     1.168000  0.5612000     0.7093000E-01  0.8300000 
1 1 1 25 16 0  o 8.947000  0.1689000     8.947000  0.1689000     8.947000  0.1689000     0.000000       0.000000  
1 1 1 25 16 1  o 4.327000  0.1526000     4.509000  0.2092000     4.145000  0.2223000     0.3638000      0.3053000 
1 1 1 25 16 2  o 3.363000  0.1912000     3.408000  0.2724000     3.318000  0.2684000     0.9005000E-01  0.3824000 
1 1 1 25 16 3  o 4.550000  0.1577000     4.660000  0.2214000     4.440000  0.2246000     0.2203000      0.3154000 
1 1 1 25 16 4  f 5.715000  0.1465000     5.768000  0.2070000     5.662000  0.2073000     0.1064000      0.2929000 
1 1 1 25 16 5  o 12.46000  0.1402000     12.38000  0.1983000     12.54000  0.1982000     -0.1611000     0.2804000 
1 1 1 25 16 6  o 6.684000  0.1458000     6.640000  0.2119000     6.727000  0.2002000     -0.8655000E-01 0.2915000 
1 1 1 25 16 7  o 2.707000  0.3925000     2.816000  0.5613000     2.598000  0.5487000     0.2177000      0.7849000 
1 1 1 25 16 8  o 2.862000  0.3948000     3.084000  0.4905000     2.640000  0.6189000     0.4439000      0.7897000 
1 1 1 25 16 9  o 4.789000  0.2998000     4.770000  0.3535000     4.808000  0.4844000     -0.3815000E-01 0.5997000 
1 1 1 25 16 10 o 7.382000  0.2654000     7.080000  0.4381000     7.685000  0.2998000     -0.6053000     0.5309000 
1 1 1 25 16 11 o 6.976000  0.2256000     7.058000  0.3061000     6.893000  0.3315000     0.1651000      0.4512000 
1 1 1 25 16 12 o 3.021000  0.4525000     3.072000  0.6001000     2.969000  0.6774000     0.1026000      0.9049000 
1 1 1 25 16 13 o 3.197000  0.4497000     2.921000  0.6234000     3.473000  0.6484000     -0.5529000     0.8995000 
1 1 1 25 16 14 o 2.296000  0.5011000     2.376000  0.6835000     2.217000  0.7329000     0.1587000      1.002000  
1 1 1 25 16 15 o 1.770000  0.4890000     1.764000  0.6675000     1.776000  0.7149000     -0.1170000E-01 0.9781000 
1 1 1 25 16 16 o 1.858000  0.4799000     1.663000  0.6504000     2.054000  0.7059000     -0.3906000     0.9599000 
1 1 1 25 16 17 o 1.249000  0.4070000     1.235000  0.5702000     1.263000  0.5810000     -0.2774000E-01 0.8141000 
1 1 1 25 16 18 o 1.638000  0.5323000     1.844000  0.8110000     1.432000  0.6895000     0.4125000      1.065000  
1 1 1 25 16 19 o 2.933000  0.4467000     3.075000  0.5574000     2.791000  0.6981000     0.2849000      0.8933000 
1 1 1 25 16 20 o 1.353000  0.4256000     1.496000  0.6393000     1.209000  0.5620000     0.2874000      0.8512000 
1 1 1 25 17 0  o 15.36000  0.2045000     15.36000  0.2045000     15.36000  0.2045000     -0.000000      0.000000  
1 1 1 25 17 1  o 11.38000  0.1266000     11.37000  0.1790000     11.39000  0.1791000     -0.1740000E-01 0.2532000 
1 1 1 25 17 2  o 10.13000  0.1252000     10.32000  0.1762000     9.946000  0.1778000     0.3718000      0.2503000 
1 1 1 25 17 3  o 7.375000  0.1307000     7.339000  0.1848000     7.410000  0.1850000     -0.7121000E-01 0.2615000 
1 1 1 25 17 4  o 4.509000  0.1698000     4.513000  0.2388000     4.504000  0.2415000     0.9776000E-02  0.3396000 
1 1 1 25 17 5  o 9.823000  0.1365000     9.846000  0.1941000     9.800000  0.1920000     0.4568000E-01  0.2730000 
1 1 1 25 17 6  o 9.678000  0.1566000     9.517000  0.2428000     9.838000  0.1978000     -0.3209000     0.3132000 
1 1 1 25 17 7  o 7.404000  0.1707000     7.393000  0.2647000     7.414000  0.2157000     -0.2174000E-01 0.3415000 
1 1 1 25 17 8  o 3.781000  0.2890000     3.420000  0.4787000     4.142000  0.3238000     -0.7215000     0.5779000 
1 1 1 25 17 9  f 5.625000  0.2840000     6.011000  0.3569000     5.239000  0.4418000     0.7714000      0.5680000 
1 1 1 25 17 10 o 2.845000  0.4382000     2.773000  0.5949000     2.918000  0.6437000     -0.1443000     0.8765000 
1 1 1 25 17 11 o 4.195000  0.3218000     4.103000  0.4460000     4.288000  0.4641000     -0.1849000     0.6436000 
1 1 1 25 17 12 o 5.611000  0.2739000     5.629000  0.3509000     5.592000  0.4206000     0.3738000E-01  0.5478000 
1 1 1 25 17 13 o 3.782000  0.3759000     3.867000  0.4992000     3.697000  0.5620000     0.1700000      0.7517000 
1 1 1 25 17 14 o 4.806000  0.3258000     4.884000  0.4364000     4.728000  0.4838000     0.1568000      0.6515000 
1 1 1 25 17 15 o 3.511000  0.4836000     3.292000  0.7812000     3.730000  0.5704000     -0.4381000     0.9673000 
1 1 1 25 17 16 o 1.602000  0.4642000     1.590000  0.6499000     1.613000  0.6629000     -0.2295000E-01 0.9283000 
1 1 1 25 17 17 o 1.114000  0.3742000     1.070000  0.5114000     1.158000  0.5463000     -0.8751000E-01 0.7483000 
1 1 1 25 17 18 o 2.032000  0.5642000     2.090000  0.8582000     1.973000  0.7327000     0.1167000      1.128000  
1 1 1 25 17 19 o 1.014000  0.3515000     0.9378000 0.4605000     1.091000  0.5310000     -0.1528000     0.7029000 
1 1 1 25 17 20 o 1.329000  0.4209000     1.067000  0.5091000     1.591000  0.6705000     -0.5235000     0.8418000 
1 1 1 25 18 0  o 3.439000  0.2857000     3.439000  0.2857000     3.439000  0.2857000     0.000000       0.000000  
1 1 1 25 18 1  o 7.004000  0.1296000     7.020000  0.1813000     6.987000  0.1852000     0.3272000E-01  0.2592000 
1 1 1 25 18 2  o 7.187000  0.1312000     7.227000  0.1838000     7.148000  0.1873000     0.7940000E-01  0.2624000 
1 1 1 25 18 3  o 10.34000  0.1319000     10.12000  0.1868000     10.55000  0.1864000     -0.4261000     0.2638000 
1 1 1 25 18 4  o 6.194000  0.1474000     6.178000  0.2078000     6.210000  0.2090000     -0.3275000E-01 0.2947000 
1 1 1 25 18 5  o 5.907000  0.1586000     5.751000  0.2316000     6.063000  0.2168000     -0.3117000     0.3173000 
1 1 1 25 18 6  o 6.304000  0.1850000     5.956000  0.2546000     6.651000  0.2686000     -0.6950000     0.3701000 
1 1 1 25 18 7  o 2.432000  0.3635000     2.104000  0.5571000     2.759000  0.4671000     -0.6548000     0.7270000 
1 1 1 25 18 8  o 5.317000  0.2185000     5.776000  0.3278000     4.857000  0.2890000     0.9194000      0.4370000 
1 1 1 25 18 9  o 7.795000  0.3523000     7.651000  0.6441000     7.939000  0.2859000     -0.2876000     0.7047000 
1 1 1 25 18 10 f 5.348000  0.2608000     5.527000  0.3442000     5.170000  0.3919000     0.3571000      0.5216000 
1 1 1 25 18 11 o 9.413000  0.1952000     9.507000  0.2718000     9.319000  0.2801000     0.1875000      0.3903000 
1 1 1 25 18 12 o 5.958000  0.3461000     6.129000  0.3613000     5.788000  0.5905000     0.3413000      0.6923000 
1 1 1 25 18 13 o 3.853000  0.3595000     4.052000  0.4540000     3.654000  0.5575000     0.3986000      0.7190000 
1 1 1 25 18 14 o 3.866000  0.3555000     3.639000  0.5189000     4.092000  0.4862000     -0.4523000     0.7111000 
1 1 1 25 18 15 o 2.278000  0.6414000     2.882000  1.093000      1.673000  0.6709000     1.209000       1.283000  
1 1 1 25 18 16 o 1.498000  0.4479000     1.530000  0.6360000     1.466000  0.6309000     0.6376000E-01  0.8958000 
1 1 1 25 18 17 o 1.926000  0.4872000     2.076000  0.7029000     1.775000  0.6749000     0.3011000      0.9745000 
1 1 1 25 18 18 o 1.873000  0.5145000     1.529000  0.7160000     2.216000  0.7390000     -0.6871000     1.029000  
1 1 1 25 18 19 o 1.558000  0.4439000     1.899000  0.6770000     1.217000  0.5743000     0.6816000      0.8877000 
1 1 1 25 18 20 o 2.044000  0.4893000     2.477000  0.6988000     1.610000  0.6852000     0.8670000      0.9787000 
1 1 1 25 19 0  o 0.9901000 0.5698000     0.9901000 0.5698000     0.9901000 0.5698000     -0.000000      0.000000  
1 1 1 25 19 1  o 13.47000  0.1384000     13.44000  0.1953000     13.49000  0.1962000     -0.5395000E-01 0.2768000 
1 1 1 25 19 2  o 13.49000  0.1403000     13.51000  0.1984000     13.48000  0.1984000     0.2285000E-01  0.2806000 
1 1 1 25 19 3  o 10.48000  0.1335000     10.53000  0.1906000     10.43000  0.1870000     0.9588000E-01  0.2670000 
1 1 1 25 19 4  o 10.81000  0.1373000     10.68000  0.1933000     10.94000  0.1949000     -0.2583000     0.2746000 
1 1 1 25 19 5  o 7.868000  0.1615000     7.879000  0.2480000     7.857000  0.2068000     0.2196000E-01  0.3229000 
1 1 1 25 19 6  o 10.12000  0.1529000     10.09000  0.2080000     10.15000  0.2241000     -0.5905000E-01 0.3057000 
1 1 1 25 19 7  o 14.49000  0.1594000     14.49000  0.2249000     14.49000  0.2260000     -0.7511000E-02 0.3188000 
1 1 1 25 19 8  o 2.514000  0.4237000     2.689000  0.5818000     2.340000  0.6162000     0.3487000      0.8475000 
1 1 1 25 19 9  o 3.733000  0.4888000     2.711000  0.9269000     4.755000  0.3103000     -2.044000      0.9775000 
1 1 1 25 19 10 f 4.992000  0.2778000     5.030000  0.3757000     4.953000  0.4093000     0.7699000E-01  0.5556000 
1 1 1 25 19 11 o 1.463000  0.4507000     1.338000  0.6015000     1.589000  0.6714000     -0.2504000     0.9014000 
1 1 1 25 19 12 o 4.006000  0.4689000     3.999000  0.5010000     4.013000  0.7927000     -0.1394000E-01 0.9378000 
1 1 1 25 19 13 o 2.007000  0.4934000     1.817000  0.6777000     2.197000  0.7173000     -0.3798000     0.9868000 
1 1 1 25 19 14 f 3.140000  0.4264000     3.440000  0.5255000     2.841000  0.6717000     0.5994000      0.8528000 
1 1 1 25 19 15 o 2.376000  0.5651000     2.210000  0.9003000     2.542000  0.6832000     -0.3320000     1.130000  
1 1 1 25 19 16 o 2.264000  0.4848000     2.181000  0.6697000     2.347000  0.7012000     -0.1664000     0.9696000 
1 1 1 25 19 17 o 1.273000  0.4290000     1.465000  0.6775000     1.081000  0.5263000     0.3844000      0.8579000 
1 1 1 25 19 18 o 1.602000  0.4938000     1.475000  0.7025000     1.729000  0.6940000     -0.2537000     0.9875000 
1 1 1 25 19 19 o 1.181000  0.3924000     1.211000  0.5586000     1.151000  0.5512000     0.6013000E-01  0.7847000 
1 1 1 25 19 20 o 1.366000  0.4438000     1.656000  0.7152000     1.077000  0.5255000     0.5793000      0.8875000 
1 1 1 25 20 0  o 10.69000  0.1864000     10.69000  0.1864000     10.69000  0.1864000     0.000000       0.000000  
1 1 1 25 20 1  o 5.101000  0.1583000     5.208000  0.2182000     4.994000  0.2294000     0.2142000      0.3167000 
1 1 1 25 20 2  o 1.600000  0.3690000     1.442000  0.5218000     1.758000  0.5219000     -0.3158000     0.7381000 
1 1 1 25 20 3  o 4.571000  0.1796000     4.362000  0.2646000     4.781000  0.2430000     -0.4192000     0.3593000 
1 1 1 25 20 4  o 1.343000  0.3711000     1.201000  0.5032000     1.484000  0.5455000     -0.2828000     0.7422000 
1 1 1 25 20 5  o 16.47000  0.1872000     16.47000  0.2631000     16.46000  0.2664000     0.2384000E-03  0.3744000 
1 1 1 25 20 6  o 4.183000  0.2177000     3.930000  0.3231000     4.437000  0.2920000     -0.5079000     0.4355000 
1 1 1 25 20 7  o 5.611000  0.1909000     5.353000  0.2762000     5.869000  0.2636000     -0.5163000     0.3818000 
1 1 1 25 20 8  o 8.714000  0.3199000     8.389000  0.5761000     9.039000  0.2786000     -0.6504000     0.6399000 
1 1 1 25 20 9  o 2.968000  0.3869000     3.121000  0.5857000     2.815000  0.5057000     0.3066000      0.7739000 
1 1 1 25 20 10 o 2.293000  0.5055000     2.247000  0.7042000     2.339000  0.7254000     -0.9230000E-01 1.011000  
1 1 1 25 20 11 o 6.240000  0.2379000     6.218000  0.3191000     6.263000  0.3531000     -0.4569000E-01 0.4759000 
1 1 1 25 20 12 o 6.167000  0.2694000     6.599000  0.3509000     5.735000  0.4088000     0.8639000      0.5387000 
1 1 1 25 20 13 o 3.661000  0.3788000     4.056000  0.4406000     3.266000  0.6162000     0.7893000      0.7575000 
1 1 1 25 20 14 o 2.080000  0.4864000     2.458000  0.6604000     1.702000  0.7143000     0.7566000      0.9728000 
1 1 1 25 20 15 o 2.933000  0.4472000     2.886000  0.6256000     2.980000  0.6393000     -0.9433000E-01 0.8945000 
1 1 1 25 20 16 o 2.758000  0.4507000     2.636000  0.6399000     2.880000  0.6348000     -0.2440000     0.9013000 
1 1 1 25 20 17 o 1.783000  0.5508000     2.068000  0.8509000     1.498000  0.6998000     0.5697000      1.102000  
1 1 1 25 20 18 o 2.752000  0.5648000     3.377000  0.8593000     2.127000  0.7332000     1.250000       1.130000  
1 1 1 25 20 19 o 1.455000  0.4470000     1.237000  0.5692000     1.673000  0.6893000     -0.4361000     0.8939000 
1 1 1 25 20 20 o 1.335000  0.4521000     1.334000  0.6745000     1.337000  0.6021000     -0.3428000E-02 0.9042000 
1 1 1 25 21 0  o 4.096000  0.2665000     4.096000  0.2665000     4.096000  0.2665000     0.000000       0.000000  
1 1 1 25 21 1  o 7.409000  0.1382000     7.319000  0.1947000     7.500000  0.1962000     -0.1808000     0.2764000 
1 1 1 25 21 2  o 12.94000  0.1424000     12.71000  0.2000000     13.17000  0.2027000     -0.4620000     0.2848000 
1 1 1 25 21 3  o 8.874000  0.1407000     8.742000  0.1980000     9.006000  0.1998000     -0.2642000     0.2813000 
1 1 1 25 21 4  o 7.881000  0.1629000     7.919000  0.2480000     7.844000  0.2112000     0.7482000E-01  0.3258000 
1 1 1 25 21 5  o 10.02000  0.1523000     9.987000  0.2056000     10.06000  0.2248000     -0.7116000E-01 0.3047000 
1 1 1 25 21 6  o 11.10000  0.1496000     11.24000  0.2114000     10.95000  0.2116000     0.2909000      0.2991000 
1 1 1 25 21 7  o 5.905000  0.2579000     6.032000  0.2812000     5.778000  0.4323000     0.2549000      0.5157000 
1 1 1 25 21 8  o 3.169000  0.3585000     3.563000  0.5031000     2.776000  0.5108000     0.7865000      0.7170000 
1 1 1 25 21 9  o 6.029000  0.2136000     6.038000  0.3356000     6.021000  0.2644000     0.1641000E-01  0.4273000 
1 1 1 25 21 10 o 5.306000  0.2555000     4.981000  0.4170000     5.631000  0.2953000     -0.6505000     0.5110000 
1 1 1 25 21 11 o 1.974000  0.4830000     1.434000  0.6175000     2.513000  0.7429000     -1.078000      0.9660000 
1 1 1 25 21 12 o 6.170000  0.2369000     6.325000  0.3225000     6.014000  0.3470000     0.3105000      0.4737000 
1 1 1 25 21 13 o 4.940000  0.2856000     5.308000  0.3646000     4.571000  0.4398000     0.7374000      0.5713000 
1 1 1 25 21 14 o 1.492000  0.4687000     1.480000  0.6633000     1.503000  0.6625000     -0.2303000E-01 0.9374000 
1 1 1 25 21 15 o 2.477000  0.4769000     2.595000  0.6412000     2.359000  0.7060000     0.2365000      0.9538000 
1 1 1 25 21 16 o 1.108000  0.3723000     1.252000  0.5708000     0.9635000 0.4781000     0.2883000      0.7445000 
1 1 1 25 21 17 o 1.704000  0.5767000     1.685000  0.8129000     1.724000  0.8181000     -0.3901000E-01 1.153000  
1 1 1 25 21 18 o 2.595000  0.6011000     2.830000  0.9457000     2.360000  0.7422000     0.4700000      1.202000  
1 1 1 25 21 19 o 1.715000  0.4369000     2.238000  0.6667000     1.192000  0.5649000     1.045000       0.8738000 
1 1 1 25 21 20 o 1.392000  0.4530000     1.560000  0.7049000     1.223000  0.5692000     0.3375000      0.9060000 
1 1 1 25 22 0  o 15.65000  0.2184000     15.65000  0.2184000     15.65000  0.2184000     -0.000000      0.000000  
1 1 1 25 22 1  o 2.851000  0.2725000     2.664000  0.4026000     3.039000  0.3675000     -0.3748000     0.5451000 
1 1 1 25 22 2  o 1.392000  0.3576000     1.746000  0.5410000     1.038000  0.4677000     0.7081000      0.7152000 
1 1 1 25 22 3  o 3.781000  0.2443000     3.651000  0.3848000     3.911000  0.3012000     -0.2600000     0.4886000 
1 1 1 25 22 4  o 8.363000  0.1793000     8.413000  0.2335000     8.314000  0.2721000     0.9833000E-01  0.3586000 
1 1 1 25 22 5  o 5.840000  0.1760000     5.781000  0.2471000     5.898000  0.2506000     -0.1173000     0.3519000 
1 1 1 25 22 6  o 13.21000  0.1699000     13.30000  0.2209000     13.13000  0.2583000     0.1624000      0.3399000 
1 1 1 25 22 7  o 4.579000  0.3163000     4.232000  0.5182000     4.926000  0.3627000     -0.6944000     0.6325000 
1 1 1 25 22 8  f 5.899000  0.1968000     5.784000  0.2792000     6.015000  0.2773000     -0.2305000     0.3935000 
1 1 1 25 22 9  o 4.424000  0.2482000     4.475000  0.3447000     4.372000  0.3571000     0.1035000      0.4963000 
1 1 1 25 22 10 o 3.144000  0.3906000     3.558000  0.5532000     2.729000  0.5515000     0.8293000      0.7812000 
1 1 1 25 22 11 o 3.563000  0.5118000     4.212000  0.5282000     2.914000  0.8769000     1.298000       1.024000  
1 1 1 25 22 12 o 2.561000  0.4384000     1.762000  0.6783000     3.359000  0.5556000     -1.596000      0.8768000 
1 1 1 25 22 13 o 6.425000  0.2316000     6.391000  0.3222000     6.460000  0.3329000     -0.6864000E-01 0.4633000 
1 1 1 25 22 14 o 4.262000  0.6089000     4.083000  1.138000      4.441000  0.4339000     -0.3583000     1.218000  
1 1 1 25 22 15 o 2.542000  0.4501000     3.189000  0.5655000     1.894000  0.7005000     1.295000       0.9003000 
1 1 1 25 22 16 o 2.171000  0.4420000     1.417000  0.6148000     2.924000  0.6353000     -1.508000      0.8840000 
1 1 1 25 22 17 o 1.781000  0.5593000     2.148000  0.8965000     1.414000  0.6690000     0.7342000      1.119000  
1 1 1 25 22 18 o 1.654000  0.4835000     1.525000  0.6683000     1.783000  0.6990000     -0.2585000     0.9671000 
1 1 1 25 22 19 f 1.539000  0.4635000     1.620000  0.6655000     1.459000  0.6454000     0.1603000      0.9270000 
1 1 1 25 22 20 o 1.008000  0.3647000     0.9752000 0.5019000     1.042000  0.5294000     -0.6657000E-01 0.7294000 
1 1 1 25 23 0  o 3.712000  0.3125000     3.712000  0.3125000     3.712000  0.3125000     -0.000000      0.000000  
1 1 1 25 23 1  o 16.27000  0.1596000     16.21000  0.2252000     16.32000  0.2264000     -0.1072000     0.3193000 
1 1 1 25 23 2  o 1.938000  0.3945000     2.410000  0.5632000     1.467000  0.5526000     0.9429000      0.7890000 
1 1 1 25 23 3  o 2.665000  0.3544000     2.877000  0.4520000     2.453000  0.5459000     0.4238000      0.7088000 
1 1 1 25 23 4  f 2.443000  0.3634000     2.752000  0.4458000     2.133000  0.5741000     0.6191000      0.7269000 
1 1 1 25 23 5  o 7.212000  0.1806000     7.353000  0.2290000     7.072000  0.2792000     0.2816000      0.3611000 
1 1 1 25 23 6  o 5.086000  0.2732000     5.147000  0.4071000     5.025000  0.3645000     0.1221000      0.5464000 
1 1 1 25 23 7  o 4.491000  0.2307000     4.433000  0.3381000     4.550000  0.3141000     -0.1171000     0.4615000 
1 1 1 25 23 8  o 1.407000  0.4125000     1.248000  0.5523000     1.566000  0.6128000     -0.3187000     0.8250000 
1 1 1 25 23 9  o 3.730000  0.2936000     4.010000  0.3741000     3.449000  0.4527000     0.5604000      0.5873000 
1 1 1 25 23 10 o 4.417000  0.2482000     4.753000  0.3369000     4.081000  0.3645000     0.6720000      0.4964000 
1 1 1 25 23 11 o 3.961000  0.3714000     3.428000  0.6041000     4.494000  0.4323000     -1.067000      0.7428000 
1 1 1 25 23 12 o 6.576000  0.2473000     6.518000  0.3242000     6.633000  0.3736000     -0.1156000     0.4946000 
1 1 1 25 23 13 o 5.309000  0.2799000     4.903000  0.3779000     5.716000  0.4129000     -0.8128000     0.5597000 
1 1 1 25 23 14 o 2.364000  0.4496000     1.547000  0.6853000     3.181000  0.5822000     -1.634000      0.8992000 
1 1 1 25 23 15 o 1.507000  0.4498000     1.273000  0.5798000     1.741000  0.6879000     -0.4685000     0.8997000 
1 1 1 25 23 16 o 1.216000  0.3936000     1.270000  0.5668000     1.162000  0.5461000     0.1086000      0.7871000 
1 1 1 25 23 17 o 1.229000  0.4147000     1.142000  0.5738000     1.315000  0.5990000     -0.1733000     0.8295000 
1 1 1 25 23 18 o 1.359000  0.4391000     1.460000  0.6528000     1.258000  0.5875000     0.2022000      0.8782000 
1 1 1 25 23 19 o 2.270000  0.5068000     2.109000  0.7107000     2.431000  0.7226000     -0.3219000     1.014000  
1 1 1 25 24 0  o 5.321000  0.2931000     5.321000  0.2931000     5.321000  0.2931000     -0.000000      0.000000  
1 1 1 25 24 1  o 7.037000  0.1707000     7.245000  0.2536000     6.829000  0.2284000     0.4162000      0.3413000 
1 1 1 25 24 2  o 8.878000  0.1673000     8.880000  0.2341000     8.876000  0.2391000     0.4062000E-02  0.3346000 
1 1 1 25 24 3  o 4.107000  0.2696000     4.046000  0.3117000     4.169000  0.4400000     -0.1231000     0.5392000 
1 1 1 25 24 4  o 5.650000  0.2083000     5.820000  0.2732000     5.480000  0.3145000     0.3399000      0.4166000 
1 1 1 25 24 5  o 4.832000  0.2766000     4.626000  0.4256000     5.039000  0.3535000     -0.4133000     0.5532000 
1 1 1 25 24 6  o 3.744000  0.2993000     4.166000  0.4309000     3.322000  0.4155000     0.8443000      0.5986000 
1 1 1 25 24 7  o 2.948000  0.3402000     2.793000  0.5052000     3.103000  0.4559000     -0.3099000     0.6805000 
1 1 1 25 24 8  o 4.195000  0.2584000     4.128000  0.3729000     4.261000  0.3579000     -0.1335000     0.5169000 
1 1 1 25 24 9  o 1.186000  0.3787000     1.191000  0.5360000     1.181000  0.5350000     0.9426000E-02  0.7573000 
1 1 1 25 24 10 o 1.284000  0.4113000     1.359000  0.6139000     1.209000  0.5475000     0.1503000      0.8226000 
1 1 1 25 24 11 o 5.370000  0.2619000     5.165000  0.4207000     5.575000  0.3121000     -0.4102000     0.5238000 
1 1 1 25 24 12 o 2.023000  0.4886000     1.978000  0.7214000     2.069000  0.6592000     -0.9108000E-01 0.9772000 
1 1 1 25 24 13 o 2.776000  0.5221000     2.887000  0.7681000     2.665000  0.7074000     0.2223000      1.044000  
1 1 1 25 24 14 o 2.417000  0.4611000     2.183000  0.6661000     2.651000  0.6377000     -0.4684000     0.9221000 
1 1 1 25 24 15 o 2.627000  0.4450000     2.854000  0.5794000     2.400000  0.6756000     0.4538000      0.8900000 
1 1 1 25 24 16 o 1.807000  0.4878000     2.103000  0.7137000     1.511000  0.6652000     0.5922000      0.9756000 
1 1 1 25 24 17 o 1.537000  0.4877000     1.553000  0.7302000     1.521000  0.6466000     0.3161000E-01  0.9754000 
1 1 1 25 24 18 o 1.793000  0.4980000     1.627000  0.6693000     1.959000  0.7376000     -0.3313000     0.9960000 
1 1 1 25 24 19 o 2.086000  0.4619000     1.445000  0.6550000     2.727000  0.6516000     -1.283000      0.9239000 
1 1 1 25 25 0  o 9.968000  0.2826000     9.968000  0.2826000     9.968000  0.2826000     -0.000000      0.000000  
1 1 1 25 25 1  o 6.140000  0.3128000     6.140000  0.3128000     ?         ?             ?              ?         
1 1 1 25 25 2  o 2.704000  0.4823000     2.978000  0.4621000     2.431000  0.8467000     0.5466000      0.9646000 
1 1 1 25 25 3  o 7.610000  0.1826000     7.751000  0.2405000     7.468000  0.2748000     0.2830000      0.3651000 
1 1 1 25 25 4  o 3.692000  0.3183000     4.185000  0.3955000     3.199000  0.4988000     0.9854000      0.6365000 
1 1 1 25 25 5  o 8.386000  0.1773000     8.337000  0.2734000     8.436000  0.2259000     -0.9961000E-01 0.3546000 
1 1 1 25 25 6  o 6.597000  0.1769000     6.530000  0.2521000     6.664000  0.2484000     -0.1339000     0.3539000 
1 1 1 25 25 7  o 5.518000  0.2179000     5.391000  0.3270000     5.645000  0.2880000     -0.2533000     0.4357000 
1 1 1 25 25 8  o 1.667000  0.4404000     1.655000  0.6223000     1.679000  0.6232000     -0.2358000E-01 0.8807000 
1 1 1 25 25 9  o 4.108000  0.2708000     3.579000  0.4199000     4.636000  0.3422000     -1.058000      0.5416000 
1 1 1 25 25 10 o 5.589000  0.2765000     5.661000  0.4224000     5.517000  0.3569000     0.1439000      0.5530000 
1 1 1 25 25 11 o 2.636000  0.4113000     2.598000  0.5793000     2.675000  0.5841000     -0.7624000E-01 0.8226000 
1 1 1 25 25 12 o 4.374000  0.3069000     4.992000  0.4427000     3.757000  0.4252000     1.235000       0.6138000 
1 1 1 25 25 13 o 3.406000  0.5262000     2.186000  0.9696000     4.626000  0.4093000     -2.441000      1.052000  
1 1 1 25 25 14 o 1.325000  0.4191000     1.381000  0.6026000     1.270000  0.5827000     0.1117000      0.8383000 
1 1 1 25 25 15 o 1.910000  0.4790000     1.726000  0.6641000     2.094000  0.6904000     -0.3684000     0.9580000 
1 1 1 25 25 16 o 2.441000  0.5773000     2.230000  0.7000000     2.653000  0.9183000     -0.4228000     1.155000  
1 1 1 25 25 17 o 2.454000  0.5482000     2.268000  0.8777000     2.640000  0.6571000     -0.3719000     1.096000  
1 1 1 25 25 18 o 1.809000  0.4814000     1.427000  0.6187000     2.191000  0.7377000     -0.7646000     0.9628000 
1 1 1 25 25 19 o 1.769000  0.5594000     1.877000  0.8883000     1.660000  0.6803000     0.2174000      1.119000  
1 1 1 25 26 0  o 0.8323000 0.5555000     0.8323000 0.5555000     0.8323000 0.5555000     -0.000000      0.000000  
1 1 1 25 26 1  o 7.575000  0.1702000     7.592000  0.2525000     7.558000  0.2284000     0.3372000E-01  0.3405000 
1 1 1 25 26 2  o 1.799000  0.4197000     2.086000  0.6143000     1.511000  0.5720000     0.5752000      0.8394000 
1 1 1 25 26 3  f 3.243000  0.3226000     2.810000  0.5408000     3.676000  0.3519000     -0.8660000     0.6452000 
1 1 1 25 26 4  o 1.872000  0.4045000     1.506000  0.5835000     2.237000  0.5603000     -0.7313000     0.8089000 
1 1 1 25 26 5  o 8.351000  0.1620000     8.443000  0.2280000     8.259000  0.2303000     0.1835000      0.3241000 
1 1 1 25 26 6  o 6.438000  0.1874000     6.847000  0.2546000     6.030000  0.2750000     0.8172000      0.3748000 
1 1 1 25 26 7  o 4.890000  0.2296000     5.104000  0.3164000     4.676000  0.3328000     0.4276000      0.4592000 
1 1 1 25 26 8  o 5.042000  0.2289000     5.124000  0.3307000     4.959000  0.3166000     0.1647000      0.4579000 
1 1 1 25 26 9  o 4.582000  0.2526000     4.409000  0.3752000     4.755000  0.3382000     -0.3462000     0.5051000 
1 1 1 25 26 10 o 2.262000  0.4873000     1.918000  0.6389000     2.605000  0.7361000     -0.6865000     0.9747000 
1 1 1 25 26 11 o 1.699000  0.4478000     1.811000  0.6311000     1.586000  0.6356000     0.2248000      0.8957000 
1 1 1 25 26 12 o 2.025000  0.4678000     1.589000  0.6768000     2.461000  0.6461000     -0.8729000     0.9357000 
1 1 1 25 26 13 o 1.610000  0.5083000     1.971000  0.8385000     1.249000  0.5747000     0.7217000      1.017000  
1 1 1 25 26 14 o 2.194000  0.4841000     2.113000  0.6676000     2.274000  0.7013000     -0.1609000     0.9682000 
1 1 1 25 26 15 o 2.856000  0.4270000     3.256000  0.5323000     2.456000  0.6678000     0.7997000      0.8540000 
1 1 1 25 26 16 o 2.193000  0.5193000     2.470000  0.6632000     1.917000  0.7992000     0.5527000      1.039000  
1 1 1 25 26 17 o 2.215000  0.5609000     2.349000  0.8794000     2.081000  0.6964000     0.2675000      1.122000  
1 1 1 25 26 18 o 1.538000  0.4540000     1.097000  0.5238000     1.980000  0.7417000     -0.8824000     0.9080000 
1 1 1 25 26 19 o 1.160000  0.3992000     1.384000  0.6484000     0.9355000 0.4656000     0.4480000      0.7983000 
1 1 1 25 27 0  o 4.001000  0.3367000     4.001000  0.3367000     4.001000  0.3367000     -0.000000      0.000000  
1 1 1 25 27 1  o 4.021000  0.2333000     3.730000  0.3486000     4.312000  0.3102000     -0.5819000     0.4666000 
1 1 1 25 27 2  o 3.663000  0.2553000     3.553000  0.3646000     3.773000  0.3574000     -0.2203000     0.5106000 
1 1 1 25 27 3  o 3.259000  0.2912000     3.426000  0.3972000     3.093000  0.4259000     0.3326000      0.5824000 
1 1 1 25 27 4  f 6.092000  0.1877000     5.789000  0.2768000     6.394000  0.2536000     -0.6050000     0.3754000 
1 1 1 25 27 5  o 7.775000  0.1708000     8.202000  0.2365000     7.348000  0.2466000     0.8536000      0.3417000 
1 1 1 25 27 6  o 4.556000  0.2358000     4.572000  0.3258000     4.540000  0.3410000     0.3204000E-01  0.4716000 
1 1 1 25 27 7  o 3.919000  0.2696000     4.064000  0.3765000     3.775000  0.3859000     0.2893000      0.5391000 
1 1 1 25 27 8  o 4.123000  0.2704000     4.013000  0.3894000     4.234000  0.3754000     -0.2209000     0.5409000 
1 1 1 25 27 9  o 2.409000  0.5052000     2.841000  0.7359000     1.978000  0.6922000     0.8634000      1.010000  
1 1 1 25 27 10 o 1.696000  0.4453000     1.502000  0.6156000     1.890000  0.6436000     -0.3878000     0.8906000 
1 1 1 25 27 11 o 3.319000  0.3508000     3.109000  0.5279000     3.529000  0.4621000     -0.4197000     0.7016000 
1 1 1 25 27 12 o 6.299000  0.2585000     6.711000  0.3120000     5.886000  0.4121000     0.8245000      0.5169000 
1 1 1 25 27 13 o 2.513000  0.4525000     2.220000  0.7358000     2.806000  0.5267000     -0.5861000     0.9049000 
1 1 1 25 27 14 o 1.888000  0.4565000     2.264000  0.6473000     1.511000  0.6439000     0.7529000      0.9130000 
1 1 1 25 27 15 o 1.843000  0.4426000     1.254000  0.5706000     2.431000  0.6768000     -1.177000      0.8852000 
1 1 1 25 27 16 f 1.741000  0.4775000     2.318000  0.7779000     1.163000  0.5540000     1.155000       0.9551000 
1 1 1 25 27 17 o 1.730000  0.5246000     2.051000  0.8443000     1.409000  0.6230000     0.6421000      1.049000  
1 1 1 25 27 18 o 1.182000  0.3957000     1.005000  0.4915000     1.360000  0.6204000     -0.3553000     0.7915000 
1 1 1 25 28 0  o 5.783000  0.2613000     5.783000  0.2613000     5.783000  0.2613000     -0.000000      0.000000  
1 1 1 25 28 1  o 5.632000  0.1926000     5.634000  0.2688000     5.630000  0.2759000     0.4121000E-02  0.3852000 
1 1 1 25 28 2  o 4.639000  0.2193000     4.671000  0.3110000     4.607000  0.3095000     0.6404000E-01  0.4387000 
1 1 1 25 28 3  o 5.391000  0.1997000     5.402000  0.2801000     5.379000  0.2848000     0.2280000E-01  0.3995000 
1 1 1 25 28 4  o 9.914000  0.1583000     9.873000  0.2247000     9.954000  0.2229000     -0.8112000E-01 0.3165000 
1 1 1 25 28 5  o 8.201000  0.1698000     8.305000  0.2394000     8.097000  0.2407000     0.2081000      0.3395000 
1 1 1 25 28 6  o 13.11000  0.1640000     13.17000  0.2320000     13.05000  0.2318000     0.1176000      0.3279000 
1 1 1 25 28 7  o 6.446000  0.1902000     6.360000  0.2696000     6.532000  0.2685000     -0.1721000     0.3804000 
1 1 1 25 28 8  o 1.518000  0.4243000     1.283000  0.5668000     1.752000  0.6314000     -0.4683000     0.8485000 
1 1 1 25 28 9  o 3.008000  0.4348000     2.986000  0.5616000     3.031000  0.6640000     -0.4561000E-01 0.8697000 
1 1 1 25 28 10 o 5.076000  0.2437000     5.327000  0.3374000     4.825000  0.3519000     0.5019000      0.4875000 
1 1 1 25 28 11 f 5.332000  0.2683000     4.779000  0.3515000     5.885000  0.4053000     -1.107000      0.5365000 
1 1 1 25 28 12 o 1.383000  0.4463000     1.362000  0.6611000     1.403000  0.5997000     -0.4084000E-01 0.8925000 
1 1 1 25 28 13 o 1.987000  0.4671000     1.907000  0.7073000     2.067000  0.6102000     -0.1593000     0.9341000 
1 1 1 25 28 14 o 2.331000  0.4968000     2.611000  0.7178000     2.051000  0.6871000     0.5596000      0.9936000 
1 1 1 25 28 15 o 1.182000  0.3970000     0.9753000 0.4818000     1.389000  0.6310000     -0.4141000     0.7940000 
1 1 1 25 28 16 o 2.004000  0.5472000     2.033000  0.8423000     1.976000  0.6987000     0.5723000E-01  1.094000  
1 1 1 25 28 17 o 1.514000  0.4569000     1.233000  0.6049000     1.795000  0.6850000     -0.5627000     0.9138000 
1 1 1 25 28 18 o 1.463000  0.4686000     1.399000  0.6516000     1.527000  0.6736000     -0.1287000     0.9372000 
1 1 1 25 29 0  o 7.664000  0.2347000     7.664000  0.2347000     7.664000  0.2347000     -0.000000      0.000000  
1 1 1 25 29 1  o 13.52000  0.1595000     13.55000  0.2245000     13.50000  0.2265000     0.4964000E-01  0.3190000 
1 1 1 25 29 2  o 2.726000  0.3605000     3.254000  0.4186000     2.198000  0.5871000     1.056000       0.7211000 
1 1 1 25 29 3  o 3.930000  0.2572000     4.248000  0.3358000     3.611000  0.3897000     0.6365000      0.5144000 
1 1 1 25 29 4  o 1.488000  0.3980000     1.129000  0.5140000     1.846000  0.6077000     -0.7169000     0.7960000 
1 1 1 25 29 5  o 4.076000  0.2620000     4.366000  0.3504000     3.785000  0.3895000     0.5811000      0.5240000 
1 1 1 25 29 6  o 3.856000  0.2807000     3.918000  0.3881000     3.795000  0.4057000     0.1230000      0.5615000 
1 1 1 25 29 7  o 2.884000  0.3587000     2.937000  0.5018000     2.831000  0.5127000     0.1063000      0.7174000 
1 1 1 25 29 8  o 2.793000  0.4826000     3.461000  0.6666000     2.124000  0.6979000     1.337000       0.9651000 
1 1 1 25 29 9  o 2.409000  0.3885000     3.347000  0.4635000     1.472000  0.6237000     1.876000       0.7771000 
1 1 1 25 29 10 o 2.474000  0.4414000     2.285000  0.6585000     2.663000  0.5879000     -0.3780000     0.8827000 
1 1 1 25 29 11 o 1.380000  0.4364000     1.410000  0.6076000     1.350000  0.6265000     0.6005000E-01  0.8727000 
1 1 1 25 29 12 o 2.271000  0.4429000     2.309000  0.6229000     2.233000  0.6299000     0.7525000E-01  0.8859000 
1 1 1 25 29 13 o 2.416000  0.4139000     2.450000  0.5857000     2.383000  0.5851000     0.6762000E-01  0.8279000 
1 1 1 25 29 14 o 2.471000  0.4480000     3.241000  0.6511000     1.701000  0.6155000     1.540000       0.8960000 
1 1 1 25 29 15 o 3.393000  0.5901000     3.535000  0.5699000     3.252000  1.033000      0.2827000      1.180000  
1 1 1 25 29 16 o 1.851000  0.5211000     1.770000  0.7821000     1.933000  0.6887000     -0.1621000     1.042000  
1 1 1 25 29 17 o 2.038000  0.5324000     1.789000  0.7907000     2.286000  0.7132000     -0.4969000     1.065000  
1 1 1 25 29 18 o 1.353000  0.4457000     1.330000  0.6330000     1.376000  0.6277000     -0.4536000E-01 0.8914000 
1 1 1 25 30 0  o 4.835000  0.2976000     4.835000  0.2976000     4.835000  0.2976000     -0.000000      0.000000  
1 1 1 25 30 1  o 4.615000  0.2260000     4.941000  0.2963000     4.288000  0.3412000     0.6528000      0.4519000 
1 1 1 25 30 2  o 2.068000  0.4009000     2.561000  0.5293000     1.574000  0.6022000     0.9875000      0.8018000 
1 1 1 25 30 3  o 1.769000  0.4265000     1.710000  0.6022000     1.828000  0.6041000     -0.1178000     0.8530000 
1 1 1 25 30 4  o 8.006000  0.1692000     8.147000  0.2365000     7.865000  0.2419000     0.2820000      0.3384000 
1 1 1 25 30 5  o 7.187000  0.1793000     7.247000  0.2545000     7.127000  0.2525000     0.1204000      0.3585000 
1 1 1 25 30 6  o 5.083000  0.2298000     4.851000  0.3379000     5.314000  0.3116000     -0.4628000     0.4596000 
1 1 1 25 30 7  o 2.041000  0.4809000     2.115000  0.7127000     1.967000  0.6460000     0.1483000      0.9619000 
1 1 1 25 30 8  o 3.500000  0.3760000     3.520000  0.4731000     3.481000  0.5846000     0.3879000E-01  0.7520000 
1 1 1 25 30 9  o 2.270000  0.4533000     2.299000  0.6389000     2.241000  0.6432000     0.5788000E-01  0.9066000 
1 1 1 25 30 10 o 5.930000  0.2393000     5.949000  0.3162000     5.911000  0.3591000     0.3845000E-01  0.4785000 
1 1 1 25 30 11 o 3.811000  0.3455000     3.453000  0.5679000     4.170000  0.3936000     -0.7165000     0.6909000 
1 1 1 25 30 12 o 1.225000  0.3896000     1.278000  0.5629000     1.172000  0.5388000     0.1059000      0.7792000 
1 1 1 25 30 13 o 3.013000  0.3777000     3.271000  0.4736000     2.756000  0.5887000     0.5154000      0.7555000 
1 1 1 25 30 14 o 1.648000  0.4366000     1.334000  0.6078000     1.962000  0.6270000     -0.6281000     0.8732000 
1 1 1 25 30 15 o 1.438000  0.4483000     1.183000  0.5650000     1.693000  0.6962000     -0.5096000     0.8966000 
1 1 1 25 30 16 o 2.248000  0.5276000     1.932000  0.8218000     2.565000  0.6620000     -0.6332000     1.055000  
1 1 1 25 30 17 o 1.426000  0.4497000     1.338000  0.6087000     1.514000  0.6622000     -0.1759000     0.8995000 
1 1 1 25 30 18 o 1.391000  0.4408000     1.444000  0.6290000     1.338000  0.6175000     0.1055000      0.8815000 
1 1 1 25 31 0  f 3.789000  0.3672000     3.789000  0.3672000     3.789000  0.3672000     -0.000000      0.000000  
1 1 1 25 31 1  o 6.925000  0.1741000     6.825000  0.2433000     7.024000  0.2491000     -0.1985000     0.3482000 
1 1 1 25 31 2  o 3.461000  0.2964000     3.396000  0.4190000     3.526000  0.4194000     -0.1298000     0.5928000 
1 1 1 25 31 3  o 5.307000  0.2100000     5.381000  0.2931000     5.233000  0.3008000     0.1484000      0.4200000 
1 1 1 25 31 4  o 5.420000  0.2100000     5.549000  0.2926000     5.292000  0.3013000     0.2570000      0.4200000 
1 1 1 25 31 5  o 7.424000  0.1816000     7.354000  0.2595000     7.493000  0.2540000     -0.1388000     0.3631000 
1 1 1 25 31 6  o 6.286000  0.2004000     6.370000  0.2796000     6.201000  0.2871000     0.1690000      0.4008000 
1 1 1 25 31 7  o 2.463000  0.4569000     1.697000  0.7141000     3.229000  0.5702000     -1.532000      0.9139000 
1 1 1 25 31 8  o 3.217000  0.3498000     3.182000  0.4800000     3.251000  0.5088000     -0.6876000E-01 0.6995000 
1 1 1 25 31 9  o 1.536000  0.4362000     1.669000  0.6313000     1.404000  0.6021000     0.2654000      0.8723000 
1 1 1 25 31 10 o 2.583000  0.4881000     2.621000  0.6414000     2.545000  0.7360000     0.7624000E-01  0.9763000 
1 1 1 25 31 11 o 2.671000  0.4169000     2.677000  0.5879000     2.666000  0.5913000     0.1139000E-01  0.8339000 
1 1 1 25 31 12 o 2.442000  0.4362000     2.546000  0.5913000     2.338000  0.6413000     0.2078000      0.8723000 
1 1 1 25 31 13 f 1.512000  0.4288000     1.615000  0.6158000     1.409000  0.5968000     0.2062000      0.8575000 
1 1 1 25 31 14 o 2.137000  0.4939000     1.985000  0.7633000     2.289000  0.6271000     -0.3046000     0.9879000 
1 1 1 25 31 15 o 1.301000  0.4109000     1.305000  0.6021000     1.297000  0.5593000     0.7566000E-02  0.8218000 
1 1 1 25 31 16 o 1.331000  0.4469000     1.502000  0.7060000     1.161000  0.5483000     0.3413000      0.8939000 
1 1 1 25 31 17 f 2.677000  0.5663000     2.956000  0.8388000     2.397000  0.7610000     0.5588000      1.133000  
1 1 1 25 32 0  o 5.203000  0.3067000     5.203000  0.3067000     5.203000  0.3067000     0.000000       0.000000  
1 1 1 25 32 1  o 2.709000  0.3629000     1.727000  0.6121000     3.692000  0.3901000     -1.965000      0.7258000 
1 1 1 25 32 2  o 2.727000  0.3719000     2.631000  0.5292000     2.822000  0.5226000     -0.1910000     0.7438000 
1 1 1 25 32 3  o 7.303000  0.1793000     7.196000  0.2553000     7.410000  0.2519000     -0.2139000     0.3586000 
1 1 1 25 32 4  o 7.864000  0.1758000     7.764000  0.2492000     7.965000  0.2479000     -0.2011000     0.3515000 
1 1 1 25 32 5  o 12.26000  0.1674000     12.18000  0.2368000     12.34000  0.2367000     -0.1561000     0.3348000 
1 1 1 25 32 6  o 2.838000  0.4229000     3.180000  0.5968000     2.495000  0.5994000     0.6848000      0.8459000 
1 1 1 25 32 7  f 3.519000  0.3800000     3.607000  0.5375000     3.432000  0.5374000     0.1750000      0.7601000 
1 1 1 25 32 8  o 1.746000  0.4384000     1.405000  0.5879000     2.087000  0.6506000     -0.6821000     0.8769000 
1 1 1 25 32 9  o 1.466000  0.4525000     1.577000  0.6355000     1.354000  0.6443000     0.2230000      0.9050000 
1 1 1 25 32 10 o 1.753000  0.4683000     2.113000  0.7266000     1.392000  0.5908000     0.7212000      0.9365000 
1 1 1 25 32 11 o 1.667000  0.4373000     2.008000  0.6515000     1.326000  0.5834000     0.6826000      0.8746000 
1 1 1 25 32 12 o 1.376000  0.4172000     1.222000  0.5508000     1.529000  0.6268000     -0.3071000     0.8345000 
1 1 1 25 32 13 o 2.776000  0.3993000     2.747000  0.5691000     2.805000  0.5602000     -0.5822000E-01 0.7986000 
1 1 1 25 32 14 o 1.190000  0.3943000     1.130000  0.5328000     1.249000  0.5813000     -0.1195000     0.7885000 
1 1 1 25 32 15 o 1.759000  0.4754000     1.938000  0.7330000     1.581000  0.6055000     0.3572000      0.9507000 
1 1 1 25 32 16 o 3.124000  0.5421000     3.415000  0.8669000     2.833000  0.6513000     0.5814000      1.084000  
1 1 1 25 32 17 o 1.094000  0.3804000     0.9518000 0.4858000     1.236000  0.5854000     -0.2842000     0.7607000 
1 1 1 25 33 0  o 9.027000  0.2327000     9.027000  0.2327000     9.027000  0.2327000     -0.000000      0.000000  
1 1 1 25 33 1  o 1.583000  0.3877000     1.038000  0.4872000     2.127000  0.6033000     -1.089000      0.7754000 
1 1 1 25 33 2  o 1.587000  0.3802000     0.9524000 0.4609000     2.221000  0.6049000     -1.269000      0.7605000 
1 1 1 25 33 3  o 5.896000  0.2040000     5.842000  0.2904000     5.951000  0.2865000     -0.1089000     0.4079000 
1 1 1 25 33 4  o 6.618000  0.1899000     6.676000  0.2701000     6.561000  0.2669000     0.1146000      0.3797000 
1 1 1 25 33 5  o 4.306000  0.2882000     4.312000  0.4503000     4.299000  0.3597000     0.1271000E-01  0.5763000 
1 1 1 25 33 6  o 3.282000  0.4055000     3.171000  0.5442000     3.394000  0.6014000     -0.2240000     0.8110000 
1 1 1 25 33 7  o 5.033000  0.2369000     5.207000  0.3240000     4.859000  0.3457000     0.3472000      0.4738000 
1 1 1 25 33 8  o 5.206000  0.2778000     5.582000  0.3474000     4.830000  0.4337000     0.7520000      0.5556000 
1 1 1 25 33 9  o 6.786000  0.2496000     6.797000  0.3493000     6.775000  0.3567000     0.2154000E-01  0.4992000 
1 1 1 25 33 10 o 5.331000  0.2392000     5.136000  0.3427000     5.525000  0.3338000     -0.3897000     0.4783000 
1 1 1 25 33 11 o 2.868000  0.4020000     2.693000  0.6035000     3.043000  0.5312000     -0.3503000     0.8040000 
1 1 1 25 33 12 o 2.812000  0.4031000     2.979000  0.5379000     2.646000  0.6006000     0.3336000      0.8062000 
1 1 1 25 33 13 o 1.850000  0.4832000     1.819000  0.7092000     1.881000  0.6564000     -0.6180000E-01 0.9663000 
1 1 1 25 33 14 o 1.215000  0.3922000     1.201000  0.5419000     1.230000  0.5672000     -0.2924000E-01 0.7844000 
1 1 1 25 33 15 o 1.564000  0.4855000     1.843000  0.7963000     1.285000  0.5556000     0.5584000      0.9709000 
1 1 1 25 33 16 o 1.395000  0.4655000     1.540000  0.7209000     1.251000  0.5891000     0.2892000      0.9310000 
1 1 1 25 33 17 o 1.251000  0.4107000     1.291000  0.5857000     1.210000  0.5761000     0.8065000E-01  0.8215000 
1 1 1 25 34 0  f 1.008000  0.6326000     1.008000  0.6326000     1.008000  0.6326000     -0.000000      0.000000  
1 1 1 25 34 1  o 2.578000  0.3931000     2.218000  0.6100000     2.938000  0.4960000     -0.7203000     0.7862000 
1 1 1 25 34 2  o 4.444000  0.2485000     4.360000  0.3493000     4.528000  0.3535000     -0.1681000     0.4970000 
1 1 1 25 34 3  o 5.940000  0.2067000     5.999000  0.2888000     5.881000  0.2959000     0.1187000      0.4134000 
1 1 1 25 34 4  o 2.396000  0.4537000     2.351000  0.6865000     2.442000  0.5933000     -0.9101000E-01 0.9074000 
1 1 1 25 34 5  o 2.065000  0.4708000     1.665000  0.6622000     2.465000  0.6695000     -0.8002000     0.9417000 
1 1 1 25 34 6  o 3.073000  0.3656000     3.145000  0.4988000     3.001000  0.5346000     0.1440000      0.7312000 
1 1 1 25 34 7  o 2.952000  0.4207000     2.548000  0.6064000     3.356000  0.5834000     -0.8087000     0.8415000 
1 1 1 25 34 8  o 4.861000  0.3345000     5.116000  0.4867000     4.606000  0.4589000     0.5100000      0.6689000 
1 1 1 25 34 9  o 4.104000  0.2969000     4.517000  0.3742000     3.691000  0.4611000     0.8260000      0.5938000 
1 1 1 25 34 10 o 1.630000  0.4034000     2.240000  0.6416000     1.020000  0.4892000     1.220000       0.8068000 
1 1 1 25 34 11 o 1.777000  0.4426000     1.443000  0.6126000     2.111000  0.6390000     -0.6681000     0.8852000 
1 1 1 25 34 12 o 1.869000  0.4617000     1.894000  0.6451000     1.844000  0.6607000     0.5031000E-01  0.9234000 
1 1 1 25 34 13 o 2.550000  0.5266000     2.362000  0.8156000     2.738000  0.6664000     -0.3759000     1.053000  
1 1 1 25 34 14 o 2.125000  0.4502000     2.439000  0.6225000     1.811000  0.6505000     0.6281000      0.9003000 
1 1 1 25 34 15 o 4.147000  0.3130000     4.131000  0.4717000     4.163000  0.4115000     -0.3211000E-01 0.6259000 
1 1 1 25 34 16 o 1.876000  0.5474000     1.719000  0.8294000     2.033000  0.7147000     -0.3139000     1.095000  
1 1 1 25 35 0  o 2.150000  0.7106000     2.150000  0.7106000     2.150000  0.7106000     -0.000000      0.000000  
1 1 1 25 35 1  o 4.931000  0.2275000     5.117000  0.3152000     4.744000  0.3281000     0.3733000      0.4550000 
1 1 1 25 35 2  o 4.723000  0.2426000     4.937000  0.3311000     4.509000  0.3547000     0.4274000      0.4853000 
1 1 1 25 35 3  o 6.531000  0.2201000     6.300000  0.3410000     6.763000  0.2783000     -0.4629000     0.4402000 
1 1 1 25 35 4  o 4.263000  0.2946000     4.099000  0.4297000     4.427000  0.4032000     -0.3273000     0.5893000 
1 1 1 25 35 5  o 4.854000  0.2854000     4.595000  0.3626000     5.113000  0.4409000     -0.5177000     0.5708000 
1 1 1 25 35 6  o 7.431000  0.2231000     7.140000  0.3107000     7.722000  0.3203000     -0.5819000     0.4463000 
1 1 1 25 35 7  o 5.729000  0.2986000     5.433000  0.4621000     6.025000  0.3784000     -0.5917000     0.5972000 
1 1 1 25 35 8  o 2.390000  0.4322000     1.948000  0.6562000     2.832000  0.5626000     -0.8836000     0.8644000 
1 1 1 25 35 9  o 5.127000  0.2464000     5.326000  0.3327000     4.928000  0.3637000     0.3977000      0.4929000 
1 1 1 25 35 10 o 6.595000  0.2120000     6.351000  0.3062000     6.839000  0.2934000     -0.4883000     0.4241000 
1 1 1 25 35 11 o 2.069000  0.4422000     2.407000  0.6054000     1.730000  0.6448000     0.6775000      0.8844000 
1 1 1 25 35 12 o 1.561000  0.4407000     1.428000  0.6017000     1.694000  0.6441000     -0.2666000     0.8814000 
1 1 1 25 35 13 o 1.631000  0.4605000     1.812000  0.6644000     1.449000  0.6378000     0.3633000      0.9210000 
1 1 1 25 35 14 o 2.643000  0.4180000     2.679000  0.5884000     2.608000  0.5939000     0.7068000E-01  0.8360000 
1 1 1 25 35 15 o 1.247000  0.4054000     1.239000  0.5718000     1.255000  0.5749000     -0.1659000E-01 0.8108000 
1 1 1 25 35 16 o 1.600000  0.4688000     1.486000  0.7042000     1.714000  0.6191000     -0.2288000     0.9377000 
1 1 1 25 36 0  o 1.906000  0.8318000     1.906000  0.8318000     1.906000  0.8318000     0.000000       0.000000  
1 1 1 25 36 1  o 4.635000  0.2967000     4.654000  0.4208000     4.617000  0.4185000     0.3633000E-01  0.5934000 
1 1 1 25 36 2  f 6.671000  0.2864000     6.692000  0.4135000     6.651000  0.3965000     0.4042000E-01  0.5729000 
1 1 1 25 36 3  o 4.271000  0.4267000     4.344000  0.4131000     4.198000  0.7467000     0.1461000      0.8534000 
1 1 1 25 36 4  o 3.874000  0.3557000     4.025000  0.3946000     3.724000  0.5920000     0.3004000      0.7114000 
1 1 1 25 36 5  o 3.672000  0.3619000     3.659000  0.4830000     3.685000  0.5390000     -0.2584000E-01 0.7237000 
1 1 1 25 36 6  o 2.891000  0.4722000     2.374000  0.7345000     3.408000  0.5935000     -1.035000      0.9443000 
1 1 1 25 36 7  o 7.544000  0.1991000     7.694000  0.2760000     7.394000  0.2871000     0.3001000      0.3983000 
1 1 1 25 36 8  o 2.729000  0.4073000     2.986000  0.5451000     2.473000  0.6054000     0.5128000      0.8147000 
1 1 1 25 36 9  o 5.674000  0.2309000     5.671000  0.3220000     5.677000  0.3311000     -0.5693000E-02 0.4619000 
1 1 1 25 36 10 o 1.933000  0.4351000     1.466000  0.6107000     2.400000  0.6199000     -0.9342000     0.8702000 
1 1 1 25 36 11 o 1.584000  0.4355000     1.301000  0.5751000     1.868000  0.6541000     -0.5673000     0.8710000 
1 1 1 25 36 12 o 1.917000  0.5067000     2.369000  0.8057000     1.464000  0.6147000     0.9053000      1.013000  
1 1 1 25 36 13 o 2.987000  0.3801000     3.111000  0.5042000     2.863000  0.5689000     0.2480000      0.7601000 
1 1 1 25 36 14 o 1.548000  0.4110000     1.994000  0.6382000     1.102000  0.5181000     0.8921000      0.8220000 
1 1 1 25 36 15 o 1.728000  0.4980000     1.918000  0.7254000     1.538000  0.6824000     0.3793000      0.9959000 
1 1 1 25 36 16 o 2.947000  0.4571000     2.569000  0.6876000     3.326000  0.6026000     -0.7573000     0.9142000 
1 1 1 25 37 0  o 2.880000  0.7790000     2.880000  0.7790000     2.880000  0.7790000     -0.000000      0.000000  
1 1 1 25 37 1  o 1.555000  0.4958000     1.340000  0.6105000     1.770000  0.7814000     -0.4303000     0.9916000 
1 1 1 25 37 2  o 2.390000  0.4976000     2.675000  0.6246000     2.106000  0.7748000     0.5691000      0.9952000 
1 1 1 25 37 3  o 3.644000  0.3549000     3.483000  0.4974000     3.806000  0.5064000     -0.3229000     0.7099000 
1 1 1 25 37 4  o 4.185000  0.3551000     4.231000  0.5434000     4.139000  0.4574000     0.9204000E-01  0.7103000 
1 1 1 25 37 5  o 1.812000  0.4656000     2.236000  0.7156000     1.389000  0.5957000     0.8472000      0.9311000 
1 1 1 25 37 6  o 4.629000  0.2682000     4.348000  0.3944000     4.909000  0.3635000     -0.5611000     0.5364000 
1 1 1 25 37 7  o 3.577000  0.3209000     3.611000  0.4535000     3.543000  0.4541000     0.6802000E-01  0.6418000 
1 1 1 25 37 8  f 3.217000  0.3667000     3.030000  0.5522000     3.404000  0.4826000     -0.3737000     0.7333000 
1 1 1 25 37 9  o 3.593000  0.3364000     3.734000  0.4478000     3.451000  0.5021000     0.2830000      0.6728000 
1 1 1 25 37 10 o 2.813000  0.4125000     3.115000  0.5518000     2.511000  0.6132000     0.6034000      0.8249000 
1 1 1 25 37 11 o 1.627000  0.4473000     1.670000  0.6414000     1.585000  0.6237000     0.8447000E-01  0.8947000 
1 1 1 25 37 12 f 2.134000  0.5061000     1.859000  0.6857000     2.410000  0.7445000     -0.5511000     1.012000  
1 1 1 25 37 13 o 2.973000  0.3925000     2.733000  0.5864000     3.214000  0.5220000     -0.4809000     0.7850000 
1 1 1 25 37 14 o 1.594000  0.4530000     1.660000  0.6373000     1.528000  0.6440000     0.1314000      0.9061000 
1 1 1 25 37 15 o 2.621000  0.4573000     2.757000  0.6417000     2.486000  0.6518000     0.2701000      0.9147000 
1 1 1 25 38 0  o 3.536000  0.5297000     3.536000  0.5297000     3.536000  0.5297000     0.000000       0.000000  
1 1 1 25 38 1  o 1.765000  0.4638000     1.628000  0.6592000     1.901000  0.6527000     -0.2725000     0.9277000 
1 1 1 25 38 2  o 5.041000  0.2602000     5.264000  0.3849000     4.818000  0.3501000     0.4461000      0.5203000 
1 1 1 25 38 3  o 6.194000  0.2307000     6.280000  0.3458000     6.108000  0.3056000     0.1720000      0.4615000 
1 1 1 25 38 4  o 3.128000  0.3631000     3.160000  0.5121000     3.096000  0.5148000     0.6378000E-01  0.7261000 
1 1 1 25 38 5  o 2.946000  0.3943000     3.328000  0.5064000     2.563000  0.6046000     0.7651000      0.7887000 
1 1 1 25 38 6  o 3.843000  0.3088000     3.935000  0.4273000     3.751000  0.4460000     0.1838000      0.6176000 
1 1 1 25 38 7  o 2.500000  0.4343000     2.557000  0.6149000     2.443000  0.6135000     0.1146000      0.8687000 
1 1 1 25 38 8  o 4.077000  0.2902000     4.007000  0.4192000     4.147000  0.4014000     -0.1400000     0.5803000 
1 1 1 25 38 9  o 2.068000  0.3809000     1.146000  0.5307000     2.990000  0.5466000     -1.843000      0.7619000 
1 1 1 25 38 10 o 1.633000  0.4218000     2.087000  0.6479000     1.178000  0.5401000     0.9095000      0.8435000 
1 1 1 25 38 11 o 2.444000  0.5061000     3.068000  0.7823000     1.820000  0.6421000     1.248000       1.012000  
1 1 1 25 38 12 o 3.921000  0.3201000     3.896000  0.4248000     3.947000  0.4789000     -0.5137000E-01 0.6401000 
1 1 1 25 38 13 o 1.544000  0.4378000     1.355000  0.5925000     1.734000  0.6446000     -0.3783000     0.8755000 
1 1 1 25 38 14 o 1.419000  0.4576000     1.422000  0.6471000     1.416000  0.6473000     0.5930000E-02  0.9153000 
1 1 1 25 38 15 o 1.673000  0.4647000     1.671000  0.6727000     1.676000  0.6414000     -0.4872000E-02 0.9295000 
1 1 1 25 39 0  o 1.138000  0.6883000     1.138000  0.6883000     1.138000  0.6883000     0.000000       0.000000  
1 1 1 25 39 1  o 4.443000  0.2673000     4.424000  0.3753000     4.462000  0.3807000     -0.3822000E-01 0.5346000 
1 1 1 25 39 2  o 6.657000  0.2075000     7.061000  0.2797000     6.252000  0.3067000     0.8092000      0.4151000 
1 1 1 25 39 3  o 2.159000  0.4587000     2.127000  0.6480000     2.191000  0.6493000     -0.6411000E-01 0.9173000 
1 1 1 25 39 4  o 5.982000  0.2227000     6.522000  0.2937000     5.442000  0.3349000     1.080000       0.4454000 
1 1 1 25 39 5  o 3.650000  0.3210000     3.872000  0.4276000     3.429000  0.4788000     0.4438000      0.6420000 
1 1 1 25 39 6  o 4.376000  0.2713000     4.206000  0.4036000     4.545000  0.3628000     -0.3386000     0.5427000 
1 1 1 25 39 7  o 3.234000  0.3610000     3.166000  0.5244000     3.301000  0.4963000     -0.1351000     0.7220000 
1 1 1 25 39 8  o 2.305000  0.4583000     2.130000  0.6569000     2.480000  0.6392000     -0.3500000     0.9166000 
1 1 1 25 39 9  o 1.691000  0.4512000     1.570000  0.6248000     1.811000  0.6512000     -0.2403000     0.9025000 
1 1 1 25 39 10 o 1.514000  0.4279000     1.300000  0.5740000     1.728000  0.6348000     -0.4276000     0.8558000 
1 1 1 25 39 11 o 4.683000  0.3517000     5.433000  0.3840000     3.934000  0.5895000     1.500000       0.7035000 
1 1 1 25 39 12 o 1.335000  0.4121000     1.280000  0.5712000     1.389000  0.5941000     -0.1090000     0.8242000 
1 1 1 25 39 13 o 1.355000  0.4224000     1.278000  0.5717000     1.432000  0.6220000     -0.1542000     0.8448000 
1 1 1 25 39 14 f 1.401000  0.4366000     1.460000  0.6439000     1.341000  0.5897000     0.1188000      0.8731000 
1 1 1 25 40 0  o 3.448000  0.4871000     3.448000  0.4871000     3.448000  0.4871000     -0.000000      0.000000  
1 1 1 25 40 1  o 3.056000  0.3727000     3.122000  0.5118000     2.990000  0.5419000     0.1319000      0.7454000 
1 1 1 25 40 2  o 1.262000  0.3981000     1.329000  0.5781000     1.195000  0.5476000     0.1335000      0.7962000 
1 1 1 25 40 3  o 3.012000  0.3777000     3.068000  0.5134000     2.956000  0.5542000     0.1122000      0.7555000 
1 1 1 25 40 4  o 1.618000  0.4251000     2.043000  0.6515000     1.194000  0.5463000     0.8492000      0.8503000 
1 1 1 25 40 5  o 5.513000  0.2343000     6.039000  0.3123000     4.988000  0.3494000     1.051000       0.4686000 
1 1 1 25 40 6  o 3.352000  0.3486000     3.765000  0.4380000     2.939000  0.5425000     0.8263000      0.6973000 
1 1 1 25 40 7  o 3.101000  0.3805000     3.374000  0.4969000     2.828000  0.5765000     0.5461000      0.7611000 
1 1 1 25 40 8  o 3.852000  0.3133000     4.152000  0.4070000     3.551000  0.4765000     0.6003000      0.6266000 
1 1 1 25 40 9  o 2.488000  0.4397000     2.490000  0.6188000     2.486000  0.6249000     0.3747000E-02  0.8795000 
1 1 1 25 40 10 o 2.388000  0.5453000     2.623000  0.8425000     2.154000  0.6926000     0.4692000      1.091000  
1 1 1 25 40 11 o 2.392000  0.4804000     2.553000  0.6361000     2.231000  0.7200000     0.3219000      0.9607000 
1 1 1 25 40 12 o 1.868000  0.4334000     1.288000  0.5761000     2.449000  0.6477000     -1.161000      0.8668000 
1 1 1 25 40 13 o 1.601000  0.4270000     2.165000  0.6827000     1.037000  0.5129000     1.128000       0.8539000 
1 1 1 25 40 14 o 1.499000  0.4466000     1.561000  0.6520000     1.436000  0.6106000     0.1255000      0.8932000 
1 1 1 25 41 0  o 3.086000  0.5693000     3.086000  0.5693000     3.086000  0.5693000     -0.000000      0.000000  
1 1 1 25 41 1  f 1.892000  0.4233000     1.327000  0.5813000     2.458000  0.6155000     -1.131000      0.8466000 
1 1 1 25 41 2  o 3.315000  0.3780000     4.367000  0.3870000     2.264000  0.6495000     2.103000       0.7561000 
1 1 1 25 41 3  o 3.893000  0.3124000     3.445000  0.4878000     4.340000  0.3904000     -0.8951000     0.6248000 
1 1 1 25 41 4  o 3.616000  0.3352000     4.077000  0.4128000     3.155000  0.5282000     0.9215000      0.6704000 
1 1 1 25 41 5  o 1.676000  0.4528000     1.587000  0.6318000     1.766000  0.6488000     -0.1793000     0.9056000 
1 1 1 25 41 6  o 4.992000  0.2502000     4.558000  0.3792000     5.426000  0.3264000     -0.8685000     0.5003000 
1 1 1 25 41 7  o 2.560000  0.4426000     2.569000  0.6198000     2.551000  0.6321000     0.1769000E-01  0.8852000 
1 1 1 25 41 8  o 3.240000  0.3780000     3.771000  0.4309000     2.709000  0.6211000     1.062000       0.7560000 
1 1 1 25 41 9  o 4.518000  0.3225000     4.289000  0.5229000     4.746000  0.3776000     -0.4575000     0.6449000 
1 1 1 25 41 10 o 2.854000  0.4645000     3.217000  0.5109000     2.491000  0.7758000     0.7254000      0.9290000 
1 1 1 25 41 11 o 3.096000  0.3865000     2.926000  0.5662000     3.265000  0.5263000     -0.3395000     0.7730000 
1 1 1 25 41 12 o 1.758000  0.5042000     1.878000  0.6947000     1.637000  0.7309000     0.2407000      1.008000  
1 1 1 25 41 13 o 1.529000  0.4492000     1.605000  0.6606000     1.454000  0.6090000     0.1510000      0.8984000 
1 1 1 25 42 0  o 4.167000  0.4908000     4.167000  0.4908000     4.167000  0.4908000     -0.000000      0.000000  
1 1 1 25 42 1  o 2.637000  0.4223000     2.491000  0.6320000     2.784000  0.5602000     -0.2936000     0.8445000 
1 1 1 25 42 2  o 2.315000  0.4561000     2.177000  0.6478000     2.452000  0.6422000     -0.2752000     0.9122000 
1 1 1 25 42 3  o 3.024000  0.3828000     2.607000  0.6021000     3.441000  0.4727000     -0.8332000     0.7655000 
1 1 1 25 42 4  o 3.129000  0.3771000     3.560000  0.4691000     2.699000  0.5905000     0.8614000      0.7541000 
1 1 1 25 42 5  o 3.489000  0.3351000     3.606000  0.4589000     3.372000  0.4883000     0.2342000      0.6702000 
1 1 1 25 42 6  o 5.365000  0.2439000     5.339000  0.3463000     5.390000  0.3436000     -0.5087000E-01 0.4879000 
1 1 1 25 42 7  o 1.163000  0.3807000     0.9630000 0.4698000     1.364000  0.5992000     -0.4008000     0.7614000 
1 1 1 25 42 8  o 3.109000  0.3888000     2.941000  0.5786000     3.278000  0.5196000     -0.3374000     0.7777000 
1 1 1 25 42 9  o 2.193000  0.4052000     3.209000  0.5901000     1.177000  0.5553000     2.033000       0.8103000 
1 1 1 25 42 10 o 2.895000  0.4129000     3.622000  0.4784000     2.168000  0.6731000     1.453000       0.8258000 
1 1 1 25 42 11 o 1.520000  0.4503000     1.577000  0.6337000     1.463000  0.6398000     0.1136000      0.9005000 
1 1 1 25 42 12 o 1.939000  0.5208000     1.651000  0.6961000     2.226000  0.7748000     -0.5757000     1.042000  
1 1 1 25 42 13 o 1.436000  0.4325000     1.564000  0.6336000     1.307000  0.5888000     0.2569000      0.8649000 
1 1 1 25 43 0  o 2.822000  0.6546000     2.822000  0.6546000     2.822000  0.6546000     -0.000000      0.000000  
1 1 1 25 43 1  o 6.049000  0.2382000     6.274000  0.3521000     5.823000  0.3210000     0.4511000      0.4765000 
1 1 1 25 43 2  o 1.621000  0.4548000     1.661000  0.6515000     1.582000  0.6347000     0.7888000E-01  0.9096000 
1 1 1 25 43 3  o 5.421000  0.2395000     5.471000  0.3361000     5.371000  0.3414000     0.1002000      0.4791000 
1 1 1 25 43 4  o 1.535000  0.4440000     1.569000  0.6364000     1.500000  0.6192000     0.6903000E-01  0.8879000 
1 1 1 25 43 5  o 4.073000  0.2963000     3.979000  0.4287000     4.167000  0.4093000     -0.1879000     0.5927000 
1 1 1 25 43 6  o 4.277000  0.2861000     4.505000  0.3793000     4.049000  0.4283000     0.4557000      0.5722000 
1 1 1 25 43 7  o 1.101000  0.3685000     1.072000  0.5092000     1.131000  0.5329000     -0.5909000E-01 0.7371000 
1 1 1 25 43 8  o 1.411000  0.4560000     1.444000  0.6730000     1.378000  0.6153000     0.6618000E-01  0.9119000 
1 1 1 25 43 9  o 1.914000  0.4820000     1.833000  0.6671000     1.995000  0.6960000     -0.1619000     0.9640000 
1 1 1 25 43 10 o 3.478000  0.3926000     3.706000  0.4841000     3.250000  0.6184000     0.4560000      0.7853000 
1 1 1 25 43 11 o 2.166000  0.5299000     2.207000  0.7315000     2.125000  0.7669000     0.8233000E-01  1.060000  
1 1 1 25 43 12 o 0.9413000 0.4643000     ?         ?             0.9413000 0.4643000     ?              ?         
1 1 1 25 44 0  o 6.324000  0.3132000     6.324000  0.3132000     6.324000  0.3132000     -0.000000      0.000000  
1 1 1 25 44 1  o 2.817000  0.4196000     2.397000  0.6527000     3.237000  0.5274000     -0.8406000     0.8392000 
1 1 1 25 44 2  o 4.069000  0.3026000     4.213000  0.4121000     3.924000  0.4433000     0.2897000      0.6053000 
1 1 1 25 44 3  o 1.987000  0.4686000     2.016000  0.6576000     1.957000  0.6679000     0.5887000E-01  0.9373000 
1 1 1 25 44 4  o 2.653000  0.4414000     2.411000  0.6510000     2.895000  0.5963000     -0.4832000     0.8828000 
1 1 1 25 44 5  o 5.425000  0.2460000     5.234000  0.3592000     5.617000  0.3360000     -0.3829000     0.4919000 
1 1 1 25 44 6  f 1.248000  0.3989000     1.314000  0.5816000     1.182000  0.5461000     0.1315000      0.7978000 
1 1 1 25 44 7  o 1.590000  0.4677000     1.280000  0.6169000     1.899000  0.7032000     -0.6187000     0.9354000 
1 1 1 25 44 8  o 4.384000  0.3151000     4.662000  0.3871000     4.106000  0.4974000     0.5557000      0.6303000 
1 1 1 25 44 9  o 3.622000  0.3823000     4.038000  0.4235000     3.206000  0.6366000     0.8320000      0.7646000 
1 1 1 25 44 10 o 2.145000  0.5225000     1.957000  0.7017000     2.334000  0.7744000     -0.3765000     1.045000  
1 1 1 25 44 11 o 1.665000  0.4684000     1.555000  0.6528000     1.774000  0.6718000     -0.2189000     0.9368000 
1 1 1 25 44 12 o 1.404000  0.4094000     1.013000  0.4910000     1.796000  0.6552000     -0.7837000     0.8188000 
1 1 1 25 45 0  o 1.225000  0.7333000     1.225000  0.7333000     1.225000  0.7333000     0.000000       0.000000  
1 1 1 25 45 1  o 3.601000  0.3525000     3.474000  0.5098000     3.727000  0.4870000     -0.2531000     0.7050000 
1 1 1 25 45 2  o 2.833000  0.4301000     2.602000  0.6253000     3.063000  0.5906000     -0.4614000     0.8601000 
1 1 1 25 45 3  o 3.606000  0.3483000     3.229000  0.5338000     3.984000  0.4477000     -0.7548000     0.6967000 
1 1 1 25 45 4  o 4.998000  0.2652000     4.721000  0.3840000     5.275000  0.3659000     -0.5541000     0.5305000 
1 1 1 25 45 5  o 4.770000  0.2747000     4.678000  0.3902000     4.861000  0.3868000     -0.1829000     0.5495000 
1 1 1 25 45 6  o 2.046000  0.5503000     2.453000  0.8638000     1.639000  0.6822000     0.8139000      1.101000  
1 1 1 25 45 7  o 1.877000  0.4886000     1.875000  0.6745000     1.879000  0.7070000     -0.4087000E-02 0.9772000 
1 1 1 25 45 8  o 1.579000  0.4390000     1.973000  0.6737000     1.185000  0.5632000     0.7882000      0.8781000 
1 1 1 25 45 9  o 2.718000  0.5131000     3.064000  0.6495000     2.372000  0.7945000     0.6916000      1.026000  
1 1 1 25 45 10 o 1.538000  0.4516000     1.834000  0.7007000     1.243000  0.5697000     0.5908000      0.9031000 
1 1 1 25 45 11 o 1.308000  0.4122000     1.143000  0.5360000     1.473000  0.6265000     -0.3296000     0.8245000 
1 1 1 25 46 0  o 7.871000  0.2965000     7.871000  0.2965000     7.871000  0.2965000     0.000000       0.000000  
1 1 1 25 46 1  o 3.239000  0.3885000     3.144000  0.5650000     3.335000  0.5333000     -0.1913000     0.7769000 
1 1 1 25 46 2  o 4.247000  0.3043000     4.232000  0.4193000     4.261000  0.4412000     -0.2971000E-01 0.6087000 
1 1 1 25 46 3  o 3.217000  0.3822000     3.372000  0.5115000     3.062000  0.5679000     0.3108000      0.7643000 
1 1 1 25 46 4  o 3.192000  0.4237000     3.437000  0.5959000     2.947000  0.6024000     0.4905000      0.8473000 
1 1 1 25 46 5  o 1.854000  0.5224000     2.167000  0.8126000     1.541000  0.6567000     0.6260000      1.045000  
1 1 1 25 46 6  o 3.290000  0.4198000     3.475000  0.5254000     3.104000  0.6550000     0.3717000      0.8397000 
1 1 1 25 46 7  o 2.014000  0.5000000     1.972000  0.6714000     2.055000  0.7411000     -0.8371000E-01 1.000000  
1 1 1 25 46 8  o 1.336000  0.4300000     1.463000  0.6374000     1.209000  0.5774000     0.2549000      0.8600000 
1 1 1 25 46 9  o 3.872000  0.3670000     4.341000  0.4894000     3.404000  0.5470000     0.9375000      0.7340000 
1 1 1 25 46 10 o 1.224000  0.3966000     1.087000  0.5173000     1.362000  0.6014000     -0.2750000     0.7933000 
1 1 1 25 47 0  o 1.911000  0.8303000     1.911000  0.8303000     1.911000  0.8303000     0.000000       0.000000  
1 1 1 25 47 1  o 2.701000  0.4499000     2.827000  0.6065000     2.574000  0.6647000     0.2525000      0.8998000 
1 1 1 25 47 2  o 1.710000  0.4826000     1.843000  0.7152000     1.576000  0.6481000     0.2672000      0.9652000 
1 1 1 25 47 3  o 3.159000  0.4575000     3.098000  0.7041000     3.220000  0.5843000     -0.1215000     0.9150000 
1 1 1 25 47 4  o 4.466000  0.3426000     4.337000  0.4987000     4.595000  0.4698000     -0.2578000     0.6852000 
1 1 1 25 47 5  o 2.036000  0.5013000     2.284000  0.6715000     1.788000  0.7446000     0.4960000      1.003000  
1 1 1 25 47 6  o 2.085000  0.4866000     2.516000  0.6881000     1.653000  0.6883000     0.8621000      0.9733000 
1 1 1 25 47 7  o 2.587000  0.4883000     3.039000  0.6231000     2.136000  0.7521000     0.9030000      0.9767000 
1 1 1 25 47 8  o 2.296000  0.4935000     2.756000  0.7201000     1.836000  0.6752000     0.9203000      0.9871000 
1 1 1 25 47 9  o 1.702000  0.4595000     1.943000  0.6707000     1.460000  0.6281000     0.4830000      0.9189000 
1 1 1 25 47 10 o 2.746000  0.5544000     3.242000  0.7096000     2.250000  0.8519000     0.9922000      1.109000  
1 1 1 25 48 0  f 2.896000  0.8338000     2.896000  0.8338000     2.896000  0.8338000     0.000000       0.000000  
1 1 1 25 48 1  o 4.663000  0.3979000     4.671000  0.5077000     4.656000  0.6129000     0.1510000E-01  0.7959000 
1 1 1 25 48 2  f 1.719000  0.5137000     1.669000  0.6919000     1.768000  0.7594000     -0.9845000E-01 1.027000  
1 1 1 25 48 3  f 2.445000  0.5954000     2.519000  0.7291000     2.371000  0.9416000     0.1485000      1.191000  
1 1 1 25 48 4  o 3.785000  0.5772000     3.655000  0.5534000     3.915000  1.013000      -0.2603000     1.154000  
1 1 1 25 48 5  o 1.731000  0.4951000     1.768000  0.6939000     1.694000  0.7064000     0.7362000E-01  0.9902000 
1 1 1 25 48 6  o 1.205000  0.4019000     1.318000  0.6035000     1.092000  0.5310000     0.2263000      0.8039000 
1 1 1 25 48 7  o 1.649000  0.4765000     1.730000  0.7021000     1.567000  0.6444000     0.1627000      0.9530000 
1 1 1 25 48 8  o 1.235000  0.4005000     1.374000  0.6067000     1.096000  0.5229000     0.2780000      0.8010000 
1 1 1 25 48 9  o 1.134000  0.3833000     1.035000  0.5128000     1.233000  0.5699000     -0.1979000     0.7666000 
1 1 1 25 49 0  o 1.110000  0.7635000     1.110000  0.7635000     1.110000  0.7635000     -0.000000      0.000000  
1 1 1 25 49 1  o 1.736000  0.5199000     1.461000  0.6717000     2.011000  0.7938000     -0.5494000     1.040000  
1 1 1 25 49 2  f 1.328000  0.4438000     1.381000  0.6418000     1.274000  0.6132000     0.1071000      0.8877000 
1 1 1 25 49 3  o 3.510000  0.4813000     3.389000  0.7262000     3.631000  0.6318000     -0.2416000     0.9626000 
1 1 1 25 49 4  o 1.540000  0.4603000     1.442000  0.6394000     1.638000  0.6622000     -0.1965000     0.9205000 
1 1 1 25 49 5  o 1.606000  0.4712000     1.765000  0.7042000     1.446000  0.6264000     0.3189000      0.9425000 
1 1 1 25 49 6  o 1.775000  0.4734000     1.626000  0.6566000     1.925000  0.6820000     -0.2984000     0.9468000 
1 1 1 25 49 7  o 1.417000  0.4282000     1.707000  0.6685000     1.127000  0.5355000     0.5801000      0.8565000 
1 1 1 25 49 8  o 2.191000  0.4934000     2.367000  0.6852000     2.016000  0.7102000     0.3510000      0.9868000 
1 1 1 25 50 0  o 2.985000  0.7064000     2.985000  0.7064000     2.985000  0.7064000     -0.000000      0.000000  
1 1 1 25 50 1  o 1.595000  0.4596000     1.615000  0.6511000     1.574000  0.6489000     0.4130000E-01  0.9192000 
1 1 1 25 50 2  o 1.914000  0.4845000     1.755000  0.6693000     2.074000  0.7008000     -0.3192000     0.9691000 
1 1 1 25 50 3  o 1.393000  0.4223000     1.692000  0.6641000     1.093000  0.5220000     0.5984000      0.8447000 
1 1 1 25 50 4  o 1.181000  0.3891000     1.259000  0.5727000     1.103000  0.5270000     0.1558000      0.7782000 
1 1 1 25 50 5  o 1.580000  0.4557000     1.705000  0.6642000     1.456000  0.6241000     0.2493000      0.9114000 
1 1 1 25 50 6  o 2.874000  0.4431000     2.980000  0.6081000     2.768000  0.6446000     0.2128000      0.8861000 
1 1 1 25 50 7  o 1.420000  0.4378000     1.388000  0.6087000     1.451000  0.6294000     -0.6337000E-01 0.8756000 
1 1 1 25 51 0  o 2.722000  0.7628000     2.722000  0.7628000     2.722000  0.7628000     -0.000000      0.000000  
1 1 1 25 51 1  o 2.078000  0.4944000     2.093000  0.6957000     2.062000  0.7028000     0.3136000E-01  0.9889000 
1 1 1 25 51 2  o 1.261000  0.4089000     1.226000  0.5658000     1.296000  0.5905000     -0.6986000E-01 0.8178000 
1 1 1 25 51 3  o 3.493000  0.3806000     3.469000  0.5365000     3.517000  0.5401000     -0.4787000E-01 0.7612000 
1 1 1 25 51 4  o 2.003000  0.4859000     1.756000  0.6748000     2.250000  0.6993000     -0.4941000     0.9718000 
1 1 1 25 51 5  o 1.375000  0.4282000     1.463000  0.6255000     1.286000  0.5851000     0.1770000      0.8565000 
1 1 1 25 52 0  o 2.399000  0.8181000     2.399000  0.8181000     2.399000  0.8181000     0.000000       0.000000  
1 1 1 25 52 1  o 1.851000  0.4590000     1.340000  0.6004000     2.362000  0.6945000     -1.022000      0.9180000 
1 1 1 25 52 2  o 1.072000  0.3653000     0.9711000 0.4781000     1.174000  0.5525000     -0.2025000     0.7307000 
1 1 1 25 52 3  o 1.162000  0.3878000     1.153000  0.5451000     1.171000  0.5517000     -0.1756000E-01 0.7756000 
1 1 1 25 52 4  o 1.260000  0.4179000     1.385000  0.6254000     1.135000  0.5544000     0.2493000      0.8357000 
1 1 1 26 0  2  o 12.54000  0.2237000     12.54000  0.2237000     12.54000  0.2237000     -0.000000      0.000000  
1 1 1 26 0  3  o 9.358000  0.2138000     9.358000  0.2138000     9.358000  0.2138000     0.000000       0.000000  
1 1 1 26 0  4  o 24.84000  0.2805000     24.84000  0.2805000     24.84000  0.2805000     0.000000       0.000000  
1 1 1 26 0  5  o 14.89000  0.2215000     14.89000  0.2215000     14.89000  0.2215000     0.000000       0.000000  
1 1 1 26 0  6  o 5.862000  0.1874000     5.862000  0.1874000     5.862000  0.1874000     -0.000000      0.000000  
1 1 1 26 0  7  o 3.216000  0.7034000     3.216000  0.7034000     3.216000  0.7034000     -0.000000      0.000000  
1 1 1 26 0  8  o 6.705000  0.3080000     6.705000  0.3080000     6.705000  0.3080000     -0.000000      0.000000  
1 1 1 26 0  9  o 9.014000  0.3072000     9.014000  0.3072000     9.014000  0.3072000     0.000000       0.000000  
1 1 1 26 0  10 o 2.470000  0.9633000     2.470000  0.9633000     2.470000  0.9633000     0.000000       0.000000  
1 1 1 26 0  11 o 1.905000  0.9754000     1.905000  0.9754000     1.905000  0.9754000     0.000000       0.000000  
1 1 1 26 0  12 o 5.338000  0.7647000     5.338000  0.7647000     5.338000  0.7647000     0.000000       0.000000  
1 1 1 26 0  13 o 8.566000  0.3909000     8.566000  0.3909000     8.566000  0.3909000     0.000000       0.000000  
1 1 1 26 0  14 o 2.967000  1.211000      2.967000  1.211000      2.967000  1.211000      0.000000       0.000000  
1 1 1 26 0  15 o 1.147000  0.7373000     1.147000  0.7373000     1.147000  0.7373000     0.000000       0.000000  
1 1 1 26 0  16 o 1.266000  0.7686000     1.266000  0.7686000     1.266000  0.7686000     0.000000       0.000000  
1 1 1 26 0  17 o 1.079000  0.7421000     1.079000  0.7421000     1.079000  0.7421000     0.000000       0.000000  
1 1 1 26 0  18 o 0.7133000 0.5143000     0.7133000 0.5143000     0.7133000 0.5143000     0.000000       0.000000  
1 1 1 26 0  19 o 0.9603000 0.6672000     0.9603000 0.6672000     0.9603000 0.6672000     0.000000       0.000000  
1 1 1 26 0  20 o 1.876000  0.8839000     1.876000  0.8839000     1.876000  0.8839000     0.000000       0.000000  
1 1 1 26 0  21 o 1.620000  0.8721000     1.620000  0.8721000     1.620000  0.8721000     0.000000       0.000000  
1 1 1 26 1  2  o 15.69000  0.1868000     15.66000  0.2620000     15.72000  0.2663000     -0.5887000E-01 0.3736000 
1 1 1 26 1  3  o 5.975000  0.1554000     6.187000  0.2107000     5.763000  0.2286000     0.4240000      0.3108000 
1 1 1 26 1  4  o 4.615000  0.8884000E-01 4.705000  0.1337000     4.525000  0.1170000     0.1798000      0.1777000 
1 1 1 26 1  5  o 12.06000  0.1285000     11.87000  0.1749000     12.24000  0.1884000     -0.3730000     0.2571000 
1 1 1 26 1  6  o 5.708000  0.1776000     5.688000  0.1814000     5.728000  0.3055000     -0.4072000E-01 0.3553000 
1 1 1 26 1  7  o 15.02000  0.2233000     14.86000  0.2712000     15.18000  0.3548000     -0.3220000     0.4466000 
1 1 1 26 1  8  o 2.876000  0.4106000     1.780000  0.6858000     3.972000  0.4517000     -2.192000      0.8211000 
1 1 1 26 1  9  o 1.875000  0.5300000     1.759000  0.7369000     1.991000  0.7620000     -0.2322000     1.060000  
1 1 1 26 1  10 o 6.563000  0.2637000     6.459000  0.3835000     6.667000  0.3619000     -0.2079000     0.5273000 
1 1 1 26 1  11 o 6.023000  0.3040000     6.393000  0.4143000     5.654000  0.4450000     0.7393000      0.6080000 
1 1 1 26 1  12 o 3.234000  0.7033000     3.239000  1.007000      3.230000  0.9819000     0.9115000E-02  1.407000  
1 1 1 26 1  13 o 5.010000  0.4039000     5.002000  0.5673000     5.019000  0.5753000     -0.1633000E-01 0.8079000 
1 1 1 26 1  14 o 2.270000  0.6402000     1.987000  0.8770000     2.554000  0.9330000     -0.5676000     1.280000  
1 1 1 26 1  15 o 2.745000  0.4739000     3.488000  0.6098000     2.003000  0.7255000     1.485000       0.9477000 
1 1 1 26 1  16 o 1.814000  0.4974000     1.828000  0.7108000     1.801000  0.6960000     0.2695000E-01  0.9948000 
1 1 1 26 1  17 o 1.481000  0.4815000     1.389000  0.6638000     1.573000  0.6976000     -0.1836000     0.9630000 
1 1 1 26 1  18 o 2.194000  0.5050000     1.854000  0.7160000     2.534000  0.7123000     -0.6807000     1.010000  
1 1 1 26 1  19 o 1.411000  0.4540000     1.054000  0.5246000     1.768000  0.7410000     -0.7138000     0.9079000 
1 1 1 26 1  20 o 1.633000  0.4746000     1.377000  0.6260000     1.889000  0.7135000     -0.5117000     0.9492000 
1 1 1 26 1  21 o 1.568000  0.4762000     1.504000  0.6613000     1.631000  0.6853000     -0.1269000     0.9524000 
1 1 1 26 2  2  o 5.080000  0.1337000     5.097000  0.1792000     5.063000  0.1984000     0.3352000E-01  0.2674000 
1 1 1 26 2  3  o 3.844000  0.2781000     4.399000  0.4752000     3.290000  0.2891000     1.109000       0.5562000 
1 1 1 26 2  4  o 10.47000  0.1166000     10.34000  0.1820000     10.59000  0.1457000     -0.2472000     0.2331000 
1 1 1 26 2  5  o 5.478000  0.1341000     5.716000  0.1763000     5.240000  0.2021000     0.4761000      0.2682000 
1 1 1 26 2  6  o 5.011000  0.1596000     4.941000  0.1997000     5.081000  0.2490000     -0.1402000     0.3191000 
1 1 1 26 2  7  o 4.131000  0.4749000     4.088000  0.6693000     4.175000  0.6738000     -0.8700000E-01 0.9497000 
1 1 1 26 2  8  o 5.621000  0.2299000     5.622000  0.2348000     5.620000  0.3953000     0.2031000E-02  0.4598000 
1 1 1 26 2  9  o 8.016000  0.2588000     7.979000  0.4039000     8.054000  0.3239000     -0.7509000E-01 0.5177000 
1 1 1 26 2  10 o 3.612000  0.4472000     3.526000  0.6639000     3.699000  0.5991000     -0.1728000     0.8943000 
1 1 1 26 2  11 o 3.025000  0.5639000     3.230000  0.7927000     2.819000  0.8022000     0.4113000      1.128000  
1 1 1 26 2  12 o 2.090000  0.6347000     2.324000  0.9537000     1.856000  0.8378000     0.4688000      1.269000  
1 1 1 26 2  13 o 3.797000  0.5381000     4.565000  0.6348000     3.029000  0.8689000     1.536000       1.076000  
1 1 1 26 2  14 o 3.771000  0.6110000     2.487000  0.9965000     5.055000  0.7072000     -2.568000      1.222000  
1 1 1 26 2  15 o 3.566000  0.4129000     4.059000  0.5266000     3.073000  0.6361000     0.9863000      0.8258000 
1 1 1 26 2  16 f 2.118000  0.4885000     1.702000  0.6951000     2.533000  0.6866000     -0.8304000     0.9770000 
1 1 1 26 2  17 o 1.437000  0.4677000     1.590000  0.7079000     1.283000  0.6114000     0.3065000      0.9354000 
1 1 1 26 2  18 o 1.147000  0.3888000     1.129000  0.5453000     1.165000  0.5544000     -0.3573000E-01 0.7777000 
1 1 1 26 2  19 o 2.086000  0.5388000     2.505000  0.8068000     1.668000  0.7142000     0.8373000      1.078000  
1 1 1 26 2  20 o 1.114000  0.3803000     1.026000  0.5056000     1.201000  0.5683000     -0.1748000     0.7607000 
1 1 1 26 2  21 o 1.397000  0.4405000     1.219000  0.5758000     1.576000  0.6668000     -0.3576000     0.8810000 
1 1 1 26 3  1  o 12.30000  0.1820000     12.40000  0.2950000     12.20000  0.2133000     0.1954000      0.3640000 
1 1 1 26 3  2  o 3.793000  0.2339000     3.569000  0.4175000     4.018000  0.2109000     -0.4487000     0.4677000 
1 1 1 26 3  3  o 3.981000  0.2902000     3.723000  0.5256000     4.238000  0.2462000     -0.5147000     0.5804000 
1 1 1 26 3  4  o 15.70000  0.2112000     15.59000  0.2118000     15.82000  0.3656000     -0.2346000     0.4225000 
1 1 1 26 3  5  o 6.676000  0.1494000     6.694000  0.1652000     6.658000  0.2489000     0.3574000E-01  0.2987000 
1 1 1 26 3  6  o 13.51000  0.1425000     13.54000  0.1973000     13.48000  0.2056000     0.6308000E-01  0.2849000 
1 1 1 26 3  7  o 4.268000  0.3377000     5.026000  0.5307000     3.510000  0.4176000     1.516000       0.6753000 
1 1 1 26 3  8  o 4.647000  0.2612000     4.787000  0.2697000     4.507000  0.4473000     0.2794000      0.5224000 
1 1 1 26 3  9  o 7.775000  0.2978000     7.667000  0.2478000     7.883000  0.5416000     -0.2165000     0.5956000 
1 1 1 26 3  10 o 2.820000  0.5613000     2.780000  0.7692000     2.860000  0.8177000     -0.7998000E-01 1.123000  
1 1 1 26 3  11 o 2.028000  0.5447000     2.383000  0.8112000     1.673000  0.7270000     0.7101000      1.089000  
1 1 1 26 3  12 o 2.612000  0.6555000     2.534000  0.9736000     2.691000  0.8780000     -0.1561000     1.311000  
1 1 1 26 3  13 o 3.944000  0.5079000     4.126000  0.6962000     3.763000  0.7396000     0.3628000      1.016000  
1 1 1 26 3  14 o 3.272000  0.6962000     3.141000  1.030000      3.402000  0.9372000     -0.2612000     1.392000  
1 1 1 26 3  15 o 4.107000  0.3472000     3.869000  0.5323000     4.345000  0.4460000     -0.4761000     0.6944000 
1 1 1 26 3  16 o 3.318000  0.4090000     3.094000  0.6175000     3.543000  0.5366000     -0.4488000     0.8181000 
1 1 1 26 3  17 o 2.065000  0.5243000     1.578000  0.6990000     2.552000  0.7817000     -0.9742000     1.049000  
1 1 1 26 3  18 o 1.124000  0.3819000     1.265000  0.5889000     0.9831000 0.4863000     0.2823000      0.7637000 
1 1 1 26 3  19 o 2.313000  0.5001000     1.628000  0.7036000     2.997000  0.7108000     -1.368000      1.000000  
1 1 1 26 3  20 o 1.341000  0.4216000     1.745000  0.7028000     0.9359000 0.4659000     0.8092000      0.8432000 
1 1 1 26 3  21 f 1.577000  0.4483000     1.095000  0.5320000     2.059000  0.7217000     -0.9643000     0.8966000 
1 1 1 26 4  1  o 12.63000  0.1761000     12.60000  0.2999000     12.66000  0.1846000     -0.5410000E-01 0.3522000 
1 1 1 26 4  2  o 7.586000  0.1672000     7.612000  0.2866000     7.560000  0.1723000     0.5210000E-01  0.3344000 
1 1 1 26 4  3  o 9.562000  0.1934000     9.482000  0.3359000     9.642000  0.1917000     -0.1599000     0.3867000 
1 1 1 26 4  4  o 12.06000  0.1718000     12.29000  0.1818000     11.82000  0.2915000     0.4704000      0.3435000 
1 1 1 26 4  5  o 10.85000  0.1256000     10.94000  0.1734000     10.76000  0.1819000     0.1773000      0.2513000 
1 1 1 26 4  6  o 5.577000  0.1763000     5.224000  0.2063000     5.931000  0.2859000     -0.7074000     0.3526000 
1 1 1 26 4  7  o 9.620000  0.2856000     9.520000  0.5315000     9.721000  0.2094000     -0.2004000     0.5713000 
1 1 1 26 4  8  o 1.591000  0.4446000     1.081000  0.4889000     2.102000  0.7426000     -1.021000      0.8891000 
1 1 1 26 4  9  o 8.367000  0.2771000     8.445000  0.2459000     8.290000  0.4966000     0.1551000      0.5541000 
1 1 1 26 4  10 o 3.597000  0.4453000     4.094000  0.3657000     3.100000  0.8121000     0.9946000      0.8907000 
1 1 1 26 4  11 o 2.500000  0.5661000     2.956000  0.7836000     2.045000  0.8172000     0.9105000      1.132000  
1 1 1 26 4  12 o 6.796000  0.3650000     6.622000  0.5859000     6.970000  0.4354000     -0.3483000     0.7300000 
1 1 1 26 4  13 o 2.011000  0.5661000     2.400000  0.8674000     1.622000  0.7276000     0.7789000      1.132000  
1 1 1 26 4  14 o 2.122000  0.6366000     1.612000  0.7823000     2.631000  1.005000      -1.018000      1.273000  
1 1 1 26 4  15 o 1.513000  0.4540000     1.167000  0.5568000     1.858000  0.7172000     -0.6908000     0.9080000 
1 1 1 26 4  16 o 1.314000  0.4204000     1.155000  0.5471000     1.472000  0.6385000     -0.3172000     0.8409000 
1 1 1 26 4  17 o 1.746000  0.5107000     1.581000  0.6954000     1.911000  0.7482000     -0.3298000     1.021000  
1 1 1 26 4  18 o 1.108000  0.3766000     1.214000  0.5688000     1.002000  0.4937000     0.2126000      0.7532000 
1 1 1 26 4  19 o 1.606000  0.4791000     1.224000  0.5893000     1.987000  0.7556000     -0.7634000     0.9582000 
1 1 1 26 4  20 o 1.306000  0.4242000     1.215000  0.5730000     1.396000  0.6255000     -0.1811000     0.8483000 
1 1 1 26 4  21 o 1.572000  0.4526000     2.012000  0.7238000     1.131000  0.5437000     0.8812000      0.9052000 
1 1 1 26 5  1  o 6.000000  0.1375000     5.924000  0.2201000     6.077000  0.1647000     -0.1537000     0.2749000 
1 1 1 26 5  2  o 7.708000  0.1681000     7.668000  0.2825000     7.749000  0.1824000     -0.8151000E-01 0.3363000 
1 1 1 26 5  3  o 5.260000  0.9704000E-01 5.244000  0.1278000     5.277000  0.1461000     -0.3324000E-01 0.1941000 
1 1 1 26 5  4  o 9.366000  0.1345000     9.263000  0.1527000     9.469000  0.2214000     -0.2069000     0.2690000 
1 1 1 26 5  5  o 2.661000  0.2297000     2.718000  0.2866000     2.603000  0.3590000     0.1150000      0.4594000 
1 1 1 26 5  6  f 6.262000  0.1456000     6.269000  0.1973000     6.255000  0.2143000     0.1393000E-01  0.2913000 
1 1 1 26 5  7  o 2.660000  0.4561000     2.420000  0.7896000     2.899000  0.4569000     -0.4790000     0.9123000 
1 1 1 26 5  8  o 13.12000  0.1581000     13.16000  0.2187000     13.08000  0.2284000     0.7586000E-01  0.3162000 
1 1 1 26 5  9  o 11.09000  0.2242000     10.89000  0.2408000     11.29000  0.3783000     -0.4011000     0.4484000 
1 1 1 26 5  10 o 4.171000  0.3688000     4.398000  0.3390000     3.944000  0.6550000     0.4544000      0.7375000 
1 1 1 26 5  11 o 2.123000  0.5113000     2.290000  0.6300000     1.956000  0.8055000     0.3335000      1.023000  
1 1 1 26 5  12 o 3.921000  0.4996000     3.614000  0.7504000     4.227000  0.6598000     -0.6133000     0.9992000 
1 1 1 26 5  13 o 2.256000  0.5729000     2.767000  0.8611000     1.745000  0.7560000     1.022000       1.146000  
1 1 1 26 5  14 o 2.876000  0.7105000     2.978000  1.075000      2.774000  0.9289000     0.2041000      1.421000  
1 1 1 26 5  15 o 4.338000  0.3327000     3.711000  0.5230000     4.965000  0.4115000     -1.255000      0.6655000 
1 1 1 26 5  16 o 3.184000  0.4188000     3.757000  0.5035000     2.611000  0.6693000     1.145000       0.8375000 
1 1 1 26 5  17 o 1.408000  0.4564000     1.337000  0.6216000     1.479000  0.6683000     -0.1423000     0.9127000 
1 1 1 26 5  18 o 1.835000  0.4587000     2.407000  0.7087000     1.262000  0.5825000     1.145000       0.9173000 
1 1 1 26 5  19 o 1.690000  0.4992000     1.853000  0.7370000     1.528000  0.6735000     0.3247000      0.9984000 
1 1 1 26 5  20 o 1.740000  0.4877000     1.803000  0.7000000     1.677000  0.6792000     0.1259000      0.9754000 
1 1 1 26 5  21 o 1.201000  0.3992000     1.025000  0.5024000     1.377000  0.6206000     -0.3521000     0.7984000 
1 1 1 26 6  0  o 6.988000  0.1217000     6.988000  0.1217000     6.988000  0.1217000     0.000000       0.000000  
1 1 1 26 6  1  o 8.495000  0.1253000     8.533000  0.1833000     8.458000  0.1709000     0.7467000E-01  0.2506000 
1 1 1 26 6  2  o 10.84000  0.1709000     10.74000  0.3047000     10.93000  0.1550000     -0.1908000     0.3418000 
1 1 1 26 6  3  o 7.041000  0.1007000     7.048000  0.1368000     7.034000  0.1477000     0.1407000E-01  0.2013000 
1 1 1 26 6  4  o 6.803000  0.1178000     7.123000  0.1538000     6.483000  0.1784000     0.6406000      0.2355000 
1 1 1 26 6  5  o 5.468000  0.1413000     5.612000  0.1907000     5.324000  0.2084000     0.2874000      0.2825000 
1 1 1 26 6  6  o 9.881000  0.1534000     10.24000  0.1896000     9.523000  0.2413000     0.7162000      0.3069000 
1 1 1 26 6  7  o 10.64000  0.1462000     10.49000  0.2027000     10.79000  0.2108000     -0.2946000     0.2925000 
1 1 1 26 6  8  o 8.469000  0.1806000     8.360000  0.2174000     8.578000  0.2884000     -0.2170000     0.3611000 
1 1 1 26 6  9  o 5.390000  0.3125000     5.406000  0.2896000     5.375000  0.5538000     0.3056000E-01  0.6250000 
1 1 1 26 6  10 o 3.360000  0.3539000     3.421000  0.4559000     3.299000  0.5414000     0.1218000      0.7078000 
1 1 1 26 6  11 o 2.943000  0.4930000     2.852000  0.5501000     3.034000  0.8183000     -0.1822000     0.9860000 
1 1 1 26 6  12 o 4.873000  0.3994000     4.926000  0.5709000     4.821000  0.5587000     0.1058000      0.7988000 
1 1 1 26 6  13 o 1.628000  0.5352000     1.319000  0.6366000     1.936000  0.8607000     -0.6170000     1.070000  
1 1 1 26 6  14 o 4.753000  0.5317000     3.951000  0.8963000     5.555000  0.5722000     -1.604000      1.063000  
1 1 1 26 6  15 o 1.977000  0.5000000     2.223000  0.7244000     1.730000  0.6894000     0.4937000      1.000000  
1 1 1 26 6  16 o 1.468000  0.4393000     1.812000  0.6948000     1.125000  0.5378000     0.6879000      0.8787000 
1 1 1 26 6  17 o 2.292000  0.4958000     3.001000  0.7066000     1.583000  0.6957000     1.418000       0.9916000 
1 1 1 26 6  18 o 2.306000  0.4816000     2.810000  0.6704000     1.802000  0.6917000     1.008000       0.9633000 
1 1 1 26 6  19 o 2.011000  0.5257000     1.708000  0.7200000     2.314000  0.7663000     -0.6054000     1.051000  
1 1 1 26 6  20 o 1.424000  0.4453000     1.354000  0.6128000     1.493000  0.6464000     -0.1392000     0.8907000 
1 1 1 26 6  21 o 1.230000  0.4063000     1.313000  0.5993000     1.147000  0.5487000     0.1662000      0.8126000 
1 1 1 26 7  0  o 3.670000  0.1689000     3.670000  0.1689000     3.670000  0.1689000     0.000000       0.000000  
1 1 1 26 7  1  o 6.905000  0.9334000E-01 6.934000  0.1498000     6.875000  0.1113000     0.5916000E-01  0.1867000 
1 1 1 26 7  2  o 9.952000  0.1057000     9.929000  0.1457000     9.974000  0.1533000     -0.4489000E-01 0.2115000 
1 1 1 26 7  3  o 7.186000  0.1102000     7.186000  0.1479000     7.186000  0.1633000     -0.2079000E-03 0.2203000 
1 1 1 26 7  4  o 11.81000  0.1251000     11.88000  0.1737000     11.75000  0.1802000     0.1290000      0.2503000 
1 1 1 26 7  5  o 9.766000  0.1265000     9.808000  0.1751000     9.724000  0.1826000     0.8437000E-01  0.2530000 
1 1 1 26 7  6  o 6.464000  0.1709000     6.290000  0.2043000     6.637000  0.2741000     -0.3472000     0.3419000 
1 1 1 26 7  7  f 9.840000  0.1480000     9.886000  0.2020000     9.794000  0.2165000     0.9108000E-01  0.2961000 
1 1 1 26 7  8  o 7.825000  0.1670000     7.780000  0.2205000     7.869000  0.2509000     -0.8870000E-01 0.3340000 
1 1 1 26 7  9  o 9.932000  0.1784000     9.828000  0.2273000     10.04000  0.2751000     -0.2094000     0.3569000 
1 1 1 26 7  10 o 3.178000  0.3705000     3.184000  0.4869000     3.171000  0.5585000     0.1264000E-01  0.7409000 
1 1 1 26 7  11 o 6.232000  0.2287000     6.150000  0.3150000     6.314000  0.3315000     -0.1634000     0.4573000 
1 1 1 26 7  12 o 7.874000  0.2560000     7.760000  0.3419000     7.987000  0.3810000     -0.2266000     0.5119000 
1 1 1 26 7  13 o 3.563000  0.5974000     3.800000  0.7077000     3.326000  0.9625000     0.4744000      1.195000  
1 1 1 26 7  14 o 3.761000  0.7983000     3.306000  1.009000      4.216000  1.237000      -0.9093000     1.597000  
1 1 1 26 7  15 o 2.466000  0.5154000     2.900000  0.6554000     2.032000  0.7955000     0.8672000      1.031000  
1 1 1 26 7  16 o 2.737000  0.4604000     2.954000  0.6237000     2.520000  0.6774000     0.4347000      0.9208000 
1 1 1 26 7  17 o 1.316000  0.4336000     1.237000  0.5783000     1.395000  0.6461000     -0.1583000     0.8671000 
1 1 1 26 7  18 o 1.799000  0.4838000     2.036000  0.7122000     1.562000  0.6548000     0.4741000      0.9675000 
1 1 1 26 7  19 o 2.019000  0.5343000     2.001000  0.7694000     2.036000  0.7417000     -0.3443000E-01 1.069000  
1 1 1 26 7  20 o 1.190000  0.3977000     1.144000  0.5483000     1.237000  0.5762000     -0.9287000E-01 0.7954000 
1 1 1 26 7  21 o 1.233000  0.4088000     1.174000  0.5588000     1.292000  0.5968000     -0.1178000     0.8175000 
1 1 1 26 8  0  o 16.04000  0.1898000     16.04000  0.1898000     16.04000  0.1898000     -0.000000      0.000000  
1 1 1 26 8  1  o 5.233000  0.1052000     5.280000  0.1703000     5.186000  0.1234000     0.9330000E-01  0.2103000 
1 1 1 26 8  2  o 10.94000  0.1130000     10.97000  0.1783000     10.92000  0.1389000     0.4489000E-01  0.2260000 
1 1 1 26 8  3  o 1.945000  0.2973000     1.601000  0.4488000     2.289000  0.3899000     -0.6873000     0.5945000 
1 1 1 26 8  4  o 9.980000  0.1226000     9.993000  0.1704000     9.968000  0.1763000     0.2442000E-01  0.2451000 
1 1 1 26 8  5  o 5.273000  0.1510000     5.255000  0.2127000     5.292000  0.2142000     -0.3677000E-01 0.3019000 
1 1 1 26 8  6  o 3.891000  0.2576000     4.022000  0.3106000     3.759000  0.4109000     0.2635000      0.5151000 
1 1 1 26 8  7  o 1.992000  0.3770000     1.430000  0.5469000     2.554000  0.5191000     -1.124000      0.7540000 
1 1 1 26 8  8  o 6.265000  0.1855000     6.394000  0.2392000     6.136000  0.2835000     0.2588000      0.3710000 
1 1 1 26 8  9  o 5.113000  0.2361000     5.076000  0.3039000     5.151000  0.3614000     -0.7474000E-01 0.4722000 
1 1 1 26 8  10 o 6.292000  0.2138000     6.365000  0.2921000     6.220000  0.3123000     0.1451000      0.4276000 
1 1 1 26 8  11 o 8.825000  0.1889000     8.886000  0.2645000     8.764000  0.2699000     0.1220000      0.3779000 
1 1 1 26 8  12 o 8.368000  0.1997000     8.502000  0.2738000     8.234000  0.2907000     0.2673000      0.3993000 
1 1 1 26 8  13 o 2.038000  0.6043000     1.964000  0.7988000     2.111000  0.9068000     -0.1477000     1.209000  
1 1 1 26 8  14 o 3.301000  0.6412000     3.951000  0.5375000     2.650000  1.164000      1.301000       1.282000  
1 1 1 26 8  15 o 2.905000  0.4792000     2.626000  0.5616000     3.184000  0.7765000     -0.5583000     0.9583000 
1 1 1 26 8  16 o 1.153000  0.3885000     1.101000  0.5102000     1.205000  0.5860000     -0.1044000     0.7770000 
1 1 1 26 8  17 o 1.516000  0.4727000     1.435000  0.6296000     1.597000  0.7053000     -0.1627000     0.9454000 
1 1 1 26 8  18 o 1.132000  0.3822000     1.033000  0.5061000     1.230000  0.5729000     -0.1968000     0.7645000 
1 1 1 26 8  19 o 1.554000  0.4580000     1.827000  0.7015000     1.281000  0.5891000     0.5462000      0.9160000 
1 1 1 26 8  20 o 1.237000  0.4037000     1.078000  0.5221000     1.396000  0.6160000     -0.3177000     0.8075000 
1 1 1 26 8  21 o 1.557000  0.4670000     1.755000  0.7011000     1.359000  0.6171000     0.3955000      0.9340000 
1 1 1 26 9  0  o 1.440000  0.4513000     1.440000  0.4513000     1.440000  0.4513000     -0.000000      0.000000  
1 1 1 26 9  1  o 9.359000  0.9695000E-01 9.367000  0.1429000     9.350000  0.1310000     0.1745000E-01  0.1939000 
1 1 1 26 9  2  o 6.907000  0.1078000     6.920000  0.1708000     6.894000  0.1315000     0.2607000E-01  0.2155000 
1 1 1 26 9  3  f 3.395000  0.2156000     3.194000  0.3094000     3.597000  0.3003000     -0.4039000     0.4312000 
1 1 1 26 9  4  o 9.839000  0.1248000     10.03000  0.1732000     9.650000  0.1798000     0.3788000      0.2496000 
1 1 1 26 9  5  o 18.45000  0.1673000     18.50000  0.2348000     18.40000  0.2383000     0.1061000      0.3345000 
1 1 1 26 9  6  o 1.897000  0.4292000     1.651000  0.6971000     2.143000  0.5008000     -0.4921000     0.8584000 
1 1 1 26 9  7  o 2.007000  0.3950000     2.281000  0.5161000     1.733000  0.5982000     0.5488000      0.7901000 
1 1 1 26 9  8  o 5.809000  0.1964000     5.511000  0.2700000     6.107000  0.2854000     -0.5961000     0.3928000 
1 1 1 26 9  9  o 4.850000  0.3018000     4.902000  0.3270000     4.797000  0.5073000     0.1055000      0.6036000 
1 1 1 26 9  10 o 5.793000  0.2307000     5.889000  0.3103000     5.697000  0.3414000     0.1920000      0.4614000 
1 1 1 26 9  11 o 2.643000  0.4842000     2.793000  0.6163000     2.492000  0.7471000     0.3011000      0.9685000 
1 1 1 26 9  12 f 2.357000  0.4873000     2.316000  0.6810000     2.397000  0.6971000     -0.8076000E-01 0.9745000 
1 1 1 26 9  13 o 4.066000  0.5251000     4.506000  0.8276000     3.626000  0.6465000     0.8797000      1.050000  
1 1 1 26 9  14 o 5.918000  0.2729000     5.515000  0.3669000     6.321000  0.4041000     -0.8055000     0.5458000 
1 1 1 26 9  15 o 1.763000  0.4765000     1.936000  0.6310000     1.589000  0.7143000     0.3473000      0.9530000 
1 1 1 26 9  16 o 2.166000  0.4326000     2.797000  0.5172000     1.535000  0.6935000     1.263000       0.8651000 
1 1 1 26 9  17 o 1.724000  0.4879000     1.454000  0.5945000     1.995000  0.7738000     -0.5410000     0.9758000 
1 1 1 26 9  18 o 1.706000  0.4831000     1.439000  0.5882000     1.974000  0.7665000     -0.5350000     0.9662000 
1 1 1 26 9  19 o 1.317000  0.4171000     1.108000  0.5321000     1.526000  0.6425000     -0.4181000     0.8342000 
1 1 1 26 9  20 o 1.729000  0.4705000     2.143000  0.7279000     1.314000  0.5965000     0.8283000      0.9411000 
1 1 1 26 9  21 o 1.223000  0.4137000     1.146000  0.5552000     1.300000  0.6134000     -0.1538000     0.8273000 
1 1 1 26 10 0  o 9.736000  0.1477000     9.736000  0.1477000     9.736000  0.1477000     0.000000       0.000000  
1 1 1 26 10 1  o 12.99000  0.1203000     12.90000  0.1696000     13.08000  0.1707000     -0.1780000     0.2406000 
1 1 1 26 10 2  o 10.56000  0.1207000     10.46000  0.1839000     10.66000  0.1566000     -0.1993000     0.2415000 
1 1 1 26 10 3  o 2.641000  0.2125000     2.897000  0.3093000     2.384000  0.2913000     0.5137000      0.4249000 
1 1 1 26 10 4  o 6.039000  0.1383000     5.995000  0.1919000     6.084000  0.1993000     -0.8879000E-01 0.2767000 
1 1 1 26 10 5  o 2.933000  0.3097000     3.013000  0.3376000     2.853000  0.5193000     0.1596000      0.6194000 
1 1 1 26 10 6  o 5.540000  0.1701000     5.364000  0.2411000     5.715000  0.2402000     -0.3508000     0.3403000 
1 1 1 26 10 7  o 6.035000  0.1804000     5.942000  0.2458000     6.127000  0.2642000     -0.1843000     0.3609000 
1 1 1 26 10 8  o 8.452000  0.1833000     8.345000  0.2524000     8.560000  0.2659000     -0.2148000     0.3666000 
1 1 1 26 10 9  o 5.201000  0.2337000     4.709000  0.3310000     5.692000  0.3299000     -0.9831000     0.4673000 
1 1 1 26 10 10 o 1.911000  0.4474000     2.317000  0.6222000     1.505000  0.6432000     0.8114000      0.8949000 
1 1 1 26 10 11 o 1.871000  0.5001000     2.034000  0.7037000     1.708000  0.7108000     0.3253000      1.000000  
1 1 1 26 10 12 o 1.148000  0.3828000     1.016000  0.4924000     1.281000  0.5864000     -0.2653000     0.7657000 
1 1 1 26 10 13 o 5.868000  0.3596000     6.063000  0.5828000     5.672000  0.4214000     0.3909000      0.7192000 
1 1 1 26 10 14 o 7.016000  0.2607000     7.360000  0.3484000     6.673000  0.3879000     0.6873000      0.5214000 
1 1 1 26 10 15 o 2.520000  0.4636000     2.612000  0.6234000     2.429000  0.6862000     0.1830000      0.9271000 
1 1 1 26 10 16 o 1.680000  0.4680000     1.838000  0.6108000     1.522000  0.7091000     0.3166000      0.9359000 
1 1 1 26 10 17 o 4.817000  0.3131000     4.384000  0.3801000     5.249000  0.4978000     -0.8647000     0.6263000 
1 1 1 26 10 18 o 2.232000  0.4826000     2.451000  0.5751000     2.013000  0.7751000     0.4380000      0.9652000 
1 1 1 26 10 19 o 1.297000  0.4222000     1.146000  0.5223000     1.449000  0.6634000     -0.3032000     0.8443000 
1 1 1 26 10 20 o 1.544000  0.4614000     1.071000  0.4992000     2.018000  0.7761000     -0.9469000     0.9228000 
1 1 1 26 10 21 o 0.8865000 0.3197000     0.9264000 0.4704000     0.8465000 0.4331000     0.7996000E-01  0.6394000 
1 1 1 26 11 0  o 2.814000  0.2509000     2.814000  0.2509000     2.814000  0.2509000     0.000000       0.000000  
1 1 1 26 11 1  o 7.305000  0.1162000     7.291000  0.1810000     7.319000  0.1457000     -0.2818000E-01 0.2323000 
1 1 1 26 11 2  o 5.051000  0.1379000     4.928000  0.1971000     5.175000  0.1929000     -0.2471000     0.2758000 
1 1 1 26 11 3  o 11.41000  0.1273000     11.25000  0.2002000     11.58000  0.1573000     -0.3311000     0.2546000 
1 1 1 26 11 4  o 17.61000  0.1726000     17.75000  0.2608000     17.47000  0.2262000     0.2779000      0.3453000 
1 1 1 26 11 5  o 12.68000  0.2338000     12.68000  0.4206000     12.68000  0.2046000     0.4797000E-03  0.4677000 
1 1 1 26 11 6  o 5.631000  0.1730000     5.481000  0.2377000     5.781000  0.2516000     -0.3002000     0.3461000 
1 1 1 26 11 7  o 1.570000  0.4157000     1.665000  0.5799000     1.474000  0.5959000     0.1909000      0.8315000 
1 1 1 26 11 8  o 5.364000  0.2818000     5.429000  0.3052000     5.298000  0.4738000     0.1307000      0.5636000 
1 1 1 26 11 9  o 4.924000  0.2547000     5.030000  0.3339000     4.817000  0.3847000     0.2126000      0.5094000 
1 1 1 26 11 10 o 4.789000  0.2651000     4.427000  0.3741000     5.150000  0.3757000     -0.7223000     0.5302000 
1 1 1 26 11 11 o 2.698000  0.6252000     2.607000  1.058000      2.790000  0.6669000     -0.1827000     1.250000  
1 1 1 26 11 12 o 1.733000  0.4743000     1.789000  0.6643000     1.677000  0.6773000     0.1120000      0.9486000 
1 1 1 26 11 13 o 2.319000  0.5666000     1.930000  0.8473000     2.707000  0.7524000     -0.7761000     1.133000  
1 1 1 26 11 14 o 2.838000  0.4802000     2.386000  0.6880000     3.290000  0.6700000     -0.9040000     0.9603000 
1 1 1 26 11 15 o 2.302000  0.4745000     2.549000  0.6304000     2.055000  0.7093000     0.4936000      0.9489000 
1 1 1 26 11 16 o 3.166000  0.4099000     3.369000  0.5247000     2.964000  0.6298000     0.4051000      0.8198000 
1 1 1 26 11 17 o 3.004000  0.3993000     3.148000  0.5166000     2.859000  0.6090000     0.2897000      0.7986000 
1 1 1 26 11 18 o 3.047000  0.4802000     3.718000  0.4094000     2.376000  0.8688000     1.342000       0.9604000 
1 1 1 26 11 19 o 2.244000  0.5023000     2.199000  0.6173000     2.289000  0.7927000     -0.9072000E-01 1.005000  
1 1 1 26 11 20 o 1.431000  0.4325000     1.570000  0.6102000     1.292000  0.6130000     0.2781000      0.8649000 
1 1 1 26 12 0  o 14.69000  0.2218000     14.69000  0.2218000     14.69000  0.2218000     0.000000       0.000000  
1 1 1 26 12 1  o 14.77000  0.1750000     14.52000  0.2713000     15.02000  0.2212000     -0.4955000     0.3500000 
1 1 1 26 12 2  f 1.527000  0.2857000     1.990000  0.3768000     1.064000  0.4294000     0.9261000      0.5713000 
1 1 1 26 12 3  f 2.339000  0.2684000     2.381000  0.3307000     2.296000  0.4228000     0.8544000E-01  0.5368000 
1 1 1 26 12 4  o 3.171000  0.2445000     3.260000  0.3713000     3.081000  0.3180000     0.1792000      0.4889000 
1 1 1 26 12 5  o 8.059000  0.1902000     7.931000  0.3230000     8.188000  0.2010000     -0.2564000     0.3805000 
1 1 1 26 12 6  o 5.199000  0.1864000     5.205000  0.2499000     5.192000  0.2765000     0.1268000E-01  0.3727000 
1 1 1 26 12 7  o 2.875000  0.3344000     3.178000  0.3910000     2.573000  0.5426000     0.6049000      0.6689000 
1 1 1 26 12 8  o 3.842000  0.3799000     3.411000  0.4346000     4.272000  0.6233000     -0.8612000     0.7598000 
1 1 1 26 12 9  o 1.552000  0.4463000     1.423000  0.5927000     1.682000  0.6673000     -0.2596000     0.8925000 
1 1 1 26 12 10 o 3.893000  0.3269000     4.188000  0.3961000     3.598000  0.5200000     0.5900000      0.6537000 
1 1 1 26 12 11 o 1.512000  0.4961000     1.718000  0.7941000     1.306000  0.5949000     0.4120000      0.9923000 
1 1 1 26 12 12 o 1.283000  0.4146000     1.133000  0.5363000     1.433000  0.6325000     -0.3000000     0.8292000 
1 1 1 26 12 13 f 3.144000  0.6506000     2.773000  1.087000      3.514000  0.7149000     -0.7408000     1.301000  
1 1 1 26 12 14 o 2.251000  0.5113000     2.305000  0.6740000     2.197000  0.7690000     0.1084000      1.023000  
1 1 1 26 12 15 o 2.015000  0.4774000     1.762000  0.6612000     2.268000  0.6888000     -0.5059000     0.9547000 
1 1 1 26 12 16 o 1.488000  0.4606000     1.681000  0.7112000     1.295000  0.5855000     0.3864000      0.9212000 
1 1 1 26 12 17 o 1.227000  0.3965000     1.271000  0.5720000     1.184000  0.5492000     0.8684000E-01  0.7930000 
1 1 1 26 12 18 o 1.260000  0.4063000     1.467000  0.6293000     1.053000  0.5140000     0.4134000      0.8125000 
1 1 1 26 12 19 o 2.155000  0.4462000     2.355000  0.5877000     1.954000  0.6716000     0.4011000      0.8924000 
1 1 1 26 12 20 o 1.284000  0.4115000     1.365000  0.5804000     1.204000  0.5835000     0.1618000      0.8230000 
1 1 1 26 13 0  o 9.176000  0.2226000     9.176000  0.2226000     9.176000  0.2226000     0.000000       0.000000  
1 1 1 26 13 1  o 9.101000  0.1361000     9.144000  0.1608000     9.057000  0.2196000     0.8730000E-01  0.2722000 
1 1 1 26 13 2  f 3.993000  0.1979000     4.126000  0.2952000     3.861000  0.2636000     0.2657000      0.3958000 
1 1 1 26 13 3  o 11.18000  0.1408000     11.21000  0.1926000     11.14000  0.2055000     0.6962000E-01  0.2816000 
1 1 1 26 13 4  o 2.314000  0.3738000     2.361000  0.6406000     2.268000  0.3852000     0.9219000E-01  0.7475000 
1 1 1 26 13 5  o 2.259000  0.3283000     2.462000  0.4817000     2.056000  0.4462000     0.4060000      0.6566000 
1 1 1 26 13 6  o 3.057000  0.2926000     3.047000  0.3937000     3.068000  0.4329000     -0.2124000E-01 0.5852000 
1 1 1 26 13 7  o 2.557000  0.3814000     2.896000  0.4457000     2.218000  0.6191000     0.6786000      0.7628000 
1 1 1 26 13 8  o 2.378000  0.4448000     2.556000  0.5577000     2.199000  0.6930000     0.3577000      0.8895000 
1 1 1 26 13 9  o 3.576000  0.3331000     3.618000  0.4303000     3.533000  0.5087000     0.8565000E-01  0.6663000 
1 1 1 26 13 10 o 4.508000  0.3191000     4.694000  0.3609000     4.323000  0.5263000     0.3714000      0.6382000 
1 1 1 26 13 11 o 4.736000  0.3769000     4.411000  0.6462000     5.060000  0.3881000     -0.6493000     0.7538000 
1 1 1 26 13 12 f 5.301000  0.2685000     5.489000  0.3617000     5.112000  0.3968000     0.3770000      0.5369000 
1 1 1 26 13 13 o 3.590000  0.7259000     4.539000  0.9730000     2.642000  1.078000      1.897000       1.452000  
1 1 1 26 13 14 o 1.937000  0.4826000     1.311000  0.5914000     2.563000  0.7628000     -1.252000      0.9652000 
1 1 1 26 13 15 o 3.634000  0.3389000     3.722000  0.4382000     3.546000  0.5171000     0.1762000      0.6778000 
1 1 1 26 13 16 o 1.560000  0.5129000     1.710000  0.8241000     1.410000  0.6108000     0.3009000      1.026000  
1 1 1 26 13 17 o 1.520000  0.4380000     1.281000  0.5758000     1.758000  0.6602000     -0.4769000     0.8760000 
1 1 1 26 13 18 o 1.741000  0.5086000     1.740000  0.6696000     1.742000  0.7656000     -0.1349000E-02 1.017000  
1 1 1 26 13 19 o 2.036000  0.4697000     2.007000  0.6478000     2.065000  0.6804000     -0.5789000E-01 0.9394000 
1 1 1 26 13 20 o 1.770000  0.4665000     1.903000  0.6618000     1.636000  0.6576000     0.2669000      0.9330000 
1 1 1 26 14 0  o 4.895000  0.2086000     4.895000  0.2086000     4.895000  0.2086000     -0.000000      0.000000  
1 1 1 26 14 1  o 4.351000  0.1830000     4.245000  0.2752000     4.457000  0.2415000     -0.2120000     0.3661000 
1 1 1 26 14 2  o 13.56000  0.1562000     13.54000  0.2200000     13.58000  0.2219000     -0.4463000E-01 0.3125000 
1 1 1 26 14 3  o 4.351000  0.1676000     4.306000  0.2631000     4.396000  0.2077000     -0.9036000E-01 0.3352000 
1 1 1 26 14 4  o 4.200000  0.1666000     4.467000  0.2267000     3.933000  0.2443000     0.5333000      0.3333000 
1 1 1 26 14 5  o 4.415000  0.2015000     4.072000  0.3329000     4.757000  0.2271000     -0.6842000     0.4030000 
1 1 1 26 14 6  o 4.720000  0.2174000     4.945000  0.3017000     4.495000  0.3130000     0.4500000      0.4348000 
1 1 1 26 14 7  o 2.723000  0.3769000     2.444000  0.5363000     3.002000  0.5297000     -0.5582000     0.7538000 
1 1 1 26 14 8  o 2.136000  0.4534000     1.967000  0.6115000     2.304000  0.6696000     -0.3375000     0.9068000 
1 1 1 26 14 9  f 3.682000  0.3244000     3.614000  0.4314000     3.750000  0.4847000     -0.1358000     0.6489000 
1 1 1 26 14 10 o 2.969000  0.4794000     2.350000  0.7014000     3.588000  0.6537000     -1.238000      0.9588000 
1 1 1 26 14 11 o 5.206000  0.2640000     5.108000  0.3725000     5.304000  0.3742000     -0.1964000     0.5280000 
1 1 1 26 14 12 o 1.802000  0.5055000     1.557000  0.7195000     2.046000  0.7102000     -0.4892000     1.011000  
1 1 1 26 14 13 o 2.144000  0.6878000     1.761000  0.8366000     2.527000  1.092000      -0.7651000     1.376000  
1 1 1 26 14 14 o 3.655000  0.3848000     3.376000  0.5245000     3.933000  0.5632000     -0.5565000     0.7696000 
1 1 1 26 14 15 o 2.303000  0.4752000     2.535000  0.6341000     2.072000  0.7079000     0.4626000      0.9504000 
1 1 1 26 14 16 o 1.352000  0.4541000     1.695000  0.7645000     1.008000  0.4901000     0.6878000      0.9081000 
1 1 1 26 14 17 o 1.273000  0.4042000     1.187000  0.5467000     1.359000  0.5954000     -0.1725000     0.8083000 
1 1 1 26 14 18 o 1.408000  0.4689000     1.321000  0.5871000     1.496000  0.7312000     -0.1749000     0.9377000 
1 1 1 26 14 19 o 1.252000  0.3974000     1.230000  0.5529000     1.274000  0.5709000     -0.4343000E-01 0.7948000 
1 1 1 26 14 20 o 1.418000  0.4303000     1.459000  0.6128000     1.378000  0.6043000     0.8131000E-01  0.8606000 
1 1 1 26 15 0  o 21.46000  0.2552000     21.46000  0.2552000     21.46000  0.2552000     0.000000       0.000000  
1 1 1 26 15 1  o 5.905000  0.1280000     5.817000  0.1819000     5.993000  0.1802000     -0.1759000     0.2561000 
1 1 1 26 15 2  f 3.349000  0.1902000     3.609000  0.2556000     3.089000  0.2817000     0.5200000      0.3804000 
1 1 1 26 15 3  o 8.419000  0.1231000     8.418000  0.1751000     8.420000  0.1730000     -0.1964000E-02 0.2461000 
1 1 1 26 15 4  o 1.290000  0.3249000     1.688000  0.5025000     0.8925000 0.4121000     0.7952000      0.6499000 
1 1 1 26 15 5  o 1.255000  0.3528000     1.153000  0.4846000     1.357000  0.5129000     -0.2043000     0.7056000 
1 1 1 26 15 6  o 6.879000  0.1581000     7.103000  0.2443000     6.654000  0.2009000     0.4497000      0.3163000 
1 1 1 26 15 7  o 9.797000  0.2233000     10.17000  0.2968000     9.426000  0.3339000     0.7414000      0.4467000 
1 1 1 26 15 8  o 7.423000  0.1887000     7.078000  0.2595000     7.769000  0.2741000     -0.6920000     0.3775000 
1 1 1 26 15 9  o 7.777000  0.1956000     7.765000  0.2641000     7.788000  0.2887000     -0.2387000E-01 0.3913000 
1 1 1 26 15 10 o 9.138000  0.3563000     9.482000  0.6574000     8.793000  0.2747000     0.6887000      0.7125000 
1 1 1 26 15 11 o 5.303000  0.2616000     5.256000  0.3581000     5.350000  0.3816000     -0.9434000E-01 0.5233000 
1 1 1 26 15 12 o 2.785000  0.5343000     2.521000  0.8720000     3.049000  0.6177000     -0.5287000     1.069000  
1 1 1 26 15 13 o 2.865000  0.6966000     1.695000  0.7901000     4.034000  1.148000      -2.339000      1.393000  
1 1 1 26 15 14 o 3.246000  0.4186000     2.677000  0.6163000     3.814000  0.5666000     -1.137000      0.8372000 
1 1 1 26 15 15 o 1.668000  0.4532000     1.919000  0.6621000     1.418000  0.6192000     0.5011000      0.9065000 
1 1 1 26 15 16 o 1.879000  0.4963000     1.667000  0.7185000     2.090000  0.6849000     -0.4221000     0.9926000 
1 1 1 26 15 17 o 1.388000  0.4268000     1.447000  0.6164000     1.329000  0.5904000     0.1178000      0.8535000 
1 1 1 26 15 18 o 1.575000  0.4880000     1.539000  0.6305000     1.611000  0.7450000     -0.7211000E-01 0.9760000 
1 1 1 26 15 19 o 1.338000  0.4149000     1.198000  0.5461000     1.478000  0.6246000     -0.2794000     0.8297000 
1 1 1 26 15 20 o 1.284000  0.4018000     1.610000  0.6507000     0.9583000 0.4717000     0.6516000      0.8037000 
1 1 1 26 16 0  o 3.906000  0.2366000     3.906000  0.2366000     3.906000  0.2366000     -0.000000      0.000000  
1 1 1 26 16 1  o 12.15000  0.1280000     12.25000  0.1810000     12.06000  0.1810000     0.1925000      0.2560000 
1 1 1 26 16 2  o 6.119000  0.1320000     6.044000  0.1894000     6.195000  0.1838000     -0.1514000     0.2640000 
1 1 1 26 16 3  o 16.10000  0.1509000     16.04000  0.2123000     16.15000  0.2145000     -0.1040000     0.3018000 
1 1 1 26 16 4  f 3.928000  0.1892000     3.779000  0.2805000     4.077000  0.2540000     -0.2983000     0.3784000 
1 1 1 26 16 5  o 7.848000  0.1390000     7.778000  0.1986000     7.918000  0.1947000     -0.1398000     0.2781000 
1 1 1 26 16 6  o 10.67000  0.1530000     10.70000  0.2422000     10.63000  0.1869000     0.7420000E-01  0.3060000 
1 1 1 26 16 7  o 1.790000  0.4373000     2.025000  0.6302000     1.556000  0.6065000     0.4690000      0.8747000 
1 1 1 26 16 8  o 1.566000  0.4338000     1.722000  0.6197000     1.411000  0.6073000     0.3108000      0.8677000 
1 1 1 26 16 9  o 4.018000  0.3214000     4.199000  0.4037000     3.837000  0.5001000     0.3620000      0.6427000 
1 1 1 26 16 10 o 4.531000  0.3793000     4.377000  0.6407000     4.684000  0.4063000     -0.3071000     0.7587000 
1 1 1 26 16 11 o 1.662000  0.4694000     1.739000  0.6627000     1.586000  0.6649000     0.1532000      0.9388000 
1 1 1 26 16 12 o 1.934000  0.5537000     1.952000  0.8572000     1.917000  0.7011000     0.3510000E-01  1.107000  
1 1 1 26 16 13 o 2.671000  0.6020000     3.494000  0.9519000     1.848000  0.7371000     1.646000       1.204000  
1 1 1 26 16 14 f 2.096000  0.5129000     1.969000  0.6987000     2.223000  0.7511000     -0.2539000     1.026000  
1 1 1 26 16 15 o 1.656000  0.4392000     2.087000  0.6636000     1.226000  0.5755000     0.8615000      0.8784000 
1 1 1 26 16 16 o 2.322000  0.4595000     1.873000  0.6631000     2.770000  0.6364000     -0.8969000     0.9191000 
1 1 1 26 16 17 o 2.157000  0.4731000     2.069000  0.6531000     2.246000  0.6848000     -0.1775000     0.9463000 
1 1 1 26 16 18 o 1.352000  0.4325000     1.449000  0.6116000     1.254000  0.6117000     0.1953000      0.8650000 
1 1 1 26 16 19 o 2.114000  0.4736000     2.236000  0.6512000     1.992000  0.6878000     0.2447000      0.9472000 
1 1 1 26 16 20 o 1.614000  0.4159000     2.225000  0.6738000     1.002000  0.4877000     1.223000       0.8318000 
1 1 1 26 17 0  o 0.4129000 0.3027000     0.4129000 0.3027000     0.4129000 0.3027000     -0.000000      0.000000  
1 1 1 26 17 1  o 4.235000  0.1640000     4.294000  0.2295000     4.175000  0.2343000     0.1191000      0.3280000 
1 1 1 26 17 2  o 18.68000  0.1655000     18.80000  0.2343000     18.56000  0.2337000     0.2356000      0.3309000 
1 1 1 26 17 3  o 12.15000  0.1344000     12.18000  0.1893000     12.13000  0.1907000     0.5400000E-01  0.2687000 
1 1 1 26 17 4  o 5.200000  0.1616000     5.184000  0.2301000     5.216000  0.2270000     -0.3262000E-01 0.3233000 
1 1 1 26 17 5  o 5.834000  0.1578000     5.775000  0.2205000     5.893000  0.2258000     -0.1174000     0.3157000 
1 1 1 26 17 6  o 8.157000  0.1637000     8.091000  0.2560000     8.223000  0.2041000     -0.1318000     0.3274000 
1 1 1 26 17 7  o 6.971000  0.1763000     7.005000  0.2768000     6.938000  0.2183000     0.6761000E-01  0.3525000 
1 1 1 26 17 8  o 12.32000  0.1697000     12.28000  0.2668000     12.37000  0.2097000     -0.8845000E-01 0.3393000 
1 1 1 26 17 9  o 3.800000  0.3535000     3.436000  0.4786000     4.164000  0.5205000     -0.7275000     0.7071000 
1 1 1 26 17 10 o 5.253000  0.2546000     5.181000  0.3480000     5.325000  0.3716000     -0.1438000     0.5091000 
1 1 1 26 17 11 o 2.162000  0.4994000     2.137000  0.6884000     2.188000  0.7238000     -0.5095000E-01 0.9989000 
1 1 1 26 17 12 o 5.123000  0.4293000     4.788000  0.7611000     5.458000  0.3973000     -0.6696000     0.8585000 
1 1 1 26 17 13 o 2.710000  0.6148000     2.939000  0.9715000     2.482000  0.7536000     0.4566000      1.230000  
1 1 1 26 17 14 o 5.172000  0.3866000     5.457000  0.4664000     4.886000  0.6167000     0.5713000      0.7732000 
1 1 1 26 17 15 o 1.641000  0.4760000     1.401000  0.6252000     1.881000  0.7180000     -0.4808000     0.9520000 
1 1 1 26 17 16 o 1.478000  0.4343000     1.213000  0.5551000     1.744000  0.6682000     -0.5310000     0.8687000 
1 1 1 26 17 17 o 2.119000  0.4799000     1.958000  0.6728000     2.281000  0.6846000     -0.3234000     0.9599000 
1 1 1 26 17 18 o 1.353000  0.4211000     1.475000  0.6158000     1.230000  0.5746000     0.2449000      0.8423000 
1 1 1 26 17 19 o 1.529000  0.4280000     1.082000  0.5126000     1.975000  0.6856000     -0.8930000     0.8561000 
1 1 1 26 17 20 o 1.480000  0.4466000     1.496000  0.6185000     1.464000  0.6444000     0.3181000E-01  0.8932000 
1 1 1 26 18 0  o 2.524000  0.3872000     2.524000  0.3872000     2.524000  0.3872000     0.000000       0.000000  
1 1 1 26 18 1  o 8.046000  0.1268000     8.009000  0.1795000     8.082000  0.1791000     -0.7248000E-01 0.2535000 
1 1 1 26 18 2  o 6.443000  0.1370000     6.630000  0.1903000     6.255000  0.1971000     0.3750000      0.2739000 
1 1 1 26 18 3  o 6.392000  0.1446000     6.382000  0.2058000     6.401000  0.2030000     -0.1936000E-01 0.2891000 
1 1 1 26 18 4  o 5.451000  0.1613000     5.428000  0.2303000     5.473000  0.2260000     -0.4505000E-01 0.3226000 
1 1 1 26 18 5  o 13.68000  0.1475000     13.84000  0.2104000     13.52000  0.2067000     0.3196000      0.2949000 
1 1 1 26 18 6  o 3.755000  0.2669000     3.797000  0.3479000     3.713000  0.4050000     0.8348000E-01  0.5339000 
1 1 1 26 18 7  o 1.360000  0.3853000     1.085000  0.5083000     1.634000  0.5793000     -0.5489000     0.7707000 
1 1 1 26 18 8  o 4.373000  0.2492000     4.435000  0.3854000     4.311000  0.3160000     0.1233000      0.4984000 
1 1 1 26 18 9  o 2.074000  0.5772000     2.128000  0.9181000     2.021000  0.6999000     0.1069000      1.154000  
1 1 1 26 18 10 o 3.799000  0.3311000     3.663000  0.4623000     3.934000  0.4743000     -0.2702000     0.6623000 
1 1 1 26 18 11 o 2.568000  0.4754000     2.058000  0.6967000     3.078000  0.6471000     -1.021000      0.9508000 
1 1 1 26 18 12 o 2.294000  0.6221000     3.169000  1.043000      1.419000  0.6790000     1.750000       1.244000  
1 1 1 26 18 13 o 1.245000  0.4311000     1.298000  0.6428000     1.192000  0.5745000     0.1054000      0.8622000 
1 1 1 26 18 14 o 2.788000  0.4731000     2.363000  0.6754000     3.213000  0.6627000     -0.8508000     0.9462000 
1 1 1 26 18 15 o 2.305000  0.6345000     2.524000  1.068000      2.085000  0.6853000     0.4387000      1.269000  
1 1 1 26 18 16 o 1.889000  0.4720000     2.077000  0.6677000     1.701000  0.6673000     0.3763000      0.9440000 
1 1 1 26 18 17 o 1.470000  0.4387000     1.505000  0.6228000     1.434000  0.6179000     0.7067000E-01  0.8773000 
1 1 1 26 18 18 o 2.405000  0.4221000     1.550000  0.6275000     3.260000  0.5648000     -1.709000      0.8442000 
1 1 1 26 18 19 o 1.119000  0.3734000     1.144000  0.5310000     1.094000  0.5251000     0.5015000E-01  0.7468000 
1 1 1 26 18 20 o 1.086000  0.3726000     0.9611000 0.4733000     1.210000  0.5756000     -0.2489000     0.7452000 
1 1 1 26 19 0  o 3.882000  0.2655000     3.882000  0.2655000     3.882000  0.2655000     -0.000000      0.000000  
1 1 1 26 19 1  o 4.050000  0.1833000     3.742000  0.2741000     4.357000  0.2436000     -0.6159000     0.3667000 
1 1 1 26 19 2  o 2.455000  0.2955000     2.059000  0.4695000     2.851000  0.3591000     -0.7923000     0.5911000 
1 1 1 26 19 3  o 12.45000  0.1395000     12.44000  0.1969000     12.46000  0.1976000     -0.1554000E-01 0.2789000 
1 1 1 26 19 4  o 12.95000  0.1440000     12.76000  0.2039000     13.14000  0.2035000     -0.3790000     0.2881000 
1 1 1 26 19 5  f 9.912000  0.1576000     9.692000  0.2437000     10.13000  0.1999000     -0.4381000     0.3152000 
1 1 1 26 19 6  o 3.282000  0.2806000     3.300000  0.3748000     3.265000  0.4178000     0.3502000E-01  0.5613000 
1 1 1 26 19 7  o 4.620000  0.2155000     4.447000  0.3113000     4.794000  0.2979000     -0.3479000     0.4309000 
1 1 1 26 19 8  o 5.491000  0.2333000     5.348000  0.3560000     5.633000  0.3015000     -0.2854000     0.4665000 
1 1 1 26 19 9  o 3.816000  0.4837000     2.705000  0.9213000     4.926000  0.2953000     -2.221000      0.9674000 
1 1 1 26 19 10 o 1.759000  0.4490000     2.111000  0.6485000     1.407000  0.6212000     0.7034000      0.8980000 
1 1 1 26 19 11 o 1.929000  0.4860000     1.917000  0.6852000     1.941000  0.6895000     -0.2330000E-01 0.9721000 
1 1 1 26 19 12 o 2.492000  0.6724000     2.716000  1.035000      2.269000  0.8585000     0.4469000      1.345000  
1 1 1 26 19 13 o 1.340000  0.4375000     1.174000  0.5632000     1.507000  0.6697000     -0.3329000     0.8750000 
1 1 1 26 19 14 o 2.000000  0.5071000     1.738000  0.6757000     2.263000  0.7563000     -0.5248000     1.014000  
1 1 1 26 19 15 o 1.826000  0.5743000     2.032000  0.9419000     1.621000  0.6575000     0.4113000      1.149000  
1 1 1 26 19 16 o 1.575000  0.4491000     1.485000  0.6153000     1.666000  0.6542000     -0.1813000     0.8982000 
1 1 1 26 19 17 o 1.526000  0.4619000     1.472000  0.6322000     1.579000  0.6736000     -0.1063000     0.9238000 
1 1 1 26 19 18 o 1.340000  0.4185000     1.213000  0.5566000     1.467000  0.6251000     -0.2538000     0.8370000 
1 1 1 26 19 19 o 1.837000  0.4755000     1.683000  0.6572000     1.991000  0.6875000     -0.3077000     0.9511000 
1 1 1 26 20 0  o 10.15000  0.1870000     10.15000  0.1870000     10.15000  0.1870000     -0.000000      0.000000  
1 1 1 26 20 1  o 1.618000  0.3282000     1.011000  0.4720000     2.224000  0.4560000     -1.213000      0.6563000 
1 1 1 26 20 2  o 3.550000  0.2182000     3.279000  0.3232000     3.822000  0.2931000     -0.5432000     0.4363000 
1 1 1 26 20 3  o 10.75000  0.1380000     10.72000  0.1956000     10.79000  0.1949000     -0.7275000E-01 0.2761000 
1 1 1 26 20 4  o 15.82000  0.1580000     15.83000  0.2235000     15.82000  0.2235000     0.1121000E-01  0.3161000 
1 1 1 26 20 5  o 10.63000  0.1648000     10.76000  0.2267000     10.50000  0.2391000     0.2580000      0.3295000 
1 1 1 26 20 6  o 5.136000  0.1932000     5.406000  0.2577000     4.866000  0.2879000     0.5404000      0.3864000 
1 1 1 26 20 7  o 2.422000  0.3809000     2.221000  0.5648000     2.622000  0.5112000     -0.4009000     0.7618000 
1 1 1 26 20 8  o 3.724000  0.3078000     3.803000  0.4066000     3.644000  0.4621000     0.1591000      0.6155000 
1 1 1 26 20 9  o 8.868000  0.1819000     8.923000  0.2900000     8.813000  0.2195000     0.1096000      0.3637000 
1 1 1 26 20 10 o 8.276000  0.2233000     8.339000  0.3437000     8.214000  0.2853000     0.1255000      0.4467000 
1 1 1 26 20 11 o 7.936000  0.2453000     8.589000  0.3092000     7.284000  0.3809000     1.304000       0.4906000 
1 1 1 26 20 12 o 3.384000  0.5276000     3.720000  0.8344000     3.049000  0.6460000     0.6711000      1.055000  
1 1 1 26 20 13 o 1.462000  0.4592000     1.486000  0.6493000     1.438000  0.6494000     0.4780000E-01  0.9183000 
1 1 1 26 20 14 o 4.702000  0.3198000     5.001000  0.3702000     4.402000  0.5217000     0.5994000      0.6397000 
1 1 1 26 20 15 o 2.017000  0.5184000     2.005000  0.7719000     2.029000  0.6922000     -0.2386000E-01 1.037000  
1 1 1 26 20 16 o 2.491000  0.4620000     2.415000  0.6365000     2.567000  0.6698000     -0.1519000     0.9239000 
1 1 1 26 20 17 o 1.848000  0.5333000     1.774000  0.6893000     1.922000  0.8139000     -0.1479000     1.067000  
1 1 1 26 20 18 o 1.430000  0.4353000     1.439000  0.6120000     1.422000  0.6193000     0.1728000E-01  0.8707000 
1 1 1 26 20 19 o 1.520000  0.4318000     1.903000  0.6745000     1.138000  0.5394000     0.7649000      0.8637000 
1 1 1 26 21 0  o 5.535000  0.2258000     5.535000  0.2258000     5.535000  0.2258000     -0.000000      0.000000  
1 1 1 26 21 1  o 4.780000  0.1753000     4.691000  0.2503000     4.869000  0.2455000     -0.1781000     0.3506000 
1 1 1 26 21 2  o 10.05000  0.1365000     10.09000  0.1921000     10.01000  0.1939000     0.8069000E-01  0.2729000 
1 1 1 26 21 3  o 4.046000  0.2093000     3.843000  0.3091000     4.248000  0.2822000     -0.4053000     0.4185000 
1 1 1 26 21 4  o 7.685000  0.1656000     7.747000  0.2541000     7.624000  0.2126000     0.1235000      0.3313000 
1 1 1 26 21 5  o 6.114000  0.1722000     6.171000  0.2343000     6.058000  0.2525000     0.1137000      0.3444000 
1 1 1 26 21 6  o 8.197000  0.1570000     8.273000  0.2226000     8.122000  0.2215000     0.1511000      0.3141000 
1 1 1 26 21 7  o 7.213000  0.1924000     7.397000  0.2571000     7.029000  0.2861000     0.3679000      0.3847000 
1 1 1 26 21 8  o 6.707000  0.2017000     6.966000  0.3119000     6.448000  0.2559000     0.5177000      0.4035000 
1 1 1 26 21 9  o 1.770000  0.4494000     1.723000  0.6665000     1.816000  0.6029000     -0.9302000E-01 0.8987000 
1 1 1 26 21 10 o 2.733000  0.4188000     3.086000  0.6052000     2.381000  0.5789000     0.7056000      0.8375000 
1 1 1 26 21 11 o 3.020000  0.4463000     2.554000  0.6735000     3.486000  0.5859000     -0.9320000     0.8927000 
1 1 1 26 21 12 o 3.659000  0.4883000     3.891000  0.8197000     3.426000  0.5307000     0.4652000      0.9765000 
1 1 1 26 21 13 o 2.368000  0.4985000     2.510000  0.6471000     2.227000  0.7585000     0.2834000      0.9970000 
1 1 1 26 21 14 o 1.339000  0.4347000     1.327000  0.6134000     1.350000  0.6161000     -0.2226000E-01 0.8694000 
1 1 1 26 21 15 o 2.340000  0.4481000     2.788000  0.5665000     1.892000  0.6943000     0.8959000      0.8961000 
1 1 1 26 21 16 o 1.687000  0.4675000     1.527000  0.6296000     1.847000  0.6913000     -0.3196000     0.9350000 
1 1 1 26 21 17 o 2.036000  0.5123000     2.429000  0.7126000     1.644000  0.7362000     0.7852000      1.025000  
1 1 1 26 21 18 o 1.756000  0.4651000     2.105000  0.6977000     1.407000  0.6151000     0.6987000      0.9302000 
1 1 1 26 21 19 o 1.735000  0.4557000     1.397000  0.6001000     2.073000  0.6861000     -0.6758000     0.9115000 
1 1 1 26 22 0  o 3.593000  0.3120000     3.593000  0.3120000     3.593000  0.3120000     0.000000       0.000000  
1 1 1 26 22 1  o 10.18000  0.1378000     10.03000  0.1939000     10.33000  0.1957000     -0.3029000     0.2755000 
1 1 1 26 22 2  o 3.080000  0.2602000     3.305000  0.3316000     2.854000  0.4010000     0.4510000      0.5203000 
1 1 1 26 22 3  o 6.715000  0.1733000     6.702000  0.2686000     6.727000  0.2190000     -0.2461000E-01 0.3466000 
1 1 1 26 22 4  o 10.03000  0.1772000     9.993000  0.2332000     10.07000  0.2670000     -0.8073000E-01 0.3545000 
1 1 1 26 22 5  o 2.972000  0.3074000     3.274000  0.3873000     2.670000  0.4776000     0.6038000      0.6149000 
1 1 1 26 22 6  o 5.135000  0.2233000     5.361000  0.2753000     4.908000  0.3518000     0.4529000      0.4467000 
1 1 1 26 22 7  o 4.091000  0.3348000     3.887000  0.5331000     4.296000  0.4051000     -0.4085000     0.6695000 
1 1 1 26 22 8  o 3.145000  0.3466000     3.990000  0.3580000     2.299000  0.5936000     1.691000       0.6932000 
1 1 1 26 22 9  o 9.038000  0.1686000     9.091000  0.2389000     8.984000  0.2381000     0.1063000      0.3373000 
1 1 1 26 22 10 o 5.368000  0.2464000     5.026000  0.4035000     5.711000  0.2828000     -0.6849000     0.4928000 
1 1 1 26 22 11 o 4.610000  0.4530000     4.650000  0.6309000     4.571000  0.6502000     0.7954000E-01  0.9060000 
1 1 1 26 22 12 o 4.205000  0.4691000     3.894000  0.8377000     4.516000  0.4225000     -0.6220000     0.9382000 
1 1 1 26 22 13 f 2.087000  0.5003000     2.087000  0.6705000     2.087000  0.7427000     0.9482000E-03  1.001000  
1 1 1 26 22 14 o 1.773000  0.5620000     2.012000  0.9215000     1.535000  0.6435000     0.4776000      1.124000  
1 1 1 26 22 15 o 2.046000  0.4571000     2.352000  0.6279000     1.739000  0.6646000     0.6138000      0.9143000 
1 1 1 26 22 16 o 2.149000  0.4796000     2.173000  0.6714000     2.124000  0.6852000     0.4865000E-01  0.9593000 
1 1 1 26 22 17 o 1.281000  0.4141000     1.270000  0.5767000     1.292000  0.5945000     -0.2251000E-01 0.8283000 
1 1 1 26 22 18 o 2.145000  0.4581000     2.758000  0.6513000     1.532000  0.6445000     1.225000       0.9163000 
1 1 1 26 22 19 o 1.277000  0.4125000     1.190000  0.5566000     1.365000  0.6089000     -0.1745000     0.8250000 
1 1 1 26 23 0  o 11.35000  0.1985000     11.35000  0.1985000     11.35000  0.1985000     0.000000       0.000000  
1 1 1 26 23 1  f 4.548000  0.1906000     4.336000  0.2741000     4.760000  0.2649000     -0.4238000     0.3812000 
1 1 1 26 23 2  o 5.472000  0.1901000     5.473000  0.2886000     5.472000  0.2475000     0.1137000E-02  0.3801000 
1 1 1 26 23 3  o 6.714000  0.1817000     6.497000  0.2585000     6.930000  0.2555000     -0.4328000     0.3634000 
1 1 1 26 23 4  o 10.34000  0.1546000     10.75000  0.2088000     9.926000  0.2281000     0.8286000      0.3092000 
1 1 1 26 23 5  o 9.665000  0.1656000     9.504000  0.2133000     9.826000  0.2533000     -0.3220000     0.3312000 
1 1 1 26 23 6  o 6.008000  0.2162000     6.053000  0.2841000     5.963000  0.3261000     0.9005000E-01  0.4325000 
1 1 1 26 23 7  o 1.340000  0.3904000     1.590000  0.5972000     1.090000  0.5029000     0.4999000      0.7808000 
1 1 1 26 23 8  o 5.420000  0.2060000     5.099000  0.3092000     5.741000  0.2724000     -0.6417000     0.4121000 
1 1 1 26 23 9  o 4.001000  0.2687000     4.179000  0.3615000     3.824000  0.3976000     0.3557000      0.5373000 
1 1 1 26 23 10 o 1.492000  0.4321000     1.822000  0.6856000     1.162000  0.5263000     0.6601000      0.8643000 
1 1 1 26 23 11 o 3.806000  0.5091000     3.663000  0.8804000     3.949000  0.5116000     -0.2858000     1.018000  
1 1 1 26 23 12 o 4.575000  0.4250000     4.259000  0.7478000     4.891000  0.4042000     -0.6316000     0.8500000 
1 1 1 26 23 13 o 4.796000  0.2940000     4.208000  0.4222000     5.384000  0.4092000     -1.176000      0.5880000 
1 1 1 26 23 14 o 1.227000  0.4099000     1.364000  0.6306000     1.091000  0.5240000     0.2725000      0.8199000 
1 1 1 26 23 15 o 2.852000  0.4149000     2.272000  0.6437000     3.432000  0.5236000     -1.160000      0.8297000 
1 1 1 26 23 16 o 2.009000  0.4792000     1.797000  0.6635000     2.221000  0.6916000     -0.4235000     0.9584000 
1 1 1 26 23 17 o 1.219000  0.3971000     1.135000  0.5325000     1.304000  0.5892000     -0.1690000     0.7941000 
1 1 1 26 23 18 o 1.560000  0.4422000     1.194000  0.5574000     1.925000  0.6867000     -0.7314000     0.8844000 
1 1 1 26 23 19 o 1.746000  0.4876000     1.691000  0.6720000     1.801000  0.7068000     -0.1098000     0.9752000 
1 1 1 26 24 0  o 0.8274000 0.5563000     0.8274000 0.5563000     0.8274000 0.5563000     -0.000000      0.000000  
1 1 1 26 24 1  o 1.696000  0.3994000     2.115000  0.5919000     1.276000  0.5363000     0.8390000      0.7987000 
1 1 1 26 24 2  o 9.204000  0.1652000     9.193000  0.2330000     9.214000  0.2343000     -0.2067000E-01 0.3305000 
1 1 1 26 24 3  o 8.718000  0.1810000     8.874000  0.2095000     8.562000  0.2953000     0.3119000      0.3621000 
1 1 1 26 24 4  o 3.219000  0.3355000     3.584000  0.3772000     2.854000  0.5550000     0.7295000      0.6711000 
1 1 1 26 24 5  o 8.420000  0.1847000     8.200000  0.2480000     8.640000  0.2738000     -0.4404000     0.3694000 
1 1 1 26 24 6  o 8.056000  0.1850000     7.550000  0.2915000     8.562000  0.2278000     -1.012000      0.3700000 
1 1 1 26 24 7  o 4.474000  0.2327000     4.656000  0.3126000     4.293000  0.3448000     0.3625000      0.4654000 
1 1 1 26 24 8  o 3.791000  0.2732000     3.901000  0.3772000     3.680000  0.3953000     0.2205000      0.5464000 
1 1 1 26 24 9  o 3.111000  0.3406000     3.301000  0.4548000     2.922000  0.5072000     0.3786000      0.6812000 
1 1 1 26 24 10 o 2.521000  0.4407000     2.036000  0.7162000     3.006000  0.5136000     -0.9705000     0.8813000 
1 1 1 26 24 11 o 1.874000  0.5142000     1.844000  0.8134000     1.904000  0.6292000     -0.5968000E-01 1.028000  
1 1 1 26 24 12 o 2.364000  0.5742000     2.747000  0.9099000     1.982000  0.7008000     0.7645000      1.148000  
1 1 1 26 24 13 o 1.086000  0.3723000     0.8308000 0.4172000     1.341000  0.6166000     -0.5099000     0.7445000 
1 1 1 26 24 14 o 1.111000  0.3712000     0.9697000 0.4732000     1.253000  0.5721000     -0.2836000     0.7425000 
1 1 1 26 24 15 o 1.273000  0.4046000     1.359000  0.5938000     1.188000  0.5497000     0.1708000      0.8092000 
1 1 1 26 24 16 o 1.409000  0.4341000     1.587000  0.6424000     1.230000  0.5840000     0.3570000      0.8682000 
1 1 1 26 24 17 o 1.742000  0.4657000     2.003000  0.6838000     1.480000  0.6325000     0.5229000      0.9314000 
1 1 1 26 24 18 o 2.014000  0.5070000     1.991000  0.7451000     2.038000  0.6879000     -0.4659000E-01 1.014000  
1 1 1 26 25 0  o 3.902000  0.4462000     3.902000  0.4462000     3.902000  0.4462000     -0.000000      0.000000  
1 1 1 26 25 1  o 3.574000  0.4703000     3.574000  0.4703000     ?         ?             ?              ?         
1 1 1 26 25 2  o 10.89000  0.2498000     11.07000  0.2316000     10.72000  0.4427000     0.3489000      0.4996000 
1 1 1 26 25 3  o 5.978000  0.2059000     5.875000  0.2748000     6.082000  0.3066000     -0.2068000     0.4118000 
1 1 1 26 25 4  o 4.470000  0.2873000     4.462000  0.4209000     4.479000  0.3911000     -0.1700000E-01 0.5746000 
1 1 1 26 25 5  o 3.306000  0.3368000     3.086000  0.5512000     3.526000  0.3874000     -0.4398000     0.6737000 
1 1 1 26 25 6  o 2.554000  0.3823000     2.657000  0.5101000     2.451000  0.5695000     0.2057000      0.7646000 
1 1 1 26 25 7  o 6.772000  0.1798000     6.491000  0.2625000     7.052000  0.2457000     -0.5610000     0.3595000 
1 1 1 26 25 8  o 3.377000  0.3199000     3.815000  0.3967000     2.940000  0.5019000     0.8750000      0.6398000 
1 1 1 26 25 9  o 3.364000  0.3148000     3.449000  0.4273000     3.279000  0.4624000     0.1699000      0.6297000 
1 1 1 26 25 10 o 1.756000  0.4698000     1.691000  0.6459000     1.822000  0.6823000     -0.1316000     0.9395000 
1 1 1 26 25 11 o 2.189000  0.4575000     1.626000  0.7511000     2.752000  0.5226000     -1.126000      0.9151000 
1 1 1 26 25 12 o 4.743000  0.4151000     4.341000  0.7596000     5.145000  0.3350000     -0.8038000     0.8302000 
1 1 1 26 25 13 o 3.613000  0.6216000     3.527000  1.106000      3.698000  0.5666000     -0.1710000     1.243000  
1 1 1 26 25 14 o 3.462000  0.3651000     4.085000  0.3942000     2.840000  0.6146000     1.245000       0.7301000 
1 1 1 26 25 15 o 1.983000  0.4481000     1.526000  0.6347000     2.440000  0.6328000     -0.9145000     0.8962000 
1 1 1 26 25 16 o 1.910000  0.5685000     1.674000  0.6735000     2.146000  0.9162000     -0.4716000     1.137000  
1 1 1 26 25 17 o 1.468000  0.4294000     1.785000  0.6651000     1.151000  0.5433000     0.6343000      0.8588000 
1 1 1 26 25 18 o 1.131000  0.3783000     0.9155000 0.4533000     1.346000  0.6058000     -0.4307000     0.7567000 
1 1 1 26 26 0  o 4.949000  0.3105000     4.949000  0.3105000     4.949000  0.3105000     -0.000000      0.000000  
1 1 1 26 26 1  o 2.918000  0.3622000     3.078000  0.4653000     2.758000  0.5551000     0.3204000      0.7243000 
1 1 1 26 26 2  o 7.681000  0.1741000     7.303000  0.2641000     8.059000  0.2270000     -0.7566000     0.3482000 
1 1 1 26 26 3  o 7.087000  0.1793000     7.039000  0.2727000     7.135000  0.2328000     -0.9639000E-01 0.3585000 
1 1 1 26 26 4  o 6.419000  0.1789000     6.166000  0.2613000     6.672000  0.2445000     -0.5052000     0.3579000 
1 1 1 26 26 5  o 6.835000  0.1744000     6.794000  0.2479000     6.876000  0.2453000     -0.8147000E-01 0.3488000 
1 1 1 26 26 6  o 8.810000  0.1622000     8.758000  0.2294000     8.863000  0.2293000     -0.1042000     0.3243000 
1 1 1 26 26 7  o 4.662000  0.2311000     4.752000  0.3249000     4.573000  0.3289000     0.1794000      0.4623000 
1 1 1 26 26 8  o 3.550000  0.3065000     3.251000  0.4716000     3.850000  0.3917000     -0.5990000     0.6131000 
1 1 1 26 26 9  o 2.342000  0.4508000     2.020000  0.7140000     2.665000  0.5505000     -0.6453000     0.9016000 
1 1 1 26 26 10 o 1.038000  0.3505000     1.068000  0.5036000     1.009000  0.4876000     0.5960000E-01  0.7009000 
1 1 1 26 26 11 o 1.527000  0.4462000     1.503000  0.6412000     1.551000  0.6207000     -0.4862000E-01 0.8924000 
1 1 1 26 26 12 o 2.099000  0.4919000     2.138000  0.7408000     2.060000  0.6474000     0.7846000E-01  0.9838000 
1 1 1 26 26 13 o 1.552000  0.4709000     1.384000  0.6336000     1.719000  0.6968000     -0.3345000     0.9418000 
1 1 1 26 26 14 o 1.271000  0.4060000     1.262000  0.5700000     1.280000  0.5783000     -0.1819000E-01 0.8120000 
1 1 1 26 26 15 o 1.337000  0.4076000     1.040000  0.4998000     1.634000  0.6440000     -0.5943000     0.8151000 
1 1 1 26 26 16 o 1.814000  0.5065000     1.854000  0.6665000     1.774000  0.7628000     0.8076000E-01  1.013000  
1 1 1 26 26 17 f 1.443000  0.4392000     1.361000  0.5988000     1.525000  0.6428000     -0.1642000     0.8785000 
1 1 1 26 26 18 o 1.227000  0.3988000     1.360000  0.5982000     1.095000  0.5275000     0.2653000      0.7976000 
1 1 1 26 27 0  o 4.268000  0.3148000     4.268000  0.3148000     4.268000  0.3148000     0.000000       0.000000  
1 1 1 26 27 1  o 7.348000  0.1643000     7.415000  0.2271000     7.281000  0.2375000     0.1346000      0.3286000 
1 1 1 26 27 2  o 9.627000  0.1532000     9.777000  0.2144000     9.476000  0.2189000     0.3010000      0.3064000 
1 1 1 26 27 3  o 2.087000  0.4056000     1.909000  0.6012000     2.266000  0.5445000     -0.3576000     0.8111000 
1 1 1 26 27 4  f 2.377000  0.3970000     2.623000  0.5317000     2.130000  0.5898000     0.4929000      0.7940000 
1 1 1 26 27 5  o 10.14000  0.1597000     10.29000  0.2246000     9.981000  0.2271000     0.3140000      0.3194000 
1 1 1 26 27 6  o 8.947000  0.1636000     8.791000  0.2327000     9.103000  0.2300000     -0.3114000     0.3272000 
1 1 1 26 27 7  o 4.081000  0.2632000     3.973000  0.3720000     4.190000  0.3724000     -0.2167000     0.5264000 
1 1 1 26 27 8  o 3.023000  0.3440000     2.961000  0.5015000     3.085000  0.4711000     -0.1238000     0.6880000 
1 1 1 26 27 9  f 4.388000  0.3338000     4.624000  0.5036000     4.153000  0.4381000     0.4705000      0.6675000 
1 1 1 26 27 10 o 4.817000  0.2456000     4.815000  0.3509000     4.818000  0.3438000     -0.2672000E-02 0.4912000 
1 1 1 26 27 11 o 3.391000  0.3589000     3.659000  0.5112000     3.123000  0.5037000     0.5360000      0.7177000 
1 1 1 26 27 12 o 2.342000  0.4997000     1.855000  0.7361000     2.828000  0.6760000     -0.9724000     0.9994000 
1 1 1 26 27 13 o 1.965000  0.4153000     1.321000  0.6021000     2.609000  0.5721000     -1.288000      0.8306000 
1 1 1 26 27 14 o 1.445000  0.4369000     1.328000  0.5886000     1.562000  0.6458000     -0.2340000     0.8738000 
1 1 1 26 27 15 o 1.276000  0.4178000     1.162000  0.5368000     1.390000  0.6403000     -0.2284000     0.8356000 
1 1 1 26 27 16 o 1.376000  0.4240000     1.554000  0.6385000     1.197000  0.5582000     0.3572000      0.8481000 
1 1 1 26 27 17 o 1.189000  0.3912000     0.9899000 0.4841000     1.387000  0.6146000     -0.3974000     0.7823000 
1 1 1 26 27 18 o 1.751000  0.5024000     1.953000  0.6935000     1.550000  0.7272000     0.4035000      1.005000  
1 1 1 26 28 0  o 6.477000  0.2449000     6.477000  0.2449000     6.477000  0.2449000     0.000000       0.000000  
1 1 1 26 28 1  o 6.540000  0.1740000     6.564000  0.2394000     6.516000  0.2525000     0.4756000E-01  0.3479000 
1 1 1 26 28 2  f 5.914000  0.1868000     5.716000  0.2681000     6.112000  0.2603000     -0.3965000     0.3737000 
1 1 1 26 28 3  o 5.175000  0.2019000     5.149000  0.2863000     5.201000  0.2847000     -0.5179000E-01 0.4038000 
1 1 1 26 28 4  o 1.638000  0.4071000     1.264000  0.5461000     2.011000  0.6039000     -0.7473000     0.8142000 
1 1 1 26 28 5  o 4.093000  0.2551000     4.280000  0.3456000     3.906000  0.3754000     0.3744000      0.5102000 
1 1 1 26 28 6  o 7.752000  0.1729000     7.988000  0.2440000     7.516000  0.2451000     0.4716000      0.3458000 
1 1 1 26 28 7  o 1.652000  0.3981000     1.122000  0.5140000     2.182000  0.6081000     -1.060000      0.7963000 
1 1 1 26 28 8  o 1.703000  0.4429000     1.858000  0.6442000     1.549000  0.6080000     0.3089000      0.8858000 
1 1 1 26 28 9  o 5.130000  0.2784000     4.419000  0.4044000     5.841000  0.3827000     -1.421000      0.5568000 
1 1 1 26 28 10 o 2.881000  0.4280000     2.381000  0.7150000     3.380000  0.4708000     -0.9988000     0.8560000 
1 1 1 26 28 11 o 1.803000  0.4831000     1.925000  0.6994000     1.681000  0.6667000     0.2437000      0.9663000 
1 1 1 26 28 12 o 4.280000  0.3137000     4.112000  0.4814000     4.449000  0.4025000     -0.3368000     0.6275000 
1 1 1 26 28 13 o 1.828000  0.4695000     1.709000  0.6882000     1.947000  0.6389000     -0.2386000     0.9391000 
1 1 1 26 28 14 o 2.942000  0.4188000     2.487000  0.6471000     3.396000  0.5318000     -0.9091000     0.8376000 
1 1 1 26 28 15 o 1.949000  0.5457000     1.785000  0.6806000     2.113000  0.8531000     -0.3282000     1.091000  
1 1 1 26 28 16 o 2.509000  0.4439000     1.950000  0.6725000     3.068000  0.5797000     -1.117000      0.8879000 
1 1 1 26 28 17 o 1.172000  0.3886000     1.009000  0.4933000     1.335000  0.6007000     -0.3258000     0.7773000 
1 1 1 26 28 18 o 0.9106000 0.4703000     ?         ?             0.9106000 0.4703000     ?              ?         
1 1 1 26 29 0  o 12.90000  0.2224000     12.90000  0.2224000     12.90000  0.2224000     -0.000000      0.000000  
1 1 1 26 29 1  o 8.095000  0.1607000     7.884000  0.2274000     8.307000  0.2272000     -0.4237000     0.3214000 
1 1 1 26 29 2  o 1.231000  0.3737000     1.001000  0.4714000     1.461000  0.5799000     -0.4608000     0.7473000 
1 1 1 26 29 3  o 6.122000  0.1854000     6.043000  0.2664000     6.202000  0.2579000     -0.1584000     0.3707000 
1 1 1 26 29 4  o 3.865000  0.2638000     4.004000  0.3574000     3.725000  0.3880000     0.2784000      0.5276000 
1 1 1 26 29 5  o 4.167000  0.2543000     4.126000  0.3658000     4.207000  0.3532000     -0.8126000E-01 0.5085000 
1 1 1 26 29 6  o 3.481000  0.3075000     4.063000  0.3717000     2.899000  0.4900000     1.164000       0.6150000 
1 1 1 26 29 7  o 1.433000  0.4106000     1.266000  0.5504000     1.599000  0.6095000     -0.3334000     0.8212000 
1 1 1 26 29 8  o 2.483000  0.4722000     2.031000  0.7370000     2.934000  0.5906000     -0.9030000     0.9444000 
1 1 1 26 29 9  o 3.522000  0.3219000     3.720000  0.4263000     3.325000  0.4824000     0.3955000      0.6438000 
1 1 1 26 29 10 o 2.391000  0.4708000     2.365000  0.7043000     2.416000  0.6249000     -0.5084000E-01 0.9416000 
1 1 1 26 29 11 o 4.234000  0.4080000     3.830000  0.5651000     4.638000  0.5886000     -0.8080000     0.8160000 
1 1 1 26 29 12 o 3.405000  0.3510000     3.093000  0.5018000     3.716000  0.4910000     -0.6227000     0.7021000 
1 1 1 26 29 13 o 1.395000  0.4315000     1.508000  0.6550000     1.282000  0.5619000     0.2262000      0.8630000 
1 1 1 26 29 14 o 1.618000  0.4515000     1.626000  0.6784000     1.609000  0.5959000     0.1626000E-01  0.9029000 
1 1 1 26 29 15 o 1.611000  0.4911000     1.258000  0.5799000     1.963000  0.7927000     -0.7044000     0.9822000 
1 1 1 26 29 16 o 1.910000  0.4624000     2.220000  0.6561000     1.600000  0.6518000     0.6204000      0.9248000 
1 1 1 26 29 17 o 1.520000  0.4275000     1.983000  0.6844000     1.057000  0.5124000     0.9258000      0.8549000 
1 1 1 26 30 0  o 1.452000  0.7187000     1.452000  0.7187000     1.452000  0.7187000     0.000000       0.000000  
1 1 1 26 30 1  o 7.104000  0.1711000     7.195000  0.2392000     7.013000  0.2448000     0.1814000      0.3423000 
1 1 1 26 30 2  o 3.888000  0.2605000     4.455000  0.3130000     3.320000  0.4164000     1.135000       0.5209000 
1 1 1 26 30 3  o 1.869000  0.4216000     1.602000  0.5983000     2.136000  0.5942000     -0.5340000     0.8432000 
1 1 1 26 30 4  o 1.438000  0.4018000     1.762000  0.6181000     1.114000  0.5137000     0.6478000      0.8037000 
1 1 1 26 30 5  o 3.775000  0.2760000     3.880000  0.3841000     3.670000  0.3966000     0.2105000      0.5521000 
1 1 1 26 30 6  f 4.518000  0.2412000     4.445000  0.3442000     4.590000  0.3380000     -0.1447000     0.4824000 
1 1 1 26 30 7  o 5.313000  0.2533000     4.917000  0.4075000     5.710000  0.3012000     -0.7925000     0.5067000 
1 1 1 26 30 8  o 3.483000  0.3867000     3.430000  0.4748000     3.536000  0.6104000     -0.1059000     0.7734000 
1 1 1 26 30 9  o 8.248000  0.1825000     8.361000  0.2566000     8.134000  0.2597000     0.2275000      0.3651000 
1 1 1 26 30 10 o 2.440000  0.4935000     2.524000  0.7139000     2.357000  0.6815000     0.1666000      0.9870000 
1 1 1 26 30 11 o 3.168000  0.3949000     3.122000  0.5936000     3.214000  0.5211000     -0.9200000E-01 0.7899000 
1 1 1 26 30 12 o 1.852000  0.4623000     1.602000  0.6167000     2.103000  0.6890000     -0.5008000     0.9247000 
1 1 1 26 30 13 o 2.585000  0.4071000     3.226000  0.4717000     1.943000  0.6637000     1.283000       0.8142000 
1 1 1 26 30 14 o 1.422000  0.4341000     1.472000  0.6536000     1.371000  0.5714000     0.1003000      0.8682000 
1 1 1 26 30 15 o 1.339000  0.4293000     1.236000  0.5683000     1.441000  0.6435000     -0.2051000     0.8585000 
1 1 1 26 30 16 o 1.433000  0.4222000     1.706000  0.6443000     1.160000  0.5458000     0.5469000      0.8445000 
1 1 1 26 30 17 o 1.273000  0.4141000     1.336000  0.5962000     1.210000  0.5748000     0.1261000      0.8282000 
1 1 1 26 31 0  o 6.388000  0.2550000     6.388000  0.2550000     6.388000  0.2550000     0.000000       0.000000  
1 1 1 26 31 1  o 1.847000  0.3773000     2.501000  0.5364000     1.194000  0.5308000     1.307000       0.7546000 
1 1 1 26 31 2  o 2.566000  0.3765000     2.359000  0.5595000     2.774000  0.5041000     -0.4154000     0.7531000 
1 1 1 26 31 3  o 5.282000  0.2104000     5.502000  0.2895000     5.063000  0.3053000     0.4389000      0.4208000 
1 1 1 26 31 4  o 2.883000  0.3604000     3.240000  0.4506000     2.527000  0.5626000     0.7130000      0.7208000 
1 1 1 26 31 5  o 1.780000  0.4336000     2.061000  0.6246000     1.500000  0.6015000     0.5611000      0.8671000 
1 1 1 26 31 6  o 2.697000  0.3848000     2.669000  0.5517000     2.725000  0.5367000     -0.5651000E-01 0.7697000 
1 1 1 26 31 7  o 4.001000  0.3657000     4.166000  0.5484000     3.837000  0.4840000     0.3288000      0.7314000 
1 1 1 26 31 8  f 3.202000  0.3549000     3.633000  0.4241000     2.770000  0.5691000     0.8630000      0.7097000 
1 1 1 26 31 9  o 1.514000  0.4337000     1.572000  0.6200000     1.456000  0.6066000     0.1159000      0.8674000 
1 1 1 26 31 10 o 3.639000  0.4378000     3.406000  0.6863000     3.872000  0.5439000     -0.4655000     0.8757000 
1 1 1 26 31 11 o 3.829000  0.3461000     3.686000  0.5487000     3.973000  0.4220000     -0.2862000     0.6922000 
1 1 1 26 31 12 o 2.182000  0.4651000     1.983000  0.6330000     2.382000  0.6817000     -0.3991000     0.9303000 
1 1 1 26 31 13 o 1.257000  0.3845000     0.9571000 0.4601000     1.556000  0.6161000     -0.5990000     0.7689000 
1 1 1 26 31 14 o 1.445000  0.4556000     1.788000  0.7497000     1.103000  0.5178000     0.6848000      0.9111000 
1 1 1 26 31 15 f 2.062000  0.4791000     2.142000  0.7422000     1.983000  0.6061000     0.1592000      0.9582000 
1 1 1 26 31 16 o 2.063000  0.4832000     1.734000  0.6724000     2.393000  0.6941000     -0.6588000     0.9664000 
1 1 1 26 31 17 o 1.267000  0.4285000     1.257000  0.6164000     1.276000  0.5954000     -0.1879000E-01 0.8569000 
1 1 1 26 32 0  o 0.5817000 0.4210000     0.5817000 0.4210000     0.5817000 0.4210000     -0.000000      0.000000  
1 1 1 26 32 1  o 3.788000  0.2693000     3.462000  0.4019000     4.114000  0.3586000     -0.6521000     0.5386000 
1 1 1 26 32 2  o 2.780000  0.3681000     2.737000  0.5378000     2.823000  0.5028000     -0.8642000E-01 0.7363000 
1 1 1 26 32 3  o 6.183000  0.1936000     5.904000  0.2813000     6.462000  0.2660000     -0.5581000     0.3871000 
1 1 1 26 32 4  o 8.300000  0.1702000     8.094000  0.2454000     8.505000  0.2358000     -0.4116000     0.3404000 
1 1 1 26 32 5  f 1.344000  0.4054000     1.397000  0.5840000     1.292000  0.5624000     0.1052000      0.8108000 
1 1 1 26 32 6  o 1.812000  0.4675000     2.044000  0.7003000     1.580000  0.6195000     0.4639000      0.9350000 
1 1 1 26 32 7  o 3.758000  0.3128000     3.436000  0.4595000     4.081000  0.4247000     -0.6453000     0.6257000 
1 1 1 26 32 8  o 4.469000  0.2552000     4.383000  0.3618000     4.555000  0.3600000     -0.1722000     0.5104000 
1 1 1 26 32 9  o 1.665000  0.4952000     1.347000  0.5955000     1.984000  0.7914000     -0.6375000     0.9904000 
1 1 1 26 32 10 o 4.209000  0.3050000     4.328000  0.4581000     4.089000  0.4027000     0.2389000      0.6099000 
1 1 1 26 32 11 o 1.827000  0.4576000     1.832000  0.6419000     1.821000  0.6524000     0.1079000E-01  0.9152000 
1 1 1 26 32 12 o 1.924000  0.4647000     1.979000  0.6402000     1.869000  0.6737000     0.1102000      0.9294000 
1 1 1 26 32 13 o 1.405000  0.4176000     1.437000  0.5938000     1.373000  0.5875000     0.6405000E-01  0.8353000 
1 1 1 26 32 14 o 1.440000  0.4323000     1.569000  0.6294000     1.310000  0.5927000     0.2589000      0.8645000 
1 1 1 26 32 15 o 1.330000  0.4163000     1.278000  0.5977000     1.381000  0.5796000     -0.1029000     0.8326000 
1 1 1 26 32 16 f 1.104000  0.3738000     1.138000  0.5396000     1.069000  0.5175000     0.6915000E-01  0.7476000 
1 1 1 26 33 0  o 6.755000  0.2589000     6.755000  0.2589000     6.755000  0.2589000     0.000000       0.000000  
1 1 1 26 33 1  o 2.333000  0.3786000     3.115000  0.4554000     1.551000  0.6050000     1.564000       0.7572000 
1 1 1 26 33 2  f 4.477000  0.2463000     4.713000  0.3295000     4.241000  0.3661000     0.4718000      0.4925000 
1 1 1 26 33 3  o 1.497000  0.4245000     1.467000  0.5975000     1.527000  0.6031000     -0.5920000E-01 0.8490000 
1 1 1 26 33 4  o 5.927000  0.2019000     5.613000  0.2967000     6.241000  0.2739000     -0.6287000     0.4038000 
1 1 1 26 33 5  o 1.567000  0.4500000     1.626000  0.6657000     1.508000  0.6056000     0.1176000      0.8999000 
1 1 1 26 33 6  o 2.274000  0.4778000     1.730000  0.6646000     2.818000  0.6868000     -1.087000      0.9557000 
1 1 1 26 33 7  o 2.693000  0.4125000     3.104000  0.5193000     2.281000  0.6412000     0.8229000      0.8251000 
1 1 1 26 33 8  o 1.879000  0.4387000     2.249000  0.6045000     1.509000  0.6360000     0.7398000      0.8775000 
1 1 1 26 33 9  o 1.494000  0.4548000     1.307000  0.5956000     1.680000  0.6875000     -0.3730000     0.9096000 
1 1 1 26 33 10 o 1.707000  0.4584000     2.007000  0.6971000     1.408000  0.5955000     0.5987000      0.9168000 
1 1 1 26 33 11 o 1.472000  0.4166000     1.123000  0.5224000     1.822000  0.6491000     -0.6983000     0.8332000 
1 1 1 26 33 12 o 1.365000  0.4173000     1.490000  0.6066000     1.241000  0.5733000     0.2489000      0.8347000 
1 1 1 26 33 13 o 2.237000  0.4276000     1.571000  0.6713000     2.904000  0.5300000     -1.333000      0.8553000 
1 1 1 26 33 14 o 2.936000  0.4018000     3.233000  0.5132000     2.640000  0.6184000     0.5934000      0.8036000 
1 1 1 26 33 15 o 2.553000  0.5064000     2.768000  0.7324000     2.337000  0.6996000     0.4313000      1.013000  
1 1 1 26 33 16 o 1.735000  0.4985000     1.510000  0.6599000     1.959000  0.7475000     -0.4491000     0.9971000 
1 1 1 26 34 0  o 2.730000  0.5953000     2.730000  0.5953000     2.730000  0.5953000     0.000000       0.000000  
1 1 1 26 34 1  o 3.760000  0.2810000     3.737000  0.3994000     3.783000  0.3954000     -0.4662000E-01 0.5620000 
1 1 1 26 34 2  f 5.733000  0.2120000     5.891000  0.2909000     5.576000  0.3086000     0.3150000      0.4241000 
1 1 1 26 34 3  o 4.043000  0.2690000     4.027000  0.3809000     4.060000  0.3799000     -0.3374000E-01 0.5379000 
1 1 1 26 34 4  o 3.281000  0.3836000     2.775000  0.6551000     3.787000  0.3993000     -1.012000      0.7672000 
1 1 1 26 34 5  o 3.371000  0.4055000     3.013000  0.6026000     3.729000  0.5428000     -0.7160000     0.8110000 
1 1 1 26 34 6  f 5.750000  0.2174000     5.623000  0.3099000     5.876000  0.3050000     -0.2527000     0.4348000 
1 1 1 26 34 7  o 1.401000  0.4262000     1.209000  0.5479000     1.594000  0.6529000     -0.3853000     0.8523000 
1 1 1 26 34 8  o 2.022000  0.5155000     1.947000  0.7299000     2.097000  0.7281000     -0.1501000     1.031000  
1 1 1 26 34 9  o 1.706000  0.4679000     1.776000  0.6870000     1.636000  0.6353000     0.1398000      0.9357000 
1 1 1 26 34 10 o 2.205000  0.4371000     1.634000  0.6641000     2.775000  0.5686000     -1.142000      0.8743000 
1 1 1 26 34 11 o 2.360000  0.4631000     2.250000  0.6457000     2.469000  0.6641000     -0.2186000     0.9263000 
1 1 1 26 34 12 o 3.010000  0.3912000     2.798000  0.5564000     3.221000  0.5502000     -0.4227000     0.7825000 
1 1 1 26 34 13 o 2.013000  0.5227000     1.908000  0.7634000     2.117000  0.7142000     -0.2091000     1.045000  
1 1 1 26 34 14 o 3.554000  0.3418000     4.122000  0.4278000     2.986000  0.5332000     1.136000       0.6836000 
1 1 1 26 34 15 f 2.419000  0.4717000     2.597000  0.7256000     2.240000  0.6029000     0.3578000      0.9434000 
1 1 1 26 34 16 o 1.219000  0.4268000     1.521000  0.7189000     0.9156000 0.4602000     0.6058000      0.8535000 
1 1 1 26 35 0  o 0.9861000 0.6231000     0.9861000 0.6231000     0.9861000 0.6231000     -0.000000      0.000000  
1 1 1 26 35 1  o 1.294000  0.3936000     1.447000  0.5892000     1.141000  0.5220000     0.3063000      0.7871000 
1 1 1 26 35 2  o 5.551000  0.2197000     5.318000  0.3181000     5.783000  0.3030000     -0.4652000     0.4393000 
1 1 1 26 35 3  o 4.857000  0.2748000     4.640000  0.4344000     5.074000  0.3369000     -0.4338000     0.5497000 
1 1 1 26 35 4  o 3.118000  0.3964000     3.754000  0.4574000     2.483000  0.6476000     1.271000       0.7928000 
1 1 1 26 35 5  o 4.245000  0.3348000     4.487000  0.3741000     4.003000  0.5552000     0.4841000      0.6695000 
1 1 1 26 35 6  o 3.138000  0.4077000     3.268000  0.5373000     3.008000  0.6133000     0.2603000      0.8153000 
1 1 1 26 35 7  o 1.691000  0.4955000     1.647000  0.6989000     1.735000  0.7026000     -0.8824000E-01 0.9911000 
1 1 1 26 35 8  o 1.505000  0.4364000     1.270000  0.5842000     1.739000  0.6486000     -0.4690000     0.8729000 
1 1 1 26 35 9  f 2.214000  0.4785000     2.519000  0.6935000     1.909000  0.6596000     0.6102000      0.9571000 
1 1 1 26 35 10 o 3.995000  0.3231000     4.723000  0.4240000     3.266000  0.4877000     1.457000       0.6462000 
1 1 1 26 35 11 o 2.924000  0.4014000     2.699000  0.5674000     3.148000  0.5679000     -0.4481000     0.8028000 
1 1 1 26 35 12 o 1.492000  0.4330000     1.277000  0.5656000     1.707000  0.6557000     -0.4307000     0.8659000 
1 1 1 26 35 13 o 1.299000  0.4133000     1.354000  0.5834000     1.245000  0.5856000     0.1089000      0.8266000 
1 1 1 26 35 14 o 1.178000  0.3803000     1.207000  0.5431000     1.149000  0.5326000     0.5772000E-01  0.7607000 
1 1 1 26 35 15 o 1.396000  0.4240000     1.445000  0.6026000     1.346000  0.5967000     0.9867000E-01  0.8480000 
1 1 1 26 36 0  o 1.080000  0.6930000     1.080000  0.6930000     1.080000  0.6930000     -0.000000      0.000000  
1 1 1 26 36 1  o 1.782000  0.4720000     2.101000  0.7028000     1.462000  0.6303000     0.6384000      0.9441000 
1 1 1 26 36 2  o 3.997000  0.4427000     3.514000  0.7041000     4.481000  0.5367000     -0.9672000     0.8853000 
1 1 1 26 36 3  o 3.150000  0.5162000     2.789000  0.6085000     3.512000  0.8341000     -0.7235000     1.032000  
1 1 1 26 36 4  o 5.438000  0.2702000     5.096000  0.3275000     5.780000  0.4299000     -0.6834000     0.5404000 
1 1 1 26 36 5  o 2.641000  0.4760000     2.674000  0.6314000     2.607000  0.7125000     0.6673000E-01  0.9520000 
1 1 1 26 36 6  o 1.764000  0.4696000     1.364000  0.6129000     2.164000  0.7116000     -0.8002000     0.9392000 
1 1 1 26 36 7  o 2.564000  0.4381000     1.990000  0.7022000     3.138000  0.5242000     -1.148000      0.8763000 
1 1 1 26 36 8  o 1.485000  0.4341000     1.470000  0.6136000     1.499000  0.6143000     -0.2916000E-01 0.8683000 
1 1 1 26 36 9  o 1.866000  0.4472000     2.406000  0.6785000     1.326000  0.5827000     1.081000       0.8944000 
1 1 1 26 36 10 o 1.713000  0.4559000     1.568000  0.6555000     1.858000  0.6339000     -0.2895000     0.9119000 
1 1 1 26 36 11 o 3.230000  0.3800000     3.332000  0.4844000     3.129000  0.5855000     0.2032000      0.7599000 
1 1 1 26 36 12 o 2.062000  0.5416000     2.164000  0.8074000     1.960000  0.7221000     0.2036000      1.083000  
1 1 1 26 36 13 o 2.844000  0.4083000     2.350000  0.6413000     3.338000  0.5054000     -0.9875000     0.8165000 
1 1 1 26 36 14 o 1.489000  0.4315000     1.458000  0.6014000     1.520000  0.6189000     -0.6183000E-01 0.8630000 
1 1 1 26 36 15 o 1.474000  0.4406000     1.744000  0.6553000     1.204000  0.5892000     0.5400000      0.8812000 
1 1 1 26 37 0  o 4.157000  0.5574000     4.157000  0.5574000     4.157000  0.5574000     0.000000       0.000000  
1 1 1 26 37 1  o 4.606000  0.4541000     4.565000  0.4832000     4.648000  0.7691000     -0.8275000E-01 0.9083000 
1 1 1 26 37 2  o 1.407000  0.4457000     1.376000  0.6049000     1.437000  0.6547000     -0.6064000E-01 0.8914000 
1 1 1 26 37 3  o 3.951000  0.3490000     4.486000  0.4050000     3.416000  0.5685000     1.070000       0.6980000 
1 1 1 26 37 4  o 1.449000  0.4459000     1.745000  0.7053000     1.153000  0.5459000     0.5921000      0.8919000 
1 1 1 26 37 5  o 3.908000  0.3389000     3.607000  0.5518000     4.208000  0.3934000     -0.6016000     0.6777000 
1 1 1 26 37 6  o 2.273000  0.4290000     1.766000  0.6427000     2.779000  0.5683000     -1.013000      0.8579000 
1 1 1 26 37 7  o 1.310000  0.4044000     1.277000  0.5648000     1.343000  0.5789000     -0.6673000E-01 0.8088000 
1 1 1 26 37 8  o 1.923000  0.4542000     1.512000  0.6488000     2.333000  0.6358000     -0.8212000     0.9084000 
1 1 1 26 37 9  o 1.875000  0.4669000     2.072000  0.6929000     1.679000  0.6259000     0.3936000      0.9337000 
1 1 1 26 37 10 o 1.276000  0.3981000     1.492000  0.6171000     1.060000  0.5030000     0.4323000      0.7961000 
1 1 1 26 37 11 o 2.098000  0.4492000     2.575000  0.5990000     1.621000  0.6697000     0.9539000      0.8985000 
1 1 1 26 37 12 o 1.270000  0.4098000     1.418000  0.6082000     1.122000  0.5494000     0.2960000      0.8196000 
1 1 1 26 37 13 o 2.813000  0.4079000     2.677000  0.5783000     2.949000  0.5754000     -0.2713000     0.8157000 
1 1 1 26 37 14 o 2.577000  0.4448000     2.834000  0.5546000     2.321000  0.6956000     0.5131000      0.8896000 
1 1 1 26 38 0  o 1.467000  0.7845000     1.467000  0.7845000     1.467000  0.7845000     0.000000       0.000000  
1 1 1 26 38 1  o 3.703000  0.3426000     3.464000  0.5369000     3.943000  0.4257000     -0.4793000     0.6852000 
1 1 1 26 38 2  o 7.902000  0.2026000     7.916000  0.3052000     7.887000  0.2667000     0.2920000E-01  0.4053000 
1 1 1 26 38 3  o 2.463000  0.4567000     2.494000  0.6752000     2.431000  0.6151000     0.6290000E-01  0.9133000 
1 1 1 26 38 4  o 5.222000  0.2410000     4.783000  0.3616000     5.661000  0.3187000     -0.8782000     0.4820000 
1 1 1 26 38 5  o 1.439000  0.4151000     1.726000  0.6376000     1.152000  0.5316000     0.5741000      0.8301000 
1 1 1 26 38 6  f 1.901000  0.4472000     1.674000  0.6274000     2.129000  0.6375000     -0.4551000     0.8944000 
1 1 1 26 38 7  o 1.338000  0.4103000     1.474000  0.6138000     1.203000  0.5445000     0.2706000      0.8206000 
1 1 1 26 38 8  o 2.150000  0.4416000     2.805000  0.6337000     1.495000  0.6152000     1.310000       0.8832000 
1 1 1 26 38 9  f 1.946000  0.4727000     1.808000  0.6738000     2.084000  0.6632000     -0.2755000     0.9454000 
1 1 1 26 38 10 o 1.435000  0.4227000     1.650000  0.6366000     1.219000  0.5562000     0.4308000      0.8453000 
1 1 1 26 38 11 o 1.251000  0.4226000     1.358000  0.6359000     1.144000  0.5569000     0.2134000      0.8452000 
1 1 1 26 38 12 o 1.746000  0.4537000     1.926000  0.6433000     1.566000  0.6398000     0.3599000      0.9073000 
1 1 1 26 38 13 o 1.060000  0.3546000     1.181000  0.5414000     0.9391000 0.4582000     0.2416000      0.7092000 
1 1 1 26 38 14 o 1.566000  0.4850000     1.145000  0.5390000     1.987000  0.8066000     -0.8418000     0.9701000 
1 1 1 26 39 0  o 1.010000  0.6412000     1.010000  0.6412000     1.010000  0.6412000     -0.000000      0.000000  
1 1 1 26 39 1  o 3.138000  0.3593000     2.959000  0.5343000     3.317000  0.4806000     -0.3582000     0.7186000 
1 1 1 26 39 2  o 3.069000  0.3683000     2.735000  0.5653000     3.404000  0.4723000     -0.6687000     0.7367000 
1 1 1 26 39 3  o 3.712000  0.3139000     3.408000  0.4745000     4.016000  0.4110000     -0.6081000     0.6277000 
1 1 1 26 39 4  o 2.987000  0.3900000     3.584000  0.4459000     2.391000  0.6401000     1.193000       0.7801000 
1 1 1 26 39 5  o 1.658000  0.4413000     1.903000  0.6470000     1.413000  0.6002000     0.4900000      0.8826000 
1 1 1 26 39 6  o 3.666000  0.3087000     3.600000  0.4463000     3.733000  0.4266000     -0.1327000     0.6174000 
1 1 1 26 39 7  o 1.374000  0.4171000     1.509000  0.6164000     1.238000  0.5620000     0.2707000      0.8341000 
1 1 1 26 39 8  o 1.688000  0.4556000     1.509000  0.6327000     1.866000  0.6558000     -0.3566000     0.9112000 
1 1 1 26 39 9  f 3.407000  0.3823000     3.061000  0.6231000     3.754000  0.4430000     -0.6928000     0.7645000 
1 1 1 26 39 10 o 1.462000  0.4486000     1.493000  0.6560000     1.431000  0.6122000     0.6155000E-01  0.8973000 
1 1 1 26 39 11 f 1.964000  0.4322000     2.721000  0.6357000     1.208000  0.5857000     1.513000       0.8644000 
1 1 1 26 39 12 o 2.094000  0.4519000     2.366000  0.6265000     1.822000  0.6513000     0.5447000      0.9037000 
1 1 1 26 39 13 o 1.248000  0.4004000     1.042000  0.4958000     1.455000  0.6287000     -0.4135000     0.8007000 
1 1 1 26 40 0  o 1.521000  0.7723000     1.521000  0.7723000     1.521000  0.7723000     0.000000       0.000000  
1 1 1 26 40 1  o 1.628000  0.4190000     2.063000  0.6378000     1.193000  0.5435000     0.8698000      0.8380000 
1 1 1 26 40 2  o 1.323000  0.4085000     1.297000  0.5715000     1.349000  0.5839000     -0.5172000E-01 0.8170000 
1 1 1 26 40 3  o 1.414000  0.4007000     1.798000  0.6333000     1.030000  0.4910000     0.7689000      0.8014000 
1 1 1 26 40 4  o 5.116000  0.2425000     5.207000  0.3330000     5.025000  0.3525000     0.1822000      0.4849000 
1 1 1 26 40 5  o 4.971000  0.2508000     5.064000  0.3477000     4.878000  0.3617000     0.1868000      0.5017000 
1 1 1 26 40 6  o 1.410000  0.4189000     1.223000  0.5554000     1.596000  0.6274000     -0.3729000     0.8379000 
1 1 1 26 40 7  o 4.846000  0.2599000     4.961000  0.3517000     4.730000  0.3829000     0.2314000      0.5199000 
1 1 1 26 40 8  o 3.013000  0.4133000     2.855000  0.6313000     3.171000  0.5336000     -0.3161000     0.8266000 
1 1 1 26 40 9  o 4.533000  0.2811000     4.487000  0.4021000     4.578000  0.3930000     -0.9179000E-01 0.5623000 
1 1 1 26 40 10 o 3.163000  0.5229000     2.590000  0.8502000     3.737000  0.6091000     -1.147000      1.046000  
1 1 1 26 40 11 o 1.454000  0.4380000     1.370000  0.5884000     1.537000  0.6489000     -0.1671000     0.8760000 
1 1 1 26 40 12 o 2.034000  0.4617000     2.365000  0.6523000     1.703000  0.6537000     0.6618000      0.9235000 
1 1 1 26 40 13 o 0.9629000 0.3379000     1.006000  0.4916000     0.9202000 0.4639000     0.8552000E-01  0.6759000 
1 1 1 26 41 0  o 5.122000  0.3492000     5.122000  0.3492000     5.122000  0.3492000     -0.000000      0.000000  
1 1 1 26 41 1  o 2.916000  0.3996000     3.307000  0.5013000     2.525000  0.6224000     0.7827000      0.7992000 
1 1 1 26 41 2  o 1.057000  0.3542000     0.9172000 0.4504000     1.196000  0.5468000     -0.2788000     0.7084000 
1 1 1 26 41 3  o 2.247000  0.4555000     2.168000  0.6524000     2.326000  0.6358000     -0.1579000     0.9110000 
1 1 1 26 41 4  o 2.252000  0.4234000     2.857000  0.5588000     1.647000  0.6363000     1.210000       0.8468000 
1 1 1 26 41 5  o 4.502000  0.2689000     4.806000  0.3598000     4.197000  0.3997000     0.6099000      0.5377000 
1 1 1 26 41 6  o 3.529000  0.3350000     3.597000  0.4695000     3.462000  0.4781000     0.1341000      0.6701000 
1 1 1 26 41 7  o 2.058000  0.4697000     2.542000  0.6937000     1.575000  0.6336000     0.9670000      0.9395000 
1 1 1 26 41 8  o 3.093000  0.4105000     2.725000  0.6634000     3.460000  0.4836000     -0.7353000     0.8209000 
1 1 1 26 41 9  o 1.356000  0.4283000     1.391000  0.6275000     1.322000  0.5831000     0.6905000E-01  0.8566000 
1 1 1 26 41 10 o 2.230000  0.5057000     2.420000  0.6952000     2.040000  0.7347000     0.3807000      1.011000  
1 1 1 26 41 11 o 3.894000  0.3399000     3.943000  0.4315000     3.845000  0.5252000     0.9729000E-01  0.6797000 
1 1 1 26 41 12 o 1.967000  0.4512000     2.612000  0.6700000     1.321000  0.6045000     1.291000       0.9024000 
1 1 1 26 42 0  o 5.353000  0.3423000     5.353000  0.3423000     5.353000  0.3423000     0.000000       0.000000  
1 1 1 26 42 1  o 1.435000  0.4311000     1.381000  0.5948000     1.488000  0.6241000     -0.1064000     0.8621000 
1 1 1 26 42 2  o 3.504000  0.3332000     3.463000  0.4655000     3.544000  0.4768000     -0.8181000E-01 0.6663000 
1 1 1 26 42 3  o 3.779000  0.3178000     3.578000  0.4573000     3.980000  0.4416000     -0.4016000     0.6357000 
1 1 1 26 42 4  o 3.272000  0.4004000     4.201000  0.4038000     2.343000  0.6915000     1.859000       0.8008000 
1 1 1 26 42 5  o 1.129000  0.3717000     1.135000  0.5284000     1.124000  0.5228000     0.1016000E-01  0.7433000 
1 1 1 26 42 6  o 1.722000  0.4499000     1.982000  0.6616000     1.462000  0.6099000     0.5194000      0.8998000 
1 1 1 26 42 7  o 2.354000  0.4803000     2.661000  0.6853000     2.048000  0.6733000     0.6129000      0.9607000 
1 1 1 26 42 8  o 1.628000  0.4682000     1.420000  0.6684000     1.837000  0.6560000     -0.4172000     0.9365000 
1 1 1 26 42 9  f 3.937000  0.3887000     3.707000  0.5280000     4.166000  0.5706000     -0.4592000     0.7774000 
1 1 1 26 42 10 o 2.430000  0.4629000     2.631000  0.5951000     2.230000  0.7092000     0.4019000      0.9258000 
1 1 1 26 42 11 f 2.815000  0.4349000     2.254000  0.6472000     3.376000  0.5811000     -1.122000      0.8698000 
1 1 1 26 42 12 o 1.467000  0.4613000     1.571000  0.6777000     1.363000  0.6259000     0.2079000      0.9225000 
1 1 1 26 43 0  o 4.241000  0.4228000     4.241000  0.4228000     4.241000  0.4228000     0.000000       0.000000  
1 1 1 26 43 1  o 2.049000  0.4221000     2.731000  0.5916000     1.366000  0.6022000     1.364000       0.8442000 
1 1 1 26 43 2  o 2.452000  0.4250000     3.002000  0.5328000     1.902000  0.6622000     1.100000       0.8499000 
1 1 1 26 43 3  o 4.442000  0.2823000     4.246000  0.4110000     4.639000  0.3870000     -0.3926000     0.5646000 
1 1 1 26 43 4  o 6.085000  0.2279000     6.240000  0.3139000     5.930000  0.3305000     0.3099000      0.4558000 
1 1 1 26 43 5  o 1.689000  0.4548000     1.574000  0.6322000     1.804000  0.6540000     -0.2294000     0.9096000 
1 1 1 26 43 6  o 1.393000  0.4243000     1.268000  0.5734000     1.518000  0.6257000     -0.2498000     0.8487000 
1 1 1 26 43 7  o 1.603000  0.4641000     1.694000  0.6836000     1.512000  0.6281000     0.1819000      0.9283000 
1 1 1 26 43 8  o 3.765000  0.5725000     3.179000  1.039000      4.351000  0.4818000     -1.172000      1.145000  
1 1 1 26 43 9  o 1.256000  0.4039000     1.041000  0.4995000     1.470000  0.6349000     -0.4287000     0.8078000 
1 1 1 26 43 10 o 3.609000  0.3773000     3.818000  0.4550000     3.400000  0.6019000     0.4177000      0.7546000 
1 1 1 26 43 11 o 1.597000  0.4589000     1.012000  0.4918000     2.182000  0.7749000     -1.170000      0.9178000 
1 1 1 26 44 0  o 6.729000  0.3011000     6.729000  0.3011000     6.729000  0.3011000     -0.000000      0.000000  
1 1 1 26 44 1  o 3.803000  0.3385000     4.467000  0.3874000     3.140000  0.5552000     1.328000       0.6770000 
1 1 1 26 44 2  o 1.911000  0.4490000     1.500000  0.6230000     2.321000  0.6468000     -0.8211000     0.8980000 
1 1 1 26 44 3  o 4.456000  0.2850000     4.591000  0.3831000     4.321000  0.4220000     0.2701000      0.5700000 
1 1 1 26 44 4  o 1.791000  0.4647000     1.800000  0.6560000     1.782000  0.6583000     0.1733000E-01  0.9294000 
1 1 1 26 44 5  o 3.994000  0.3093000     4.322000  0.4077000     3.667000  0.4653000     0.6545000      0.6186000 
1 1 1 26 44 6  o 2.386000  0.4917000     2.615000  0.7212000     2.156000  0.6686000     0.4593000      0.9834000 
1 1 1 26 44 7  o 2.048000  0.5766000     1.995000  0.9048000     2.100000  0.7149000     -0.1050000     1.153000  
1 1 1 26 44 8  o 1.234000  0.4006000     1.288000  0.5778000     1.179000  0.5551000     0.1090000      0.8012000 
1 1 1 26 44 9  o 1.561000  0.4322000     1.964000  0.6667000     1.159000  0.5502000     0.8049000      0.8644000 
1 1 1 26 44 10 o 2.793000  0.5453000     2.723000  0.6795000     2.863000  0.8529000     -0.1402000     1.091000  
1 1 1 26 44 11 o 2.862000  0.4941000     2.347000  0.8021000     3.378000  0.5770000     -1.031000      0.9881000 
1 1 1 26 45 0  o 0.6186000 0.4491000     0.6186000 0.4491000     0.6186000 0.4491000     -0.000000      0.000000  
1 1 1 26 45 1  o 2.652000  0.4342000     2.403000  0.6462000     2.900000  0.5800000     -0.4970000     0.8683000 
1 1 1 26 45 2  o 1.560000  0.4203000     2.032000  0.6624000     1.087000  0.5177000     0.9447000      0.8407000 
1 1 1 26 45 3  o 5.052000  0.2633000     5.184000  0.3621000     4.920000  0.3823000     0.2638000      0.5266000 
1 1 1 26 45 4  o 3.023000  0.4154000     3.362000  0.5229000     2.685000  0.6456000     0.6763000      0.8308000 
1 1 1 26 45 5  o 1.432000  0.4253000     1.201000  0.5552000     1.663000  0.6444000     -0.4620000     0.8505000 
1 1 1 26 45 6  o 2.387000  0.6295000     3.072000  1.060000      1.703000  0.6792000     1.369000       1.259000  
1 1 1 26 45 7  o 1.582000  0.4549000     1.230000  0.5754000     1.935000  0.7047000     -0.7050000     0.9098000 
1 1 1 26 45 8  o 1.554000  0.4537000     1.628000  0.6368000     1.480000  0.6465000     0.1478000      0.9074000 
1 1 1 26 45 9  o 1.658000  0.4606000     2.088000  0.6968000     1.228000  0.6025000     0.8593000      0.9212000 
1 1 1 26 45 10 o 2.644000  0.4857000     2.173000  0.7337000     3.115000  0.6366000     -0.9416000     0.9714000 
1 1 1 26 46 0  o 1.008000  0.6498000     1.008000  0.6498000     1.008000  0.6498000     0.000000       0.000000  
1 1 1 26 46 1  o 4.351000  0.2989000     4.464000  0.4109000     4.238000  0.4344000     0.2261000      0.5979000 
1 1 1 26 46 2  o 1.831000  0.4758000     1.904000  0.6771000     1.759000  0.6687000     0.1443000      0.9516000 
1 1 1 26 46 3  o 2.276000  0.4530000     2.746000  0.6089000     1.806000  0.6709000     0.9401000      0.9060000 
1 1 1 26 46 4  o 2.162000  0.5009000     2.014000  0.7380000     2.311000  0.6776000     -0.2976000     1.002000  
1 1 1 26 46 5  o 1.742000  0.4810000     1.407000  0.6556000     2.077000  0.7040000     -0.6691000     0.9620000 
1 1 1 26 46 6  o 1.251000  0.4129000     1.292000  0.6008000     1.210000  0.5665000     0.8142000E-01  0.8258000 
1 1 1 26 46 7  o 1.426000  0.4464000     1.202000  0.5679000     1.650000  0.6890000     -0.4473000     0.8929000 
1 1 1 26 46 8  o 2.353000  0.4426000     3.275000  0.6047000     1.431000  0.6465000     1.844000       0.8852000 
1 1 1 26 46 9  o 1.157000  0.3891000     1.069000  0.5184000     1.244000  0.5805000     -0.1751000     0.7783000 
1 1 1 26 47 0  o 1.344000  0.7597000     1.344000  0.7597000     1.344000  0.7597000     -0.000000      0.000000  
1 1 1 26 47 1  o 2.959000  0.4216000     3.290000  0.5429000     2.628000  0.6451000     0.6619000      0.8431000 
1 1 1 26 47 2  o 6.773000  0.2500000     7.066000  0.3708000     6.480000  0.3353000     0.5859000      0.4999000 
1 1 1 26 47 3  o 4.927000  0.3120000     4.498000  0.4994000     5.355000  0.3742000     -0.8572000     0.6240000 
1 1 1 26 47 4  o 2.160000  0.4981000     2.668000  0.7187000     1.652000  0.6898000     1.016000       0.9962000 
1 1 1 26 47 5  o 1.860000  0.4652000     2.313000  0.6734000     1.408000  0.6421000     0.9049000      0.9304000 
1 1 1 26 47 6  o 1.343000  0.4381000     1.254000  0.5974000     1.432000  0.6410000     -0.1778000     0.8762000 
1 1 1 26 47 7  o 1.399000  0.4408000     1.563000  0.6583000     1.235000  0.5864000     0.3288000      0.8816000 
1 1 1 26 47 8  o 1.010000  0.3487000     0.9983000 0.4910000     1.022000  0.4952000     -0.2393000E-01 0.6973000 
1 1 1 26 48 0  o 2.004000  0.9077000     2.004000  0.9077000     2.004000  0.9077000     0.000000       0.000000  
1 1 1 26 48 1  o 2.003000  0.5650000     1.953000  0.7983000     2.052000  0.7997000     -0.9878000E-01 1.130000  
1 1 1 26 48 2  o 1.780000  0.4567000     2.417000  0.7191000     1.143000  0.5632000     1.274000       0.9134000 
1 1 1 26 48 3  o 2.873000  0.5512000     3.418000  0.6047000     2.328000  0.9217000     1.089000       1.102000  
1 1 1 26 48 4  o 5.440000  0.4645000     5.318000  0.4272000     5.562000  0.8249000     -0.2442000     0.9290000 
1 1 1 26 48 5  o 2.702000  0.5053000     3.594000  0.6966000     1.810000  0.7320000     1.784000       1.011000  
1 1 1 26 48 6  o 2.989000  0.4888000     3.453000  0.6216000     2.526000  0.7545000     0.9265000      0.9776000 
1 1 1 26 48 7  o 1.048000  0.3616000     1.197000  0.5678000     0.8999000 0.4481000     0.2971000      0.7233000 
1 1 1 26 49 0  o 1.721000  1.032000      1.721000  1.032000      1.721000  1.032000      -0.000000      0.000000  
1 1 1 26 49 1  o 2.678000  0.5967000     2.549000  0.8355000     2.807000  0.8520000     -0.2580000     1.193000  
1 1 1 26 49 2  o 1.489000  0.4805000     1.460000  0.6658000     1.518000  0.6929000     -0.5850000E-01 0.9609000 
1 1 1 26 49 3  o 1.341000  0.4350000     1.281000  0.5951000     1.401000  0.6347000     -0.1197000     0.8701000 
1 1 1 26 49 4  o 1.252000  0.4109000     1.259000  0.5861000     1.245000  0.5760000     0.1317000E-01  0.8217000 
1 1 1 26 49 5  f 1.203000  0.4004000     1.334000  0.6115000     1.072000  0.5170000     0.2615000      0.8007000 
1 1 1 26 49 6  o 1.499000  0.4577000     1.524000  0.6620000     1.475000  0.6321000     0.4904000E-01  0.9154000 
1 1 1 26 50 0  o 4.216000  0.4549000     4.216000  0.4549000     4.216000  0.4549000     -0.000000      0.000000  
1 1 1 26 50 1  f 1.337000  0.4206000     1.171000  0.5524000     1.504000  0.6343000     -0.3331000     0.8411000 
1 1 1 26 50 2  o 3.625000  0.3800000     3.451000  0.5476000     3.800000  0.5269000     -0.3485000     0.7600000 
1 1 1 26 50 3  f 4.128000  0.3355000     3.911000  0.4982000     4.344000  0.4496000     -0.4329000     0.6711000 
1 1 1 26 50 4  o 4.256000  0.3519000     4.331000  0.5087000     4.180000  0.4863000     0.1508000      0.7038000 
1 1 1 26 50 5  f 3.217000  0.5082000     3.153000  0.8120000     3.281000  0.6115000     -0.1281000     1.016000  
1 1 1 26 51 0  o 0.9692000 0.6425000     0.9692000 0.6425000     0.9692000 0.6425000     0.000000       0.000000  
1 1 1 26 51 1  o 1.456000  0.4398000     1.561000  0.6409000     1.351000  0.6023000     0.2108000      0.8795000 
1 1 1 26 51 2  o 0.9888000 0.3425000     1.068000  0.5127000     0.9096000 0.4542000     0.1584000      0.6850000 
1 1 1 26 51 3  o 2.434000  0.5457000     2.186000  0.7678000     2.682000  0.7756000     -0.4958000     1.091000  
1 1 1 27 0  2  o 1.161000  0.5469000     1.161000  0.5469000     1.161000  0.5469000     0.000000       0.000000  
1 1 1 27 0  3  o 0.9548000 0.5733000     0.9548000 0.5733000     0.9548000 0.5733000     -0.000000      0.000000  
1 1 1 27 0  4  o 0.9468000 0.6025000     0.9468000 0.6025000     0.9468000 0.6025000     0.000000       0.000000  
1 1 1 27 0  5  o 4.861000  0.1674000     4.861000  0.1674000     4.861000  0.1674000     0.000000       0.000000  
1 1 1 27 0  6  o 12.55000  0.2464000     12.55000  0.2464000     12.55000  0.2464000     0.000000       0.000000  
1 1 1 27 0  7  o 0.9267000 0.6557000     0.9267000 0.6557000     0.9267000 0.6557000     0.000000       0.000000  
1 1 1 27 0  8  o 1.162000  0.7622000     1.162000  0.7622000     1.162000  0.7622000     0.000000       0.000000  
1 1 1 27 0  9  o 2.094000  1.015000      2.094000  1.015000      2.094000  1.015000      0.000000       0.000000  
1 1 1 27 0  10 o 11.37000  0.2822000     11.37000  0.2822000     11.37000  0.2822000     0.000000       0.000000  
1 1 1 27 0  11 o 1.900000  0.9557000     1.900000  0.9557000     1.900000  0.9557000     0.000000       0.000000  
1 1 1 27 0  12 o 1.101000  0.7504000     1.101000  0.7504000     1.101000  0.7504000     0.000000       0.000000  
1 1 1 27 0  13 o 2.354000  0.8674000     2.354000  0.8674000     2.354000  0.8674000     0.000000       0.000000  
1 1 1 27 0  14 o 1.613000  0.9174000     1.613000  0.9174000     1.613000  0.9174000     0.000000       0.000000  
1 1 1 27 0  15 o 1.291000  0.7682000     1.291000  0.7682000     1.291000  0.7682000     0.000000       0.000000  
1 1 1 27 0  16 f 1.296000  0.7767000     1.296000  0.7767000     1.296000  0.7767000     0.000000       0.000000  
1 1 1 27 0  17 o 1.105000  0.7601000     1.105000  0.7601000     1.105000  0.7601000     0.000000       0.000000  
1 1 1 27 0  18 o 1.090000  0.7077000     1.090000  0.7077000     1.090000  0.7077000     0.000000       0.000000  
1 1 1 27 0  19 o 0.8624000 0.6080000     0.8624000 0.6080000     0.8624000 0.6080000     0.000000       0.000000  
1 1 1 27 0  20 o 1.561000  0.8482000     1.561000  0.8482000     1.561000  0.8482000     0.000000       0.000000  
1 1 1 27 1  2  o 7.991000  0.1289000     7.858000  0.1784000     8.124000  0.1861000     -0.2664000     0.2578000 
1 1 1 27 1  3  o 8.208000  0.1516000     8.121000  0.2106000     8.295000  0.2181000     -0.1741000     0.3032000 
1 1 1 27 1  4  o 2.788000  0.4398000     ?         ?             2.788000  0.4398000     ?              ?         
1 1 1 27 1  5  o 7.742000  0.1089000     7.643000  0.1693000     7.841000  0.1370000     -0.1984000     0.2178000 
1 1 1 27 1  6  o 6.132000  0.1351000     6.201000  0.1928000     6.063000  0.1892000     0.1382000      0.2701000 
1 1 1 27 1  7  o 4.134000  0.4309000     4.042000  0.5187000     4.226000  0.6883000     -0.1842000     0.8618000 
1 1 1 27 1  8  o 2.266000  0.5827000     1.643000  0.7170000     2.889000  0.9188000     -1.246000      1.165000  
1 1 1 27 1  9  o 6.884000  0.2992000     6.373000  0.4521000     7.395000  0.3921000     -1.022000      0.5985000 
1 1 1 27 1  10 o 3.587000  0.4590000     3.228000  0.7169000     3.945000  0.5735000     -0.7167000     0.9181000 
1 1 1 27 1  11 o 7.884000  0.2317000     7.792000  0.3308000     7.977000  0.3246000     -0.1847000     0.4635000 
1 1 1 27 1  12 o 1.591000  0.5148000     1.563000  0.7188000     1.620000  0.7372000     -0.5635000E-01 1.030000  
1 1 1 27 1  13 f 2.717000  0.4564000     3.656000  0.5699000     1.778000  0.7131000     1.878000       0.9128000 
1 1 1 27 1  14 o 2.096000  0.5778000     2.123000  0.8326000     2.070000  0.8015000     0.5320000E-01  1.156000  
1 1 1 27 1  15 o 1.657000  0.4746000     1.564000  0.6626000     1.749000  0.6797000     -0.1844000     0.9492000 
1 1 1 27 1  16 o 1.715000  0.4826000     1.908000  0.7140000     1.522000  0.6495000     0.3856000      0.9652000 
1 1 1 27 1  17 o 1.921000  0.5668000     2.008000  0.8163000     1.835000  0.7866000     0.1727000      1.134000  
1 1 1 27 1  18 o 1.802000  0.4926000     1.887000  0.7090000     1.717000  0.6840000     0.1698000      0.9851000 
1 1 1 27 1  19 o 1.435000  0.4633000     1.386000  0.6456000     1.484000  0.6647000     -0.9745000E-01 0.9266000 
1 1 1 27 1  20 o 1.326000  0.4287000     1.516000  0.6606000     1.137000  0.5466000     0.3787000      0.8574000 
1 1 1 27 2  2  o 10.30000  0.1435000     10.42000  0.1984000     10.17000  0.2075000     0.2526000      0.2871000 
1 1 1 27 2  3  o 10.27000  0.2057000     10.23000  0.3619000     10.31000  0.1954000     -0.8003000E-01 0.4113000 
1 1 1 27 2  4  o 1.848000  0.2079000     ?         ?             1.848000  0.2079000     ?              ?         
1 1 1 27 2  5  o 3.820000  0.1358000     3.758000  0.2127000     3.881000  0.1690000     -0.1230000     0.2717000 
1 1 1 27 2  6  o 5.104000  0.1627000     5.134000  0.2057000     5.075000  0.2521000     0.5907000E-01  0.3254000 
1 1 1 27 2  7  o 3.166000  0.5327000     2.618000  0.7333000     3.714000  0.7729000     -1.096000      1.065000  
1 1 1 27 2  8  o 5.625000  0.3581000     5.051000  0.4747000     6.199000  0.5364000     -1.147000      0.7162000 
1 1 1 27 2  9  o 4.271000  0.4539000     4.630000  0.3224000     3.912000  0.8486000     0.7178000      0.9078000 
1 1 1 27 2  10 o 5.768000  0.2885000     5.540000  0.4299000     5.996000  0.3848000     -0.4555000     0.5770000 
1 1 1 27 2  11 o 5.262000  0.3084000     5.527000  0.4303000     4.997000  0.4420000     0.5298000      0.6168000 
1 1 1 27 2  12 o 2.104000  0.5816000     2.402000  0.8679000     1.807000  0.7744000     0.5953000      1.163000  
1 1 1 27 2  13 o 2.917000  0.4683000     2.273000  0.7515000     3.561000  0.5590000     -1.288000      0.9366000 
1 1 1 27 2  14 f 2.864000  0.5923000     2.990000  0.8751000     2.738000  0.7983000     0.2520000      1.185000  
1 1 1 27 2  15 o 1.961000  0.4740000     2.435000  0.7030000     1.486000  0.6361000     0.9488000      0.9480000 
1 1 1 27 2  16 o 1.656000  0.4765000     1.722000  0.6903000     1.590000  0.6570000     0.1320000      0.9530000 
1 1 1 27 2  17 o 1.519000  0.4996000     1.631000  0.7407000     1.407000  0.6706000     0.2238000      0.9992000 
1 1 1 27 2  18 o 1.818000  0.4913000     1.776000  0.7014000     1.861000  0.6883000     -0.8482000E-01 0.9827000 
1 1 1 27 2  19 o 2.201000  0.5476000     2.036000  0.7793000     2.367000  0.7697000     -0.3307000     1.095000  
1 1 1 27 2  20 o 1.515000  0.4385000     1.052000  0.5153000     1.977000  0.7097000     -0.9253000     0.8770000 
1 1 1 27 3  1  o 5.441000  0.1596000     ?         ?             5.441000  0.1596000     ?              ?         
1 1 1 27 3  2  o 13.72000  0.2006000     13.67000  0.3456000     13.76000  0.2037000     -0.8636000E-01 0.4011000 
1 1 1 27 3  3  o 7.901000  0.2018000     7.902000  0.3505000     7.899000  0.1999000     0.2141000E-02  0.4035000 
1 1 1 27 3  4  o 5.638000  0.9553000E-01 5.600000  0.1410000     5.676000  0.1289000     -0.7665000E-01 0.1911000 
1 1 1 27 3  5  o 0.9545000 0.2938000     0.8956000 0.3895000     1.013000  0.4398000     -0.1178000     0.5875000 
1 1 1 27 3  6  o 1.989000  0.3461000     2.013000  0.4427000     1.964000  0.5321000     0.4896000E-01  0.6922000 
1 1 1 27 3  7  o 8.304000  0.2255000     8.006000  0.3738000     8.601000  0.2524000     -0.5942000     0.4510000 
1 1 1 27 3  8  o 5.395000  0.3649000     5.281000  0.4487000     5.508000  0.5755000     -0.2264000     0.7297000 
1 1 1 27 3  9  o 5.111000  0.3784000     5.496000  0.2894000     4.725000  0.6994000     0.7710000      0.7569000 
1 1 1 27 3  10 o 4.049000  0.3839000     4.225000  0.3605000     3.872000  0.6780000     0.3536000      0.7679000 
1 1 1 27 3  11 o 3.902000  0.4165000     4.231000  0.5729000     3.573000  0.6047000     0.6579000      0.8330000 
1 1 1 27 3  12 o 2.512000  0.6223000     2.270000  0.9159000     2.754000  0.8427000     -0.4842000     1.245000  
1 1 1 27 3  13 o 2.364000  0.5186000     2.114000  0.7324000     2.615000  0.7345000     -0.5008000     1.037000  
1 1 1 27 3  14 o 2.492000  0.5960000     2.851000  0.8678000     2.134000  0.8173000     0.7170000      1.192000  
1 1 1 27 3  15 o 1.851000  0.4676000     1.436000  0.6250000     2.266000  0.6956000     -0.8293000     0.9352000 
1 1 1 27 3  16 o 1.787000  0.4768000     2.053000  0.7033000     1.522000  0.6441000     0.5310000      0.9537000 
1 1 1 27 3  17 o 1.714000  0.5338000     1.453000  0.6891000     1.975000  0.8154000     -0.5227000     1.068000  
1 1 1 27 3  18 o 2.161000  0.4739000     1.669000  0.6788000     2.653000  0.6615000     -0.9839000     0.9478000 
1 1 1 27 3  19 o 1.351000  0.4445000     1.352000  0.6339000     1.350000  0.6232000     0.2828000E-02  0.8889000 
1 1 1 27 3  20 o 1.151000  0.3885000     1.050000  0.5152000     1.251000  0.5816000     -0.2012000     0.7769000 
1 1 1 27 4  1  o 9.705000  0.1175000     9.762000  0.1713000     9.649000  0.1610000     0.1129000      0.2351000 
1 1 1 27 4  2  o 5.380000  0.1782000     5.133000  0.3009000     5.627000  0.1910000     -0.4943000     0.3564000 
1 1 1 27 4  3  o 6.978000  0.2007000     7.014000  0.3468000     6.942000  0.2022000     0.7126000E-01  0.4014000 
1 1 1 27 4  4  o 5.224000  0.1307000     5.282000  0.1452000     5.165000  0.2173000     0.1165000      0.2613000 
1 1 1 27 4  5  o 10.44000  0.1236000     10.44000  0.1679000     10.44000  0.1813000     0.8478000E-03  0.2471000 
1 1 1 27 4  6  o 7.786000  0.1399000     7.947000  0.1892000     7.625000  0.2062000     0.3219000      0.2799000 
1 1 1 27 4  7  f 11.31000  0.2858000     11.25000  0.5128000     11.37000  0.2523000     -0.1206000     0.5715000 
1 1 1 27 4  8  f 5.109000  0.3622000     4.746000  0.6259000     5.472000  0.3649000     -0.7262000     0.7245000 
1 1 1 27 4  9  o 2.112000  0.5085000     2.248000  0.5816000     1.976000  0.8344000     0.2720000      1.017000  
1 1 1 27 4  10 o 1.796000  0.4711000     0.9961000 0.4747000     2.597000  0.8139000     -1.601000      0.9422000 
1 1 1 27 4  11 o 1.998000  0.4941000     2.201000  0.6211000     1.795000  0.7686000     0.4067000      0.9882000 
1 1 1 27 4  12 o 4.782000  0.5216000     3.983000  0.8367000     5.581000  0.6231000     -1.598000      1.043000  
1 1 1 27 4  13 o 2.522000  0.5055000     2.040000  0.7282000     3.005000  0.7014000     -0.9652000     1.011000  
1 1 1 27 4  14 o 1.752000  0.5293000     1.977000  0.8096000     1.528000  0.6820000     0.4486000      1.059000  
1 1 1 27 4  15 o 1.453000  0.4412000     1.624000  0.6614000     1.283000  0.5841000     0.3405000      0.8824000 
1 1 1 27 4  16 o 1.589000  0.4629000     1.466000  0.6343000     1.712000  0.6744000     -0.2458000     0.9258000 
1 1 1 27 4  17 o 1.751000  0.5269000     1.809000  0.7685000     1.692000  0.7212000     0.1170000      1.054000  
1 1 1 27 4  18 f 2.479000  0.4799000     2.360000  0.7008000     2.599000  0.6559000     -0.2385000     0.9598000 
1 1 1 27 4  19 o 1.319000  0.4359000     1.233000  0.5916000     1.404000  0.6404000     -0.1713000     0.8719000 
1 1 1 27 4  20 o 2.031000  0.4821000     1.573000  0.6582000     2.490000  0.7047000     -0.9173000     0.9643000 
1 1 1 27 5  1  o 11.48000  0.1687000     11.65000  0.2857000     11.30000  0.1794000     0.3492000      0.3374000 
1 1 1 27 5  2  o 3.809000  0.2221000     3.764000  0.3676000     3.855000  0.2492000     -0.9114000E-01 0.4441000 
1 1 1 27 5  3  o 4.503000  0.2383000     4.323000  0.4553000     4.684000  0.1409000     -0.3605000     0.4766000 
1 1 1 27 5  4  o 4.775000  0.1414000     4.864000  0.1637000     4.686000  0.2307000     0.1777000      0.2828000 
1 1 1 27 5  5  o 9.499000  0.1236000     9.413000  0.1694000     9.585000  0.1799000     -0.1720000     0.2471000 
1 1 1 27 5  6  o 8.013000  0.1366000     7.861000  0.1858000     8.164000  0.2004000     -0.3030000     0.2733000 
1 1 1 27 5  7  o 1.806000  0.5449000     1.998000  0.8836000     1.614000  0.6379000     0.3842000      1.090000  
1 1 1 27 5  8  f 7.652000  0.2550000     7.672000  0.4181000     7.633000  0.2921000     0.3920000E-01  0.5100000 
1 1 1 27 5  9  o 2.350000  0.5077000     2.021000  0.5863000     2.679000  0.8290000     -0.6572000     1.015000  
1 1 1 27 5  10 o 2.071000  0.4986000     1.378000  0.5787000     2.763000  0.8121000     -1.385000      0.9972000 
1 1 1 27 5  11 o 2.802000  0.4878000     2.682000  0.5486000     2.922000  0.8068000     -0.2399000     0.9756000 
1 1 1 27 5  12 o 2.039000  0.5814000     1.856000  0.8161000     2.222000  0.8283000     -0.3663000     1.163000  
1 1 1 27 5  13 o 2.591000  0.5701000     2.515000  0.7475000     2.667000  0.8610000     -0.1529000     1.140000  
1 1 1 27 5  14 o 3.012000  0.5279000     3.151000  0.7564000     2.873000  0.7366000     0.2782000      1.056000  
1 1 1 27 5  15 o 1.289000  0.4152000     1.223000  0.5684000     1.355000  0.6053000     -0.1325000     0.8304000 
1 1 1 27 5  16 o 3.582000  0.3666000     3.711000  0.5035000     3.453000  0.5329000     0.2574000      0.7331000 
1 1 1 27 5  17 o 1.536000  0.4773000     1.721000  0.7175000     1.352000  0.6297000     0.3694000      0.9546000 
1 1 1 27 5  18 o 1.903000  0.4616000     2.386000  0.6844000     1.421000  0.6195000     0.9655000      0.9231000 
1 1 1 27 5  19 o 1.925000  0.5256000     2.052000  0.7655000     1.799000  0.7204000     0.2537000      1.051000  
1 1 1 27 5  20 o 1.021000  0.3539000     0.9582000 0.4761000     1.084000  0.5238000     -0.1259000     0.7078000 
1 1 1 27 6  0  o 4.798000  0.1736000     4.798000  0.1736000     4.798000  0.1736000     -0.000000      0.000000  
1 1 1 27 6  1  o 6.138000  0.1474000     6.001000  0.2338000     6.274000  0.1796000     -0.2724000     0.2948000 
1 1 1 27 6  2  o 5.059000  0.1771000     4.855000  0.3251000     5.263000  0.1405000     -0.4081000     0.3542000 
1 1 1 27 6  3  o 11.69000  0.1149000     11.72000  0.1565000     11.66000  0.1683000     0.5909000E-01  0.2298000 
1 1 1 27 6  4  o 8.831000  0.1190000     8.864000  0.1550000     8.799000  0.1806000     0.6462000E-01  0.2380000 
1 1 1 27 6  5  o 3.024000  0.2133000     3.074000  0.2771000     2.974000  0.3242000     0.1000000      0.4265000 
1 1 1 27 6  6  o 4.469000  0.2250000     4.901000  0.2334000     4.037000  0.3847000     0.8646000      0.4499000 
1 1 1 27 6  7  o 4.598000  0.4367000     5.089000  0.7598000     4.107000  0.4308000     0.9822000      0.8735000 
1 1 1 27 6  8  o 4.444000  0.2752000     4.557000  0.3339000     4.331000  0.4376000     0.2262000      0.5505000 
1 1 1 27 6  9  o 7.325000  0.2407000     7.284000  0.2387000     7.366000  0.4181000     -0.8213000E-01 0.4815000 
1 1 1 27 6  10 o 1.707000  0.4549000     1.746000  0.6287000     1.667000  0.6577000     0.7823000E-01  0.9098000 
1 1 1 27 6  11 o 1.876000  0.5072000     1.471000  0.6030000     2.281000  0.8156000     -0.8095000     1.014000  
1 1 1 27 6  12 o 2.880000  0.5531000     2.166000  0.8130000     3.594000  0.7501000     -1.428000      1.106000  
1 1 1 27 6  13 o 1.938000  0.5138000     2.002000  0.6467000     1.875000  0.7986000     0.1273000      1.028000  
1 1 1 27 6  14 o 3.252000  0.5175000     3.736000  0.4342000     2.768000  0.9395000     0.9682000      1.035000  
1 1 1 27 6  15 o 4.368000  0.3011000     4.075000  0.4583000     4.660000  0.3908000     -0.5847000     0.6023000 
1 1 1 27 6  16 f 1.909000  0.4903000     2.053000  0.7078000     1.765000  0.6788000     0.2872000      0.9807000 
1 1 1 27 6  17 o 1.389000  0.4479000     1.556000  0.6776000     1.223000  0.5859000     0.3333000      0.8958000 
1 1 1 27 6  18 o 1.270000  0.4110000     1.371000  0.6110000     1.169000  0.5499000     0.2023000      0.8220000 
1 1 1 27 6  19 o 1.704000  0.4989000     1.871000  0.7415000     1.537000  0.6676000     0.3339000      0.9978000 
1 1 1 27 6  20 o 2.012000  0.5003000     2.045000  0.7095000     1.978000  0.7056000     0.6719000E-01  1.001000  
1 1 1 27 7  0  o 13.29000  0.1670000     13.29000  0.1670000     13.29000  0.1670000     0.000000       0.000000  
1 1 1 27 7  1  o 4.513000  0.1107000     4.246000  0.1641000     4.780000  0.1486000     -0.5338000     0.2214000 
1 1 1 27 7  2  f 6.480000  0.1018000     6.303000  0.1406000     6.658000  0.1474000     -0.3546000     0.2037000 
1 1 1 27 7  3  o 9.667000  0.1163000     9.629000  0.1540000     9.706000  0.1744000     -0.7706000E-01 0.2327000 
1 1 1 27 7  4  f 3.268000  0.1806000     3.433000  0.2283000     3.103000  0.2800000     0.3296000      0.3613000 
1 1 1 27 7  5  o 6.779000  0.1332000     6.786000  0.1826000     6.772000  0.1939000     0.1403000E-01  0.2663000 
1 1 1 27 7  6  o 4.719000  0.2119000     4.692000  0.2557000     4.746000  0.3380000     -0.5380000E-01 0.4238000 
1 1 1 27 7  7  o 3.961000  0.3972000     3.894000  0.6579000     4.028000  0.4453000     -0.1341000     0.7945000 
1 1 1 27 7  8  o 6.490000  0.2092000     6.603000  0.2550000     6.377000  0.3317000     0.2257000      0.4184000 
1 1 1 27 7  9  o 5.896000  0.2179000     5.980000  0.2671000     5.811000  0.3444000     0.1687000      0.4359000 
1 1 1 27 7  10 o 3.029000  0.3849000     3.220000  0.4700000     2.839000  0.6098000     0.3812000      0.7699000 
1 1 1 27 7  11 o 3.797000  0.3149000     3.921000  0.4084000     3.674000  0.4794000     0.2462000      0.6297000 
1 1 1 27 7  12 o 1.995000  0.5265000     2.381000  0.8250000     1.610000  0.6543000     0.7709000      1.053000  
1 1 1 27 7  13 o 5.072000  0.3395000     4.976000  0.3426000     5.169000  0.5862000     -0.1930000     0.6790000 
1 1 1 27 7  14 o 2.094000  0.5321000     2.262000  0.6560000     1.926000  0.8379000     0.3359000      1.064000  
1 1 1 27 7  15 o 2.357000  0.4874000     2.409000  0.5646000     2.305000  0.7946000     0.1040000      0.9747000 
1 1 1 27 7  16 o 2.509000  0.5109000     1.964000  0.6990000     3.054000  0.7453000     -1.090000      1.022000  
1 1 1 27 7  17 o 1.898000  0.5290000     1.673000  0.7052000     2.123000  0.7888000     -0.4504000     1.058000  
1 1 1 27 7  18 o 1.252000  0.4064000     1.273000  0.5816000     1.231000  0.5677000     0.4183000E-01  0.8128000 
1 1 1 27 7  19 o 1.578000  0.4551000     1.313000  0.5978000     1.843000  0.6863000     -0.5298000     0.9101000 
1 1 1 27 7  20 o 1.189000  0.3959000     1.125000  0.5397000     1.253000  0.5793000     -0.1283000     0.7917000 
1 1 1 27 8  0  o 5.732000  0.1484000     5.732000  0.1484000     5.732000  0.1484000     0.000000       0.000000  
1 1 1 27 8  1  o 3.032000  0.1528000     3.260000  0.2381000     2.804000  0.1914000     0.4563000      0.3055000 
1 1 1 27 8  2  o 13.77000  0.1368000     13.65000  0.2018000     13.89000  0.1847000     -0.2396000     0.2736000 
1 1 1 27 8  3  o 7.031000  0.1360000     7.156000  0.1723000     6.906000  0.2105000     0.2494000      0.2720000 
1 1 1 27 8  4  o 15.08000  0.1440000     14.98000  0.1989000     15.19000  0.2083000     -0.2160000     0.2880000 
1 1 1 27 8  5  o 2.213000  0.3086000     1.905000  0.4718000     2.521000  0.3979000     -0.6158000     0.6172000 
1 1 1 27 8  6  o 2.615000  0.4809000     2.616000  0.7770000     2.614000  0.5666000     0.2007000E-02  0.9617000 
1 1 1 27 8  7  o 8.140000  0.2348000     8.071000  0.3781000     8.209000  0.2785000     -0.1373000     0.4696000 
1 1 1 27 8  8  o 8.478000  0.1927000     8.310000  0.2445000     8.645000  0.2979000     -0.3343000     0.3854000 
1 1 1 27 8  9  o 5.754000  0.2118000     5.603000  0.2822000     5.905000  0.3159000     -0.3029000     0.4236000 
1 1 1 27 8  10 o 1.922000  0.4759000     1.705000  0.6476000     2.139000  0.6976000     -0.4340000     0.9519000 
1 1 1 27 8  11 o 8.092000  0.1901000     8.039000  0.2645000     8.145000  0.2732000     -0.1059000     0.3803000 
1 1 1 27 8  12 o 5.220000  0.2538000     5.061000  0.3559000     5.378000  0.3620000     -0.3164000     0.5076000 
1 1 1 27 8  13 o 2.029000  0.4753000     2.384000  0.6595000     1.675000  0.6846000     0.7091000      0.9506000 
1 1 1 27 8  14 o 1.673000  0.5132000     1.259000  0.5568000     2.087000  0.8623000     -0.8285000     1.026000  
1 1 1 27 8  15 o 1.982000  0.4976000     1.921000  0.6065000     2.043000  0.7891000     -0.1215000     0.9952000 
1 1 1 27 8  16 o 1.352000  0.4344000     1.120000  0.5127000     1.583000  0.7013000     -0.4636000     0.8687000 
1 1 1 27 8  17 o 3.068000  0.4668000     2.903000  0.6322000     3.233000  0.6870000     -0.3296000     0.9336000 
1 1 1 27 8  18 o 1.539000  0.4525000     1.479000  0.6314000     1.600000  0.6484000     -0.1215000     0.9050000 
1 1 1 27 8  19 o 1.720000  0.4542000     2.184000  0.6993000     1.256000  0.5797000     0.9281000      0.9084000 
1 1 1 27 8  20 o 1.527000  0.4556000     1.659000  0.6727000     1.394000  0.6147000     0.2645000      0.9112000 
1 1 1 27 9  0  o 2.718000  0.2279000     2.718000  0.2279000     2.718000  0.2279000     -0.000000      0.000000  
1 1 1 27 9  1  o 10.99000  0.1145000     10.98000  0.1805000     11.00000  0.1408000     -0.2433000E-01 0.2289000 
1 1 1 27 9  2  o 6.071000  0.1133000     6.234000  0.1797000     5.908000  0.1380000     0.3261000      0.2266000 
1 1 1 27 9  3  o 11.83000  0.1612000     11.70000  0.1947000     11.95000  0.2570000     -0.2516000     0.3225000 
1 1 1 27 9  4  o 3.552000  0.2291000     3.696000  0.2473000     3.409000  0.3857000     0.2874000      0.4582000 
1 1 1 27 9  5  o 4.137000  0.1856000     4.185000  0.2502000     4.090000  0.2741000     0.9482000E-01  0.3711000 
1 1 1 27 9  6  o 7.089000  0.2866000     6.993000  0.5315000     7.186000  0.2149000     -0.1938000     0.5733000 
1 1 1 27 9  7  o 3.841000  0.4155000     3.788000  0.6874000     3.894000  0.4668000     -0.1064000     0.8309000 
1 1 1 27 9  8  o 6.709000  0.2208000     6.385000  0.2557000     7.033000  0.3599000     -0.6485000     0.4415000 
1 1 1 27 9  9  o 9.609000  0.1687000     9.485000  0.2268000     9.733000  0.2498000     -0.2477000     0.3374000 
1 1 1 27 9  10 o 6.634000  0.2107000     6.729000  0.2788000     6.538000  0.3161000     0.1907000      0.4215000 
1 1 1 27 9  11 o 5.308000  0.2624000     5.633000  0.3132000     4.984000  0.4212000     0.6484000      0.5249000 
1 1 1 27 9  12 o 4.768000  0.2707000     4.230000  0.4072000     5.306000  0.3570000     -1.076000      0.5415000 
1 1 1 27 9  13 o 3.081000  0.4297000     3.462000  0.5087000     2.700000  0.6928000     0.7624000      0.8595000 
1 1 1 27 9  14 o 1.696000  0.4554000     1.933000  0.6577000     1.460000  0.6300000     0.4737000      0.9108000 
1 1 1 27 9  15 o 4.052000  0.3710000     4.458000  0.3311000     3.646000  0.6642000     0.8118000      0.7421000 
1 1 1 27 9  16 o 1.351000  0.4335000     1.005000  0.4753000     1.697000  0.7251000     -0.6914000     0.8670000 
1 1 1 27 9  17 o 1.372000  0.4156000     1.566000  0.6034000     1.177000  0.5718000     0.3893000      0.8313000 
1 1 1 27 9  18 o 1.339000  0.4212000     1.389000  0.5791000     1.288000  0.6117000     0.1006000      0.8424000 
1 1 1 27 9  19 o 1.342000  0.4307000     0.9176000 0.4445000     1.767000  0.7379000     -0.8498000     0.8614000 
1 1 1 27 9  20 o 1.309000  0.4198000     1.243000  0.5802000     1.375000  0.6069000     -0.1320000     0.8396000 
1 1 1 27 10 0  o 1.859000  0.3986000     1.859000  0.3986000     1.859000  0.3986000     -0.000000      0.000000  
1 1 1 27 10 1  o 8.762000  0.1033000     8.601000  0.1479000     8.923000  0.1444000     -0.3222000     0.2067000 
1 1 1 27 10 2  o 15.92000  0.1514000     15.79000  0.2289000     16.04000  0.1981000     -0.2483000     0.3027000 
1 1 1 27 10 3  o 9.893000  0.1228000     9.977000  0.1890000     9.808000  0.1569000     0.1689000      0.2456000 
1 1 1 27 10 4  f 10.13000  0.1309000     10.09000  0.1795000     10.18000  0.1906000     -0.9661000E-01 0.2619000 
1 1 1 27 10 5  o 7.167000  0.1689000     7.161000  0.2147000     7.173000  0.2606000     -0.1255000E-01 0.3377000 
1 1 1 27 10 6  o 2.653000  0.4342000     2.160000  0.7848000     3.147000  0.3715000     -0.9867000     0.8683000 
1 1 1 27 10 7  o 5.167000  0.3204000     5.408000  0.5106000     4.926000  0.3872000     0.4824000      0.6408000 
1 1 1 27 10 8  o 15.34000  0.2137000     15.42000  0.2631000     15.27000  0.3367000     0.1539000      0.4273000 
1 1 1 27 10 9  o 9.216000  0.1723000     9.240000  0.2335000     9.192000  0.2533000     0.4746000E-01  0.3445000 
1 1 1 27 10 10 o 1.791000  0.4642000     1.503000  0.6100000     2.079000  0.7000000     -0.5762000     0.9285000 
1 1 1 27 10 11 o 1.710000  0.4759000     1.928000  0.6842000     1.492000  0.6617000     0.4356000      0.9518000 
1 1 1 27 10 12 o 5.573000  0.2464000     5.460000  0.3385000     5.686000  0.3581000     -0.2256000     0.4928000 
1 1 1 27 10 13 o 1.913000  0.4851000     1.741000  0.6613000     2.086000  0.7099000     -0.3448000     0.9701000 
1 1 1 27 10 14 o 2.420000  0.4585000     2.589000  0.6200000     2.251000  0.6757000     0.3383000      0.9171000 
1 1 1 27 10 15 o 2.093000  0.4692000     2.224000  0.6420000     1.961000  0.6844000     0.2630000      0.9383000 
1 1 1 27 10 16 o 1.011000  0.3445000     1.078000  0.5074000     0.9433000 0.4661000     0.1346000      0.6890000 
1 1 1 27 10 17 o 1.651000  0.4716000     1.212000  0.5306000     2.090000  0.7799000     -0.8780000     0.9433000 
1 1 1 27 10 18 o 1.384000  0.4386000     0.9471000 0.4587000     1.820000  0.7477000     -0.8731000     0.8771000 
1 1 1 27 10 19 o 1.624000  0.4653000     1.039000  0.4888000     2.210000  0.7918000     -1.170000      0.9306000 
1 1 1 27 10 20 o 1.637000  0.4573000     1.804000  0.6193000     1.471000  0.6729000     0.3327000      0.9145000 
1 1 1 27 11 0  o 1.857000  0.4320000     1.857000  0.4320000     1.857000  0.4320000     -0.000000      0.000000  
1 1 1 27 11 1  o 17.08000  0.1472000     17.11000  0.2087000     17.05000  0.2076000     0.6381000E-01  0.2943000 
1 1 1 27 11 2  o 7.187000  0.1252000     7.050000  0.1782000     7.325000  0.1760000     -0.2750000     0.2505000 
1 1 1 27 11 3  o 8.156000  0.1215000     8.082000  0.1913000     8.230000  0.1498000     -0.1480000     0.2429000 
1 1 1 27 11 4  o 5.506000  0.1471000     5.440000  0.2365000     5.571000  0.1750000     -0.1301000     0.2942000 
1 1 1 27 11 5  o 2.033000  0.3808000     2.172000  0.5488000     1.894000  0.5280000     0.2784000      0.7616000 
1 1 1 27 11 6  o 9.480000  0.1930000     9.618000  0.3246000     9.341000  0.2089000     0.2779000      0.3860000 
1 1 1 27 11 7  o 8.789000  0.2333000     8.812000  0.3674000     8.765000  0.2877000     0.4721000E-01  0.4666000 
1 1 1 27 11 8  o 4.383000  0.5350000     4.401000  0.3611000     4.365000  1.007000      0.3558000E-01  1.070000  
1 1 1 27 11 9  o 5.661000  0.2232000     5.489000  0.2968000     5.832000  0.3334000     -0.3430000     0.4463000 
1 1 1 27 11 10 o 4.556000  0.2727000     4.261000  0.3848000     4.850000  0.3864000     -0.5891000     0.5453000 
1 1 1 27 11 11 o 1.591000  0.4787000     1.430000  0.6332000     1.752000  0.7182000     -0.3215000     0.9575000 
1 1 1 27 11 12 o 5.160000  0.2653000     5.130000  0.3553000     5.190000  0.3941000     -0.5987000E-01 0.5306000 
1 1 1 27 11 13 o 3.848000  0.3841000     4.338000  0.4443000     3.358000  0.6268000     0.9797000      0.7682000 
1 1 1 27 11 14 o 1.429000  0.4259000     1.621000  0.6338000     1.237000  0.5690000     0.3846000      0.8517000 
1 1 1 27 11 15 o 1.921000  0.4695000     1.880000  0.6676000     1.963000  0.6604000     -0.8333000E-01 0.9391000 
1 1 1 27 11 16 o 1.501000  0.4450000     1.521000  0.6191000     1.482000  0.6395000     0.3925000E-01  0.8900000 
1 1 1 27 11 17 o 1.243000  0.3953000     1.111000  0.5163000     1.375000  0.5987000     -0.2648000     0.7906000 
1 1 1 27 11 18 o 1.165000  0.3815000     1.017000  0.4796000     1.314000  0.5934000     -0.2969000     0.7630000 
1 1 1 27 11 19 o 1.721000  0.4782000     1.753000  0.6257000     1.689000  0.7234000     0.6363000E-01  0.9565000 
1 1 1 27 11 20 o 1.269000  0.4183000     1.045000  0.4903000     1.492000  0.6779000     -0.4466000     0.8367000 
1 1 1 27 12 0  o 14.96000  0.1920000     14.96000  0.1920000     14.96000  0.1920000     0.000000       0.000000  
1 1 1 27 12 1  o 4.907000  0.1545000     4.462000  0.2437000     5.353000  0.1901000     -0.8908000     0.3091000 
1 1 1 27 12 2  o 14.12000  0.1394000     14.12000  0.1862000     14.11000  0.2076000     0.7526000E-02  0.2788000 
1 1 1 27 12 3  o 5.506000  0.1386000     5.377000  0.2204000     5.635000  0.1682000     -0.2576000     0.2772000 
1 1 1 27 12 4  o 7.747000  0.1493000     7.857000  0.2319000     7.637000  0.1881000     0.2208000      0.2986000 
1 1 1 27 12 5  o 6.689000  0.1858000     6.781000  0.2960000     6.596000  0.2247000     0.1853000      0.3716000 
1 1 1 27 12 6  o 2.382000  0.4833000     2.823000  0.7622000     1.941000  0.5945000     0.8813000      0.9666000 
1 1 1 27 12 7  o 8.109000  0.2442000     7.769000  0.3945000     8.449000  0.2878000     -0.6795000     0.4884000 
1 1 1 27 12 8  o 6.112000  0.5020000     6.460000  0.2904000     5.765000  0.9610000     0.6949000      1.004000  
1 1 1 27 12 9  o 10.20000  0.1756000     10.01000  0.2468000     10.39000  0.2498000     -0.3789000     0.3512000 
1 1 1 27 12 10 o 2.137000  0.4677000     1.849000  0.6487000     2.424000  0.6739000     -0.5755000     0.9354000 
1 1 1 27 12 11 o 2.490000  0.6037000     2.310000  1.010000      2.669000  0.6621000     -0.3588000     1.207000  
1 1 1 27 12 12 o 2.483000  0.4627000     1.917000  0.6768000     3.050000  0.6312000     -1.133000      0.9255000 
1 1 1 27 12 13 o 2.689000  0.4791000     2.178000  0.6878000     3.200000  0.6672000     -1.022000      0.9582000 
1 1 1 27 12 14 o 3.465000  0.3493000     3.313000  0.4935000     3.617000  0.4943000     -0.3036000     0.6985000 
1 1 1 27 12 15 o 1.529000  0.4422000     1.718000  0.6578000     1.339000  0.5911000     0.3786000      0.8843000 
1 1 1 27 12 16 o 2.025000  0.4483000     2.655000  0.6558000     1.394000  0.6115000     1.261000       0.8966000 
1 1 1 27 12 17 o 1.498000  0.4332000     1.299000  0.5686000     1.698000  0.6536000     -0.3994000     0.8663000 
1 1 1 27 12 18 o 1.964000  0.4880000     2.072000  0.6848000     1.855000  0.6955000     0.2175000      0.9760000 
1 1 1 27 12 19 o 2.423000  0.4429000     2.946000  0.5576000     1.901000  0.6883000     1.045000       0.8858000 
1 1 1 27 12 20 o 1.164000  0.3781000     1.034000  0.4859000     1.294000  0.5793000     -0.2599000     0.7561000 
1 1 1 27 13 0  o 3.495000  0.6722000     3.495000  0.6722000     3.495000  0.6722000     0.000000       0.000000  
1 1 1 27 13 1  o 17.55000  0.1970000     17.48000  0.2499000     17.62000  0.3045000     -0.1452000     0.3939000 
1 1 1 27 13 2  o 5.889000  0.1376000     5.678000  0.1812000     6.099000  0.2071000     -0.4211000     0.2752000 
1 1 1 27 13 3  o 1.113000  0.3333000     1.147000  0.4682000     1.079000  0.4744000     0.6848000E-01  0.6666000 
1 1 1 27 13 4  o 8.221000  0.1776000     8.007000  0.2959000     8.436000  0.1964000     -0.4288000     0.3551000 
1 1 1 27 13 5  o 7.487000  0.1448000     7.388000  0.2306000     7.586000  0.1750000     -0.1976000     0.2895000 
1 1 1 27 13 6  o 9.485000  0.2028000     9.579000  0.3387000     9.391000  0.2232000     0.1871000      0.4056000 
1 1 1 27 13 7  o 10.85000  0.2222000     10.73000  0.3443000     10.96000  0.2810000     -0.2223000     0.4444000 
1 1 1 27 13 8  o 3.793000  0.4101000     4.218000  0.3711000     3.369000  0.7315000     0.8497000      0.8202000 
1 1 1 27 13 9  o 2.560000  0.4131000     3.197000  0.4723000     1.922000  0.6778000     1.275000       0.8262000 
1 1 1 27 13 10 o 2.241000  0.4700000     2.040000  0.6543000     2.442000  0.6750000     -0.4022000     0.9401000 
1 1 1 27 13 11 o 1.316000  0.4394000     1.645000  0.7318000     0.9877000 0.4868000     0.6570000      0.8789000 
1 1 1 27 13 12 o 2.718000  0.4489000     2.240000  0.6659000     3.196000  0.6022000     -0.9559000     0.8978000 
1 1 1 27 13 13 o 3.587000  0.4947000     3.490000  0.5451000     3.683000  0.8257000     -0.1927000     0.9894000 
1 1 1 27 13 14 f 1.342000  0.4175000     1.169000  0.5382000     1.514000  0.6383000     -0.3454000     0.8349000 
1 1 1 27 13 15 f 1.815000  0.4697000     1.917000  0.6656000     1.714000  0.6630000     0.2034000      0.9394000 
1 1 1 27 13 16 o 1.981000  0.5544000     1.835000  0.8616000     2.127000  0.6979000     -0.2920000     1.109000  
1 1 1 27 13 17 f 1.108000  0.3643000     1.360000  0.5893000     0.8558000 0.4285000     0.5044000      0.7286000 
1 1 1 27 13 18 f 1.511000  0.4565000     1.715000  0.6554000     1.307000  0.6357000     0.4080000      0.9130000 
1 1 1 27 13 19 o 1.507000  0.4454000     1.256000  0.5990000     1.759000  0.6592000     -0.5036000     0.8907000 
1 1 1 27 13 20 o 1.582000  0.4515000     1.243000  0.5657000     1.921000  0.7038000     -0.6775000     0.9029000 
1 1 1 27 14 0  o 1.710000  0.6446000     1.710000  0.6446000     1.710000  0.6446000     0.000000       0.000000  
1 1 1 27 14 1  o 6.100000  0.1554000     6.047000  0.2328000     6.152000  0.2060000     -0.1054000     0.3109000 
1 1 1 27 14 2  o 9.242000  0.1538000     9.149000  0.2339000     9.334000  0.1998000     -0.1851000     0.3076000 
1 1 1 27 14 3  o 6.166000  0.1550000     6.219000  0.2207000     6.113000  0.2177000     0.1062000      0.3100000 
1 1 1 27 14 4  o 7.945000  0.1247000     8.020000  0.1829000     7.869000  0.1697000     0.1509000      0.2494000 
1 1 1 27 14 5  o 5.511000  0.1672000     5.653000  0.2585000     5.368000  0.2121000     0.2848000      0.3344000 
1 1 1 27 14 6  o 5.178000  0.2727000     5.515000  0.4563000     4.842000  0.2986000     0.6732000      0.5454000 
1 1 1 27 14 7  o 4.422000  0.3988000     4.162000  0.6337000     4.682000  0.4843000     -0.5200000     0.7976000 
1 1 1 27 14 8  o 5.069000  0.2741000     5.116000  0.3214000     5.022000  0.4440000     0.9444000E-01  0.5482000 
1 1 1 27 14 9  o 11.22000  0.1760000     11.11000  0.2408000     11.33000  0.2566000     -0.2197000     0.3519000 
1 1 1 27 14 10 o 5.821000  0.2497000     5.581000  0.3261000     6.061000  0.3783000     -0.4795000     0.4995000 
1 1 1 27 14 11 o 1.383000  0.4257000     1.171000  0.5380000     1.596000  0.6598000     -0.4254000     0.8514000 
1 1 1 27 14 12 o 2.670000  0.4442000     2.761000  0.5978000     2.579000  0.6571000     0.1812000      0.8883000 
1 1 1 27 14 13 f 2.706000  0.5401000     2.791000  0.6035000     2.622000  0.8959000     0.1684000      1.080000  
1 1 1 27 14 14 o 2.835000  0.4232000     3.045000  0.5246000     2.625000  0.6641000     0.4200000      0.8463000 
1 1 1 27 14 15 o 1.959000  0.4681000     2.192000  0.6499000     1.726000  0.6738000     0.4657000      0.9362000 
1 1 1 27 14 16 o 1.936000  0.5832000     2.123000  0.9548000     1.749000  0.6700000     0.3741000      1.166000  
1 1 1 27 14 17 o 1.832000  0.4517000     2.146000  0.6496000     1.519000  0.6278000     0.6274000      0.9034000 
1 1 1 27 14 18 o 1.331000  0.4529000     1.168000  0.5461000     1.495000  0.7226000     -0.3277000     0.9057000 
1 1 1 27 14 19 o 1.605000  0.4561000     1.555000  0.6319000     1.656000  0.6578000     -0.1012000     0.9122000 
1 1 1 27 14 20 o 1.249000  0.4476000     1.186000  0.6048000     1.312000  0.6600000     -0.1269000     0.8952000 
1 1 1 27 15 0  o 2.743000  0.3256000     2.743000  0.3256000     2.743000  0.3256000     0.000000       0.000000  
1 1 1 27 15 1  o 3.346000  0.1886000     3.418000  0.2670000     3.274000  0.2665000     0.1437000      0.3772000 
1 1 1 27 15 2  o 6.693000  0.1258000     6.936000  0.1788000     6.449000  0.1771000     0.4866000      0.2516000 
1 1 1 27 15 3  o 4.831000  0.1546000     4.761000  0.2240000     4.901000  0.2131000     -0.1398000     0.3092000 
1 1 1 27 15 4  o 1.984000  0.3156000     2.593000  0.3822000     1.375000  0.5023000     1.218000       0.6312000 
1 1 1 27 15 5  o 1.696000  0.3916000     1.715000  0.5829000     1.676000  0.5231000     0.3869000E-01  0.7833000 
1 1 1 27 15 6  o 3.504000  0.4196000     2.777000  0.7942000     4.231000  0.2713000     -1.454000      0.8393000 
1 1 1 27 15 7  o 3.275000  0.7280000     3.406000  0.9506000     3.144000  1.103000      0.2614000      1.456000  
1 1 1 27 15 8  f 6.029000  0.2508000     6.200000  0.2869000     5.857000  0.4115000     0.3431000      0.5016000 
1 1 1 27 15 9  o 6.408000  0.2174000     6.458000  0.2897000     6.357000  0.3241000     0.1005000      0.4347000 
1 1 1 27 15 10 o 3.425000  0.4311000     2.850000  0.6584000     4.001000  0.5567000     -1.151000      0.8622000 
1 1 1 27 15 11 o 1.870000  0.4819000     1.971000  0.6743000     1.769000  0.6886000     0.2017000      0.9638000 
1 1 1 27 15 12 o 2.475000  0.4576000     2.288000  0.6490000     2.662000  0.6452000     -0.3742000     0.9151000 
1 1 1 27 15 13 o 2.531000  0.4777000     2.569000  0.6120000     2.493000  0.7337000     0.7666000E-01  0.9555000 
1 1 1 27 15 14 o 1.452000  0.4343000     1.181000  0.5462000     1.723000  0.6752000     -0.5418000     0.8685000 
1 1 1 27 15 15 o 1.349000  0.4188000     1.236000  0.5596000     1.462000  0.6231000     -0.2257000     0.8375000 
1 1 1 27 15 16 o 1.862000  0.4818000     1.532000  0.6881000     2.192000  0.6746000     -0.6591000     0.9636000 
1 1 1 27 15 17 o 1.650000  0.4390000     2.053000  0.6693000     1.248000  0.5683000     0.8045000      0.8781000 
1 1 1 27 15 18 o 1.725000  0.5081000     1.607000  0.6287000     1.842000  0.7983000     -0.2353000     1.016000  
1 1 1 27 15 19 o 1.237000  0.3936000     1.428000  0.6048000     1.045000  0.5039000     0.3823000      0.7873000 
1 1 1 27 16 0  o 12.53000  0.1843000     12.53000  0.1843000     12.53000  0.1843000     -0.000000      0.000000  
1 1 1 27 16 1  o 4.381000  0.1612000     4.682000  0.2175000     4.080000  0.2380000     0.6023000      0.3224000 
1 1 1 27 16 2  o 5.176000  0.1464000     5.200000  0.2087000     5.152000  0.2053000     0.4857000E-01  0.2928000 
1 1 1 27 16 3  o 8.739000  0.1260000     8.848000  0.1782000     8.630000  0.1781000     0.2180000      0.2520000 
1 1 1 27 16 4  o 6.895000  0.1377000     6.887000  0.1956000     6.902000  0.1940000     -0.1511000E-01 0.2755000 
1 1 1 27 16 5  o 9.964000  0.1359000     10.12000  0.1946000     9.805000  0.1898000     0.3196000      0.2718000 
1 1 1 27 16 6  f 2.584000  0.4475000     2.597000  0.7799000     2.572000  0.4390000     0.2497000E-01  0.8949000 
1 1 1 27 16 7  f 8.000000  0.2099000     8.421000  0.2728000     7.579000  0.3190000     0.8423000      0.4197000 
1 1 1 27 16 8  o 9.359000  0.1977000     9.231000  0.2459000     9.487000  0.3096000     -0.2559000     0.3954000 
1 1 1 27 16 9  o 7.344000  0.2014000     7.457000  0.2734000     7.231000  0.2959000     0.2260000      0.4029000 
1 1 1 27 16 10 o 1.614000  0.4859000     1.383000  0.6884000     1.845000  0.6859000     -0.4618000     0.9718000 
1 1 1 27 16 11 o 3.535000  0.3503000     3.288000  0.5058000     3.782000  0.4848000     -0.4938000     0.7006000 
1 1 1 27 16 12 o 3.152000  0.3952000     2.590000  0.6179000     3.715000  0.4928000     -1.125000      0.7904000 
1 1 1 27 16 13 o 3.003000  0.4090000     2.794000  0.6029000     3.212000  0.5530000     -0.4175000     0.8181000 
1 1 1 27 16 14 o 2.563000  0.4432000     2.217000  0.6416000     2.909000  0.6115000     -0.6910000     0.8864000 
1 1 1 27 16 15 o 2.242000  0.4828000     1.846000  0.6554000     2.639000  0.7093000     -0.7930000     0.9657000 
1 1 1 27 16 16 o 1.495000  0.4435000     1.417000  0.6053000     1.573000  0.6484000     -0.1557000     0.8870000 
1 1 1 27 16 17 o 1.325000  0.4123000     1.142000  0.5326000     1.507000  0.6295000     -0.3650000     0.8246000 
1 1 1 27 16 18 o 1.423000  0.4344000     1.088000  0.5114000     1.759000  0.7024000     -0.6716000     0.8688000 
1 1 1 27 16 19 o 1.352000  0.4160000     1.536000  0.6273000     1.167000  0.5464000     0.3692000      0.8320000 
1 1 1 27 17 0  o 7.780000  0.1783000     7.780000  0.1783000     7.780000  0.1783000     0.000000       0.000000  
1 1 1 27 17 1  o 3.101000  0.2204000     2.778000  0.3441000     3.423000  0.2756000     -0.6454000     0.4408000 
1 1 1 27 17 2  o 5.103000  0.1535000     4.834000  0.2255000     5.371000  0.2084000     -0.5365000     0.3070000 
1 1 1 27 17 3  o 7.615000  0.1310000     7.850000  0.1871000     7.380000  0.1835000     0.4702000      0.2620000 
1 1 1 27 17 4  o 6.146000  0.1491000     6.128000  0.2125000     6.164000  0.2093000     -0.3696000E-01 0.2983000 
1 1 1 27 17 5  o 7.421000  0.1643000     7.391000  0.2550000     7.451000  0.2074000     -0.6078000E-01 0.3287000 
1 1 1 27 17 6  o 4.411000  0.3069000     4.562000  0.5338000     4.260000  0.3031000     0.3020000      0.6139000 
1 1 1 27 17 7  o 4.648000  0.2510000     4.812000  0.3671000     4.484000  0.3424000     0.3276000      0.5020000 
1 1 1 27 17 8  o 7.318000  0.2179000     7.336000  0.2639000     7.300000  0.3468000     0.3651000E-01  0.4358000 
1 1 1 27 17 9  o 2.748000  0.4606000     2.663000  0.5906000     2.833000  0.7068000     -0.1708000     0.9211000 
1 1 1 27 17 10 o 4.986000  0.3508000     5.775000  0.3337000     4.196000  0.6171000     1.579000       0.7016000 
1 1 1 27 17 11 o 3.484000  0.3554000     3.733000  0.4264000     3.235000  0.5687000     0.4975000      0.7108000 
1 1 1 27 17 12 o 1.826000  0.4531000     2.288000  0.6606000     1.365000  0.6202000     0.9233000      0.9061000 
1 1 1 27 17 13 o 2.252000  0.4582000     2.605000  0.6092000     1.899000  0.6844000     0.7062000      0.9163000 
1 1 1 27 17 14 o 1.709000  0.4623000     1.842000  0.6546000     1.576000  0.6531000     0.2658000      0.9247000 
1 1 1 27 17 15 o 2.140000  0.4835000     1.874000  0.6560000     2.407000  0.7106000     -0.5326000     0.9671000 
1 1 1 27 17 16 o 2.372000  0.4584000     1.981000  0.6609000     2.762000  0.6356000     -0.7812000     0.9169000 
1 1 1 27 17 17 o 1.187000  0.3849000     1.046000  0.4965000     1.327000  0.5884000     -0.2809000     0.7699000 
1 1 1 27 17 18 o 1.011000  0.3460000     1.073000  0.5100000     0.9499000 0.4676000     0.1229000      0.6919000 
1 1 1 27 17 19 o 1.451000  0.4378000     1.544000  0.6369000     1.358000  0.6009000     0.1860000      0.8756000 
1 1 1 27 18 0  o 3.515000  0.2846000     3.515000  0.2846000     3.515000  0.2846000     -0.000000      0.000000  
1 1 1 27 18 1  o 3.846000  0.1883000     3.584000  0.2831000     4.108000  0.2485000     -0.5234000     0.3766000 
1 1 1 27 18 2  o 6.246000  0.1412000     6.275000  0.2011000     6.217000  0.1984000     0.5809000E-01  0.2825000 
1 1 1 27 18 3  o 7.441000  0.1366000     7.342000  0.1954000     7.541000  0.1909000     -0.1984000     0.2732000 
1 1 1 27 18 4  o 6.600000  0.1483000     6.427000  0.2131000     6.774000  0.2064000     -0.3467000     0.2967000 
1 1 1 27 18 5  o 4.887000  0.2068000     5.234000  0.3060000     4.540000  0.2781000     0.6944000      0.4135000 
1 1 1 27 18 6  o 7.058000  0.2136000     7.299000  0.3159000     6.818000  0.2876000     0.4815000      0.4272000 
1 1 1 27 18 7  o 2.474000  0.4150000     3.151000  0.5392000     1.796000  0.6310000     1.355000       0.8300000 
1 1 1 27 18 8  o 3.787000  0.2888000     3.723000  0.4590000     3.850000  0.3508000     -0.1271000     0.5777000 
1 1 1 27 18 9  o 2.413000  0.4821000     2.190000  0.7261000     2.636000  0.6343000     -0.4466000     0.9642000 
1 1 1 27 18 10 o 1.993000  0.4640000     2.354000  0.6389000     1.632000  0.6732000     0.7217000      0.9281000 
1 1 1 27 18 11 o 5.603000  0.2460000     5.800000  0.3367000     5.406000  0.3589000     0.3948000      0.4921000 
1 1 1 27 18 12 o 2.412000  0.4323000     3.337000  0.5096000     1.487000  0.6984000     1.850000       0.8645000 
1 1 1 27 18 13 o 4.230000  0.4070000     4.146000  0.5944000     4.314000  0.5561000     -0.1676000     0.8140000 
1 1 1 27 18 14 o 2.441000  0.4638000     2.228000  0.6625000     2.655000  0.6493000     -0.4262000     0.9276000 
1 1 1 27 18 15 o 2.252000  0.4744000     3.033000  0.6943000     1.471000  0.6467000     1.562000       0.9488000 
1 1 1 27 18 16 o 1.318000  0.4070000     1.071000  0.5076000     1.565000  0.6363000     -0.4937000     0.8140000 
1 1 1 27 18 17 o 1.100000  0.3702000     0.9721000 0.4736000     1.227000  0.5691000     -0.2551000     0.7404000 
1 1 1 27 18 18 o 1.207000  0.3934000     1.126000  0.5298000     1.288000  0.5816000     -0.1627000     0.7867000 
1 1 1 27 18 19 o 2.243000  0.4684000     1.950000  0.6567000     2.536000  0.6681000     -0.5864000     0.9368000 
1 1 1 27 19 0  o 0.8772000 0.5389000     0.8772000 0.5389000     0.8772000 0.5389000     -0.000000      0.000000  
1 1 1 27 19 1  o 6.851000  0.1367000     6.872000  0.1906000     6.831000  0.1959000     0.4080000E-01  0.2733000 
1 1 1 27 19 2  o 2.515000  0.2911000     2.521000  0.4095000     2.510000  0.4138000     0.1140000E-01  0.5822000 
1 1 1 27 19 3  o 4.125000  0.1985000     3.596000  0.3073000     4.654000  0.2512000     -1.058000      0.3969000 
1 1 1 27 19 4  o 2.385000  0.3379000     2.427000  0.4734000     2.344000  0.4822000     0.8317000E-01  0.6757000 
1 1 1 27 19 5  o 6.079000  0.2315000     6.223000  0.3974000     5.935000  0.2375000     0.2878000      0.4629000 
1 1 1 27 19 6  o 8.273000  0.1795000     8.005000  0.2740000     8.541000  0.2321000     -0.5353000     0.3591000 
1 1 1 27 19 7  o 2.086000  0.4310000     1.882000  0.5943000     2.289000  0.6245000     -0.4072000     0.8621000 
1 1 1 27 19 8  o 7.695000  0.1894000     7.677000  0.2885000     7.712000  0.2455000     -0.3472000E-01 0.3788000 
1 1 1 27 19 9  o 7.459000  0.2804000     7.261000  0.4847000     7.657000  0.2821000     -0.3962000     0.5608000 
1 1 1 27 19 10 o 4.871000  0.2662000     5.085000  0.3484000     4.656000  0.4025000     0.4298000      0.5324000 
1 1 1 27 19 11 o 1.949000  0.4204000     2.554000  0.5888000     1.343000  0.6002000     1.211000       0.8409000 
1 1 1 27 19 12 o 1.889000  0.5236000     1.649000  0.6491000     2.129000  0.8219000     -0.4805000     1.047000  
1 1 1 27 19 13 o 1.831000  0.4664000     2.165000  0.6740000     1.497000  0.6449000     0.6677000      0.9328000 
1 1 1 27 19 14 o 1.687000  0.4659000     1.780000  0.6624000     1.594000  0.6554000     0.1859000      0.9319000 
1 1 1 27 19 15 o 3.042000  0.5800000     2.561000  1.043000      3.524000  0.5076000     -0.9627000     1.160000  
1 1 1 27 19 16 o 1.677000  0.4574000     1.584000  0.6267000     1.769000  0.6664000     -0.1855000     0.9148000 
1 1 1 27 19 17 o 1.149000  0.3856000     1.214000  0.5642000     1.084000  0.5257000     0.1302000      0.7712000 
1 1 1 27 19 18 o 1.873000  0.4675000     1.684000  0.6416000     2.063000  0.6801000     -0.3788000     0.9350000 
1 1 1 27 19 19 o 1.244000  0.4023000     1.151000  0.5359000     1.337000  0.6001000     -0.1860000     0.8046000 
1 1 1 27 20 0  o 4.307000  0.2609000     4.307000  0.2609000     4.307000  0.2609000     -0.000000      0.000000  
1 1 1 27 20 1  o 1.041000  0.3241000     0.8622000 0.4105000     1.220000  0.5016000     -0.3579000     0.6482000 
1 1 1 27 20 2  o 4.927000  0.1720000     4.733000  0.2484000     5.120000  0.2380000     -0.3877000     0.3440000 
1 1 1 27 20 3  o 6.427000  0.1534000     6.503000  0.2164000     6.351000  0.2174000     0.1518000      0.3068000 
1 1 1 27 20 4  o 6.664000  0.1546000     6.569000  0.2193000     6.760000  0.2179000     -0.1912000     0.3092000 
1 1 1 27 20 5  o 4.166000  0.2870000     4.185000  0.4517000     4.147000  0.3540000     0.3889000E-01  0.5739000 
1 1 1 27 20 6  o 12.90000  0.1809000     12.74000  0.2600000     13.06000  0.2516000     -0.3237000     0.3618000 
1 1 1 27 20 7  o 5.391000  0.2090000     5.224000  0.2849000     5.559000  0.3058000     -0.3355000     0.4180000 
1 1 1 27 20 8  o 1.585000  0.4554000     1.463000  0.6336000     1.707000  0.6543000     -0.2447000     0.9108000 
1 1 1 27 20 9  o 4.871000  0.2387000     5.247000  0.3548000     4.494000  0.3193000     0.7531000      0.4773000 
1 1 1 27 20 10 o 2.214000  0.4162000     1.388000  0.5960000     3.039000  0.5810000     -1.651000      0.8323000 
1 1 1 27 20 11 o 3.263000  0.3826000     2.933000  0.5836000     3.594000  0.4948000     -0.6605000     0.7652000 
1 1 1 27 20 12 o 1.416000  0.4382000     1.372000  0.5916000     1.461000  0.6465000     -0.8847000E-01 0.8763000 
1 1 1 27 20 13 o 1.742000  0.4698000     1.517000  0.6258000     1.967000  0.7010000     -0.4497000     0.9397000 
1 1 1 27 20 14 o 2.354000  0.4676000     2.047000  0.6724000     2.661000  0.6500000     -0.6136000     0.9352000 
1 1 1 27 20 15 o 1.954000  0.5128000     1.987000  0.7685000     1.922000  0.6793000     0.6555000E-01  1.026000  
1 1 1 27 20 16 o 1.492000  0.4292000     1.791000  0.6558000     1.193000  0.5539000     0.5981000      0.8584000 
1 1 1 27 20 17 f 2.314000  0.5582000     1.944000  0.6981000     2.685000  0.8712000     -0.7411000     1.116000  
1 1 1 27 20 18 o 1.223000  0.3925000     1.324000  0.5787000     1.121000  0.5304000     0.2033000      0.7849000 
1 1 1 27 20 19 o 1.884000  0.4984000     1.497000  0.6442000     2.271000  0.7607000     -0.7742000     0.9969000 
1 1 1 27 21 0  o 5.601000  0.2275000     5.601000  0.2275000     5.601000  0.2275000     -0.000000      0.000000  
1 1 1 27 21 1  o 10.90000  0.1379000     10.87000  0.1942000     10.93000  0.1959000     -0.5866000E-01 0.2758000 
1 1 1 27 21 2  o 3.995000  0.2064000     4.143000  0.2797000     3.848000  0.3035000     0.2954000      0.4128000 
1 1 1 27 21 3  f 11.23000  0.1421000     11.14000  0.2012000     11.32000  0.2008000     -0.1796000     0.2842000 
1 1 1 27 21 4  o 2.321000  0.3909000     2.456000  0.5682000     2.186000  0.5369000     0.2701000      0.7818000 
1 1 1 27 21 5  f 4.050000  0.2590000     4.129000  0.3827000     3.971000  0.3493000     0.1580000      0.5181000 
1 1 1 27 21 6  o 6.898000  0.2013000     6.626000  0.2951000     7.171000  0.2739000     -0.5448000     0.4026000 
1 1 1 27 21 7  o 3.375000  0.3180000     3.662000  0.3818000     3.087000  0.5087000     0.5753000      0.6360000 
1 1 1 27 21 8  o 6.844000  0.2027000     6.998000  0.3134000     6.691000  0.2573000     0.3065000      0.4055000 
1 1 1 27 21 9  f 2.133000  0.4510000     2.099000  0.6846000     2.167000  0.5872000     -0.6737000E-01 0.9020000 
1 1 1 27 21 10 o 3.096000  0.4149000     3.580000  0.5222000     2.613000  0.6449000     0.9674000      0.8298000 
1 1 1 27 21 11 o 2.746000  0.4542000     3.331000  0.5284000     2.161000  0.7388000     1.170000       0.9083000 
1 1 1 27 21 12 o 1.236000  0.3977000     1.240000  0.5567000     1.232000  0.5681000     0.8027000E-02  0.7954000 
1 1 1 27 21 13 o 1.863000  0.4679000     2.095000  0.6511000     1.631000  0.6721000     0.4634000      0.9358000 
1 1 1 27 21 14 o 1.558000  0.4600000     1.415000  0.6040000     1.700000  0.6939000     -0.2843000     0.9200000 
1 1 1 27 21 15 f 1.524000  0.4372000     1.652000  0.6287000     1.397000  0.6077000     0.2555000      0.8744000 
1 1 1 27 21 16 o 2.341000  0.4258000     1.597000  0.6421000     3.085000  0.5594000     -1.488000      0.8516000 
1 1 1 27 21 17 o 1.481000  0.4246000     1.867000  0.6496000     1.095000  0.5469000     0.7725000      0.8492000 
1 1 1 27 21 18 o 1.557000  0.4473000     1.296000  0.5825000     1.818000  0.6789000     -0.5222000     0.8945000 
1 1 1 27 22 0  o 5.303000  0.2407000     5.303000  0.2407000     5.303000  0.2407000     -0.000000      0.000000  
1 1 1 27 22 1  o 5.227000  0.1746000     5.249000  0.2426000     5.204000  0.2511000     0.4563000E-01  0.3491000 
1 1 1 27 22 2  o 9.943000  0.1418000     10.00000  0.1986000     9.884000  0.2025000     0.1194000      0.2836000 
1 1 1 27 22 3  o 6.347000  0.1817000     6.235000  0.2804000     6.459000  0.2311000     -0.2238000     0.3633000 
1 1 1 27 22 4  f 9.591000  0.2310000     9.702000  0.3782000     9.480000  0.2653000     0.2223000      0.4619000 
1 1 1 27 22 5  o 7.092000  0.1782000     7.210000  0.2721000     6.974000  0.2302000     0.2361000      0.3564000 
1 1 1 27 22 6  o 9.548000  0.1835000     9.502000  0.2667000     9.594000  0.2520000     -0.9229000E-01 0.3669000 
1 1 1 27 22 7  o 7.064000  0.2553000     7.093000  0.3406000     7.035000  0.3804000     0.5877000E-01  0.5106000 
1 1 1 27 22 8  o 3.198000  0.3157000     3.395000  0.4185000     3.001000  0.4728000     0.3937000      0.6314000 
1 1 1 27 22 9  o 4.984000  0.2418000     5.488000  0.3624000     4.480000  0.3201000     1.008000       0.4835000 
1 1 1 27 22 10 o 4.616000  0.3867000     4.403000  0.7087000     4.828000  0.3098000     -0.4245000     0.7735000 
1 1 1 27 22 11 o 1.597000  0.4879000     1.556000  0.6380000     1.637000  0.7382000     -0.8095000E-01 0.9757000 
1 1 1 27 22 12 o 1.499000  0.4200000     1.886000  0.6522000     1.111000  0.5294000     0.7748000      0.8401000 
1 1 1 27 22 13 o 3.834000  0.3307000     3.984000  0.4449000     3.685000  0.4895000     0.2988000      0.6614000 
1 1 1 27 22 14 o 3.884000  0.3680000     3.844000  0.5657000     3.924000  0.4709000     -0.8016000E-01 0.7360000 
1 1 1 27 22 15 o 1.388000  0.4229000     1.405000  0.5905000     1.371000  0.6055000     0.3392000E-01  0.8458000 
1 1 1 27 22 16 o 1.543000  0.4447000     1.692000  0.6498000     1.395000  0.6072000     0.2972000      0.8893000 
1 1 1 27 22 17 o 1.191000  0.3931000     1.254000  0.5691000     1.127000  0.5426000     0.1271000      0.7863000 
1 1 1 27 22 18 o 1.506000  0.4481000     1.374000  0.6073000     1.639000  0.6591000     -0.2649000     0.8962000 
1 1 1 27 23 0  o 3.479000  0.3442000     3.479000  0.3442000     3.479000  0.3442000     0.000000       0.000000  
1 1 1 27 23 1  o 3.175000  0.2638000     3.158000  0.3730000     3.193000  0.3730000     -0.3568000E-01 0.5275000 
1 1 1 27 23 2  o 5.137000  0.2051000     4.953000  0.3206000     5.321000  0.2559000     -0.3683000     0.4102000 
1 1 1 27 23 3  o 4.825000  0.2261000     4.765000  0.3285000     4.884000  0.3109000     -0.1192000     0.4523000 
1 1 1 27 23 4  o 4.318000  0.2491000     4.513000  0.3620000     4.123000  0.3423000     0.3897000      0.4982000 
1 1 1 27 23 5  o 9.022000  0.1812000     8.994000  0.2599000     9.050000  0.2527000     -0.5597000E-01 0.3625000 
1 1 1 27 23 6  o 8.367000  0.2221000     8.414000  0.2532000     8.321000  0.3649000     0.9268000E-01  0.4442000 
1 1 1 27 23 7  o 2.557000  0.4417000     2.560000  0.6455000     2.553000  0.6032000     0.6895000E-02  0.8834000 
1 1 1 27 23 8  f 4.617000  0.2304000     4.913000  0.3080000     4.321000  0.3426000     0.5919000      0.4607000 
1 1 1 27 23 9  o 4.227000  0.2594000     4.750000  0.3246000     3.704000  0.4047000     1.045000       0.5188000 
1 1 1 27 23 10 o 5.737000  0.2275000     5.819000  0.3623000     5.656000  0.2755000     0.1629000      0.4551000 
1 1 1 27 23 11 o 2.525000  0.4527000     2.322000  0.6998000     2.727000  0.5745000     -0.4051000     0.9054000 
1 1 1 27 23 12 o 1.821000  0.4668000     2.011000  0.6561000     1.631000  0.6641000     0.3795000      0.9335000 
1 1 1 27 23 13 o 4.408000  0.2829000     4.450000  0.3835000     4.365000  0.4159000     0.8532000E-01  0.5657000 
1 1 1 27 23 14 o 1.162000  0.3931000     1.262000  0.6002000     1.063000  0.5077000     0.1990000      0.7861000 
1 1 1 27 23 15 o 1.913000  0.4553000     1.501000  0.6214000     2.326000  0.6657000     -0.8254000     0.9106000 
1 1 1 27 23 16 o 1.479000  0.4481000     1.299000  0.5747000     1.659000  0.6877000     -0.3600000     0.8962000 
1 1 1 27 23 17 o 1.327000  0.4183000     1.395000  0.6052000     1.260000  0.5775000     0.1352000      0.8365000 
1 1 1 27 23 18 o 1.263000  0.4061000     1.294000  0.5836000     1.232000  0.5649000     0.6106000E-01  0.8122000 
1 1 1 27 24 0  o 4.024000  0.3795000     4.024000  0.3795000     4.024000  0.3795000     0.000000       0.000000  
1 1 1 27 24 1  o 4.474000  0.2233000     4.448000  0.3401000     4.500000  0.2895000     -0.5218000E-01 0.4466000 
1 1 1 27 24 2  o 8.208000  0.1706000     8.217000  0.2392000     8.199000  0.2432000     0.1815000E-01  0.3411000 
1 1 1 27 24 3  o 6.325000  0.1999000     6.253000  0.2429000     6.398000  0.3176000     -0.1455000     0.3999000 
1 1 1 27 24 4  o 4.054000  0.2912000     3.810000  0.4413000     4.298000  0.3800000     -0.4877000     0.5824000 
1 1 1 27 24 5  o 6.457000  0.2329000     6.209000  0.3503000     6.704000  0.3070000     -0.4952000     0.4658000 
1 1 1 27 24 6  o 5.456000  0.2344000     5.381000  0.3390000     5.532000  0.3237000     -0.1509000     0.4687000 
1 1 1 27 24 7  o 3.156000  0.3486000     3.543000  0.3824000     2.769000  0.5829000     0.7739000      0.6972000 
1 1 1 27 24 8  o 5.823000  0.1973000     6.087000  0.2745000     5.559000  0.2835000     0.5271000      0.3946000 
1 1 1 27 24 9  o 5.739000  0.2057000     5.763000  0.2908000     5.714000  0.2910000     0.4916000E-01  0.4114000 
1 1 1 27 24 10 o 1.894000  0.4698000     2.021000  0.6899000     1.768000  0.6378000     0.2529000      0.9395000 
1 1 1 27 24 11 f 1.846000  0.4606000     2.191000  0.7047000     1.501000  0.5935000     0.6900000      0.9213000 
1 1 1 27 24 12 o 2.042000  0.4751000     1.951000  0.6572000     2.133000  0.6861000     -0.1816000     0.9501000 
1 1 1 27 24 13 o 1.177000  0.3894000     1.200000  0.5489000     1.153000  0.5525000     0.4703000E-01  0.7788000 
1 1 1 27 24 14 o 1.368000  0.4049000     1.011000  0.4882000     1.725000  0.6460000     -0.7132000     0.8097000 
1 1 1 27 24 15 o 3.388000  0.3603000     2.942000  0.5647000     3.834000  0.4477000     -0.8914000     0.7206000 
1 1 1 27 24 16 o 1.698000  0.5102000     1.600000  0.6494000     1.797000  0.7870000     -0.1974000     1.020000  
1 1 1 27 24 17 o 1.340000  0.4180000     1.438000  0.6062000     1.243000  0.5757000     0.1943000      0.8360000 
1 1 1 27 24 18 o 1.856000  0.4606000     1.409000  0.6073000     2.303000  0.6927000     -0.8939000     0.9212000 
1 1 1 27 25 0  o 6.970000  0.3111000     6.970000  0.3111000     6.970000  0.3111000     -0.000000      0.000000  
1 1 1 27 25 1  o 6.299000  0.2808000     6.026000  0.3311000     6.572000  0.4535000     -0.5464000     0.5615000 
1 1 1 27 25 2  o 2.191000  0.4066000     1.345000  0.5615000     3.038000  0.5884000     -1.692000      0.8133000 
1 1 1 27 25 3  o 7.552000  0.1855000     7.620000  0.2486000     7.484000  0.2754000     0.1362000      0.3710000 
1 1 1 27 25 4  o 7.712000  0.2134000     7.606000  0.3221000     7.818000  0.2799000     -0.2115000     0.4267000 
1 1 1 27 25 5  o 9.088000  0.1725000     9.203000  0.2645000     8.972000  0.2214000     0.2313000      0.3449000 
1 1 1 27 25 6  o 4.541000  0.2553000     5.112000  0.2862000     3.970000  0.4228000     1.143000       0.5105000 
1 1 1 27 25 7  o 4.228000  0.2699000     4.477000  0.3277000     3.979000  0.4290000     0.4976000      0.5399000 
1 1 1 27 25 8  o 3.016000  0.3480000     3.290000  0.4511000     2.743000  0.5299000     0.5467000      0.6959000 
1 1 1 27 25 9  o 3.189000  0.3445000     2.602000  0.5642000     3.775000  0.3954000     -1.173000      0.6890000 
1 1 1 27 25 10 o 1.409000  0.4318000     1.218000  0.5473000     1.600000  0.6681000     -0.3816000     0.8636000 
1 1 1 27 25 11 o 3.035000  0.4005000     2.454000  0.6824000     3.616000  0.4196000     -1.162000      0.8010000 
1 1 1 27 25 12 o 2.050000  0.4533000     1.827000  0.6935000     2.273000  0.5839000     -0.4467000     0.9066000 
1 1 1 27 25 13 o 4.940000  0.3184000     4.781000  0.5202000     5.099000  0.3671000     -0.3178000     0.6367000 
1 1 1 27 25 14 o 1.182000  0.3800000     0.9309000 0.4539000     1.433000  0.6096000     -0.5024000     0.7600000 
1 1 1 27 25 15 o 1.988000  0.4638000     2.260000  0.6530000     1.717000  0.6587000     0.5436000      0.9275000 
1 1 1 27 25 16 o 1.690000  0.4653000     2.061000  0.6777000     1.319000  0.6377000     0.7415000      0.9306000 
1 1 1 27 25 17 o 1.172000  0.3878000     1.078000  0.5161000     1.266000  0.5790000     -0.1873000     0.7756000 
1 1 1 27 25 18 o 1.762000  0.5455000     1.916000  0.7623000     1.607000  0.7805000     0.3084000      1.091000  
1 1 1 27 26 0  o 1.272000  0.7088000     1.272000  0.7088000     1.272000  0.7088000     0.000000       0.000000  
1 1 1 27 26 1  o 5.479000  0.2185000     5.512000  0.2976000     5.445000  0.3199000     0.6767000E-01  0.4369000 
1 1 1 27 26 2  o 4.492000  0.2549000     4.341000  0.3643000     4.643000  0.3565000     -0.3015000     0.5097000 
1 1 1 27 26 3  o 4.618000  0.2349000     4.717000  0.3547000     4.520000  0.3082000     0.1974000      0.4699000 
1 1 1 27 26 4  o 9.649000  0.1701000     10.04000  0.2581000     9.262000  0.2215000     0.7754000      0.3401000 
1 1 1 27 26 5  o 2.244000  0.4339000     2.147000  0.6622000     2.341000  0.5610000     -0.1946000     0.8679000 
1 1 1 27 26 6  o 7.339000  0.1879000     7.480000  0.2397000     7.197000  0.2896000     0.2825000      0.3759000 
1 1 1 27 26 7  o 2.484000  0.4210000     2.824000  0.4935000     2.143000  0.6822000     0.6811000      0.8420000 
1 1 1 27 26 8  o 7.316000  0.1769000     7.442000  0.2473000     7.190000  0.2529000     0.2527000      0.3538000 
1 1 1 27 26 9  o 3.982000  0.3114000     4.061000  0.4791000     3.902000  0.3980000     0.1594000      0.6229000 
1 1 1 27 26 10 o 4.117000  0.2828000     3.843000  0.3987000     4.390000  0.4013000     -0.5472000     0.5657000 
1 1 1 27 26 11 f 2.412000  0.4350000     2.955000  0.6284000     1.870000  0.6016000     1.085000       0.8699000 
1 1 1 27 26 12 o 2.547000  0.4494000     2.237000  0.7330000     2.857000  0.5201000     -0.6193000     0.8988000 
1 1 1 27 26 13 o 1.736000  0.4803000     1.585000  0.6849000     1.886000  0.6735000     -0.3012000     0.9606000 
1 1 1 27 26 14 o 3.878000  0.3164000     3.526000  0.4682000     4.229000  0.4257000     -0.7025000     0.6328000 
1 1 1 27 26 15 o 1.934000  0.4717000     2.111000  0.6712000     1.757000  0.6628000     0.3548000      0.9433000 
1 1 1 27 26 16 o 1.219000  0.3981000     1.227000  0.5612000     1.212000  0.5647000     0.1489000E-01  0.7961000 
1 1 1 27 26 17 o 1.196000  0.3933000     1.245000  0.5696000     1.148000  0.5425000     0.9747000E-01  0.7866000 
1 1 1 27 27 0  o 3.523000  0.3862000     3.523000  0.3862000     3.523000  0.3862000     0.000000       0.000000  
1 1 1 27 27 1  o 7.154000  0.1656000     7.313000  0.2318000     6.995000  0.2365000     0.3182000      0.3312000 
1 1 1 27 27 2  o 11.58000  0.1536000     11.75000  0.2164000     11.41000  0.2180000     0.3456000      0.3071000 
1 1 1 27 27 3  o 6.795000  0.1889000     6.591000  0.2890000     6.999000  0.2433000     -0.4071000     0.3778000 
1 1 1 27 27 4  o 4.621000  0.2452000     4.700000  0.3717000     4.542000  0.3199000     0.1582000      0.4904000 
1 1 1 27 27 5  f 3.860000  0.3007000     3.578000  0.4867000     4.143000  0.3533000     -0.5647000     0.6014000 
1 1 1 27 27 6  o 2.462000  0.4191000     2.002000  0.6090000     2.922000  0.5758000     -0.9208000     0.8381000 
1 1 1 27 27 7  o 2.031000  0.4536000     2.083000  0.6068000     1.979000  0.6745000     0.1031000      0.9073000 
1 1 1 27 27 8  o 2.443000  0.4001000     2.712000  0.5142000     2.173000  0.6132000     0.5388000      0.8003000 
1 1 1 27 27 9  o 7.836000  0.2339000     8.225000  0.3548000     7.447000  0.3048000     0.7774000      0.4677000 
1 1 1 27 27 10 o 1.793000  0.3787000     2.498000  0.5579000     1.088000  0.5123000     1.410000       0.7574000 
1 1 1 27 27 11 o 2.902000  0.3602000     2.961000  0.4827000     2.843000  0.5346000     0.1172000      0.7203000 
1 1 1 27 27 12 o 2.381000  0.4414000     3.443000  0.6445000     1.318000  0.6034000     2.124000       0.8828000 
1 1 1 27 27 13 o 3.975000  0.3601000     4.079000  0.4867000     3.872000  0.5309000     0.2075000      0.7202000 
1 1 1 27 27 14 o 1.979000  0.4836000     1.863000  0.6718000     2.095000  0.6957000     -0.2317000     0.9671000 
1 1 1 27 27 15 o 2.276000  0.4720000     2.674000  0.6158000     1.878000  0.7154000     0.7959000      0.9439000 
1 1 1 27 27 16 o 1.542000  0.4425000     1.250000  0.5699000     1.835000  0.6771000     -0.5857000     0.8850000 
1 1 1 27 27 17 o 1.793000  0.4230000     2.452000  0.6523000     1.134000  0.5387000     1.318000       0.8460000 
1 1 1 27 28 0  o 0.7136000 0.4951000     0.7136000 0.4951000     0.7136000 0.4951000     -0.000000      0.000000  
1 1 1 27 28 1  o 4.655000  0.2158000     4.878000  0.2898000     4.431000  0.3198000     0.4470000      0.4316000 
1 1 1 27 28 2  o 2.441000  0.3805000     2.561000  0.5094000     2.320000  0.5654000     0.2412000      0.7610000 
1 1 1 27 28 3  o 2.618000  0.3856000     1.901000  0.6482000     3.335000  0.4179000     -1.434000      0.7712000 
1 1 1 27 28 4  o 5.417000  0.2249000     5.097000  0.3549000     5.736000  0.2762000     -0.6385000     0.4497000 
1 1 1 27 28 5  o 5.778000  0.2190000     5.770000  0.2848000     5.786000  0.3329000     -0.1576000E-01 0.4381000 
1 1 1 27 28 6  o 2.373000  0.4299000     2.531000  0.5391000     2.214000  0.6698000     0.3175000      0.8598000 
1 1 1 27 28 7  o 4.057000  0.2676000     4.444000  0.3291000     3.670000  0.4220000     0.7740000      0.5352000 
1 1 1 27 28 8  o 3.562000  0.3380000     4.056000  0.4551000     3.069000  0.4999000     0.9875000      0.6761000 
1 1 1 27 28 9  o 4.020000  0.3395000     4.413000  0.3839000     3.626000  0.5601000     0.7869000      0.6791000 
1 1 1 27 28 10 o 4.344000  0.2977000     4.824000  0.3317000     3.865000  0.4944000     0.9581000      0.5954000 
1 1 1 27 28 11 o 5.646000  0.2298000     5.860000  0.2871000     5.433000  0.3589000     0.4267000      0.4596000 
1 1 1 27 28 12 o 1.937000  0.5520000     1.895000  0.8662000     1.979000  0.6845000     -0.8417000E-01 1.104000  
1 1 1 27 28 13 o 2.192000  0.4570000     2.739000  0.6861000     1.645000  0.6039000     1.094000       0.9140000 
1 1 1 27 28 14 o 2.628000  0.4384000     3.208000  0.5237000     2.047000  0.7032000     1.161000       0.8767000 
1 1 1 27 28 15 o 1.597000  0.4922000     1.395000  0.6115000     1.799000  0.7715000     -0.4032000     0.9845000 
1 1 1 27 28 16 o 1.674000  0.4533000     1.298000  0.5856000     2.050000  0.6921000     -0.7528000     0.9066000 
1 1 1 27 28 17 o 1.237000  0.4003000     1.406000  0.6137000     1.069000  0.5143000     0.3370000      0.8007000 
1 1 1 27 29 0  o 0.8949000 0.5806000     0.8949000 0.5806000     0.8949000 0.5806000     -0.000000      0.000000  
1 1 1 27 29 1  o 7.091000  0.1713000     7.166000  0.2398000     7.015000  0.2447000     0.1514000      0.3426000 
1 1 1 27 29 2  o 4.383000  0.2328000     4.335000  0.3309000     4.432000  0.3276000     -0.9737000E-01 0.4656000 
1 1 1 27 29 3  o 3.954000  0.2740000     4.291000  0.3871000     3.617000  0.3878000     0.6746000      0.5479000 
1 1 1 27 29 4  o 5.536000  0.2227000     5.401000  0.3473000     5.671000  0.2788000     -0.2701000     0.4454000 
1 1 1 27 29 5  o 4.705000  0.2544000     4.442000  0.3470000     4.968000  0.3720000     -0.5264000     0.5087000 
1 1 1 27 29 6  o 4.216000  0.2712000     4.075000  0.3617000     4.357000  0.4041000     -0.2820000     0.5424000 
1 1 1 27 29 7  o 6.863000  0.2018000     6.991000  0.2523000     6.735000  0.3151000     0.2564000      0.4036000 
1 1 1 27 29 8  o 1.839000  0.4837000     2.264000  0.7437000     1.414000  0.6186000     0.8498000      0.9674000 
1 1 1 27 29 9  o 3.004000  0.3637000     3.585000  0.4054000     2.423000  0.6039000     1.163000       0.7273000 
1 1 1 27 29 10 o 2.707000  0.3960000     2.912000  0.5237000     2.502000  0.5942000     0.4098000      0.7921000 
1 1 1 27 29 11 o 1.858000  0.5020000     1.419000  0.5940000     2.296000  0.8095000     -0.8777000     1.004000  
1 1 1 27 29 12 o 3.162000  0.3419000     2.908000  0.5026000     3.416000  0.4637000     -0.5075000     0.6838000 
1 1 1 27 29 13 o 2.570000  0.4387000     3.133000  0.6355000     2.007000  0.6049000     1.126000       0.8774000 
1 1 1 27 29 14 o 1.461000  0.4466000     1.660000  0.6838000     1.263000  0.5747000     0.3973000      0.8932000 
1 1 1 27 29 15 o 1.335000  0.4386000     1.348000  0.6034000     1.322000  0.6367000     0.2576000E-01  0.8772000 
1 1 1 27 29 16 o 1.961000  0.4676000     1.530000  0.6406000     2.391000  0.6812000     -0.8611000     0.9351000 
1 1 1 27 29 17 o 1.309000  0.4612000     1.470000  0.7116000     1.149000  0.5869000     0.3204000      0.9224000 
1 1 1 27 30 0  o 0.8320000 0.5512000     0.8320000 0.5512000     0.8320000 0.5512000     -0.000000      0.000000  
1 1 1 27 30 1  f 5.463000  0.1986000     5.522000  0.2776000     5.405000  0.2840000     0.1165000      0.3972000 
1 1 1 27 30 2  o 1.671000  0.4196000     1.878000  0.5991000     1.464000  0.5877000     0.4133000      0.8392000 
1 1 1 27 30 3  f 5.511000  0.2158000     5.523000  0.3287000     5.499000  0.2796000     0.2479000E-01  0.4315000 
1 1 1 27 30 4  o 3.588000  0.3165000     4.235000  0.4162000     2.940000  0.4768000     1.295000       0.6329000 
1 1 1 27 30 5  o 5.656000  0.2232000     5.630000  0.2949000     5.682000  0.3351000     -0.5133000E-01 0.4463000 
1 1 1 27 30 6  f 4.611000  0.2544000     4.205000  0.3524000     5.017000  0.3669000     -0.8117000     0.5087000 
1 1 1 27 30 7  o 2.995000  0.3939000     2.907000  0.6103000     3.084000  0.4983000     -0.1774000     0.7878000 
1 1 1 27 30 8  o 3.039000  0.4353000     3.374000  0.4727000     2.703000  0.7312000     0.6715000      0.8707000 
1 1 1 27 30 9  o 2.200000  0.4379000     2.259000  0.6119000     2.141000  0.6264000     0.1181000      0.8757000 
1 1 1 27 30 10 o 5.638000  0.2397000     5.594000  0.3170000     5.683000  0.3595000     -0.8904000E-01 0.4793000 
1 1 1 27 30 11 o 2.177000  0.4839000     2.612000  0.6618000     1.742000  0.7062000     0.8705000      0.9678000 
1 1 1 27 30 12 f 1.449000  0.4206000     1.369000  0.5751000     1.529000  0.6138000     -0.1601000     0.8412000 
1 1 1 27 30 13 o 2.267000  0.4578000     2.314000  0.7201000     2.219000  0.5654000     0.9454000E-01  0.9155000 
1 1 1 27 30 14 o 2.800000  0.4389000     2.454000  0.7440000     3.145000  0.4659000     -0.6912000     0.8778000 
1 1 1 27 30 15 o 1.296000  0.4093000     1.470000  0.6153000     1.123000  0.5400000     0.3471000      0.8186000 
1 1 1 27 30 16 o 1.347000  0.4234000     1.510000  0.6361000     1.184000  0.5591000     0.3263000      0.8469000 
1 1 1 27 31 0  o 4.078000  0.3459000     4.078000  0.3459000     4.078000  0.3459000     0.000000       0.000000  
1 1 1 27 31 1  o 2.746000  0.3543000     3.011000  0.4493000     2.482000  0.5479000     0.5293000      0.7085000 
1 1 1 27 31 2  o 3.015000  0.3705000     2.367000  0.6321000     3.663000  0.3866000     -1.295000      0.7410000 
1 1 1 27 31 3  o 6.782000  0.1941000     6.763000  0.2958000     6.802000  0.2514000     -0.3927000E-01 0.3882000 
1 1 1 27 31 4  o 7.596000  0.1919000     7.652000  0.2927000     7.539000  0.2484000     0.1130000      0.3839000 
1 1 1 27 31 5  o 1.741000  0.4207000     2.215000  0.6165000     1.266000  0.5728000     0.9491000      0.8415000 
1 1 1 27 31 6  o 2.470000  0.4438000     2.568000  0.5786000     2.372000  0.6730000     0.1960000      0.8875000 
1 1 1 27 31 7  o 4.872000  0.2837000     4.746000  0.4194000     4.998000  0.3822000     -0.2522000     0.5674000 
1 1 1 27 31 8  o 1.833000  0.4479000     1.881000  0.6269000     1.786000  0.6398000     0.9529000E-01  0.8958000 
1 1 1 27 31 9  o 3.127000  0.3631000     3.703000  0.4062000     2.551000  0.6019000     1.152000       0.7261000 
1 1 1 27 31 10 o 3.383000  0.4070000     3.796000  0.4486000     2.970000  0.6792000     0.8264000      0.8140000 
1 1 1 27 31 11 o 1.675000  0.4408000     1.878000  0.6353000     1.472000  0.6112000     0.4060000      0.8816000 
1 1 1 27 31 12 o 1.777000  0.4428000     1.563000  0.6107000     1.992000  0.6414000     -0.4286000     0.8856000 
1 1 1 27 31 13 o 1.412000  0.4154000     1.458000  0.5997000     1.366000  0.5750000     0.9145000E-01  0.8308000 
1 1 1 27 31 14 o 1.594000  0.4598000     2.046000  0.7473000     1.141000  0.5360000     0.9043000      0.9196000 
1 1 1 27 31 15 o 2.157000  0.4757000     1.691000  0.6912000     2.623000  0.6538000     -0.9314000     0.9515000 
1 1 1 27 31 16 o 2.548000  0.4769000     2.564000  0.6556000     2.532000  0.6926000     0.3212000E-01  0.9537000 
1 1 1 27 32 0  f 1.022000  0.6322000     1.022000  0.6322000     1.022000  0.6322000     0.000000       0.000000  
1 1 1 27 32 1  o 1.884000  0.4026000     1.419000  0.5740000     2.349000  0.5647000     -0.9304000     0.8052000 
1 1 1 27 32 2  o 3.161000  0.3561000     2.833000  0.5770000     3.488000  0.4175000     -0.6548000     0.7122000 
1 1 1 27 32 3  o 6.211000  0.2114000     6.164000  0.3229000     6.259000  0.2730000     -0.9498000E-01 0.4228000 
1 1 1 27 32 4  o 5.486000  0.2131000     5.416000  0.3066000     5.556000  0.2960000     -0.1409000     0.4262000 
1 1 1 27 32 5  o 5.024000  0.2529000     5.318000  0.3084000     4.729000  0.4009000     0.5885000      0.5058000 
1 1 1 27 32 6  o 3.812000  0.3815000     3.774000  0.4862000     3.850000  0.5880000     -0.7675000E-01 0.7630000 
1 1 1 27 32 7  o 2.177000  0.4513000     2.443000  0.6134000     1.912000  0.6622000     0.5309000      0.9026000 
1 1 1 27 32 8  o 1.510000  0.4197000     1.776000  0.6263000     1.244000  0.5589000     0.5322000      0.8394000 
1 1 1 27 32 9  o 2.391000  0.4472000     1.877000  0.6428000     2.905000  0.6218000     -1.027000      0.8943000 
1 1 1 27 32 10 o 1.953000  0.4766000     2.149000  0.7057000     1.756000  0.6406000     0.3932000      0.9531000 
1 1 1 27 32 11 o 1.546000  0.4241000     1.812000  0.6359000     1.280000  0.5612000     0.5327000      0.8482000 
1 1 1 27 32 12 o 1.678000  0.4331000     1.918000  0.6251000     1.437000  0.5996000     0.4807000      0.8662000 
1 1 1 27 32 13 o 2.526000  0.4072000     2.954000  0.5144000     2.099000  0.6314000     0.8551000      0.8145000 
1 1 1 27 32 14 f 2.465000  0.4828000     3.372000  0.7281000     1.558000  0.6344000     1.815000       0.9657000 
1 1 1 27 32 15 o 1.294000  0.3981000     1.064000  0.5220000     1.523000  0.6012000     -0.4592000     0.7962000 
1 1 1 27 32 16 o 1.123000  0.4019000     1.066000  0.5409000     1.180000  0.5947000     -0.1138000     0.8039000 
1 1 1 27 33 0  o 0.9019000 0.5873000     0.9019000 0.5873000     0.9019000 0.5873000     0.000000       0.000000  
1 1 1 27 33 1  o 1.911000  0.3996000     2.460000  0.5586000     1.361000  0.5717000     1.100000       0.7993000 
1 1 1 27 33 2  o 1.687000  0.4355000     1.390000  0.5988000     1.984000  0.6324000     -0.5942000     0.8710000 
1 1 1 27 33 3  o 9.361000  0.1847000     9.020000  0.2815000     9.703000  0.2393000     -0.6831000     0.3695000 
1 1 1 27 33 4  o 3.503000  0.3119000     3.285000  0.4619000     3.721000  0.4192000     -0.4357000     0.6237000 
1 1 1 27 33 5  o 2.755000  0.4507000     2.082000  0.7228000     3.428000  0.5387000     -1.347000      0.9014000 
1 1 1 27 33 6  o 1.748000  0.4808000     1.994000  0.6716000     1.502000  0.6882000     0.4917000      0.9616000 
1 1 1 27 33 7  o 4.583000  0.2566000     4.879000  0.3433000     4.288000  0.3815000     0.5910000      0.5132000 
1 1 1 27 33 8  f 6.784000  0.2139000     6.668000  0.2857000     6.900000  0.3185000     -0.2322000     0.4279000 
1 1 1 27 33 9  o 4.587000  0.3288000     4.365000  0.4893000     4.808000  0.4392000     -0.4439000     0.6575000 
1 1 1 27 33 10 o 1.672000  0.4207000     2.076000  0.6262000     1.268000  0.5621000     0.8083000      0.8415000 
1 1 1 27 33 11 o 4.718000  0.2501000     4.834000  0.3483000     4.601000  0.3589000     0.2331000      0.5001000 
1 1 1 27 33 12 o 3.897000  0.2843000     3.884000  0.4046000     3.911000  0.3995000     -0.2642000E-01 0.5686000 
1 1 1 27 33 13 o 2.606000  0.4598000     2.642000  0.7076000     2.570000  0.5873000     0.7205000E-01  0.9196000 
1 1 1 27 33 14 o 1.504000  0.4210000     1.188000  0.5346000     1.821000  0.6504000     -0.6323000     0.8419000 
1 1 1 27 33 15 o 1.488000  0.4459000     1.539000  0.6664000     1.437000  0.5927000     0.1019000      0.8918000 
1 1 1 27 34 0  f 0.9409000 0.6048000     0.9409000 0.6048000     0.9409000 0.6048000     -0.000000      0.000000  
1 1 1 27 34 1  o 6.127000  0.2015000     6.074000  0.2884000     6.180000  0.2815000     -0.1067000     0.4029000 
1 1 1 27 34 2  o 4.424000  0.2724000     4.703000  0.3878000     4.145000  0.3827000     0.5585000      0.5448000 
1 1 1 27 34 3  o 5.117000  0.2494000     5.713000  0.3511000     4.522000  0.3543000     1.191000       0.4988000 
1 1 1 27 34 4  o 2.245000  0.4656000     1.763000  0.6800000     2.727000  0.6363000     -0.9639000     0.9313000 
1 1 1 27 34 5  o 5.847000  0.3260000     5.762000  0.3440000     5.932000  0.5539000     -0.1705000     0.6521000 
1 1 1 27 34 6  o 4.977000  0.2418000     5.342000  0.3104000     4.613000  0.3709000     0.7291000      0.4837000 
1 1 1 27 34 7  o 3.554000  0.3672000     3.971000  0.4129000     3.136000  0.6073000     0.8349000      0.7343000 
1 1 1 27 34 8  o 3.863000  0.3581000     3.675000  0.4871000     4.050000  0.5251000     -0.3755000     0.7162000 
1 1 1 27 34 9  o 3.985000  0.2949000     4.128000  0.4134000     3.842000  0.4206000     0.2863000      0.5897000 
1 1 1 27 34 10 o 2.823000  0.3881000     3.129000  0.4943000     2.516000  0.5984000     0.6136000      0.7762000 
1 1 1 27 34 11 o 3.185000  0.3422000     3.128000  0.4812000     3.243000  0.4866000     -0.1151000     0.6844000 
1 1 1 27 34 12 o 1.434000  0.4122000     1.745000  0.6382000     1.124000  0.5220000     0.6209000      0.8245000 
1 1 1 27 34 13 o 1.530000  0.4469000     1.562000  0.6322000     1.498000  0.6317000     0.6325000E-01  0.8937000 
1 1 1 27 34 14 o 1.618000  0.4155000     2.017000  0.6256000     1.218000  0.5468000     0.7988000      0.8309000 
1 1 1 27 34 15 o 1.375000  0.4107000     1.144000  0.5536000     1.606000  0.6067000     -0.4615000     0.8213000 
1 1 1 27 35 0  o 2.065000  0.7517000     2.065000  0.7517000     2.065000  0.7517000     -0.000000      0.000000  
1 1 1 27 35 1  o 1.997000  0.4534000     1.681000  0.6570000     2.313000  0.6251000     -0.6320000     0.9069000 
1 1 1 27 35 2  o 7.551000  0.2057000     7.971000  0.3067000     7.132000  0.2743000     0.8386000      0.4115000 
1 1 1 27 35 3  o 8.170000  0.2497000     7.659000  0.4060000     8.681000  0.2906000     -1.022000      0.4993000 
1 1 1 27 35 4  o 2.222000  0.5354000     2.039000  0.6677000     2.406000  0.8371000     -0.3670000     1.071000  
1 1 1 27 35 5  o 3.721000  0.3999000     4.521000  0.3601000     2.921000  0.7141000     1.600000       0.7998000 
1 1 1 27 35 6  o 4.449000  0.2951000     4.638000  0.3813000     4.260000  0.4506000     0.3780000      0.5903000 
1 1 1 27 35 7  o 1.593000  0.4571000     1.246000  0.5667000     1.941000  0.7174000     -0.6952000     0.9142000 
1 1 1 27 35 8  o 1.009000  0.3474000     1.132000  0.5396000     0.8857000 0.4376000     0.2467000      0.6947000 
1 1 1 27 35 9  o 1.298000  0.3992000     1.436000  0.5956000     1.161000  0.5318000     0.2753000      0.7984000 
1 1 1 27 35 10 o 2.714000  0.3996000     2.938000  0.5361000     2.491000  0.5926000     0.4466000      0.7991000 
1 1 1 27 35 11 o 1.567000  0.4323000     1.469000  0.5949000     1.665000  0.6273000     -0.1958000     0.8646000 
1 1 1 27 35 12 o 2.051000  0.4908000     2.049000  0.7388000     2.053000  0.6461000     -0.3919000E-02 0.9815000 
1 1 1 27 35 13 o 2.441000  0.4352000     2.718000  0.5546000     2.164000  0.6707000     0.5540000      0.8703000 
1 1 1 27 35 14 o 1.903000  0.4492000     1.648000  0.6215000     2.158000  0.6489000     -0.5107000     0.8985000 
1 1 1 27 36 0  o 0.9177000 0.6201000     0.9177000 0.6201000     0.9177000 0.6201000     -0.000000      0.000000  
1 1 1 27 36 1  o 1.510000  0.4688000     1.651000  0.7118000     1.370000  0.6102000     0.2814000      0.9376000 
1 1 1 27 36 2  o 2.338000  0.5728000     1.940000  0.8650000     2.735000  0.7510000     -0.7955000     1.146000  
1 1 1 27 36 3  o 5.217000  0.3480000     4.981000  0.3902000     5.452000  0.5763000     -0.4708000     0.6959000 
1 1 1 27 36 4  o 4.999000  0.2885000     4.947000  0.3417000     5.052000  0.4649000     -0.1045000     0.5770000 
1 1 1 27 36 5  o 3.351000  0.4350000     2.952000  0.5741000     3.750000  0.6536000     -0.7986000     0.8700000 
1 1 1 27 36 6  o 1.970000  0.5062000     1.902000  0.7303000     2.039000  0.7012000     -0.1366000     1.012000  
1 1 1 27 36 7  o 3.944000  0.3266000     4.176000  0.4798000     3.712000  0.4432000     0.4635000      0.6532000 
1 1 1 27 36 8  o 4.736000  0.2512000     5.253000  0.3209000     4.218000  0.3866000     1.035000       0.5025000 
1 1 1 27 36 9  o 4.098000  0.2726000     3.932000  0.4053000     4.265000  0.3646000     -0.3336000     0.5452000 
1 1 1 27 36 10 o 4.416000  0.2724000     4.733000  0.3660000     4.098000  0.4035000     0.6355000      0.5447000 
1 1 1 27 36 11 o 1.713000  0.4245000     1.327000  0.5734000     2.100000  0.6261000     -0.7726000     0.8490000 
1 1 1 27 36 12 o 1.804000  0.4794000     1.469000  0.6686000     2.140000  0.6873000     -0.6716000     0.9588000 
1 1 1 27 36 13 o 1.426000  0.4218000     1.309000  0.5734000     1.543000  0.6187000     -0.2343000     0.8435000 
1 1 1 27 36 14 o 3.301000  0.3571000     3.339000  0.4935000     3.263000  0.5163000     0.7639000E-01  0.7143000 
1 1 1 27 37 0  o 6.533000  0.3934000     6.533000  0.3934000     6.533000  0.3934000     0.000000       0.000000  
1 1 1 27 37 1  f 4.904000  0.4579000     5.118000  0.5955000     4.691000  0.6958000     0.4275000      0.9158000 
1 1 1 27 37 2  o 2.551000  0.5278000     2.373000  0.7347000     2.729000  0.7579000     -0.3564000     1.056000  
1 1 1 27 37 3  o 2.299000  0.4400000     2.980000  0.5736000     1.618000  0.6674000     1.363000       0.8800000 
1 1 1 27 37 4  o 7.248000  0.2863000     7.626000  0.3671000     6.870000  0.4393000     0.7554000      0.5725000 
1 1 1 27 37 5  o 1.561000  0.4395000     2.018000  0.6993000     1.104000  0.5325000     0.9139000      0.8790000 
1 1 1 27 37 6  o 6.544000  0.2088000     6.840000  0.2870000     6.249000  0.3033000     0.5915000      0.4175000 
1 1 1 27 37 7  o 3.650000  0.3102000     3.564000  0.4436000     3.736000  0.4336000     -0.1719000     0.6204000 
1 1 1 27 37 8  f 2.222000  0.4485000     2.395000  0.6225000     2.049000  0.6458000     0.3452000      0.8970000 
1 1 1 27 37 9  o 1.170000  0.3788000     1.176000  0.5389000     1.164000  0.5325000     0.1255000E-01  0.7576000 
1 1 1 27 37 10 o 1.362000  0.4055000     1.032000  0.4963000     1.692000  0.6414000     -0.6603000     0.8110000 
1 1 1 27 37 11 o 1.518000  0.4226000     1.175000  0.5422000     1.861000  0.6482000     -0.6863000     0.8451000 
1 1 1 27 37 12 o 1.690000  0.4765000     1.457000  0.6212000     1.923000  0.7227000     -0.4658000     0.9530000 
1 1 1 27 37 13 o 2.457000  0.4388000     2.118000  0.6677000     2.795000  0.5694000     -0.6766000     0.8775000 
1 1 1 27 37 14 o 2.514000  0.9233000     2.514000  0.9233000     ?         ?             ?              ?         
1 1 1 27 38 0  o 1.367000  0.7696000     1.367000  0.7696000     1.367000  0.7696000     0.000000       0.000000  
1 1 1 27 38 1  o 1.662000  0.4532000     1.566000  0.6492000     1.757000  0.6325000     -0.1906000     0.9064000 
1 1 1 27 38 2  o 2.515000  0.4576000     2.575000  0.6701000     2.455000  0.6234000     0.1202000      0.9152000 
1 1 1 27 38 3  o 2.161000  0.4442000     1.733000  0.6630000     2.590000  0.5914000     -0.8570000     0.8885000 
1 1 1 27 38 4  o 2.564000  0.4541000     3.154000  0.5672000     1.975000  0.7092000     1.179000       0.9081000 
1 1 1 27 38 5  o 5.044000  0.2634000     4.864000  0.3469000     5.223000  0.3964000     -0.3597000     0.5268000 
1 1 1 27 38 6  o 1.820000  0.4533000     1.800000  0.6348000     1.840000  0.6474000     -0.4032000E-01 0.9067000 
1 1 1 27 38 7  o 2.005000  0.4550000     2.032000  0.6323000     1.978000  0.6545000     0.5399000E-01  0.9101000 
1 1 1 27 38 8  o 1.590000  0.4381000     1.423000  0.5921000     1.758000  0.6458000     -0.3350000     0.8761000 
1 1 1 27 38 9  o 1.655000  0.4270000     2.037000  0.6435000     1.273000  0.5616000     0.7649000      0.8540000 
1 1 1 27 38 10 o 1.426000  0.4191000     1.591000  0.6173000     1.261000  0.5671000     0.3300000      0.8383000 
1 1 1 27 38 11 o 1.309000  0.4338000     1.557000  0.6988000     1.062000  0.5142000     0.4944000      0.8676000 
1 1 1 27 38 12 o 1.093000  0.3629000     1.220000  0.5541000     0.9663000 0.4688000     0.2538000      0.7259000 
1 1 1 27 38 13 o 1.673000  0.4447000     1.955000  0.6576000     1.391000  0.5989000     0.5641000      0.8894000 
1 1 1 27 39 0  o 5.092000  0.3884000     5.092000  0.3884000     5.092000  0.3884000     0.000000       0.000000  
1 1 1 27 39 1  o 1.044000  0.3542000     1.206000  0.5587000     0.8816000 0.4356000     0.3244000      0.7084000 
1 1 1 27 39 2  o 1.312000  0.4039000     1.180000  0.5407000     1.444000  0.6001000     -0.2641000     0.8078000 
1 1 1 27 39 3  o 1.510000  0.4402000     1.607000  0.6200000     1.412000  0.6249000     0.1952000      0.8803000 
1 1 1 27 39 4  o 1.534000  0.4270000     1.849000  0.6368000     1.220000  0.5692000     0.6282000      0.8541000 
1 1 1 27 39 5  o 4.139000  0.2868000     4.334000  0.3790000     3.945000  0.4306000     0.3892000      0.5737000 
1 1 1 27 39 6  o 2.109000  0.4411000     1.716000  0.6344000     2.503000  0.6130000     -0.7873000     0.8822000 
1 1 1 27 39 7  o 2.613000  0.4233000     2.662000  0.5939000     2.564000  0.6032000     0.9834000E-01  0.8465000 
1 1 1 27 39 8  o 2.471000  0.4283000     2.898000  0.5450000     2.045000  0.6609000     0.8532000      0.8566000 
1 1 1 27 39 9  o 2.088000  0.4492000     2.460000  0.6228000     1.717000  0.6476000     0.7435000      0.8984000 
1 1 1 27 39 10 o 1.931000  0.4909000     1.920000  0.7220000     1.941000  0.6653000     -0.2127000E-01 0.9817000 
1 1 1 27 39 11 o 1.290000  0.4107000     1.487000  0.6272000     1.092000  0.5304000     0.3956000      0.8214000 
1 1 1 27 39 12 o 2.004000  0.4525000     1.645000  0.6386000     2.363000  0.6413000     -0.7174000     0.9050000 
1 1 1 27 39 13 f 1.894000  0.5628000     1.920000  0.7448000     1.869000  0.8439000     0.5123000E-01  1.126000  
1 1 1 27 40 0  o 3.569000  0.5367000     3.569000  0.5367000     3.569000  0.5367000     0.000000       0.000000  
1 1 1 27 40 1  o 2.792000  0.4378000     2.319000  0.6813000     3.266000  0.5501000     -0.9467000     0.8756000 
1 1 1 27 40 2  o 1.261000  0.3987000     1.179000  0.5403000     1.342000  0.5864000     -0.1632000     0.7973000 
1 1 1 27 40 3  o 1.757000  0.4661000     1.858000  0.6363000     1.657000  0.6811000     0.2012000      0.9321000 
1 1 1 27 40 4  o 2.461000  0.4621000     2.055000  0.6500000     2.868000  0.6572000     -0.8130000     0.9243000 
1 1 1 27 40 5  o 2.202000  0.4502000     2.559000  0.6163000     1.845000  0.6565000     0.7141000      0.9005000 
1 1 1 27 40 6  o 1.569000  0.4396000     1.713000  0.6410000     1.424000  0.6018000     0.2888000      0.8792000 
1 1 1 27 40 7  o 2.096000  0.4604000     1.990000  0.6565000     2.201000  0.6458000     -0.2116000     0.9209000 
1 1 1 27 40 8  f 3.445000  0.3480000     3.816000  0.4387000     3.074000  0.5403000     0.7422000      0.6960000 
1 1 1 27 40 9  o 2.524000  0.4356000     2.569000  0.6228000     2.478000  0.6093000     0.9070000E-01  0.8713000 
1 1 1 27 40 10 o 2.563000  0.5353000     2.402000  0.8295000     2.723000  0.6767000     -0.3214000     1.071000  
1 1 1 27 40 11 o 1.722000  0.4330000     1.293000  0.5696000     2.151000  0.6522000     -0.8587000     0.8659000 
1 1 1 27 40 12 o 1.104000  0.3597000     1.340000  0.5761000     0.8678000 0.4308000     0.4724000      0.7194000 
1 1 1 27 41 0  o 7.647000  0.3262000     7.647000  0.3262000     7.647000  0.3262000     -0.000000      0.000000  
1 1 1 27 41 1  o 2.461000  0.4875000     2.736000  0.6677000     2.186000  0.7105000     0.5505000      0.9750000 
1 1 1 27 41 2  o 1.272000  0.3940000     0.9883000 0.4774000     1.555000  0.6269000     -0.5663000     0.7880000 
1 1 1 27 41 3  o 1.718000  0.4598000     1.937000  0.6514000     1.500000  0.6491000     0.4370000      0.9196000 
1 1 1 27 41 4  o 2.057000  0.4794000     1.915000  0.6512000     2.198000  0.7037000     -0.2826000     0.9588000 
1 1 1 27 41 5  o 3.613000  0.3291000     4.031000  0.4150000     3.194000  0.5110000     0.8376000      0.6583000 
1 1 1 27 41 6  o 1.209000  0.3907000     1.171000  0.5405000     1.247000  0.5644000     -0.7609000E-01 0.7814000 
1 1 1 27 41 7  o 2.060000  0.4489000     2.391000  0.6206000     1.729000  0.6489000     0.6619000      0.8979000 
1 1 1 27 41 8  o 1.147000  0.3765000     1.078000  0.5105000     1.216000  0.5535000     -0.1384000     0.7530000 
1 1 1 27 41 9  o 1.727000  0.4740000     1.713000  0.6938000     1.741000  0.6461000     -0.2793000E-01 0.9481000 
1 1 1 27 41 10 o 1.221000  0.3855000     1.527000  0.6223000     0.9149000 0.4551000     0.6121000      0.7710000 
1 1 1 27 41 11 o 1.095000  0.3611000     1.360000  0.5900000     0.8305000 0.4165000     0.5294000      0.7222000 
1 1 1 27 42 0  o 3.640000  0.5470000     3.640000  0.5470000     3.640000  0.5470000     0.000000       0.000000  
1 1 1 27 42 1  o 2.227000  0.4572000     1.576000  0.6305000     2.878000  0.6624000     -1.302000      0.9145000 
1 1 1 27 42 2  o 3.356000  0.3598000     3.669000  0.4409000     3.043000  0.5687000     0.6253000      0.7196000 
1 1 1 27 42 3  o 2.730000  0.4562000     2.824000  0.5694000     2.637000  0.7130000     0.1872000      0.9125000 
1 1 1 27 42 4  o 3.088000  0.4095000     3.120000  0.5255000     3.056000  0.6283000     0.6437000E-01  0.8191000 
1 1 1 27 42 5  o 1.671000  0.4507000     1.612000  0.6281000     1.731000  0.6465000     -0.1189000     0.9014000 
1 1 1 27 42 6  f 1.957000  0.4497000     2.426000  0.6520000     1.488000  0.6194000     0.9382000      0.8993000 
1 1 1 27 42 7  o 1.297000  0.3997000     1.507000  0.6123000     1.088000  0.5138000     0.4191000      0.7993000 
1 1 1 27 42 8  o 1.544000  0.4585000     1.532000  0.6683000     1.556000  0.6278000     -0.2434000E-01 0.9169000 
1 1 1 27 42 9  o 1.721000  0.4669000     2.050000  0.6846000     1.393000  0.6350000     0.6576000      0.9337000 
1 1 1 27 42 10 o 3.288000  0.3793000     3.603000  0.4780000     2.972000  0.5890000     0.6318000      0.7586000 
1 1 1 27 42 11 o 1.099000  0.3695000     1.029000  0.4928000     1.169000  0.5507000     -0.1402000     0.7390000 
1 1 1 27 43 0  o 0.7530000 0.5337000     0.7530000 0.5337000     0.7530000 0.5337000     -0.000000      0.000000  
1 1 1 27 43 1  o 3.577000  0.3614000     3.307000  0.5049000     3.847000  0.5173000     -0.5399000     0.7229000 
1 1 1 27 43 2  o 1.907000  0.4575000     2.399000  0.6358000     1.415000  0.6581000     0.9836000      0.9150000 
1 1 1 27 43 3  f 1.772000  0.4826000     1.716000  0.6498000     1.828000  0.7137000     -0.1120000     0.9652000 
1 1 1 27 43 4  o 2.430000  0.4533000     2.725000  0.5975000     2.135000  0.6817000     0.5906000      0.9065000 
1 1 1 27 43 5  o 1.802000  0.4571000     1.968000  0.6544000     1.636000  0.6384000     0.3321000      0.9142000 
1 1 1 27 43 6  o 1.706000  0.4615000     1.786000  0.6552000     1.627000  0.6501000     0.1589000      0.9230000 
1 1 1 27 43 7  o 1.284000  0.3987000     1.598000  0.6428000     0.9704000 0.4720000     0.6271000      0.7975000 
1 1 1 27 43 8  o 1.675000  0.4541000     2.096000  0.6968000     1.254000  0.5824000     0.8423000      0.9081000 
1 1 1 27 43 9  o 5.937000  0.2528000     5.850000  0.3368000     6.023000  0.3772000     -0.1727000     0.5056000 
1 1 1 27 43 10 o 5.298000  0.2793000     5.512000  0.3436000     5.084000  0.4403000     0.4283000      0.5585000 
1 1 1 27 44 0  o 1.505000  0.7956000     1.505000  0.7956000     1.505000  0.7956000     -0.000000      0.000000  
1 1 1 27 44 1  o 1.074000  0.3657000     1.017000  0.4915000     1.131000  0.5416000     -0.1138000     0.7314000 
1 1 1 27 44 2  o 1.743000  0.4919000     1.690000  0.6528000     1.796000  0.7360000     -0.1063000     0.9838000 
1 1 1 27 44 3  o 1.267000  0.4097000     1.257000  0.5656000     1.277000  0.5929000     -0.1988000E-01 0.8194000 
1 1 1 27 44 4  o 1.682000  0.4302000     1.161000  0.5383000     2.203000  0.6711000     -1.042000      0.8603000 
1 1 1 27 44 5  o 2.470000  0.4511000     2.433000  0.6393000     2.507000  0.6367000     -0.7458000E-01 0.9023000 
1 1 1 27 44 6  o 1.406000  0.4177000     1.728000  0.6596000     1.084000  0.5127000     0.6438000      0.8354000 
1 1 1 27 44 7  o 2.753000  0.5392000     2.838000  0.8356000     2.668000  0.6816000     0.1691000      1.078000  
1 1 1 27 44 8  o 1.516000  0.4451000     1.256000  0.5665000     1.775000  0.6867000     -0.5189000     0.8903000 
1 1 1 27 44 9  o 1.606000  0.4656000     1.466000  0.6197000     1.747000  0.6951000     -0.2815000     0.9312000 
1 1 1 27 45 0  o 0.9404000 0.6223000     0.9404000 0.6223000     0.9404000 0.6223000     -0.000000      0.000000  
1 1 1 27 45 1  o 5.092000  0.2872000     4.905000  0.3867000     5.280000  0.4248000     -0.3748000     0.5745000 
1 1 1 27 45 2  o 2.354000  0.5286000     2.366000  0.6538000     2.341000  0.8307000     0.2543000E-01  1.057000  
1 1 1 27 45 3  o 1.466000  0.4583000     1.277000  0.5724000     1.654000  0.7158000     -0.3772000     0.9165000 
1 1 1 27 45 4  o 3.817000  0.3229000     3.779000  0.4601000     3.855000  0.4531000     -0.7659000E-01 0.6457000 
1 1 1 27 45 5  o 1.641000  0.4422000     2.297000  0.7433000     0.9853000 0.4791000     1.312000       0.8843000 
1 1 1 27 45 6  o 2.274000  0.5206000     1.829000  0.7675000     2.720000  0.7036000     -0.8909000     1.041000  
1 1 1 27 45 7  o 1.166000  0.3869000     1.002000  0.4860000     1.331000  0.6022000     -0.3283000     0.7739000 
1 1 1 27 45 8  o 1.036000  0.3549000     1.060000  0.5055000     1.013000  0.4984000     0.4725000E-01  0.7099000 
1 1 1 27 45 9  o 2.743000  0.5437000     3.568000  0.6533000     1.918000  0.8693000     1.651000       1.087000  
1 1 1 27 46 0  o 3.225000  0.5559000     3.225000  0.5559000     3.225000  0.5559000     -0.000000      0.000000  
1 1 1 27 46 1  o 1.231000  0.4064000     1.291000  0.5785000     1.172000  0.5710000     0.1190000      0.8129000 
1 1 1 27 46 2  o 2.273000  0.5245000     2.312000  0.6609000     2.234000  0.8146000     0.7788000E-01  1.049000  
1 1 1 27 46 3  o 1.672000  0.4860000     1.551000  0.6303000     1.792000  0.7398000     -0.2412000     0.9719000 
1 1 1 27 46 4  o 2.204000  0.4849000     1.856000  0.7208000     2.551000  0.6487000     -0.6957000     0.9697000 
1 1 1 27 46 5  o 2.207000  0.5068000     1.983000  0.7256000     2.430000  0.7078000     -0.4467000     1.014000  
1 1 1 27 46 6  o 1.987000  0.4885000     1.725000  0.6680000     2.250000  0.7130000     -0.5245000     0.9770000 
1 1 1 27 46 7  o 1.313000  0.4215000     1.170000  0.5467000     1.456000  0.6418000     -0.2861000     0.8431000 
1 1 1 27 46 8  o 1.238000  0.4096000     1.268000  0.5814000     1.207000  0.5771000     0.6109000E-01  0.8192000 
1 1 1 27 47 0  o 4.254000  0.4292000     4.254000  0.4292000     4.254000  0.4292000     -0.000000      0.000000  
1 1 1 27 47 1  o 1.420000  0.4334000     1.583000  0.6354000     1.257000  0.5895000     0.3251000      0.8667000 
1 1 1 27 47 2  o 1.525000  0.4776000     1.357000  0.6176000     1.693000  0.7288000     -0.3368000     0.9553000 
1 1 1 27 47 3  o 2.032000  0.5370000     1.969000  0.7303000     2.094000  0.7875000     -0.1251000     1.074000  
1 1 1 27 47 4  o 1.489000  0.4684000     1.553000  0.6699000     1.424000  0.6548000     0.1297000      0.9368000 
1 1 1 27 47 5  o 1.523000  0.4341000     1.897000  0.6642000     1.148000  0.5592000     0.7487000      0.8683000 
1 1 1 27 47 6  o 2.653000  0.4741000     3.406000  0.5917000     1.901000  0.7408000     1.505000       0.9481000 
1 1 1 27 47 7  o 1.652000  0.4981000     1.282000  0.5953000     2.023000  0.7987000     -0.7409000     0.9961000 
1 1 1 27 48 0  o 1.302000  0.7950000     1.302000  0.7950000     1.302000  0.7950000     0.000000       0.000000  
1 1 1 27 48 1  o 1.286000  0.4360000     1.400000  0.6567000     1.173000  0.5737000     0.2267000      0.8720000 
1 1 1 27 48 2  o 2.237000  0.5989000     1.876000  0.7155000     2.598000  0.9606000     -0.7217000     1.198000  
1 1 1 27 48 3  o 1.380000  0.4558000     1.462000  0.6665000     1.297000  0.6219000     0.1648000      0.9116000 
1 1 1 27 48 4  o 1.762000  0.5539000     1.394000  0.6169000     2.131000  0.9203000     -0.7369000     1.108000  
1 1 1 27 48 5  o 2.827000  0.4900000     2.399000  0.7199000     3.254000  0.6650000     -0.8549000     0.9800000 
1 1 1 27 49 1  o 1.117000  0.3934000     1.167000  0.5681000     1.068000  0.5444000     0.9898000E-01  0.7869000 
1 1 1 27 49 2  o 1.909000  0.5647000     2.133000  0.7900000     1.685000  0.8072000     0.4487000      1.129000  
1 1 1 27 49 3  o 1.856000  0.5291000     1.902000  0.7330000     1.810000  0.7634000     0.9170000E-01  1.058000  
1 1 1 27 49 4  o 3.336000  0.4664000     3.005000  0.7104000     3.667000  0.6045000     -0.6621000     0.9328000 
1 1 1 27 50 0  o 2.585000  1.050000      2.585000  1.050000      2.585000  1.050000      0.000000       0.000000  
1 1 1 27 50 1  o 1.823000  0.5375000     1.817000  0.7308000     1.829000  0.7884000     -0.1199000E-01 1.075000  
1 1 1 28 0  2  o 2.533000  0.3101000     2.533000  0.3101000     2.533000  0.3101000     0.000000       0.000000  
1 1 1 28 0  3  o 19.18000  0.3215000     19.18000  0.3215000     19.18000  0.3215000     -0.000000      0.000000  
1 1 1 28 0  4  o 3.382000  0.4332000     3.382000  0.4332000     3.382000  0.4332000     0.000000       0.000000  
1 1 1 28 0  5  o 0.9038000 0.4863000     0.9038000 0.4863000     0.9038000 0.4863000     0.000000       0.000000  
1 1 1 28 0  6  o 7.835000  0.1780000     7.835000  0.1780000     7.835000  0.1780000     0.000000       0.000000  
1 1 1 28 0  7  o 6.603000  0.2046000     6.603000  0.2046000     6.603000  0.2046000     0.000000       0.000000  
1 1 1 28 0  8  o 1.171000  0.7295000     1.171000  0.7295000     1.171000  0.7295000     0.000000       0.000000  
1 1 1 28 0  9  o 9.169000  0.3467000     9.169000  0.3467000     9.169000  0.3467000     0.000000       0.000000  
1 1 1 28 0  10 o 1.972000  0.9062000     1.972000  0.9062000     1.972000  0.9062000     0.000000       0.000000  
1 1 1 28 0  11 o 2.813000  0.8446000     2.813000  0.8446000     2.813000  0.8446000     0.000000       0.000000  
1 1 1 28 0  12 o 1.132000  0.7406000     1.132000  0.7406000     1.132000  0.7406000     0.000000       0.000000  
1 1 1 28 0  13 o 3.581000  0.5660000     3.581000  0.5660000     3.581000  0.5660000     0.000000       0.000000  
1 1 1 28 0  14 o 0.7306000 0.5327000     0.7306000 0.5327000     0.7306000 0.5327000     0.000000       0.000000  
1 1 1 28 0  15 o 0.8461000 0.5858000     0.8461000 0.5858000     0.8461000 0.5858000     0.000000       0.000000  
1 1 1 28 0  16 o 0.9401000 0.6361000     0.9401000 0.6361000     0.9401000 0.6361000     0.000000       0.000000  
1 1 1 28 0  17 f 0.7707000 0.5506000     0.7707000 0.5506000     0.7707000 0.5506000     0.000000       0.000000  
1 1 1 28 0  18 o 0.7236000 0.5172000     0.7236000 0.5172000     0.7236000 0.5172000     0.000000       0.000000  
1 1 1 28 0  19 o 1.350000  0.8231000     1.350000  0.8231000     1.350000  0.8231000     0.000000       0.000000  
1 1 1 28 0  20 o 1.050000  0.6904000     1.050000  0.6904000     1.050000  0.6904000     0.000000       0.000000  
1 1 1 28 1  2  o 10.49000  0.1422000     10.52000  0.1975000     10.47000  0.2045000     0.4363000E-01  0.2843000 
1 1 1 28 1  3  o 4.348000  0.1829000     4.390000  0.2535000     4.307000  0.2636000     0.8364000E-01  0.3657000 
1 1 1 28 1  4  o 8.241000  0.2437000     ?         ?             8.241000  0.2437000     ?              ?         
1 1 1 28 1  5  o 11.45000  0.1206000     11.62000  0.1887000     11.29000  0.1501000     0.3302000      0.2411000 
1 1 1 28 1  6  o 5.656000  0.1360000     5.552000  0.1976000     5.760000  0.1868000     -0.2082000     0.2719000 
1 1 1 28 1  7  o 2.215000  0.3885000     2.749000  0.3733000     1.681000  0.6814000     1.068000       0.7770000 
1 1 1 28 1  8  o 7.229000  0.1980000     6.979000  0.2101000     7.479000  0.3357000     -0.4999000     0.3960000 
1 1 1 28 1  9  o 2.116000  0.5586000     2.327000  0.8216000     1.906000  0.7572000     0.4207000      1.117000  
1 1 1 28 1  10 o 6.568000  0.2361000     6.614000  0.3405000     6.521000  0.3273000     0.9294000E-01  0.4722000 
1 1 1 28 1  11 o 1.705000  0.4906000     2.038000  0.7549000     1.372000  0.6268000     0.6656000      0.9812000 
1 1 1 28 1  12 o 1.749000  0.5009000     2.036000  0.7593000     1.463000  0.6534000     0.5733000      1.002000  
1 1 1 28 1  13 o 4.034000  0.3502000     4.490000  0.4401000     3.578000  0.5449000     0.9127000      0.7005000 
1 1 1 28 1  14 o 1.767000  0.5346000     1.774000  0.7648000     1.759000  0.7473000     0.1472000E-01  1.069000  
1 1 1 28 1  15 o 2.016000  0.4882000     1.671000  0.6823000     2.361000  0.6985000     -0.6892000     0.9765000 
1 1 1 28 1  16 o 1.955000  0.4956000     1.873000  0.7021000     2.037000  0.6996000     -0.1647000     0.9912000 
1 1 1 28 1  17 o 1.325000  0.4347000     1.512000  0.6728000     1.137000  0.5505000     0.3747000      0.8693000 
1 1 1 28 1  18 o 1.498000  0.4556000     1.454000  0.6362000     1.541000  0.6522000     -0.8711000E-01 0.9112000 
1 1 1 28 1  19 o 1.785000  0.5238000     1.736000  0.7366000     1.834000  0.7448000     -0.9851000E-01 1.048000  
1 1 1 28 1  20 o 1.337000  0.4293000     1.415000  0.6290000     1.260000  0.5845000     0.1551000      0.8586000 
1 1 1 28 2  2  o 6.805000  0.1290000     6.738000  0.1754000     6.872000  0.1892000     -0.1334000     0.2580000 
1 1 1 28 2  3  f 3.820000  0.1916000     4.059000  0.2622000     3.581000  0.2795000     0.4773000      0.3832000 
1 1 1 28 2  4  o 8.464000  0.2541000     ?         ?             8.464000  0.2541000     ?              ?         
1 1 1 28 2  5  o 4.548000  0.1200000     4.695000  0.1795000     4.400000  0.1594000     0.2946000      0.2401000 
1 1 1 28 2  6  o 6.212000  0.1419000     6.119000  0.1814000     6.305000  0.2181000     -0.1863000     0.2837000 
1 1 1 28 2  7  o 6.965000  0.2552000     6.869000  0.1932000     7.060000  0.4725000     -0.1913000     0.5105000 
1 1 1 28 2  8  o 3.890000  0.3216000     4.072000  0.2911000     3.708000  0.5735000     0.3641000      0.6432000 
1 1 1 28 2  9  o 5.285000  0.3920000     5.078000  0.5164000     5.491000  0.5900000     -0.4132000     0.7840000 
1 1 1 28 2  10 o 3.576000  0.4476000     3.116000  0.6609000     4.036000  0.6038000     -0.9197000     0.8951000 
1 1 1 28 2  11 o 1.548000  0.4724000     1.736000  0.7136000     1.360000  0.6192000     0.3760000      0.9448000 
1 1 1 28 2  12 o 2.370000  0.5312000     2.095000  0.7350000     2.646000  0.7671000     -0.5515000     1.062000  
1 1 1 28 2  13 o 2.919000  0.4600000     3.226000  0.5953000     2.611000  0.7015000     0.6148000      0.9201000 
1 1 1 28 2  14 o 2.752000  0.5758000     2.890000  0.8295000     2.614000  0.7989000     0.2763000      1.152000  
1 1 1 28 2  15 o 2.319000  0.4595000     2.939000  0.6385000     1.700000  0.6608000     1.239000       0.9189000 
1 1 1 28 2  16 o 1.540000  0.4518000     1.774000  0.6856000     1.306000  0.5887000     0.4684000      0.9036000 
1 1 1 28 2  17 o 1.449000  0.4727000     1.615000  0.7297000     1.283000  0.6012000     0.3315000      0.9455000 
1 1 1 28 2  18 o 1.991000  0.4937000     1.889000  0.7020000     2.092000  0.6944000     -0.2031000     0.9874000 
1 1 1 28 2  19 o 1.432000  0.4633000     1.607000  0.7077000     1.256000  0.5982000     0.3510000      0.9267000 
1 1 1 28 2  20 o 1.402000  0.4426000     1.480000  0.6499000     1.324000  0.6010000     0.1554000      0.8852000 
1 1 1 28 3  2  o 2.760000  0.2141000     2.733000  0.2827000     2.787000  0.3216000     -0.5440000E-01 0.4282000 
1 1 1 28 3  3  o 4.250000  0.2854000     3.752000  0.5182000     4.747000  0.2393000     -0.9946000     0.5707000 
1 1 1 28 3  4  o 13.23000  0.4256000     ?         ?             13.23000  0.4256000     ?              ?         
1 1 1 28 3  5  o 5.761000  0.1246000     5.868000  0.1604000     5.653000  0.1907000     0.2150000      0.2492000 
1 1 1 28 3  6  o 8.235000  0.1328000     8.089000  0.1777000     8.381000  0.1975000     -0.2916000     0.2657000 
1 1 1 28 3  7  o 5.200000  0.2125000     5.330000  0.2468000     5.069000  0.3460000     0.2610000      0.4250000 
1 1 1 28 3  8  o 5.144000  0.2483000     5.460000  0.2455000     4.828000  0.4317000     0.6321000      0.4966000 
1 1 1 28 3  9  o 3.957000  0.4791000     4.681000  0.3231000     3.232000  0.9020000     1.449000       0.9581000 
1 1 1 28 3  10 o 3.419000  0.3972000     3.507000  0.3650000     3.330000  0.7054000     0.1766000      0.7943000 
1 1 1 28 3  11 o 4.034000  0.4217000     3.695000  0.6076000     4.372000  0.5850000     -0.6772000     0.8435000 
1 1 1 28 3  12 o 1.754000  0.5140000     1.696000  0.7028000     1.811000  0.7502000     -0.1153000     1.028000  
1 1 1 28 3  13 o 2.068000  0.5036000     2.317000  0.7077000     1.819000  0.7168000     0.4977000      1.007000  
1 1 1 28 3  14 o 4.512000  0.3637000     4.495000  0.5474000     4.529000  0.4791000     -0.3392000E-01 0.7274000 
1 1 1 28 3  15 o 1.244000  0.4000000     1.015000  0.4960000     1.474000  0.6276000     -0.4593000     0.7999000 
1 1 1 28 3  16 o 1.735000  0.4733000     1.935000  0.6983000     1.535000  0.6391000     0.3999000      0.9466000 
1 1 1 28 3  17 o 1.342000  0.4523000     1.336000  0.6371000     1.348000  0.6421000     -0.1187000E-01 0.9045000 
1 1 1 28 3  18 o 2.097000  0.4995000     2.048000  0.7183000     2.147000  0.6943000     -0.9867000E-01 0.9990000 
1 1 1 28 3  19 f 1.421000  0.4582000     1.618000  0.7053000     1.224000  0.5852000     0.3931000      0.9165000 
1 1 1 28 3  20 o 1.380000  0.4312000     1.098000  0.5324000     1.662000  0.6784000     -0.5640000     0.8623000 
1 1 1 28 4  1  o 8.622000  0.2786000     ?         ?             8.622000  0.2786000     ?              ?         
1 1 1 28 4  2  o 2.761000  0.2904000     2.794000  0.4572000     2.728000  0.3580000     0.6655000E-01  0.5807000 
1 1 1 28 4  3  o 5.385000  0.2219000     5.393000  0.3824000     5.378000  0.2250000     0.1469000E-01  0.4437000 
1 1 1 28 4  4  f 7.249000  0.1291000     7.372000  0.1525000     7.125000  0.2084000     0.2474000      0.2582000 
1 1 1 28 4  5  o 7.289000  0.1207000     7.302000  0.1619000     7.276000  0.1792000     0.2545000E-01  0.2415000 
1 1 1 28 4  6  o 7.037000  0.1405000     7.273000  0.1837000     6.801000  0.2125000     0.4719000      0.2809000 
1 1 1 28 4  7  o 5.378000  0.2121000     5.382000  0.2524000     5.375000  0.3408000     0.7174000E-02  0.4241000 
1 1 1 28 4  8  o 5.409000  0.2039000     5.296000  0.2763000     5.523000  0.2998000     -0.2267000     0.4078000 
1 1 1 28 4  9  o 3.753000  0.4115000     3.931000  0.3643000     3.574000  0.7379000     0.3571000      0.8230000 
1 1 1 28 4  10 o 1.770000  0.4802000     1.739000  0.5965000     1.801000  0.7527000     -0.6213000E-01 0.9604000 
1 1 1 28 4  11 o 3.166000  0.4473000     3.047000  0.4965000     3.285000  0.7443000     -0.2385000     0.8947000 
1 1 1 28 4  12 o 2.832000  0.5636000     2.896000  0.6278000     2.769000  0.9361000     0.1268000      1.127000  
1 1 1 28 4  13 o 1.594000  0.4722000     1.694000  0.6844000     1.494000  0.6506000     0.2000000      0.9443000 
1 1 1 28 4  14 o 1.801000  0.5084000     1.718000  0.7152000     1.884000  0.7228000     -0.1651000     1.017000  
1 1 1 28 4  15 o 1.323000  0.4225000     1.333000  0.5986000     1.313000  0.5963000     0.2054000E-01  0.8449000 
1 1 1 28 4  16 o 1.789000  0.4553000     2.286000  0.6971000     1.292000  0.5859000     0.9938000      0.9106000 
1 1 1 28 4  17 o 1.497000  0.4890000     1.419000  0.6643000     1.575000  0.7178000     -0.1565000     0.9780000 
1 1 1 28 4  18 o 1.435000  0.4398000     1.587000  0.6542000     1.283000  0.5880000     0.3040000      0.8796000 
1 1 1 28 4  19 o 2.276000  0.5134000     2.825000  0.7379000     1.726000  0.7140000     1.098000       1.027000  
1 1 1 28 4  20 o 1.271000  0.4186000     1.084000  0.5251000     1.458000  0.6520000     -0.3740000     0.8372000 
1 1 1 28 5  1  o 12.34000  0.1858000     12.26000  0.2940000     12.41000  0.2272000     -0.1516000     0.3716000 
1 1 1 28 5  2  o 7.698000  0.1717000     7.719000  0.2708000     7.676000  0.2110000     0.4328000E-01  0.3433000 
1 1 1 28 5  3  o 6.953000  0.2110000     6.560000  0.3676000     7.346000  0.2075000     -0.7865000     0.4221000 
1 1 1 28 5  4  o 11.68000  0.1492000     11.62000  0.1768000     11.74000  0.2403000     -0.1194000     0.2983000 
1 1 1 28 5  5  o 5.828000  0.1331000     5.795000  0.1817000     5.861000  0.1944000     -0.6638000E-01 0.2661000 
1 1 1 28 5  6  o 9.870000  0.1351000     10.09000  0.1865000     9.649000  0.1954000     0.4424000      0.2701000 
1 1 1 28 5  7  o 3.174000  0.5103000     2.295000  0.9389000     4.053000  0.3999000     -1.758000      1.021000  
1 1 1 28 5  8  o 4.110000  0.2453000     4.167000  0.3026000     4.054000  0.3861000     0.1132000      0.4906000 
1 1 1 28 5  9  o 6.890000  0.2424000     6.953000  0.2399000     6.826000  0.4212000     0.1267000      0.4847000 
1 1 1 28 5  10 o 3.540000  0.2978000     3.411000  0.3752000     3.668000  0.4626000     -0.2569000     0.5956000 
1 1 1 28 5  11 o 1.758000  0.4725000     1.913000  0.6147000     1.602000  0.7177000     0.3118000      0.9450000 
1 1 1 28 5  12 o 2.923000  0.6152000     2.319000  0.8758000     3.527000  0.8641000     -1.208000      1.230000  
1 1 1 28 5  13 o 3.525000  0.4496000     4.460000  0.3382000     2.589000  0.8331000     1.871000       0.8991000 
1 1 1 28 5  14 o 2.047000  0.5334000     2.002000  0.7625000     2.093000  0.7462000     -0.9066000E-01 1.067000  
1 1 1 28 5  15 o 1.171000  0.3884000     1.223000  0.5671000     1.119000  0.5310000     0.1037000      0.7769000 
1 1 1 28 5  16 o 1.627000  0.4502000     1.987000  0.6898000     1.268000  0.5788000     0.7193000      0.9005000 
1 1 1 28 5  17 o 1.602000  0.4837000     1.275000  0.6144000     1.928000  0.7473000     -0.6529000     0.9675000 
1 1 1 28 5  18 o 1.595000  0.4593000     1.809000  0.6828000     1.382000  0.6146000     0.4269000      0.9186000 
1 1 1 28 5  19 o 1.531000  0.4488000     1.893000  0.7002000     1.168000  0.5617000     0.7246000      0.8976000 
1 1 1 28 5  20 o 1.242000  0.4200000     1.114000  0.5408000     1.371000  0.6428000     -0.2568000     0.8401000 
1 1 1 28 6  0  o 17.75000  0.4190000     17.75000  0.4190000     17.75000  0.4190000     0.000000       0.000000  
1 1 1 28 6  1  o 14.20000  0.2096000     13.95000  0.3320000     14.46000  0.2559000     -0.5100000     0.4192000 
1 1 1 28 6  2  o 9.159000  0.1820000     9.142000  0.2869000     9.176000  0.2240000     -0.3372000E-01 0.3640000 
1 1 1 28 6  3  o 5.986000  0.2109000     5.992000  0.3953000     5.981000  0.1473000     0.1139000E-01  0.4219000 
1 1 1 28 6  4  o 14.23000  0.1433000     14.25000  0.1855000     14.20000  0.2184000     0.4852000E-01  0.2865000 
1 1 1 28 6  5  o 7.130000  0.1271000     7.235000  0.1698000     7.026000  0.1891000     0.2092000      0.2542000 
1 1 1 28 6  6  o 11.65000  0.1399000     11.68000  0.1936000     11.62000  0.2021000     0.6074000E-01  0.2799000 
1 1 1 28 6  7  o 2.574000  0.4994000     2.215000  0.9014000     2.934000  0.4304000     -0.7186000     0.9989000 
1 1 1 28 6  8  o 6.742000  0.1740000     6.717000  0.2285000     6.767000  0.2624000     -0.4970000E-01 0.3479000 
1 1 1 28 6  9  o 5.005000  0.2995000     4.953000  0.3032000     5.057000  0.5165000     -0.1040000     0.5989000 
1 1 1 28 6  10 o 2.316000  0.4497000     2.446000  0.5928000     2.185000  0.6764000     0.2614000      0.8994000 
1 1 1 28 6  11 f 1.939000  0.4493000     2.300000  0.6236000     1.578000  0.6469000     0.7221000      0.8985000 
1 1 1 28 6  12 o 3.734000  0.5351000     3.289000  0.8538000     4.179000  0.6452000     -0.8903000     1.070000  
1 1 1 28 6  13 o 3.828000  0.3827000     3.800000  0.4008000     3.857000  0.6521000     -0.5685000E-01 0.7654000 
1 1 1 28 6  14 o 1.661000  0.4873000     1.698000  0.6311000     1.623000  0.7426000     0.7463000E-01  0.9746000 
1 1 1 28 6  15 o 1.888000  0.5056000     2.032000  0.6927000     1.744000  0.7365000     0.2885000      1.011000  
1 1 1 28 6  16 o 1.125000  0.3776000     1.234000  0.5706000     1.016000  0.4946000     0.2180000      0.7551000 
1 1 1 28 6  17 o 1.533000  0.4728000     1.746000  0.7150000     1.320000  0.6189000     0.4263000      0.9457000 
1 1 1 28 6  18 o 1.668000  0.4712000     1.769000  0.6826000     1.568000  0.6497000     0.2008000      0.9424000 
1 1 1 28 6  19 o 1.266000  0.4213000     1.125000  0.5385000     1.407000  0.6480000     -0.2825000     0.8425000 
1 1 1 28 6  20 o 0.9218000 0.3316000     0.8759000 0.4475000     0.9676000 0.4895000     -0.9166000E-01 0.6632000 
1 1 1 28 7  0  o 17.69000  0.2374000     17.69000  0.2374000     17.69000  0.2374000     -0.000000      0.000000  
1 1 1 28 7  1  o 2.829000  0.2522000     2.508000  0.3630000     3.149000  0.3501000     -0.6405000     0.5043000 
1 1 1 28 7  2  o 8.970000  0.1684000     8.687000  0.2929000     9.254000  0.1663000     -0.5667000     0.3368000 
1 1 1 28 7  3  o 8.835000  0.1245000     8.902000  0.1844000     8.768000  0.1673000     0.1335000      0.2490000 
1 1 1 28 7  4  o 9.597000  0.1180000     9.380000  0.1607000     9.815000  0.1728000     -0.4347000     0.2360000 
1 1 1 28 7  5  o 6.744000  0.1345000     6.673000  0.1820000     6.814000  0.1982000     -0.1409000     0.2691000 
1 1 1 28 7  6  o 2.178000  0.3388000     2.018000  0.4705000     2.338000  0.4875000     -0.3193000     0.6776000 
1 1 1 28 7  7  o 6.574000  0.2075000     6.209000  0.3415000     6.940000  0.2358000     -0.7309000     0.4150000 
1 1 1 28 7  8  o 10.81000  0.1563000     10.60000  0.2146000     11.03000  0.2272000     -0.4289000     0.3125000 
1 1 1 28 7  9  o 8.620000  0.1787000     8.544000  0.2262000     8.696000  0.2766000     -0.1515000     0.3574000 
1 1 1 28 7  10 o 2.922000  0.3863000     2.931000  0.5101000     2.914000  0.5803000     0.1701000E-01  0.7726000 
1 1 1 28 7  11 o 1.797000  0.4958000     2.399000  0.8191000     1.196000  0.5589000     1.203000       0.9916000 
1 1 1 28 7  12 o 4.507000  0.4297000     4.498000  0.7425000     4.517000  0.4329000     -0.1862000E-01 0.8594000 
1 1 1 28 7  13 o 3.304000  0.4054000     2.665000  0.5142000     3.942000  0.6267000     -1.277000      0.8107000 
1 1 1 28 7  14 o 2.535000  0.5444000     2.578000  0.5902000     2.492000  0.9148000     0.8589000E-01  1.089000  
1 1 1 28 7  15 o 1.882000  0.4900000     1.746000  0.5961000     2.017000  0.7779000     -0.2707000     0.9800000 
1 1 1 28 7  16 o 1.888000  0.4882000     1.763000  0.6012000     2.013000  0.7693000     -0.2509000     0.9764000 
1 1 1 28 7  17 o 1.541000  0.4741000     1.772000  0.7224000     1.311000  0.6142000     0.4614000      0.9482000 
1 1 1 28 7  18 o 1.544000  0.4585000     1.449000  0.6299000     1.639000  0.6665000     -0.1907000     0.9171000 
1 1 1 28 7  19 o 1.441000  0.4509000     1.630000  0.6721000     1.251000  0.6014000     0.3784000      0.9019000 
1 1 1 28 7  20 o 1.201000  0.6036000     1.201000  0.6036000     ?         ?             ?              ?         
1 1 1 28 8  0  o 15.89000  0.2208000     15.89000  0.2208000     15.89000  0.2208000     0.000000       0.000000  
1 1 1 28 8  1  o 11.91000  0.1247000     11.99000  0.1825000     11.84000  0.1701000     0.1487000      0.2495000 
1 1 1 28 8  2  o 1.788000  0.2855000     1.816000  0.4079000     1.761000  0.3997000     0.5547000E-01  0.5711000 
1 1 1 28 8  3  o 9.779000  0.1434000     9.663000  0.1786000     9.895000  0.2244000     -0.2316000     0.2867000 
1 1 1 28 8  4  o 9.392000  0.1223000     9.465000  0.1695000     9.320000  0.1764000     0.1450000      0.2446000 
1 1 1 28 8  5  o 13.44000  0.1414000     13.22000  0.1964000     13.66000  0.2034000     -0.4361000     0.2828000 
1 1 1 28 8  6  o 8.268000  0.1631000     8.352000  0.1971000     8.183000  0.2600000     0.1686000      0.3263000 
1 1 1 28 8  7  o 5.179000  0.1904000     5.123000  0.2526000     5.234000  0.2849000     -0.1108000     0.3807000 
1 1 1 28 8  8  o 1.905000  0.3831000     2.476000  0.5074000     1.334000  0.5742000     1.142000       0.7663000 
1 1 1 28 8  9  o 4.661000  0.2361000     4.547000  0.3170000     4.776000  0.3499000     -0.2291000     0.4721000 
1 1 1 28 8  10 o 2.599000  0.4286000     2.425000  0.6025000     2.773000  0.6099000     -0.3485000     0.8573000 
1 1 1 28 8  11 o 1.893000  0.4723000     1.935000  0.6559000     1.851000  0.6799000     0.8379000E-01  0.9447000 
1 1 1 28 8  12 o 1.599000  0.4919000     2.044000  0.8157000     1.154000  0.5501000     0.8906000      0.9839000 
1 1 1 28 8  13 f 2.361000  0.4544000     2.092000  0.6402000     2.630000  0.6450000     -0.5380000     0.9088000 
1 1 1 28 8  14 o 2.047000  0.4534000     1.882000  0.6159000     2.211000  0.6654000     -0.3288000     0.9067000 
1 1 1 28 8  15 o 2.167000  0.4754000     2.339000  0.5462000     1.996000  0.7782000     0.3433000      0.9508000 
1 1 1 28 8  16 o 1.666000  0.4729000     1.465000  0.5793000     1.868000  0.7477000     -0.4026000     0.9459000 
1 1 1 28 8  17 o 1.583000  0.4698000     1.891000  0.7226000     1.274000  0.6006000     0.6163000      0.9397000 
1 1 1 28 8  18 o 1.061000  0.3595000     1.091000  0.5050000     1.031000  0.5118000     0.6023000E-01  0.7189000 
1 1 1 28 8  19 o 1.327000  0.4183000     1.508000  0.6390000     1.145000  0.5398000     0.3636000      0.8365000 
1 1 1 28 9  0  o 5.777000  0.1688000     5.777000  0.1688000     5.777000  0.1688000     0.000000       0.000000  
1 1 1 28 9  1  o 15.06000  0.1425000     15.15000  0.2168000     14.97000  0.1849000     0.1711000      0.2849000 
1 1 1 28 9  2  o 4.020000  0.1447000     3.785000  0.2413000     4.256000  0.1598000     -0.4705000     0.2895000 
1 1 1 28 9  3  o 8.228000  0.1558000     8.192000  0.2108000     8.265000  0.2294000     -0.7367000E-01 0.3116000 
1 1 1 28 9  4  o 3.015000  0.2146000     2.796000  0.3222000     3.234000  0.2836000     -0.4379000     0.4292000 
1 1 1 28 9  5  o 4.058000  0.1849000     4.072000  0.2529000     4.044000  0.2697000     0.2810000E-01  0.3697000 
1 1 1 28 9  6  o 2.121000  0.3654000     2.525000  0.4725000     1.718000  0.5574000     0.8070000      0.7307000 
1 1 1 28 9  7  o 2.939000  0.3066000     2.879000  0.4166000     3.000000  0.4499000     -0.1213000     0.6131000 
1 1 1 28 9  8  o 5.758000  0.2034000     5.621000  0.2693000     5.895000  0.3049000     -0.2739000     0.4068000 
1 1 1 28 9  9  o 3.541000  0.3034000     3.233000  0.4259000     3.850000  0.4322000     -0.6165000     0.6067000 
1 1 1 28 9  10 o 2.555000  0.4398000     2.262000  0.6253000     2.848000  0.6187000     -0.5851000     0.8797000 
1 1 1 28 9  11 o 1.328000  0.4138000     1.419000  0.5957000     1.238000  0.5745000     0.1809000      0.8276000 
1 1 1 28 9  12 o 2.636000  0.4579000     2.648000  0.6059000     2.624000  0.6866000     0.2429000E-01  0.9157000 
1 1 1 28 9  13 o 3.687000  0.3402000     3.495000  0.4832000     3.879000  0.4791000     -0.3837000     0.6805000 
1 1 1 28 9  14 o 1.645000  0.4510000     1.416000  0.5967000     1.874000  0.6765000     -0.4587000     0.9020000 
1 1 1 28 9  15 o 1.960000  0.4660000     2.047000  0.6493000     1.874000  0.6687000     0.1730000      0.9321000 
1 1 1 28 9  16 o 2.424000  0.4609000     2.713000  0.5098000     2.135000  0.7681000     0.5779000      0.9219000 
1 1 1 28 9  17 o 1.324000  0.4148000     1.438000  0.5912000     1.210000  0.5819000     0.2281000      0.8296000 
1 1 1 28 9  18 o 1.550000  0.4618000     1.321000  0.5541000     1.778000  0.7389000     -0.4570000     0.9236000 
1 1 1 28 9  19 o 1.495000  0.4302000     1.737000  0.6160000     1.254000  0.6007000     0.4834000      0.8604000 
1 1 1 28 10 0  o 13.32000  0.2026000     13.32000  0.2026000     13.32000  0.2026000     -0.000000      0.000000  
1 1 1 28 10 1  o 6.927000  0.1151000     7.147000  0.1780000     6.706000  0.1461000     0.4405000      0.2303000 
1 1 1 28 10 2  o 4.321000  0.1444000     4.572000  0.2197000     4.070000  0.1875000     0.5024000      0.2888000 
1 1 1 28 10 3  o 12.36000  0.1336000     12.44000  0.2036000     12.27000  0.1730000     0.1705000      0.2672000 
1 1 1 28 10 4  o 9.103000  0.1289000     9.050000  0.1811000     9.155000  0.1835000     -0.1051000     0.2578000 
1 1 1 28 10 5  o 3.114000  0.3093000     3.474000  0.3011000     2.754000  0.5403000     0.7202000      0.6185000 
1 1 1 28 10 6  o 7.515000  0.1855000     7.414000  0.3060000     7.617000  0.2097000     -0.2034000     0.3710000 
1 1 1 28 10 7  o 7.101000  0.1643000     6.946000  0.2274000     7.255000  0.2371000     -0.3090000     0.3285000 
1 1 1 28 10 8  o 6.004000  0.2056000     5.644000  0.2877000     6.363000  0.2939000     -0.7187000     0.4112000 
1 1 1 28 10 9  o 10.49000  0.1666000     10.35000  0.2313000     10.64000  0.2399000     -0.2857000     0.3333000 
1 1 1 28 10 10 o 3.506000  0.3244000     3.385000  0.4381000     3.627000  0.4786000     -0.2422000     0.6488000 
1 1 1 28 10 11 o 3.087000  0.4216000     2.842000  0.5545000     3.332000  0.6353000     -0.4901000     0.8432000 
1 1 1 28 10 12 o 1.960000  0.4317000     2.516000  0.5924000     1.404000  0.6282000     1.112000       0.8635000 
1 1 1 28 10 13 o 1.591000  0.4449000     1.305000  0.5746000     1.878000  0.6794000     -0.5737000     0.8898000 
1 1 1 28 10 14 o 1.579000  0.4510000     1.502000  0.6223000     1.657000  0.6529000     -0.1556000     0.9020000 
1 1 1 28 10 15 o 3.019000  0.3870000     3.181000  0.5105000     2.858000  0.5816000     0.3233000      0.7739000 
1 1 1 28 10 16 o 1.312000  0.3960000     1.589000  0.6192000     1.036000  0.4940000     0.5527000      0.7921000 
1 1 1 28 10 17 o 2.650000  0.3949000     2.711000  0.5035000     2.588000  0.6086000     0.1232000      0.7899000 
1 1 1 28 10 18 o 2.012000  0.5093000     2.065000  0.6283000     1.959000  0.8016000     0.1062000      1.019000  
1 1 1 28 10 19 o 2.047000  0.4718000     2.345000  0.5912000     1.750000  0.7353000     0.5954000      0.9435000 
1 1 1 28 11 0  o 5.931000  0.1942000     5.931000  0.1942000     5.931000  0.1942000     -0.000000      0.000000  
1 1 1 28 11 1  o 8.711000  0.1228000     8.584000  0.1828000     8.838000  0.1640000     -0.2540000     0.2456000 
1 1 1 28 11 2  o 17.29000  0.1957000     17.39000  0.3049000     17.19000  0.2454000     0.2072000      0.3914000 
1 1 1 28 11 3  o 13.56000  0.1424000     13.81000  0.2182000     13.30000  0.1830000     0.5137000      0.2848000 
1 1 1 28 11 4  o 3.724000  0.1962000     3.770000  0.2770000     3.677000  0.2780000     0.9286000E-01  0.3925000 
1 1 1 28 11 5  o 5.309000  0.2093000     5.196000  0.2698000     5.423000  0.3200000     -0.2269000     0.4185000 
1 1 1 28 11 6  o 4.386000  0.2041000     4.451000  0.2795000     4.322000  0.2974000     0.1285000      0.4081000 
1 1 1 28 11 7  o 1.589000  0.3954000     1.144000  0.5073000     2.033000  0.6065000     -0.8895000     0.7907000 
1 1 1 28 11 8  o 3.283000  0.4414000     3.190000  0.4525000     3.376000  0.7579000     -0.1865000     0.8827000 
1 1 1 28 11 9  o 3.812000  0.2956000     3.822000  0.3861000     3.802000  0.4477000     0.1933000E-01  0.5912000 
1 1 1 28 11 10 o 1.735000  0.4575000     1.638000  0.6214000     1.831000  0.6716000     -0.1924000     0.9150000 
1 1 1 28 11 11 o 1.615000  0.4654000     1.832000  0.6829000     1.398000  0.6325000     0.4335000      0.9308000 
1 1 1 28 11 12 o 4.370000  0.2909000     4.081000  0.3961000     4.659000  0.4263000     -0.5775000     0.5819000 
1 1 1 28 11 13 o 1.512000  0.4538000     1.482000  0.6191000     1.543000  0.6637000     -0.6118000E-01 0.9077000 
1 1 1 28 11 14 o 3.969000  0.3068000     4.054000  0.4135000     3.884000  0.4534000     0.1703000      0.6137000 
1 1 1 28 11 15 o 1.690000  0.4240000     1.219000  0.5509000     2.161000  0.6447000     -0.9418000     0.8480000 
1 1 1 28 11 16 o 2.720000  0.4297000     2.583000  0.6042000     2.857000  0.6110000     -0.2735000     0.8593000 
1 1 1 28 11 17 o 1.113000  0.3665000     1.156000  0.5311000     1.071000  0.5051000     0.8500000E-01  0.7329000 
1 1 1 28 11 18 o 1.185000  0.3925000     1.173000  0.5475000     1.196000  0.5626000     -0.2335000E-01 0.7850000 
1 1 1 28 11 19 o 1.112000  0.3625000     1.185000  0.5255000     1.038000  0.4995000     0.1473000      0.7250000 
1 1 1 28 12 0  o 2.878000  0.3506000     2.878000  0.3506000     2.878000  0.3506000     -0.000000      0.000000  
1 1 1 28 12 1  o 4.997000  0.1559000     4.981000  0.2248000     5.014000  0.2162000     -0.3254000E-01 0.3119000 
1 1 1 28 12 2  o 6.682000  0.1319000     6.553000  0.2028000     6.812000  0.1686000     -0.2590000     0.2637000 
1 1 1 28 12 3  o 5.705000  0.1430000     5.860000  0.2183000     5.550000  0.1847000     0.3093000      0.2860000 
1 1 1 28 12 4  o 7.013000  0.1469000     6.936000  0.2187000     7.090000  0.1961000     -0.1540000     0.2937000 
1 1 1 28 12 5  o 9.830000  0.1897000     9.487000  0.3212000     10.17000  0.2020000     -0.6860000     0.3794000 
1 1 1 28 12 6  o 4.713000  0.2011000     4.399000  0.2999000     5.028000  0.2681000     -0.6292000     0.4023000 
1 1 1 28 12 7  o 5.955000  0.1849000     6.357000  0.2402000     5.554000  0.2812000     0.8023000      0.3698000 
1 1 1 28 12 8  o 6.616000  0.2382000     6.412000  0.2615000     6.821000  0.3982000     -0.4094000     0.4764000 
1 1 1 28 12 9  o 2.500000  0.4161000     3.047000  0.4956000     1.953000  0.6686000     1.094000       0.8323000 
1 1 1 28 12 10 o 4.737000  0.2721000     5.320000  0.3186000     4.153000  0.4411000     1.167000       0.5442000 
1 1 1 28 12 11 o 5.116000  0.5013000     4.970000  0.9349000     5.262000  0.3620000     -0.2922000     1.003000  
1 1 1 28 12 12 o 1.634000  0.4656000     1.467000  0.6100000     1.801000  0.7037000     -0.3335000     0.9313000 
1 1 1 28 12 13 o 2.758000  0.5159000     1.791000  0.6691000     3.725000  0.7856000     -1.935000      1.032000  
1 1 1 28 12 14 o 1.515000  0.4319000     1.192000  0.5453000     1.838000  0.6699000     -0.6456000     0.8638000 
1 1 1 28 12 15 o 3.409000  0.3575000     3.190000  0.5257000     3.627000  0.4845000     -0.4368000     0.7149000 
1 1 1 28 12 16 o 2.606000  0.4690000     2.772000  0.6385000     2.439000  0.6871000     0.3328000      0.9380000 
1 1 1 28 12 17 o 1.680000  0.4491000     1.676000  0.6324000     1.683000  0.6380000     -0.6683000E-02 0.8983000 
1 1 1 28 12 18 o 1.331000  0.4261000     1.489000  0.6280000     1.172000  0.5762000     0.3175000      0.8523000 
1 1 1 28 12 19 o 1.708000  0.4230000     2.229000  0.6455000     1.186000  0.5469000     1.043000       0.8460000 
1 1 1 28 13 0  o 4.015000  0.3415000     4.015000  0.3415000     4.015000  0.3415000     0.000000       0.000000  
1 1 1 28 13 1  o 7.441000  0.1677000     7.331000  0.2498000     7.552000  0.2238000     -0.2203000     0.3354000 
1 1 1 28 13 2  o 3.898000  0.2038000     4.099000  0.2693000     3.696000  0.3060000     0.4026000      0.4076000 
1 1 1 28 13 3  o 2.657000  0.2717000     2.590000  0.3643000     2.723000  0.4031000     -0.1330000     0.5433000 
1 1 1 28 13 4  o 5.451000  0.2681000     5.352000  0.4867000     5.549000  0.2250000     -0.1970000     0.5362000 
1 1 1 28 13 5  f 5.423000  0.1786000     5.453000  0.2590000     5.392000  0.2460000     0.6103000E-01  0.3572000 
1 1 1 28 13 6  o 10.01000  0.1529000     9.686000  0.2134000     10.33000  0.2190000     -0.6390000     0.3058000 
1 1 1 28 13 7  o 5.260000  0.2095000     5.321000  0.2811000     5.200000  0.3108000     0.1208000      0.4191000 
1 1 1 28 13 8  o 1.991000  0.4558000     1.759000  0.6017000     2.223000  0.6849000     -0.4635000     0.9116000 
1 1 1 28 13 9  o 1.786000  0.4535000     1.967000  0.6369000     1.605000  0.6458000     0.3620000      0.9070000 
1 1 1 28 13 10 o 4.845000  0.2560000     4.969000  0.3396000     4.720000  0.3833000     0.2483000      0.5121000 
1 1 1 28 13 11 o 2.961000  0.5064000     2.201000  0.8888000     3.721000  0.4856000     -1.520000      1.013000  
1 1 1 28 13 12 o 1.850000  0.4451000     2.292000  0.6369000     1.408000  0.6219000     0.8841000      0.8902000 
1 1 1 28 13 13 o 1.822000  0.5449000     1.749000  0.6636000     1.894000  0.8644000     -0.1455000     1.090000  
1 1 1 28 13 14 o 1.559000  0.4482000     1.585000  0.6287000     1.533000  0.6389000     0.5152000E-01  0.8964000 
1 1 1 28 13 15 o 1.743000  0.4630000     1.643000  0.6287000     1.842000  0.6800000     -0.1992000     0.9261000 
1 1 1 28 13 16 o 1.611000  0.4643000     1.390000  0.6236000     1.832000  0.6881000     -0.4417000     0.9286000 
1 1 1 28 13 17 o 1.143000  0.3732000     1.011000  0.4847000     1.275000  0.5675000     -0.2640000     0.7463000 
1 1 1 28 13 18 o 1.704000  0.5103000     1.442000  0.6156000     1.967000  0.8140000     -0.5253000     1.021000  
1 1 1 28 13 19 o 1.213000  0.3928000     1.029000  0.4946000     1.397000  0.6103000     -0.3679000     0.7856000 
1 1 1 28 14 0  o 0.7065000 0.5075000     0.7065000 0.5075000     0.7065000 0.5075000     -0.000000      0.000000  
1 1 1 28 14 1  o 6.531000  0.1707000     6.333000  0.2543000     6.730000  0.2279000     -0.3971000     0.3414000 
1 1 1 28 14 2  o 5.258000  0.1865000     5.259000  0.2719000     5.257000  0.2552000     0.1748000E-02  0.3729000 
1 1 1 28 14 3  o 5.167000  0.1845000     4.824000  0.2660000     5.510000  0.2559000     -0.6865000     0.3691000 
1 1 1 28 14 4  o 7.294000  0.1430000     7.196000  0.2291000     7.393000  0.1714000     -0.1972000     0.2861000 
1 1 1 28 14 5  o 4.499000  0.1900000     4.721000  0.2947000     4.278000  0.2401000     0.4432000      0.3801000 
1 1 1 28 14 6  o 4.102000  0.2342000     3.970000  0.3315000     4.233000  0.3310000     -0.2624000     0.4685000 
1 1 1 28 14 7  o 9.723000  0.1694000     9.867000  0.2238000     9.579000  0.2543000     0.2879000      0.3388000 
1 1 1 28 14 8  o 4.438000  0.2500000     4.051000  0.3561000     4.824000  0.3510000     -0.7729000     0.5000000 
1 1 1 28 14 9  o 2.728000  0.4135000     2.477000  0.5965000     2.978000  0.5730000     -0.5006000     0.8271000 
1 1 1 28 14 10 o 5.160000  0.2545000     4.896000  0.3346000     5.424000  0.3834000     -0.5276000     0.5089000 
1 1 1 28 14 11 o 5.845000  0.2306000     6.064000  0.3073000     5.626000  0.3440000     0.4376000      0.4613000 
1 1 1 28 14 12 o 5.016000  0.2555000     4.755000  0.3612000     5.277000  0.3613000     -0.5227000     0.5109000 
1 1 1 28 14 13 o 1.883000  0.5208000     1.288000  0.5729000     2.478000  0.8700000     -1.191000      1.042000  
1 1 1 28 14 14 o 1.638000  0.4512000     1.440000  0.5997000     1.836000  0.6743000     -0.3964000     0.9023000 
1 1 1 28 14 15 o 2.567000  0.4147000     1.858000  0.6419000     3.276000  0.5252000     -1.418000      0.8294000 
1 1 1 28 14 16 o 1.924000  0.5147000     1.656000  0.8018000     2.191000  0.6455000     -0.5355000     1.029000  
1 1 1 28 14 17 o 1.498000  0.4348000     1.519000  0.6176000     1.476000  0.6122000     0.4364000E-01  0.8696000 
1 1 1 28 14 18 o 1.414000  0.4596000     1.122000  0.5266000     1.706000  0.7534000     -0.5843000     0.9192000 
1 1 1 28 14 19 o 1.920000  0.4645000     2.102000  0.6567000     1.738000  0.6572000     0.3642000      0.9290000 
1 1 1 28 15 0  o 15.95000  0.2428000     15.95000  0.2428000     15.95000  0.2428000     0.000000       0.000000  
1 1 1 28 15 1  o 1.496000  0.3758000     1.459000  0.5769000     1.532000  0.4816000     -0.7326000E-01 0.7515000 
1 1 1 28 15 2  o 4.205000  0.2281000     3.985000  0.3947000     4.425000  0.2287000     -0.4400000     0.4562000 
1 1 1 28 15 3  f 3.027000  0.2278000     3.008000  0.3263000     3.045000  0.3179000     -0.3622000E-01 0.4555000 
1 1 1 28 15 4  o 7.016000  0.1374000     7.104000  0.1891000     6.927000  0.1995000     0.1777000      0.2748000 
1 1 1 28 15 5  o 8.589000  0.1459000     8.566000  0.2306000     8.612000  0.1788000     -0.4569000E-01 0.2918000 
1 1 1 28 15 6  o 5.300000  0.1945000     5.014000  0.3183000     5.586000  0.2236000     -0.5719000     0.3889000 
1 1 1 28 15 7  o 3.528000  0.3640000     3.209000  0.4698000     3.848000  0.5562000     -0.6388000     0.7281000 
1 1 1 28 15 8  o 3.069000  0.3557000     3.201000  0.4543000     2.938000  0.5476000     0.2636000      0.7115000 
1 1 1 28 15 9  o 1.769000  0.4662000     1.546000  0.6139000     1.991000  0.7019000     -0.4450000     0.9325000 
1 1 1 28 15 10 o 2.293000  0.4887000     1.941000  0.6873000     2.645000  0.6948000     -0.7037000     0.9773000 
1 1 1 28 15 11 o 1.939000  0.4653000     1.525000  0.6233000     2.353000  0.6910000     -0.8282000     0.9305000 
1 1 1 28 15 12 o 3.631000  0.3466000     3.226000  0.5223000     4.037000  0.4556000     -0.8110000     0.6931000 
1 1 1 28 15 13 o 1.807000  0.4355000     2.284000  0.6226000     1.329000  0.6091000     0.9549000      0.8710000 
1 1 1 28 15 14 f 1.623000  0.4512000     1.373000  0.5908000     1.873000  0.6822000     -0.5002000     0.9025000 
1 1 1 28 15 15 o 1.431000  0.4249000     1.166000  0.5381000     1.695000  0.6578000     -0.5289000     0.8499000 
1 1 1 28 15 16 o 1.685000  0.5050000     1.901000  0.8008000     1.468000  0.6155000     0.4327000      1.010000  
1 1 1 28 15 17 o 1.180000  0.3831000     1.225000  0.5526000     1.134000  0.5307000     0.9042000E-01  0.7661000 
1 1 1 28 15 18 o 1.298000  0.4221000     1.367000  0.5898000     1.229000  0.6039000     0.1372000      0.8441000 
1 1 1 28 15 19 o 1.934000  0.4479000     1.504000  0.6209000     2.363000  0.6458000     -0.8594000     0.8959000 
1 1 1 28 16 0  o 4.379000  0.2869000     4.379000  0.2869000     4.379000  0.2869000     0.000000       0.000000  
1 1 1 28 16 1  o 7.401000  0.1380000     7.726000  0.2096000     7.076000  0.1797000     0.6499000      0.2761000 
1 1 1 28 16 2  o 3.377000  0.2271000     3.514000  0.3407000     3.240000  0.3002000     0.2737000      0.4541000 
1 1 1 28 16 3  f 2.007000  0.3390000     2.036000  0.4702000     1.978000  0.4884000     0.5766000E-01  0.6780000 
1 1 1 28 16 4  o 4.975000  0.1663000     5.127000  0.2286000     4.822000  0.2417000     0.3051000      0.3327000 
1 1 1 28 16 5  o 7.727000  0.1394000     7.874000  0.2033000     7.581000  0.1907000     0.2924000      0.2788000 
1 1 1 28 16 6  o 3.733000  0.2547000     3.482000  0.4160000     3.985000  0.2939000     -0.5026000     0.5093000 
1 1 1 28 16 7  f 3.322000  0.3459000     3.583000  0.4153000     3.061000  0.5532000     0.5212000      0.6917000 
1 1 1 28 16 8  o 3.544000  0.3321000     4.105000  0.3655000     2.983000  0.5546000     1.121000       0.6642000 
1 1 1 28 16 9  o 3.831000  0.3106000     3.737000  0.4203000     3.926000  0.4574000     -0.1887000     0.6212000 
1 1 1 28 16 10 o 3.386000  0.5660000     2.856000  1.038000      3.915000  0.4510000     -1.059000      1.132000  
1 1 1 28 16 11 o 3.190000  0.3713000     3.252000  0.4619000     3.127000  0.5815000     0.1248000      0.7426000 
1 1 1 28 16 12 o 1.924000  0.4605000     1.612000  0.6297000     2.237000  0.6722000     -0.6254000     0.9211000 
1 1 1 28 16 13 o 2.827000  0.4190000     2.470000  0.6376000     3.184000  0.5437000     -0.7145000     0.8379000 
1 1 1 28 16 14 o 1.529000  0.4413000     1.626000  0.6369000     1.432000  0.6110000     0.1942000      0.8825000 
1 1 1 28 16 15 o 1.890000  0.3804000     2.661000  0.5485000     1.120000  0.5272000     1.541000       0.7607000 
1 1 1 28 16 16 o 1.650000  0.4779000     1.999000  0.7590000     1.301000  0.5811000     0.6980000      0.9559000 
1 1 1 28 16 17 o 1.376000  0.4164000     1.572000  0.6287000     1.181000  0.5462000     0.3918000      0.8329000 
1 1 1 28 16 18 o 2.924000  0.4329000     3.210000  0.5158000     2.638000  0.6953000     0.5719000      0.8657000 
1 1 1 28 16 19 o 1.286000  0.4287000     1.358000  0.6094000     1.215000  0.6031000     0.1430000      0.8574000 
1 1 1 28 17 0  o 14.49000  0.2360000     14.49000  0.2360000     14.49000  0.2360000     -0.000000      0.000000  
1 1 1 28 17 1  o 9.852000  0.1388000     9.884000  0.2109000     9.820000  0.1803000     0.6405000E-01  0.2775000 
1 1 1 28 17 2  o 7.918000  0.1494000     7.697000  0.2262000     8.140000  0.1951000     -0.4431000     0.2987000 
1 1 1 28 17 3  o 4.933000  0.1675000     4.599000  0.2436000     5.266000  0.2301000     -0.6675000     0.3351000 
1 1 1 28 17 4  o 4.480000  0.1840000     4.482000  0.2583000     4.477000  0.2622000     0.5211000E-02  0.3681000 
1 1 1 28 17 5  o 6.321000  0.1572000     6.588000  0.2130000     6.055000  0.2313000     0.5331000      0.3144000 
1 1 1 28 17 6  o 3.290000  0.2986000     3.038000  0.4894000     3.542000  0.3423000     -0.5033000     0.5973000 
1 1 1 28 17 7  o 3.117000  0.3164000     3.097000  0.5043000     3.138000  0.3821000     -0.4053000E-01 0.6327000 
1 1 1 28 17 8  o 4.763000  0.2435000     4.905000  0.3286000     4.621000  0.3595000     0.2837000      0.4870000 
1 1 1 28 17 9  o 4.033000  0.3225000     3.902000  0.4013000     4.165000  0.5049000     -0.2627000     0.6449000 
1 1 1 28 17 10 o 5.530000  0.3120000     5.771000  0.5059000     5.290000  0.3653000     0.4807000      0.6240000 
1 1 1 28 17 11 o 2.766000  0.4266000     2.711000  0.5603000     2.821000  0.6433000     -0.1102000     0.8531000 
1 1 1 28 17 12 o 1.991000  0.4731000     2.448000  0.6751000     1.534000  0.6631000     0.9140000      0.9462000 
1 1 1 28 17 13 o 2.787000  0.4242000     2.447000  0.6343000     3.127000  0.5633000     -0.6792000     0.8483000 
1 1 1 28 17 14 o 1.142000  0.3782000     1.231000  0.5615000     1.052000  0.5068000     0.1791000      0.7564000 
1 1 1 28 17 15 o 1.433000  0.4336000     1.259000  0.5563000     1.606000  0.6652000     -0.3468000     0.8672000 
1 1 1 28 17 16 o 1.961000  0.4598000     1.734000  0.6470000     2.188000  0.6536000     -0.4534000     0.9197000 
1 1 1 28 17 17 o 1.536000  0.4416000     1.639000  0.6367000     1.433000  0.6120000     0.2061000      0.8831000 
1 1 1 28 17 18 o 1.317000  0.4138000     1.227000  0.5571000     1.408000  0.6120000     -0.1817000     0.8276000 
1 1 1 28 18 0  o 1.948000  0.5764000     1.948000  0.5764000     1.948000  0.5764000     0.000000       0.000000  
1 1 1 28 18 1  o 11.93000  0.1465000     11.90000  0.2230000     11.96000  0.1900000     -0.5610000E-01 0.2929000 
1 1 1 28 18 2  o 11.26000  0.1523000     11.21000  0.2234000     11.31000  0.2070000     -0.1008000     0.3045000 
1 1 1 28 18 3  o 5.581000  0.1615000     5.625000  0.2190000     5.538000  0.2373000     0.8645000E-01  0.3230000 
1 1 1 28 18 4  o 3.851000  0.2160000     3.899000  0.3015000     3.802000  0.3094000     0.9619000E-01  0.4320000 
1 1 1 28 18 5  o 6.254000  0.1601000     6.529000  0.2191000     5.979000  0.2337000     0.5498000      0.3203000 
1 1 1 28 18 6  o 3.231000  0.3063000     3.272000  0.3876000     3.190000  0.4745000     0.8124000E-01  0.6126000 
1 1 1 28 18 7  o 1.849000  0.4226000     1.751000  0.6407000     1.947000  0.5512000     -0.1960000     0.8452000 
1 1 1 28 18 8  o 4.088000  0.2616000     4.407000  0.3948000     3.769000  0.3434000     0.6375000      0.5233000 
1 1 1 28 18 9  o 2.300000  0.4916000     2.395000  0.6749000     2.206000  0.7149000     0.1887000      0.9831000 
1 1 1 28 18 10 o 3.264000  0.3661000     2.765000  0.5483000     3.764000  0.4852000     -0.9994000     0.7322000 
1 1 1 28 18 11 o 1.736000  0.4402000     2.101000  0.6380000     1.371000  0.6067000     0.7302000      0.8804000 
1 1 1 28 18 12 o 2.405000  0.5001000     2.917000  0.5892000     1.892000  0.8083000     1.025000       1.000000  
1 1 1 28 18 13 o 2.003000  0.4721000     1.870000  0.6549000     2.136000  0.6802000     -0.2657000     0.9442000 
1 1 1 28 18 14 o 1.938000  0.4507000     2.310000  0.6306000     1.565000  0.6441000     0.7451000      0.9014000 
1 1 1 28 18 15 o 1.462000  0.4453000     1.305000  0.5901000     1.618000  0.6669000     -0.3126000     0.8905000 
1 1 1 28 18 16 o 3.743000  0.3405000     4.237000  0.4146000     3.248000  0.5403000     0.9889000      0.6811000 
1 1 1 28 18 17 o 2.276000  0.4748000     2.417000  0.6319000     2.134000  0.7087000     0.2837000      0.9495000 
1 1 1 28 18 18 f 1.297000  0.4042000     1.502000  0.6190000     1.091000  0.5200000     0.4110000      0.8084000 
1 1 1 28 19 0  o 1.497000  0.6490000     1.497000  0.6490000     1.497000  0.6490000     0.000000       0.000000  
1 1 1 28 19 1  o 7.521000  0.1488000     7.637000  0.2257000     7.406000  0.1940000     0.2307000      0.2976000 
1 1 1 28 19 2  f 12.72000  0.1600000     12.73000  0.2327000     12.72000  0.2196000     0.5470000E-02  0.3199000 
1 1 1 28 19 3  o 4.251000  0.2024000     4.592000  0.2613000     3.910000  0.3091000     0.6821000      0.4047000 
1 1 1 28 19 4  o 3.064000  0.2729000     2.989000  0.3810000     3.138000  0.3909000     -0.1493000     0.5459000 
1 1 1 28 19 5  o 3.385000  0.2979000     3.037000  0.4827000     3.733000  0.3494000     -0.6952000     0.5959000 
1 1 1 28 19 6  o 6.842000  0.1662000     6.892000  0.2263000     6.791000  0.2436000     0.1015000      0.3325000 
1 1 1 28 19 7  f 1.938000  0.4034000     1.552000  0.6246000     2.325000  0.5107000     -0.7724000     0.8069000 
1 1 1 28 19 8  o 2.003000  0.4249000     1.614000  0.6391000     2.391000  0.5601000     -0.7771000     0.8498000 
1 1 1 28 19 9  o 1.586000  0.4969000     1.946000  0.8214000     1.227000  0.5595000     0.7189000      0.9938000 
1 1 1 28 19 10 o 2.466000  0.4502000     2.340000  0.6316000     2.592000  0.6417000     -0.2523000     0.9004000 
1 1 1 28 19 11 f 2.876000  0.4253000     3.359000  0.4784000     2.392000  0.7034000     0.9670000      0.8507000 
1 1 1 28 19 12 o 2.291000  0.5070000     2.465000  0.5970000     2.118000  0.8195000     0.3474000      1.014000  
1 1 1 28 19 13 o 4.811000  0.2632000     5.294000  0.3332000     4.327000  0.4075000     0.9675000      0.5264000 
1 1 1 28 19 14 o 3.618000  0.3360000     3.689000  0.4498000     3.546000  0.4992000     0.1432000      0.6719000 
1 1 1 28 19 15 o 1.475000  0.4958000     1.723000  0.8183000     1.226000  0.5599000     0.4971000      0.9915000 
1 1 1 28 19 16 o 1.977000  0.4370000     1.433000  0.6058000     2.520000  0.6299000     -1.088000      0.8740000 
1 1 1 28 19 17 o 1.115000  0.3864000     1.052000  0.5073000     1.178000  0.5830000     -0.1257000     0.7728000 
1 1 1 28 19 18 o 1.233000  0.3980000     1.150000  0.5376000     1.317000  0.5869000     -0.1664000     0.7959000 
1 1 1 28 20 0  o 7.180000  0.1993000     7.180000  0.1993000     7.180000  0.1993000     0.000000       0.000000  
1 1 1 28 20 1  o 6.551000  0.1600000     6.550000  0.2418000     6.552000  0.2095000     -0.2158000E-02 0.3200000 
1 1 1 28 20 2  o 1.251000  0.3530000     0.9477000 0.4521000     1.555000  0.5422000     -0.6071000     0.7059000 
1 1 1 28 20 3  o 8.595000  0.1489000     8.526000  0.2028000     8.663000  0.2180000     -0.1374000     0.2977000 
1 1 1 28 20 4  o 1.949000  0.3926000     1.739000  0.5570000     2.159000  0.5535000     -0.4195000     0.7852000 
1 1 1 28 20 5  o 6.594000  0.1926000     6.587000  0.2569000     6.600000  0.2870000     -0.1350000E-01 0.3852000 
1 1 1 28 20 6  o 1.983000  0.3973000     2.091000  0.5504000     1.875000  0.5731000     0.2167000      0.7946000 
1 1 1 28 20 7  o 4.622000  0.2160000     4.963000  0.2874000     4.281000  0.3226000     0.6822000      0.4320000 
1 1 1 28 20 8  o 5.246000  0.2849000     5.665000  0.3692000     4.827000  0.4339000     0.8375000      0.5698000 
1 1 1 28 20 9  o 1.496000  0.4269000     1.704000  0.6561000     1.288000  0.5463000     0.4160000      0.8538000 
1 1 1 28 20 10 o 2.519000  0.4060000     3.334000  0.4737000     1.703000  0.6596000     1.631000       0.8120000 
1 1 1 28 20 11 o 2.105000  0.4716000     2.007000  0.6418000     2.203000  0.6913000     -0.1968000     0.9433000 
1 1 1 28 20 12 o 1.415000  0.4326000     1.271000  0.5583000     1.559000  0.6609000     -0.2875000     0.8652000 
1 1 1 28 20 13 o 1.946000  0.4549000     2.252000  0.6286000     1.639000  0.6578000     0.6128000      0.9098000 
1 1 1 28 20 14 o 2.359000  0.4580000     2.231000  0.6455000     2.486000  0.6500000     -0.2547000     0.9161000 
1 1 1 28 20 15 o 2.017000  0.5067000     2.207000  0.7708000     1.827000  0.6581000     0.3799000      1.013000  
1 1 1 28 20 16 o 1.778000  0.4657000     1.617000  0.6405000     1.939000  0.6762000     -0.3217000     0.9314000 
1 1 1 28 20 17 o 1.594000  0.5162000     1.373000  0.6083000     1.815000  0.8340000     -0.4417000     1.032000  
1 1 1 28 20 18 o 1.300000  0.4059000     1.020000  0.4921000     1.580000  0.6457000     -0.5599000     0.8118000 
1 1 1 28 21 0  o 5.077000  0.2529000     5.077000  0.2529000     5.077000  0.2529000     -0.000000      0.000000  
1 1 1 28 21 1  o 6.402000  0.1674000     6.369000  0.2562000     6.435000  0.2155000     -0.6603000E-01 0.3348000 
1 1 1 28 21 2  o 9.272000  0.1536000     9.362000  0.2342000     9.182000  0.1988000     0.1800000      0.3072000 
1 1 1 28 21 3  f 3.914000  0.2549000     3.930000  0.3794000     3.898000  0.3405000     0.3166000E-01  0.5098000 
1 1 1 28 21 4  o 3.022000  0.3211000     2.904000  0.5001000     3.140000  0.4028000     -0.2359000     0.6421000 
1 1 1 28 21 5  o 4.696000  0.2054000     4.407000  0.2967000     4.985000  0.2843000     -0.5782000     0.4109000 
1 1 1 28 21 6  f 5.680000  0.1838000     5.821000  0.2575000     5.540000  0.2624000     0.2817000      0.3676000 
1 1 1 28 21 7  o 10.19000  0.1769000     10.07000  0.2223000     10.31000  0.2753000     -0.2419000     0.3538000 
1 1 1 28 21 8  o 1.648000  0.4814000     1.518000  0.7043000     1.778000  0.6565000     -0.2601000     0.9628000 
1 1 1 28 21 9  o 1.380000  0.3978000     1.803000  0.6501000     0.9565000 0.4585000     0.8466000      0.7955000 
1 1 1 28 21 10 o 3.042000  0.3803000     2.770000  0.5619000     3.313000  0.5127000     -0.5433000     0.7607000 
1 1 1 28 21 11 o 3.465000  0.3899000     3.588000  0.4635000     3.342000  0.6270000     0.2465000      0.7797000 
1 1 1 28 21 12 o 2.442000  0.4457000     2.084000  0.6365000     2.799000  0.6242000     -0.7155000     0.8915000 
1 1 1 28 21 13 o 3.956000  0.3025000     3.938000  0.4032000     3.975000  0.4511000     -0.3625000E-01 0.6051000 
1 1 1 28 21 14 o 2.391000  0.4631000     2.469000  0.6127000     2.313000  0.6947000     0.1563000      0.9263000 
1 1 1 28 21 15 o 1.679000  0.4625000     1.726000  0.6601000     1.633000  0.6479000     0.9231000E-01  0.9250000 
1 1 1 28 21 16 o 1.260000  0.4030000     1.308000  0.5832000     1.213000  0.5564000     0.9438000E-01  0.8061000 
1 1 1 28 21 17 o 1.304000  0.4318000     1.258000  0.5717000     1.351000  0.6473000     -0.9280000E-01 0.8636000 
1 1 1 28 21 18 o 1.422000  0.4288000     1.209000  0.5525000     1.635000  0.6560000     -0.4261000     0.8576000 
1 1 1 28 22 0  o 4.286000  0.2897000     4.286000  0.2897000     4.286000  0.2897000     0.000000       0.000000  
1 1 1 28 22 1  f 1.193000  0.3685000     1.350000  0.5652000     1.037000  0.4731000     0.3126000      0.7371000 
1 1 1 28 22 2  o 3.415000  0.2798000     3.247000  0.4405000     3.583000  0.3452000     -0.3354000     0.5597000 
1 1 1 28 22 3  f 5.532000  0.2021000     5.530000  0.3056000     5.534000  0.2645000     -0.3695000E-02 0.4042000 
1 1 1 28 22 4  o 7.828000  0.1868000     8.147000  0.2469000     7.509000  0.2805000     0.6373000      0.3736000 
1 1 1 28 22 5  o 3.756000  0.2552000     3.652000  0.3610000     3.859000  0.3608000     -0.2068000     0.5104000 
1 1 1 28 22 6  o 3.387000  0.3024000     3.216000  0.4207000     3.559000  0.4346000     -0.3428000     0.6048000 
1 1 1 28 22 7  o 2.066000  0.4611000     2.581000  0.6634000     1.550000  0.6407000     1.031000       0.9223000 
1 1 1 28 22 8  o 1.897000  0.4010000     1.324000  0.5579000     2.470000  0.5761000     -1.146000      0.8020000 
1 1 1 28 22 9  o 3.468000  0.3382000     3.083000  0.5689000     3.852000  0.3660000     -0.7681000     0.6765000 
1 1 1 28 22 10 o 1.627000  0.4385000     1.896000  0.6723000     1.358000  0.5630000     0.5379000      0.8769000 
1 1 1 28 22 11 o 1.566000  0.4866000     1.327000  0.5861000     1.805000  0.7770000     -0.4782000     0.9732000 
1 1 1 28 22 12 o 1.418000  0.4217000     1.568000  0.6167000     1.269000  0.5753000     0.2990000      0.8434000 
1 1 1 28 22 13 o 2.526000  0.4195000     1.784000  0.6435000     3.268000  0.5384000     -1.485000      0.8390000 
1 1 1 28 22 14 o 1.928000  0.4877000     2.405000  0.7416000     1.452000  0.6335000     0.9529000      0.9753000 
1 1 1 28 22 15 o 1.183000  0.3882000     1.195000  0.5483000     1.172000  0.5497000     0.2264000E-01  0.7765000 
1 1 1 28 22 16 o 2.182000  0.4786000     2.102000  0.6704000     2.262000  0.6832000     -0.1606000     0.9572000 
1 1 1 28 22 17 o 1.387000  0.4335000     1.394000  0.6051000     1.380000  0.6209000     0.1406000E-01  0.8670000 
1 1 1 28 22 18 o 1.504000  0.7317000     1.504000  0.7317000     ?         ?             ?              ?         
1 1 1 28 23 0  o 6.238000  0.2305000     6.238000  0.2305000     6.238000  0.2305000     -0.000000      0.000000  
1 1 1 28 23 1  f 4.693000  0.2115000     4.558000  0.3274000     4.828000  0.2679000     -0.2701000     0.4230000 
1 1 1 28 23 2  o 3.461000  0.2781000     3.753000  0.3853000     3.169000  0.4010000     0.5845000      0.5561000 
1 1 1 28 23 3  o 2.849000  0.4238000     2.762000  0.6718000     2.936000  0.5169000     -0.1739000     0.8477000 
1 1 1 28 23 4  o 7.905000  0.1634000     8.026000  0.2228000     7.783000  0.2392000     0.2432000      0.3269000 
1 1 1 28 23 5  o 3.305000  0.3240000     3.317000  0.3948000     3.293000  0.5139000     0.2401000E-01  0.6480000 
1 1 1 28 23 6  o 3.145000  0.4034000     3.690000  0.4042000     2.600000  0.6983000     1.091000       0.8068000 
1 1 1 28 23 7  o 2.609000  0.4057000     2.191000  0.6684000     3.028000  0.4600000     -0.8371000     0.8114000 
1 1 1 28 23 8  o 1.680000  0.4214000     1.466000  0.5767000     1.894000  0.6146000     -0.4282000     0.8428000 
1 1 1 28 23 9  o 2.841000  0.3444000     3.124000  0.4402000     2.558000  0.5298000     0.5651000      0.6888000 
1 1 1 28 23 10 o 1.163000  0.3772000     1.221000  0.5613000     1.105000  0.5040000     0.1165000      0.7543000 
1 1 1 28 23 11 o 1.764000  0.4665000     1.881000  0.6387000     1.647000  0.6802000     0.2344000      0.9331000 
1 1 1 28 23 12 o 3.197000  0.3680000     3.170000  0.4958000     3.224000  0.5439000     -0.5418000E-01 0.7360000 
1 1 1 28 23 13 f 3.678000  0.3275000     3.155000  0.5035000     4.202000  0.4190000     -1.047000      0.6550000 
1 1 1 28 23 14 o 1.731000  0.5553000     2.422000  0.9911000     1.040000  0.5012000     1.382000       1.111000  
1 1 1 28 23 15 o 1.208000  0.3907000     1.263000  0.5637000     1.152000  0.5411000     0.1117000      0.7814000 
1 1 1 28 23 16 o 1.609000  0.4642000     1.692000  0.6478000     1.525000  0.6651000     0.1678000      0.9284000 
1 1 1 28 23 17 o 1.559000  0.4124000     0.9496000 0.4658000     2.168000  0.6807000     -1.219000      0.8248000 
1 1 1 28 24 0  o 1.799000  0.7791000     1.799000  0.7791000     1.799000  0.7791000     0.000000       0.000000  
1 1 1 28 24 1  o 1.137000  0.3561000     0.9553000 0.4618000     1.318000  0.5421000     -0.3627000     0.7121000 
1 1 1 28 24 2  o 3.571000  0.3322000     3.673000  0.5295000     3.469000  0.4013000     0.2048000      0.6644000 
1 1 1 28 24 3  o 6.025000  0.2242000     6.398000  0.2916000     5.651000  0.3407000     0.7468000      0.4484000 
1 1 1 28 24 4  o 6.956000  0.1942000     6.839000  0.2419000     7.074000  0.3039000     -0.2349000     0.3884000 
1 1 1 28 24 5  o 1.259000  0.3994000     1.274000  0.5532000     1.245000  0.5762000     0.2911000E-01  0.7987000 
1 1 1 28 24 6  o 6.393000  0.2069000     6.520000  0.3011000     6.266000  0.2840000     0.2536000      0.4139000 
1 1 1 28 24 7  o 5.194000  0.2651000     5.759000  0.2724000     4.629000  0.4548000     1.129000       0.5302000 
1 1 1 28 24 8  o 2.996000  0.3410000     3.239000  0.4309000     2.752000  0.5286000     0.4868000      0.6820000 
1 1 1 28 24 9  o 2.612000  0.3896000     2.758000  0.4906000     2.466000  0.6055000     0.2924000      0.7793000 
1 1 1 28 24 10 o 3.392000  0.3677000     3.736000  0.5367000     3.048000  0.5028000     0.6882000      0.7354000 
1 1 1 28 24 11 o 1.953000  0.4181000     1.493000  0.6385000     2.413000  0.5399000     -0.9201000     0.8361000 
1 1 1 28 24 12 o 1.334000  0.4124000     1.483000  0.6133000     1.185000  0.5515000     0.2971000      0.8249000 
1 1 1 28 24 13 o 3.298000  0.4041000     3.778000  0.4352000     2.817000  0.6810000     0.9603000      0.8082000 
1 1 1 28 24 14 o 2.204000  0.4302000     1.433000  0.6469000     2.976000  0.5674000     -1.543000      0.8605000 
1 1 1 28 24 15 o 1.208000  0.3844000     0.8754000 0.4351000     1.540000  0.6338000     -0.6650000     0.7688000 
1 1 1 28 24 16 o 1.280000  0.4359000     1.034000  0.5025000     1.526000  0.7123000     -0.4913000     0.8717000 
1 1 1 28 24 17 o 1.443000  0.4385000     1.514000  0.6371000     1.371000  0.6026000     0.1430000      0.8770000 
1 1 1 28 25 0  o 3.290000  0.6021000     3.290000  0.6021000     3.290000  0.6021000     0.000000       0.000000  
1 1 1 28 25 1  o 3.154000  0.5519000     2.978000  0.8363000     3.329000  0.7205000     -0.3515000     1.104000  
1 1 1 28 25 2  o 1.565000  0.4423000     1.209000  0.5599000     1.920000  0.6847000     -0.7114000     0.8845000 
1 1 1 28 25 3  o 1.789000  0.5001000     1.695000  0.6732000     1.883000  0.7396000     -0.1878000     1.000000  
1 1 1 28 25 4  f 2.558000  0.4117000     3.270000  0.4485000     1.846000  0.6906000     1.424000       0.8234000 
1 1 1 28 25 5  o 4.529000  0.2553000     4.796000  0.3714000     4.263000  0.3505000     0.5338000      0.5107000 
1 1 1 28 25 6  o 2.116000  0.4192000     1.995000  0.5669000     2.237000  0.6177000     -0.2427000     0.8384000 
1 1 1 28 25 7  o 8.980000  0.1638000     9.048000  0.2280000     8.912000  0.2353000     0.1361000      0.3277000 
1 1 1 28 25 8  o 8.326000  0.1690000     8.238000  0.2397000     8.413000  0.2383000     -0.1753000     0.3381000 
1 1 1 28 25 9  f 1.411000  0.4100000     1.290000  0.5605000     1.532000  0.5986000     -0.2421000     0.8200000 
1 1 1 28 25 10 o 6.957000  0.2218000     6.939000  0.2801000     6.975000  0.3439000     -0.3667000E-01 0.4435000 
1 1 1 28 25 11 o 2.557000  0.4233000     2.820000  0.6413000     2.293000  0.5525000     0.5267000      0.8465000 
1 1 1 28 25 12 o 2.177000  0.4398000     2.706000  0.5812000     1.648000  0.6603000     1.058000       0.8796000 
1 1 1 28 25 13 o 2.123000  0.5104000     2.164000  0.7533000     2.081000  0.6889000     0.8239000E-01  1.021000  
1 1 1 28 25 14 o 3.157000  0.3915000     3.803000  0.4380000     2.510000  0.6491000     1.293000       0.7831000 
1 1 1 28 25 15 o 2.246000  0.4783000     2.586000  0.6232000     1.906000  0.7257000     0.6800000      0.9566000 
1 1 1 28 25 16 o 1.639000  0.5110000     1.611000  0.6485000     1.667000  0.7900000     -0.5632000E-01 1.022000  
1 1 1 28 25 17 o 1.877000  0.4205000     1.117000  0.5304000     2.637000  0.6527000     -1.520000      0.8411000 
1 1 1 28 26 0  o 5.680000  0.2957000     5.680000  0.2957000     5.680000  0.2957000     -0.000000      0.000000  
1 1 1 28 26 1  o 4.318000  0.2927000     4.221000  0.3843000     4.415000  0.4415000     -0.1940000     0.5853000 
1 1 1 28 26 2  o 3.345000  0.3888000     3.325000  0.6143000     3.365000  0.4769000     -0.4005000E-01 0.7777000 
1 1 1 28 26 3  o 8.497000  0.2158000     8.741000  0.3352000     8.253000  0.2718000     0.4887000      0.4316000 
1 1 1 28 26 4  o 10.89000  0.1997000     11.01000  0.2681000     10.78000  0.2960000     0.2341000      0.3994000 
1 1 1 28 26 5  o 8.134000  0.1707000     8.232000  0.2268000     8.036000  0.2552000     0.1957000      0.3414000 
1 1 1 28 26 6  o 2.604000  0.3794000     2.637000  0.4872000     2.571000  0.5818000     0.6552000E-01  0.7589000 
1 1 1 28 26 7  o 6.189000  0.2010000     5.930000  0.2745000     6.449000  0.2938000     -0.5193000     0.4021000 
1 1 1 28 26 8  o 5.655000  0.2059000     5.508000  0.2893000     5.802000  0.2931000     -0.2937000     0.4118000 
1 1 1 28 26 9  f 1.512000  0.4401000     1.698000  0.6720000     1.327000  0.5683000     0.3707000      0.8801000 
1 1 1 28 26 10 o 2.151000  0.4310000     2.427000  0.5626000     1.875000  0.6530000     0.5521000      0.8619000 
1 1 1 28 26 11 o 1.447000  0.4233000     1.823000  0.6875000     1.072000  0.4941000     0.7507000      0.8467000 
1 1 1 28 26 12 o 1.178000  0.3859000     1.314000  0.5955000     1.042000  0.4909000     0.2721000      0.7717000 
1 1 1 28 26 13 o 2.474000  0.4552000     1.638000  0.7416000     3.310000  0.5280000     -1.672000      0.9104000 
1 1 1 28 26 14 o 2.794000  0.4193000     3.225000  0.5072000     2.363000  0.6679000     0.8624000      0.8387000 
1 1 1 28 26 15 o 1.604000  0.4269000     2.082000  0.6704000     1.127000  0.5288000     0.9550000      0.8539000 
1 1 1 28 26 16 o 1.385000  0.4253000     1.536000  0.6242000     1.235000  0.5779000     0.3014000      0.8506000 
1 1 1 28 26 17 o 1.640000  0.5291000     1.572000  0.6881000     1.707000  0.8040000     -0.1355000     1.058000  
1 1 1 28 27 0  o 1.692000  0.7098000     1.692000  0.7098000     1.692000  0.7098000     -0.000000      0.000000  
1 1 1 28 27 1  o 1.518000  0.4030000     1.309000  0.5477000     1.727000  0.5913000     -0.4184000     0.8060000 
1 1 1 28 27 2  o 3.552000  0.2996000     3.357000  0.4822000     3.747000  0.3558000     -0.3903000     0.5993000 
1 1 1 28 27 3  o 2.863000  0.3689000     2.601000  0.6050000     3.125000  0.4223000     -0.5233000     0.7378000 
1 1 1 28 27 4  o 3.713000  0.2957000     3.747000  0.4563000     3.679000  0.3761000     0.6837000E-01  0.5913000 
1 1 1 28 27 5  o 7.885000  0.1755000     8.044000  0.2336000     7.726000  0.2620000     0.3173000      0.3511000 
1 1 1 28 27 6  o 3.134000  0.3301000     2.711000  0.4918000     3.557000  0.4406000     -0.8464000     0.6603000 
1 1 1 28 27 7  o 6.295000  0.1970000     6.164000  0.2645000     6.425000  0.2919000     -0.2615000     0.3939000 
1 1 1 28 27 8  f 5.896000  0.2040000     5.435000  0.2962000     6.358000  0.2805000     -0.9231000     0.4079000 
1 1 1 28 27 9  o 1.687000  0.4813000     1.863000  0.7261000     1.512000  0.6320000     0.3510000      0.9626000 
1 1 1 28 27 10 o 3.244000  0.3302000     3.495000  0.4073000     2.993000  0.5198000     0.5027000      0.6603000 
1 1 1 28 27 11 o 2.681000  0.3717000     2.037000  0.6209000     3.325000  0.4087000     -1.288000      0.7434000 
1 1 1 28 27 12 o 2.960000  0.5327000     2.949000  0.8397000     2.972000  0.6557000     -0.2256000E-01 1.065000  
1 1 1 28 27 13 o 1.855000  0.4499000     2.224000  0.6432000     1.485000  0.6294000     0.7382000      0.8999000 
1 1 1 28 27 14 o 2.888000  0.4256000     3.013000  0.5636000     2.763000  0.6380000     0.2502000      0.8513000 
1 1 1 28 27 15 o 1.817000  0.4612000     2.117000  0.6554000     1.518000  0.6491000     0.5995000      0.9224000 
1 1 1 28 27 16 o 1.920000  0.4845000     1.941000  0.6770000     1.899000  0.6933000     0.4178000E-01  0.9690000 
1 1 1 28 28 0  o 2.668000  0.5365000     2.668000  0.5365000     2.668000  0.5365000     0.000000       0.000000  
1 1 1 28 28 1  f 1.885000  0.3963000     2.341000  0.5413000     1.429000  0.5789000     0.9116000      0.7926000 
1 1 1 28 28 2  o 2.260000  0.4326000     2.378000  0.6386000     2.142000  0.5836000     0.2362000      0.8651000 
1 1 1 28 28 3  o 2.875000  0.3674000     3.691000  0.4445000     2.059000  0.5850000     1.632000       0.7348000 
1 1 1 28 28 4  o 1.650000  0.4085000     1.265000  0.5703000     2.035000  0.5850000     -0.7708000     0.8170000 
1 1 1 28 28 5  o 5.018000  0.2260000     5.163000  0.2978000     4.873000  0.3399000     0.2902000      0.4519000 
1 1 1 28 28 6  o 5.611000  0.2140000     5.775000  0.2779000     5.447000  0.3255000     0.3285000      0.4280000 
1 1 1 28 28 7  o 7.372000  0.1894000     7.554000  0.2474000     7.190000  0.2869000     0.3645000      0.3788000 
1 1 1 28 28 8  o 4.051000  0.3104000     3.738000  0.4944000     4.364000  0.3756000     -0.6266000     0.6209000 
1 1 1 28 28 9  o 2.022000  0.4526000     1.931000  0.6124000     2.114000  0.6664000     -0.1834000     0.9051000 
1 1 1 28 28 10 o 5.895000  0.2089000     6.018000  0.2828000     5.772000  0.3075000     0.2453000      0.4178000 
1 1 1 28 28 11 o 2.617000  0.3934000     2.446000  0.5804000     2.788000  0.5313000     -0.3420000     0.7868000 
1 1 1 28 28 12 o 2.523000  0.5948000     2.736000  1.001000      2.310000  0.6422000     0.4259000      1.190000  
1 1 1 28 28 13 o 3.238000  0.3848000     3.006000  0.6532000     3.470000  0.4069000     -0.4635000     0.7696000 
1 1 1 28 28 14 o 2.700000  0.4256000     3.364000  0.4886000     2.036000  0.6969000     1.328000       0.8511000 
1 1 1 28 28 15 o 1.914000  0.5380000     1.906000  0.6937000     1.922000  0.8224000     -0.1607000E-01 1.076000  
1 1 1 28 28 16 o 1.425000  0.4176000     1.010000  0.4903000     1.840000  0.6762000     -0.8296000     0.8352000 
1 1 1 28 29 0  o 0.8150000 0.5434000     0.8150000 0.5434000     0.8150000 0.5434000     0.000000       0.000000  
1 1 1 28 29 1  o 4.805000  0.2172000     4.592000  0.3124000     5.017000  0.3019000     -0.4250000     0.4344000 
1 1 1 28 29 2  o 2.854000  0.3769000     3.310000  0.5056000     2.397000  0.5591000     0.9130000      0.7538000 
1 1 1 28 29 3  o 4.579000  0.2485000     4.520000  0.3903000     4.639000  0.3075000     -0.1192000     0.4969000 
1 1 1 28 29 4  o 1.245000  0.3907000     1.222000  0.5583000     1.268000  0.5467000     -0.4595000E-01 0.7814000 
1 1 1 28 29 5  o 5.875000  0.2065000     6.039000  0.2743000     5.710000  0.3088000     0.3287000      0.4130000 
1 1 1 28 29 6  o 4.870000  0.2376000     4.978000  0.3095000     4.762000  0.3607000     0.2159000      0.4753000 
1 1 1 28 29 7  o 3.183000  0.3444000     3.376000  0.4368000     2.990000  0.5327000     0.3852000      0.6889000 
1 1 1 28 29 8  o 1.361000  0.4276000     1.157000  0.5520000     1.565000  0.6532000     -0.4090000     0.8552000 
1 1 1 28 29 9  o 3.621000  0.3099000     3.962000  0.3809000     3.281000  0.4889000     0.6810000      0.6198000 
1 1 1 28 29 10 o 2.171000  0.4191000     2.557000  0.5391000     1.786000  0.6419000     0.7717000      0.8382000 
1 1 1 28 29 11 o 4.254000  0.2953000     3.902000  0.4310000     4.605000  0.4039000     -0.7031000     0.5907000 
1 1 1 28 29 12 o 2.831000  0.3832000     2.437000  0.6488000     3.224000  0.4079000     -0.7870000     0.7664000 
1 1 1 28 29 13 o 3.254000  0.3744000     3.347000  0.6051000     3.162000  0.4413000     0.1852000      0.7489000 
1 1 1 28 29 14 o 2.218000  0.4523000     2.660000  0.6115000     1.775000  0.6666000     0.8844000      0.9046000 
1 1 1 28 29 15 o 1.216000  0.4055000     1.303000  0.5866000     1.128000  0.5601000     0.1747000      0.8110000 
1 1 1 28 29 16 o 1.476000  0.4348000     1.691000  0.6480000     1.260000  0.5798000     0.4312000      0.8695000 
1 1 1 28 30 0  o 5.545000  0.2694000     5.545000  0.2694000     5.545000  0.2694000     0.000000       0.000000  
1 1 1 28 30 1  o 3.289000  0.2949000     3.516000  0.3868000     3.063000  0.4453000     0.4530000      0.5899000 
1 1 1 28 30 2  o 1.666000  0.4401000     1.734000  0.6503000     1.597000  0.5931000     0.1376000      0.8802000 
1 1 1 28 30 3  o 4.161000  0.2692000     3.903000  0.4317000     4.420000  0.3219000     -0.5164000     0.5385000 
1 1 1 28 30 4  o 3.028000  0.3664000     3.219000  0.5434000     2.836000  0.4917000     0.3832000      0.7328000 
1 1 1 28 30 5  o 2.130000  0.3861000     2.880000  0.5120000     1.379000  0.5779000     1.501000       0.7721000 
1 1 1 28 30 6  f 4.475000  0.2562000     4.425000  0.3477000     4.525000  0.3764000     -0.9933000E-01 0.5124000 
1 1 1 28 30 7  o 6.550000  0.2260000     6.439000  0.3395000     6.661000  0.2984000     -0.2225000     0.4520000 
1 1 1 28 30 8  o 5.906000  0.2444000     6.194000  0.3511000     5.619000  0.3400000     0.5745000      0.4887000 
1 1 1 28 30 9  o 1.501000  0.4257000     1.643000  0.6130000     1.360000  0.5908000     0.2825000      0.8513000 
1 1 1 28 30 10 o 6.627000  0.2264000     6.928000  0.3077000     6.327000  0.3323000     0.6008000      0.4529000 
1 1 1 28 30 11 o 3.637000  0.4022000     3.975000  0.5400000     3.299000  0.5962000     0.6757000      0.8044000 
1 1 1 28 30 12 o 1.336000  0.3970000     1.080000  0.5017000     1.593000  0.6154000     -0.5127000     0.7940000 
1 1 1 28 30 13 o 1.780000  0.4607000     1.930000  0.7094000     1.631000  0.5881000     0.2996000      0.9215000 
1 1 1 28 30 14 f 1.554000  0.4558000     1.621000  0.6827000     1.487000  0.6041000     0.1336000      0.9116000 
1 1 1 28 30 15 o 1.445000  0.4314000     1.194000  0.5479000     1.696000  0.6666000     -0.5020000     0.8628000 
1 1 1 28 31 0  o 0.8402000 0.5574000     0.8402000 0.5574000     0.8402000 0.5574000     -0.000000      0.000000  
1 1 1 28 31 1  o 2.147000  0.4057000     1.802000  0.6016000     2.491000  0.5444000     -0.6892000     0.8114000 
1 1 1 28 31 2  o 4.944000  0.2184000     4.941000  0.3142000     4.946000  0.3035000     -0.5266000E-02 0.4368000 
1 1 1 28 31 3  o 5.983000  0.2128000     5.773000  0.3360000     6.192000  0.2611000     -0.4190000     0.4255000 
1 1 1 28 31 4  o 2.844000  0.3932000     1.975000  0.6837000     3.713000  0.3883000     -1.738000      0.7863000 
1 1 1 28 31 5  o 2.650000  0.4124000     2.033000  0.6866000     3.266000  0.4570000     -1.233000      0.8248000 
1 1 1 28 31 6  o 1.577000  0.4350000     1.440000  0.5865000     1.715000  0.6425000     -0.2751000     0.8699000 
1 1 1 28 31 7  o 1.646000  0.4518000     1.181000  0.5411000     2.111000  0.7236000     -0.9299000     0.9035000 
1 1 1 28 31 8  o 3.423000  0.3333000     3.748000  0.3921000     3.098000  0.5391000     0.6503000      0.6667000 
1 1 1 28 31 9  o 4.968000  0.2405000     4.656000  0.3368000     5.281000  0.3433000     -0.6249000     0.4809000 
1 1 1 28 31 10 o 4.909000  0.3511000     4.793000  0.3932000     5.025000  0.5817000     -0.2321000     0.7022000 
1 1 1 28 31 11 o 2.393000  0.4317000     1.952000  0.6805000     2.833000  0.5315000     -0.8812000     0.8635000 
1 1 1 28 31 12 o 2.475000  0.4133000     2.566000  0.5709000     2.384000  0.5979000     0.1827000      0.8266000 
1 1 1 28 31 13 o 2.931000  0.3391000     3.171000  0.4492000     2.691000  0.5082000     0.4802000      0.6783000 
1 1 1 28 31 14 o 1.584000  0.4916000     1.426000  0.7055000     1.742000  0.6847000     -0.3163000     0.9831000 
1 1 1 28 31 15 o 2.976000  0.4343000     3.226000  0.5591000     2.727000  0.6649000     0.4981000      0.8687000 
1 1 1 28 32 0  o 1.172000  0.6757000     1.172000  0.6757000     1.172000  0.6757000     -0.000000      0.000000  
1 1 1 28 32 1  o 3.214000  0.3099000     3.057000  0.4599000     3.371000  0.4155000     -0.3131000     0.6198000 
1 1 1 28 32 2  o 4.367000  0.2532000     4.079000  0.3742000     4.655000  0.3413000     -0.5761000     0.5065000 
1 1 1 28 32 3  o 3.297000  0.3603000     2.844000  0.6080000     3.751000  0.3868000     -0.9071000     0.7206000 
1 1 1 28 32 4  o 1.525000  0.4206000     1.241000  0.5693000     1.809000  0.6194000     -0.5685000     0.8413000 
1 1 1 28 32 5  o 2.042000  0.4365000     2.661000  0.6444000     1.423000  0.5889000     1.239000       0.8729000 
1 1 1 28 32 6  f 1.907000  0.4692000     2.311000  0.6936000     1.503000  0.6319000     0.8080000      0.9383000 
1 1 1 28 32 7  o 3.576000  0.3248000     3.838000  0.4029000     3.313000  0.5095000     0.5250000      0.6496000 
1 1 1 28 32 8  o 8.334000  0.1905000     8.445000  0.2559000     8.223000  0.2823000     0.2222000      0.3810000 
1 1 1 28 32 9  o 2.520000  0.4621000     2.932000  0.5918000     2.107000  0.7100000     0.8253000      0.9243000 
1 1 1 28 32 10 o 5.677000  0.2494000     5.593000  0.3674000     5.760000  0.3373000     -0.1677000     0.4987000 
1 1 1 28 32 11 o 3.906000  0.2973000     3.280000  0.4779000     4.531000  0.3539000     -1.251000      0.5947000 
1 1 1 28 32 12 o 1.528000  0.4180000     1.220000  0.5451000     1.837000  0.6339000     -0.6171000     0.8360000 
1 1 1 28 32 13 o 1.974000  0.4331000     2.323000  0.6054000     1.624000  0.6195000     0.6992000      0.8662000 
1 1 1 28 32 14 o 2.674000  0.4320000     1.775000  0.7028000     3.574000  0.5026000     -1.799000      0.8641000 
1 1 1 28 32 15 o 1.216000  0.4102000     1.496000  0.6861000     0.9362000 0.4499000     0.5601000      0.8204000 
1 1 1 28 33 0  o 2.118000  0.7111000     2.118000  0.7111000     2.118000  0.7111000     0.000000       0.000000  
1 1 1 28 33 1  o 2.033000  0.4307000     2.228000  0.5947000     1.837000  0.6231000     0.3907000      0.8614000 
1 1 1 28 33 2  o 2.339000  0.4181000     2.430000  0.5702000     2.248000  0.6117000     0.1829000      0.8362000 
1 1 1 28 33 3  o 1.758000  0.4493000     2.099000  0.6831000     1.417000  0.5837000     0.6816000      0.8985000 
1 1 1 28 33 4  f 6.558000  0.2111000     6.547000  0.3204000     6.570000  0.2750000     -0.2298000E-01 0.4222000 
1 1 1 28 33 5  o 1.381000  0.4251000     1.576000  0.6583000     1.187000  0.5381000     0.3889000      0.8502000 
1 1 1 28 33 6  o 1.308000  0.4168000     1.099000  0.5201000     1.518000  0.6513000     -0.4187000     0.8335000 
1 1 1 28 33 7  o 2.207000  0.3796000     3.093000  0.4816000     1.321000  0.5870000     1.772000       0.7593000 
1 1 1 28 33 8  o 2.103000  0.4747000     2.234000  0.6085000     1.973000  0.7288000     0.2616000      0.9494000 
1 1 1 28 33 9  o 5.184000  0.3318000     5.124000  0.4494000     5.244000  0.4882000     -0.1199000     0.6635000 
1 1 1 28 33 10 o 4.403000  0.2716000     4.319000  0.3753000     4.488000  0.3926000     -0.1695000     0.5431000 
1 1 1 28 33 11 o 1.158000  0.3750000     1.239000  0.5493000     1.078000  0.5107000     0.1616000      0.7500000 
1 1 1 28 33 12 o 1.134000  0.3674000     1.243000  0.5480000     1.025000  0.4896000     0.2187000      0.7348000 
1 1 1 28 33 13 o 1.055000  0.3581000     1.098000  0.5282000     1.012000  0.4837000     0.8609000E-01  0.7162000 
1 1 1 28 33 14 o 1.493000  0.4310000     1.328000  0.6104000     1.658000  0.6085000     -0.3301000     0.8619000 
1 1 1 28 34 0  o 2.075000  0.7138000     2.075000  0.7138000     2.075000  0.7138000     -0.000000      0.000000  
1 1 1 28 34 1  o 3.555000  0.3000000     3.753000  0.3954000     3.358000  0.4512000     0.3951000      0.5999000 
1 1 1 28 34 2  o 1.314000  0.4008000     1.207000  0.5409000     1.420000  0.5917000     -0.2126000     0.8017000 
1 1 1 28 34 3  o 1.743000  0.4532000     1.643000  0.6572000     1.842000  0.6242000     -0.1993000     0.9064000 
1 1 1 28 34 4  o 1.224000  0.3933000     1.164000  0.5493000     1.284000  0.5631000     -0.1193000     0.7866000 
1 1 1 28 34 5  o 1.647000  0.4881000     1.619000  0.6982000     1.676000  0.6821000     -0.5644000E-01 0.9761000 
1 1 1 28 34 6  o 1.647000  0.4581000     1.736000  0.6779000     1.559000  0.6163000     0.1776000      0.9161000 
1 1 1 28 34 7  o 2.462000  0.4457000     2.730000  0.5541000     2.194000  0.6982000     0.5356000      0.8913000 
1 1 1 28 34 8  o 1.689000  0.4802000     1.611000  0.6314000     1.767000  0.7236000     -0.1555000     0.9604000 
1 1 1 28 34 9  o 3.200000  0.3794000     2.917000  0.5962000     3.482000  0.4695000     -0.5653000     0.7589000 
1 1 1 28 34 10 o 1.074000  0.3581000     1.112000  0.5162000     1.036000  0.4964000     0.7556000E-01  0.7161000 
1 1 1 28 34 11 o 1.664000  0.4134000     2.143000  0.6196000     1.186000  0.5474000     0.9575000      0.8268000 
1 1 1 28 34 12 o 1.850000  0.4502000     1.867000  0.6329000     1.833000  0.6404000     0.3411000E-01  0.9004000 
1 1 1 28 34 13 o 1.621000  0.4362000     1.973000  0.6580000     1.270000  0.5727000     0.7032000      0.8724000 
1 1 1 28 34 14 o 1.341000  0.4015000     1.641000  0.6317000     1.041000  0.4958000     0.5992000      0.8031000 
1 1 1 28 35 0  o 3.785000  0.4053000     3.785000  0.4053000     3.785000  0.4053000     -0.000000      0.000000  
1 1 1 28 35 1  o 3.534000  0.2994000     3.376000  0.4386000     3.692000  0.4076000     -0.3168000     0.5988000 
1 1 1 28 35 2  o 3.475000  0.3226000     4.041000  0.3869000     2.909000  0.5164000     1.132000       0.6453000 
1 1 1 28 35 3  o 3.934000  0.3267000     3.981000  0.4703000     3.886000  0.4536000     0.9483000E-01  0.6534000 
1 1 1 28 35 4  o 6.243000  0.2912000     6.380000  0.4240000     6.106000  0.3992000     0.2735000      0.5824000 
1 1 1 28 35 5  o 4.801000  0.2860000     5.316000  0.3917000     4.286000  0.4169000     1.030000       0.5721000 
1 1 1 28 35 6  o 1.872000  0.4303000     1.197000  0.5606000     2.547000  0.6529000     -1.350000      0.8606000 
1 1 1 28 35 7  o 2.254000  0.4666000     2.690000  0.6126000     1.818000  0.7039000     0.8720000      0.9331000 
1 1 1 28 35 8  o 1.975000  0.4627000     1.645000  0.6558000     2.305000  0.6530000     -0.6602000     0.9254000 
1 1 1 28 35 9  o 3.006000  0.3784000     3.013000  0.5179000     3.000000  0.5518000     0.1353000E-01  0.7568000 
1 1 1 28 35 10 o 1.813000  0.4588000     1.958000  0.6472000     1.668000  0.6503000     0.2898000      0.9175000 
1 1 1 28 35 11 o 1.649000  0.4241000     2.016000  0.6251000     1.282000  0.5733000     0.7338000      0.8482000 
1 1 1 28 35 12 o 1.507000  0.4508000     1.543000  0.6622000     1.471000  0.6119000     0.7154000E-01  0.9017000 
1 1 1 28 35 13 o 1.845000  0.4665000     1.757000  0.6353000     1.933000  0.6833000     -0.1761000     0.9331000 
1 1 1 28 36 0  f 4.526000  0.4312000     4.526000  0.4312000     4.526000  0.4312000     -0.000000      0.000000  
1 1 1 28 36 1  o 4.227000  0.3197000     4.314000  0.4556000     4.141000  0.4487000     0.1724000      0.6394000 
1 1 1 28 36 2  o 1.571000  0.4872000     1.557000  0.6923000     1.585000  0.6857000     -0.2827000E-01 0.9744000 
1 1 1 28 36 3  o 2.255000  0.5295000     2.389000  0.6652000     2.120000  0.8239000     0.2688000      1.059000  
1 1 1 28 36 4  o 1.775000  0.4956000     1.871000  0.6986000     1.679000  0.7032000     0.1922000      0.9912000 
1 1 1 28 36 5  o 3.252000  0.5234000     3.330000  0.7060000     3.174000  0.7728000     0.1557000      1.047000  
1 1 1 28 36 6  o 1.498000  0.4948000     1.868000  0.8290000     1.129000  0.5405000     0.7395000      0.9897000 
1 1 1 28 36 7  o 3.783000  0.3228000     4.098000  0.4437000     3.468000  0.4689000     0.6294000      0.6455000 
1 1 1 28 36 8  o 1.913000  0.4317000     2.362000  0.6011000     1.464000  0.6197000     0.8980000      0.8633000 
1 1 1 28 36 9  o 1.302000  0.3941000     0.9174000 0.4479000     1.686000  0.6486000     -0.7684000     0.7882000 
1 1 1 28 36 10 o 1.401000  0.4149000     1.111000  0.5168000     1.691000  0.6491000     -0.5802000     0.8297000 
1 1 1 28 36 11 o 2.372000  0.4156000     2.956000  0.5026000     1.788000  0.6621000     1.168000       0.8313000 
1 1 1 28 36 12 o 1.747000  0.4964000     1.606000  0.7077000     1.889000  0.6963000     -0.2839000     0.9928000 
1 1 1 28 36 13 o 1.474000  0.4338000     1.597000  0.6310000     1.350000  0.5956000     0.2475000      0.8677000 
1 1 1 28 37 0  o 1.386000  0.8151000     1.386000  0.8151000     1.386000  0.8151000     -0.000000      0.000000  
1 1 1 28 37 1  o 3.516000  0.5337000     3.516000  0.6045000     3.517000  0.8797000     -0.1074000E-02 1.067000  
1 1 1 28 37 2  o 2.183000  0.4831000     1.395000  0.6049000     2.970000  0.7533000     -1.575000      0.9661000 
1 1 1 28 37 3  o 1.383000  0.4244000     1.125000  0.5268000     1.640000  0.6655000     -0.5150000     0.8487000 
1 1 1 28 37 4  o 1.755000  0.4957000     1.762000  0.7214000     1.748000  0.6801000     0.1339000E-01  0.9914000 
1 1 1 28 37 5  o 2.393000  0.5531000     2.454000  0.8515000     2.333000  0.7062000     0.1210000      1.106000  
1 1 1 28 37 6  o 1.860000  0.4848000     1.685000  0.7361000     2.035000  0.6310000     -0.3501000     0.9695000 
1 1 1 28 37 7  o 3.501000  0.3795000     2.992000  0.6454000     4.009000  0.3995000     -1.017000      0.7590000 
1 1 1 28 37 8  o 3.762000  0.3081000     4.198000  0.3855000     3.326000  0.4807000     0.8721000      0.6162000 
1 1 1 28 37 9  o 1.135000  0.3749000     0.9678000 0.4671000     1.302000  0.5867000     -0.3347000     0.7499000 
1 1 1 28 37 10 o 1.350000  0.4111000     1.463000  0.5956000     1.238000  0.5668000     0.2251000      0.8222000 
1 1 1 28 37 11 o 1.399000  0.4333000     1.366000  0.6152000     1.431000  0.6104000     -0.6485000E-01 0.8667000 
1 1 1 28 37 12 o 1.237000  0.3937000     1.289000  0.5692000     1.185000  0.5441000     0.1036000      0.7874000 
1 1 1 28 37 13 o 1.302000  0.4467000     1.290000  0.6322000     1.314000  0.6311000     -0.2470000E-01 0.8933000 
1 1 1 28 38 0  o 3.422000  0.5407000     3.422000  0.5407000     3.422000  0.5407000     -0.000000      0.000000  
1 1 1 28 38 1  o 3.321000  0.3701000     3.877000  0.4669000     2.764000  0.5743000     1.113000       0.7401000 
1 1 1 28 38 2  o 7.179000  0.2159000     6.748000  0.3354000     7.609000  0.2720000     -0.8613000     0.4318000 
1 1 1 28 38 3  o 3.494000  0.3530000     3.394000  0.5496000     3.593000  0.4431000     -0.1992000     0.7060000 
1 1 1 28 38 4  o 1.391000  0.4259000     1.602000  0.6600000     1.180000  0.5384000     0.4220000      0.8517000 
1 1 1 28 38 5  o 3.708000  0.3556000     3.819000  0.5456000     3.597000  0.4563000     0.2220000      0.7113000 
1 1 1 28 38 6  o 1.358000  0.4171000     1.192000  0.5615000     1.525000  0.6168000     -0.3324000     0.8341000 
1 1 1 28 38 7  o 1.491000  0.4448000     1.483000  0.6451000     1.499000  0.6125000     -0.1536000E-01 0.8896000 
1 1 1 28 38 8  f 2.075000  0.4424000     1.771000  0.6421000     2.378000  0.6087000     -0.6064000     0.8848000 
1 1 1 28 38 9  o 1.972000  0.4316000     1.472000  0.6057000     2.473000  0.6151000     -1.001000      0.8632000 
1 1 1 28 38 10 o 1.016000  0.3463000     0.9560000 0.4629000     1.077000  0.5152000     -0.1206000     0.6926000 
1 1 1 28 38 11 o 1.601000  0.4879000     1.616000  0.7090000     1.586000  0.6704000     0.2959000E-01  0.9758000 
1 1 1 28 38 12 o 1.226000  0.3935000     1.033000  0.4929000     1.418000  0.6134000     -0.3848000     0.7869000 
1 1 1 28 39 0  o 3.930000  0.4149000     3.930000  0.4149000     3.930000  0.4149000     -0.000000      0.000000  
1 1 1 28 39 1  o 2.818000  0.3926000     2.534000  0.5900000     3.102000  0.5180000     -0.5681000     0.7851000 
1 1 1 28 39 2  o 1.092000  0.3632000     1.008000  0.4828000     1.175000  0.5427000     -0.1669000     0.7263000 
1 1 1 28 39 3  o 6.073000  0.2152000     6.056000  0.2971000     6.090000  0.3114000     -0.3461000E-01 0.4305000 
1 1 1 28 39 4  o 5.004000  0.2432000     5.318000  0.3277000     4.691000  0.3595000     0.6270000      0.4865000 
1 1 1 28 39 5  o 4.266000  0.3108000     4.324000  0.4862000     4.208000  0.3871000     0.1161000      0.6215000 
1 1 1 28 39 6  o 3.170000  0.4134000     2.992000  0.6671000     3.349000  0.4882000     -0.3566000     0.8267000 
1 1 1 28 39 7  o 6.006000  0.2482000     6.064000  0.3801000     5.947000  0.3194000     0.1172000      0.4965000 
1 1 1 28 39 8  o 1.552000  0.4225000     1.186000  0.5428000     1.918000  0.6476000     -0.7316000     0.8450000 
1 1 1 28 39 9  o 1.231000  0.3848000     0.9924000 0.4769000     1.470000  0.6039000     -0.4780000     0.7695000 
1 1 1 28 39 10 f 1.372000  0.4032000     0.9384000 0.4684000     1.806000  0.6564000     -0.8679000     0.8065000 
1 1 1 28 39 11 o 1.237000  0.3979000     1.253000  0.5606000     1.221000  0.5649000     0.3242000E-01  0.7958000 
1 1 1 28 40 0  o 1.510000  0.7736000     1.510000  0.7736000     1.510000  0.7736000     0.000000       0.000000  
1 1 1 28 40 1  o 1.733000  0.4518000     1.720000  0.6384000     1.746000  0.6394000     -0.2553000E-01 0.9035000 
1 1 1 28 40 2  o 2.370000  0.4290000     1.992000  0.6365000     2.748000  0.5755000     -0.7561000     0.8581000 
1 1 1 28 40 3  o 1.566000  0.3891000     0.8709000 0.4304000     2.262000  0.6484000     -1.391000      0.7782000 
1 1 1 28 40 4  o 1.620000  0.4416000     1.402000  0.5999000     1.838000  0.6483000     -0.4353000     0.8832000 
1 1 1 28 40 5  o 3.213000  0.4117000     2.744000  0.6930000     3.681000  0.4446000     -0.9370000     0.8233000 
1 1 1 28 40 6  o 1.722000  0.4558000     1.424000  0.6362000     2.020000  0.6528000     -0.5964000     0.9115000 
1 1 1 28 40 7  o 3.442000  0.4113000     2.742000  0.7198000     4.143000  0.3982000     -1.401000      0.8226000 
1 1 1 28 40 8  o 1.572000  0.4348000     2.159000  0.7275000     0.9842000 0.4764000     1.175000       0.8696000 
1 1 1 28 40 9  o 1.237000  0.3887000     1.000000  0.4825000     1.473000  0.6095000     -0.4729000     0.7774000 
1 1 1 28 40 10 o 1.823000  0.4812000     1.945000  0.6805000     1.701000  0.6805000     0.2437000      0.9624000 
1 1 1 28 40 11 o 1.687000  0.4596000     1.818000  0.6558000     1.556000  0.6441000     0.2623000      0.9192000 
1 1 1 28 41 0  o 4.126000  0.4092000     4.126000  0.4092000     4.126000  0.4092000     -0.000000      0.000000  
1 1 1 28 41 1  o 2.001000  0.4314000     1.489000  0.6082000     2.513000  0.6121000     -1.024000      0.8629000 
1 1 1 28 41 2  o 2.030000  0.4614000     1.879000  0.6449000     2.180000  0.6600000     -0.3002000     0.9228000 
1 1 1 28 41 3  o 2.225000  0.4486000     1.859000  0.6545000     2.590000  0.6137000     -0.7315000     0.8972000 
1 1 1 28 41 4  o 4.475000  0.2730000     4.030000  0.4103000     4.920000  0.3602000     -0.8904000     0.5459000 
1 1 1 28 41 5  o 3.571000  0.3393000     3.203000  0.5240000     3.940000  0.4311000     -0.7372000     0.6785000 
1 1 1 28 41 6  o 3.308000  0.4053000     3.352000  0.6083000     3.264000  0.5358000     0.8824000E-01  0.8106000 
1 1 1 28 41 7  o 4.483000  0.3170000     4.185000  0.5169000     4.782000  0.3670000     -0.5975000     0.6340000 
1 1 1 28 41 8  o 1.235000  0.4022000     1.299000  0.5983000     1.170000  0.5376000     0.1293000      0.8044000 
1 1 1 28 41 9  o 1.730000  0.4423000     1.073000  0.5223000     2.386000  0.7140000     -1.313000      0.8846000 
1 1 1 28 41 10 o 1.256000  0.3961000     1.499000  0.6190000     1.013000  0.4944000     0.4864000      0.7922000 
1 1 1 28 42 0  o 0.8463000 0.5736000     0.8463000 0.5736000     0.8463000 0.5736000     -0.000000      0.000000  
1 1 1 28 42 1  o 1.999000  0.4464000     2.319000  0.6245000     1.678000  0.6380000     0.6415000      0.8927000 
1 1 1 28 42 2  o 4.193000  0.2911000     4.127000  0.4110000     4.258000  0.4125000     -0.1317000     0.5823000 
1 1 1 28 42 3  o 4.195000  0.2891000     4.011000  0.4172000     4.379000  0.4004000     -0.3682000     0.5783000 
1 1 1 28 42 4  o 2.647000  0.4217000     2.475000  0.6164000     2.820000  0.5757000     -0.3451000     0.8435000 
1 1 1 28 42 5  o 2.706000  0.4182000     2.452000  0.6240000     2.960000  0.5569000     -0.5076000     0.8364000 
1 1 1 28 42 6  o 2.501000  0.4823000     2.510000  0.7371000     2.492000  0.6221000     0.1867000E-01  0.9645000 
1 1 1 28 42 7  o 1.675000  0.4485000     2.188000  0.7171000     1.162000  0.5390000     1.026000       0.8971000 
1 1 1 28 42 8  o 1.329000  0.4186000     1.193000  0.5685000     1.466000  0.6145000     -0.2737000     0.8372000 
1 1 1 28 42 9  f 1.115000  0.3877000     1.254000  0.6057000     0.9751000 0.4840000     0.2793000      0.7753000 
1 1 1 28 42 10 o 1.166000  0.4022000     1.037000  0.5123000     1.295000  0.6202000     -0.2582000     0.8045000 
1 1 1 28 43 0  o 3.056000  0.6069000     3.056000  0.6069000     3.056000  0.6069000     0.000000       0.000000  
1 1 1 28 43 1  o 1.139000  0.3711000     0.9361000 0.4590000     1.342000  0.5833000     -0.4055000     0.7422000 
1 1 1 28 43 2  o 3.459000  0.3489000     3.636000  0.4576000     3.283000  0.5269000     0.3534000      0.6978000 
1 1 1 28 43 3  o 1.395000  0.4206000     1.455000  0.6042000     1.335000  0.5852000     0.1205000      0.8411000 
1 1 1 28 43 4  o 3.054000  0.3908000     3.774000  0.4474000     2.334000  0.6410000     1.439000       0.7817000 
1 1 1 28 43 5  o 1.217000  0.3911000     1.303000  0.5757000     1.132000  0.5295000     0.1712000      0.7821000 
1 1 1 28 43 6  f 2.641000  0.4742000     2.785000  0.7164000     2.496000  0.6216000     0.2890000      0.9485000 
1 1 1 28 43 7  o 2.177000  0.4941000     2.437000  0.7366000     1.916000  0.6588000     0.5206000      0.9882000 
1 1 1 28 43 8  o 1.626000  0.4929000     1.923000  0.7799000     1.330000  0.6030000     0.5933000      0.9858000 
1 1 1 28 43 9  o 1.696000  0.4719000     1.559000  0.6701000     1.832000  0.6648000     -0.2729000     0.9439000 
1 1 1 28 44 0  o 0.9085000 0.6030000     0.9085000 0.6030000     0.9085000 0.6030000     -0.000000      0.000000  
1 1 1 28 44 1  o 3.843000  0.3270000     4.325000  0.4076000     3.360000  0.5114000     0.9647000      0.6540000 
1 1 1 28 44 2  o 1.467000  0.4332000     1.479000  0.6117000     1.455000  0.6135000     0.2391000E-01  0.8663000 
1 1 1 28 44 3  o 1.435000  0.4276000     1.281000  0.5715000     1.588000  0.6363000     -0.3070000     0.8553000 
1 1 1 28 44 4  o 2.354000  0.4540000     2.347000  0.6428000     2.361000  0.6412000     -0.1424000E-01 0.9079000 
1 1 1 28 44 5  o 1.156000  0.3777000     1.046000  0.4998000     1.266000  0.5663000     -0.2208000     0.7553000 
1 1 1 28 44 6  o 1.879000  0.4403000     1.290000  0.6037000     2.468000  0.6411000     -1.178000      0.8806000 
1 1 1 28 44 7  o 1.621000  0.4713000     1.280000  0.6163000     1.961000  0.7133000     -0.6811000     0.9427000 
1 1 1 28 44 8  f 1.739000  0.4881000     1.699000  0.6926000     1.780000  0.6880000     -0.8077000E-01 0.9762000 
1 1 1 28 45 0  o 1.886000  0.8062000     1.886000  0.8062000     1.886000  0.8062000     0.000000       0.000000  
1 1 1 28 45 1  o 4.761000  0.2740000     4.403000  0.3999000     5.119000  0.3747000     -0.7163000     0.5481000 
1 1 1 28 45 2  o 3.228000  0.3825000     3.539000  0.4742000     2.918000  0.6004000     0.6204000      0.7650000 
1 1 1 28 45 3  o 2.288000  0.4527000     1.859000  0.6540000     2.718000  0.6262000     -0.8593000     0.9054000 
1 1 1 28 45 4  o 4.265000  0.3025000     4.599000  0.3942000     3.931000  0.4590000     0.6675000      0.6050000 
1 1 1 28 45 5  o 3.337000  0.4182000     2.904000  0.6902000     3.769000  0.4725000     -0.8645000     0.8365000 
1 1 1 28 45 6  o 1.402000  0.4559000     1.398000  0.6570000     1.407000  0.6324000     -0.9803000E-02 0.9118000 
1 1 1 28 45 7  o 1.397000  0.4228000     0.9536000 0.4768000     1.841000  0.6984000     -0.8872000     0.8456000 
1 1 1 28 46 0  o 1.018000  0.6532000     1.018000  0.6532000     1.018000  0.6532000     -0.000000      0.000000  
1 1 1 28 46 1  o 2.555000  0.4450000     2.905000  0.5782000     2.205000  0.6766000     0.6997000      0.8900000 
1 1 1 28 46 2  o 1.797000  0.4577000     2.061000  0.6586000     1.534000  0.6358000     0.5279000      0.9154000 
1 1 1 28 46 3  o 1.175000  0.3851000     0.9877000 0.4799000     1.363000  0.6024000     -0.3749000     0.7702000 
1 1 1 28 46 4  o 2.560000  0.4738000     2.176000  0.7262000     2.945000  0.6086000     -0.7684000     0.9475000 
1 1 1 28 46 5  o 3.633000  0.3971000     3.946000  0.5233000     3.320000  0.5975000     0.6255000      0.7943000 
1 1 1 28 46 6  o 2.153000  0.4720000     1.580000  0.6452000     2.726000  0.6891000     -1.146000      0.9440000 
1 1 1 28 47 0  o 1.462000  0.7889000     1.462000  0.7889000     1.462000  0.7889000     0.000000       0.000000  
1 1 1 28 47 1  o 1.284000  0.4086000     1.345000  0.5926000     1.223000  0.5627000     0.1227000      0.8172000 
1 1 1 28 47 2  o 1.491000  0.4522000     1.444000  0.6406000     1.538000  0.6384000     -0.9443000E-01 0.9044000 
1 1 1 28 47 3  o 1.732000  0.4915000     1.687000  0.6938000     1.778000  0.6963000     -0.9077000E-01 0.9829000 
1 1 1 28 47 4  o 1.544000  0.4658000     1.707000  0.6940000     1.381000  0.6216000     0.3263000      0.9317000 
1 1 1 28 47 5  o 1.061000  0.5208000     1.061000  0.5208000     ?         ?             ?              ?         
1 1 1 28 48 0  o 2.807000  0.9028000     2.807000  0.9028000     2.807000  0.9028000     0.000000       0.000000  
1 1 1 28 48 1  o 1.502000  0.4859000     1.449000  0.6718000     1.556000  0.7022000     -0.1069000     0.9718000 
1 1 1 28 48 2  o 3.941000  0.4464000     3.585000  0.6137000     4.297000  0.6483000     -0.7121000     0.8927000 
1 1 1 28 48 3  o 1.173000  0.5895000     1.173000  0.5895000     ?         ?             ?              ?         
1 1 1 29 0  3  o 10.67000  0.2241000     10.67000  0.2241000     10.67000  0.2241000     -0.000000      0.000000  
1 1 1 29 0  4  o 17.02000  0.4089000     17.02000  0.4089000     17.02000  0.4089000     0.000000       0.000000  
1 1 1 29 0  5  o 4.607000  0.1471000     4.607000  0.1471000     4.607000  0.1471000     0.000000       0.000000  
1 1 1 29 0  6  o 6.248000  0.1862000     6.248000  0.1862000     6.248000  0.1862000     0.000000       0.000000  
1 1 1 29 0  7  o 2.575000  0.4107000     2.575000  0.4107000     2.575000  0.4107000     -0.000000      0.000000  
1 1 1 29 0  8  o 7.850000  0.2091000     7.850000  0.2091000     7.850000  0.2091000     -0.000000      0.000000  
1 1 1 29 0  9  o 5.181000  0.4184000     5.181000  0.4184000     5.181000  0.4184000     0.000000       0.000000  
1 1 1 29 0  10 o 3.942000  0.4628000     3.942000  0.4628000     3.942000  0.4628000     0.000000       0.000000  
1 1 1 29 0  11 o 1.002000  0.6511000     1.002000  0.6511000     1.002000  0.6511000     0.000000       0.000000  
1 1 1 29 0  12 o 1.596000  0.9008000     1.596000  0.9008000     1.596000  0.9008000     0.000000       0.000000  
1 1 1 29 0  13 o 1.139000  0.7377000     1.139000  0.7377000     1.139000  0.7377000     0.000000       0.000000  
1 1 1 29 0  14 o 1.886000  0.9038000     1.886000  0.9038000     1.886000  0.9038000     0.000000       0.000000  
1 1 1 29 0  15 o 0.7743000 0.5531000     0.7743000 0.5531000     0.7743000 0.5531000     0.000000       0.000000  
1 1 1 29 0  16 o 1.693000  0.8921000     1.693000  0.8921000     1.693000  0.8921000     0.000000       0.000000  
1 1 1 29 0  17 o 0.8232000 0.5894000     0.8232000 0.5894000     0.8232000 0.5894000     0.000000       0.000000  
1 1 1 29 0  18 o 0.8472000 0.5968000     0.8472000 0.5968000     0.8472000 0.5968000     0.000000       0.000000  
1 1 1 29 0  19 o 1.393000  0.8330000     1.393000  0.8330000     1.393000  0.8330000     0.000000       0.000000  
1 1 1 29 1  2  o 4.239000  0.1431000     4.429000  0.1890000     4.050000  0.2149000     0.3786000      0.2861000 
1 1 1 29 1  3  o 7.327000  0.1532000     7.293000  0.2135000     7.361000  0.2198000     -0.6865000E-01 0.3064000 
1 1 1 29 1  4  o 4.323000  0.2602000     4.366000  0.3477000     4.280000  0.3873000     0.8645000E-01  0.5205000 
1 1 1 29 1  5  o 1.458000  0.2492000     1.072000  0.3989000     1.845000  0.2987000     -0.7732000     0.4984000 
1 1 1 29 1  6  o 4.557000  0.1436000     4.495000  0.2206000     4.618000  0.1838000     -0.1227000     0.2871000 
1 1 1 29 1  7  o 6.147000  0.1480000     6.350000  0.2088000     5.943000  0.2097000     0.4067000      0.2959000 
1 1 1 29 1  8  o 6.883000  0.1993000     6.980000  0.1968000     6.786000  0.3466000     0.1946000      0.3985000 
1 1 1 29 1  9  o 5.781000  0.2998000     5.423000  0.2698000     6.139000  0.5355000     -0.7162000     0.5996000 
1 1 1 29 1  10 o 1.694000  0.4657000     1.539000  0.6459000     1.849000  0.6711000     -0.3098000     0.9314000 
1 1 1 29 1  11 o 2.709000  0.4332000     3.032000  0.5216000     2.386000  0.6919000     0.6457000      0.8665000 
1 1 1 29 1  12 o 3.884000  0.4617000     4.310000  0.5735000     3.457000  0.7236000     0.8533000      0.9233000 
1 1 1 29 1  13 o 3.541000  0.4256000     3.844000  0.5618000     3.238000  0.6396000     0.6067000      0.8513000 
1 1 1 29 1  14 o 1.663000  0.4767000     1.236000  0.5879000     2.090000  0.7506000     -0.8539000     0.9534000 
1 1 1 29 1  15 o 1.786000  0.4998000     2.247000  0.7773000     1.325000  0.6286000     0.9219000      0.9997000 
1 1 1 29 1  16 o 1.956000  0.5110000     2.386000  0.7740000     1.526000  0.6674000     0.8603000      1.022000  
1 1 1 29 1  17 o 1.392000  0.4623000     1.636000  0.7327000     1.147000  0.5640000     0.4899000      0.9246000 
1 1 1 29 1  18 o 1.778000  0.4806000     2.364000  0.7722000     1.192000  0.5723000     1.172000       0.9611000 
1 1 1 29 1  19 o 1.430000  0.4588000     1.262000  0.6012000     1.598000  0.6933000     -0.3356000     0.9176000 
1 1 1 29 2  2  f 4.291000  0.1501000     3.914000  0.2173000     4.668000  0.2072000     -0.7539000     0.3003000 
1 1 1 29 2  3  o 4.654000  0.1784000     4.457000  0.2490000     4.851000  0.2556000     -0.3943000     0.3568000 
1 1 1 29 2  4  o 6.413000  0.2700000     ?         ?             6.413000  0.2700000     ?              ?         
1 1 1 29 2  5  o 4.977000  0.1097000     5.028000  0.1652000     4.927000  0.1444000     0.1011000      0.2194000 
1 1 1 29 2  6  o 3.827000  0.1635000     3.758000  0.2517000     3.896000  0.2088000     -0.1380000     0.3270000 
1 1 1 29 2  7  o 5.924000  0.1705000     6.142000  0.2112000     5.706000  0.2677000     0.4357000      0.3410000 
1 1 1 29 2  8  o 6.577000  0.2001000     6.860000  0.2066000     6.294000  0.3428000     0.5661000      0.4003000 
1 1 1 29 2  9  o 2.843000  0.4722000     3.418000  0.3774000     2.268000  0.8657000     1.150000       0.9443000 
1 1 1 29 2  10 o 3.246000  0.4138000     3.561000  0.3610000     2.931000  0.7448000     0.6307000      0.8277000 
1 1 1 29 2  11 o 3.128000  0.3838000     3.055000  0.5286000     3.202000  0.5565000     -0.1470000     0.7676000 
1 1 1 29 2  12 o 2.214000  0.5659000     2.085000  0.7838000     2.342000  0.8165000     -0.2568000     1.132000  
1 1 1 29 2  13 o 1.850000  0.5074000     1.867000  0.7266000     1.834000  0.7085000     0.3326000E-01  1.015000  
1 1 1 29 2  14 o 1.497000  0.4668000     1.443000  0.6505000     1.550000  0.6696000     -0.1070000     0.9336000 
1 1 1 29 2  15 o 2.548000  0.4616000     1.662000  0.7131000     3.434000  0.5863000     -1.773000      0.9232000 
1 1 1 29 2  16 o 1.596000  0.4834000     1.498000  0.6689000     1.694000  0.6980000     -0.1965000     0.9668000 
1 1 1 29 2  17 o 1.368000  0.4575000     1.314000  0.6316000     1.421000  0.6619000     -0.1061000     0.9149000 
1 1 1 29 2  18 o 1.301000  0.4339000     1.430000  0.6588000     1.171000  0.5648000     0.2590000      0.8678000 
1 1 1 29 2  19 f 1.296000  0.4322000     1.355000  0.6343000     1.237000  0.5871000     0.1186000      0.8643000 
1 1 1 29 3  2  o 8.921000  0.1356000     8.722000  0.1807000     9.120000  0.2022000     -0.3982000     0.2712000 
1 1 1 29 3  3  o 12.82000  0.2125000     12.99000  0.3696000     12.64000  0.2097000     0.3515000      0.4250000 
1 1 1 29 3  4  o 4.591000  0.3374000     ?         ?             4.591000  0.3374000     ?              ?         
1 1 1 29 3  5  o 9.037000  0.1108000     9.088000  0.1725000     8.986000  0.1391000     0.1014000      0.2216000 
1 1 1 29 3  6  o 6.225000  0.1682000     6.233000  0.1839000     6.217000  0.2816000     0.1603000E-01  0.3363000 
1 1 1 29 3  7  o 5.953000  0.1652000     5.940000  0.2092000     5.966000  0.2558000     -0.2555000E-01 0.3305000 
1 1 1 29 3  8  o 3.471000  0.2708000     3.240000  0.3657000     3.702000  0.3996000     -0.4615000     0.5417000 
1 1 1 29 3  9  o 3.806000  0.4170000     3.930000  0.3571000     3.681000  0.7537000     0.2489000      0.8340000 
1 1 1 29 3  10 o 2.976000  0.4218000     3.453000  0.3560000     2.499000  0.7649000     0.9543000      0.8437000 
1 1 1 29 3  11 o 4.182000  0.3362000     4.402000  0.3244000     3.961000  0.5890000     0.4407000      0.6724000 
1 1 1 29 3  12 o 2.558000  0.5031000     1.440000  0.6682000     3.676000  0.7523000     -2.236000      1.006000  
1 1 1 29 3  13 o 2.230000  0.4934000     2.819000  0.7196000     1.640000  0.6752000     1.179000       0.9867000 
1 1 1 29 3  14 o 1.741000  0.4643000     2.417000  0.7696000     1.065000  0.5198000     1.353000       0.9287000 
1 1 1 29 3  15 f 1.384000  0.4462000     1.411000  0.6442000     1.357000  0.6176000     0.5460000E-01  0.8924000 
1 1 1 29 3  16 o 1.127000  0.3858000     1.166000  0.5609000     1.087000  0.5299000     0.7906000E-01  0.7717000 
1 1 1 29 3  17 o 1.475000  0.4812000     1.403000  0.6591000     1.547000  0.7012000     -0.1439000     0.9624000 
1 1 1 29 3  18 o 1.477000  0.4458000     1.988000  0.7509000     0.9666000 0.4806000     1.022000       0.8916000 
1 1 1 29 3  19 o 1.320000  0.4363000     1.385000  0.6411000     1.254000  0.5919000     0.1315000      0.8725000 
1 1 1 29 4  1  o 6.414000  0.1662000     ?         ?             6.414000  0.1662000     ?              ?         
1 1 1 29 4  2  o 5.799000  0.1659000     5.954000  0.2674000     5.644000  0.1963000     0.3109000      0.3317000 
1 1 1 29 4  3  o 4.527000  0.2642000     4.288000  0.4643000     4.765000  0.2520000     -0.4768000     0.5283000 
1 1 1 29 4  5  o 2.692000  0.2098000     2.621000  0.2685000     2.763000  0.3225000     -0.1420000     0.4196000 
1 1 1 29 4  6  o 9.207000  0.1323000     9.219000  0.1794000     9.195000  0.1944000     0.2394000E-01  0.2645000 
1 1 1 29 4  7  o 9.157000  0.1596000     9.030000  0.1921000     9.285000  0.2549000     -0.2553000     0.3192000 
1 1 1 29 4  8  o 7.706000  0.1617000     7.740000  0.2148000     7.671000  0.2417000     0.6894000E-01  0.3234000 
1 1 1 29 4  9  o 2.184000  0.4779000     2.370000  0.5603000     1.998000  0.7744000     0.3721000      0.9559000 
1 1 1 29 4  10 o 2.447000  0.4588000     2.436000  0.5175000     2.457000  0.7576000     -0.2050000E-01 0.9175000 
1 1 1 29 4  11 o 5.050000  0.2841000     5.249000  0.2891000     4.852000  0.4892000     0.3970000      0.5682000 
1 1 1 29 4  12 o 1.972000  0.5334000     1.414000  0.6010000     2.530000  0.8815000     -1.116000      1.067000  
1 1 1 29 4  13 o 1.569000  0.4989000     1.170000  0.5651000     1.969000  0.8224000     -0.7989000     0.9978000 
1 1 1 29 4  14 o 2.262000  0.5249000     2.383000  0.7546000     2.140000  0.7297000     0.2430000      1.050000  
1 1 1 29 4  15 f 2.047000  0.5092000     2.445000  0.7585000     1.650000  0.6795000     0.7958000      1.018000  
1 1 1 29 4  16 o 1.806000  0.5078000     1.709000  0.7121000     1.903000  0.7242000     -0.1942000     1.016000  
1 1 1 29 4  17 o 1.493000  0.5088000     1.762000  0.8301000     1.225000  0.5886000     0.5374000      1.018000  
1 1 1 29 4  18 o 1.328000  0.4335000     1.432000  0.6490000     1.223000  0.5749000     0.2086000      0.8670000 
1 1 1 29 4  19 o 1.388000  0.4512000     1.422000  0.6511000     1.354000  0.6249000     0.6792000E-01  0.9025000 
1 1 1 29 5  1  o 3.362000  0.1679000     3.270000  0.2366000     3.453000  0.2383000     -0.1826000     0.3358000 
1 1 1 29 5  2  o 9.312000  0.1678000     9.446000  0.2809000     9.179000  0.1836000     0.2672000      0.3356000 
1 1 1 29 5  3  o 8.619000  0.2002000     8.362000  0.3461000     8.876000  0.2012000     -0.5139000     0.4004000 
1 1 1 29 5  4  o 9.831000  0.1468000     9.728000  0.1982000     9.934000  0.2167000     -0.2065000     0.2936000 
1 1 1 29 5  5  o 4.604000  0.1466000     4.597000  0.1932000     4.611000  0.2207000     -0.1431000E-01 0.2933000 
1 1 1 29 5  6  o 7.486000  0.1393000     7.383000  0.1916000     7.588000  0.2022000     -0.2058000     0.2786000 
1 1 1 29 5  7  o 4.447000  0.2363000     4.204000  0.2940000     4.690000  0.3700000     -0.4860000     0.4726000 
1 1 1 29 5  8  o 5.675000  0.1860000     5.432000  0.2486000     5.918000  0.2766000     -0.4859000     0.3719000 
1 1 1 29 5  9  o 2.066000  0.4925000     1.688000  0.5854000     2.444000  0.7922000     -0.7561000     0.9850000 
1 1 1 29 5  10 o 5.333000  0.2159000     5.107000  0.2918000     5.560000  0.3182000     -0.4526000     0.4317000 
1 1 1 29 5  11 o 1.974000  0.4887000     1.435000  0.5780000     2.512000  0.7882000     -1.078000      0.9775000 
1 1 1 29 5  12 o 4.605000  0.3772000     4.018000  0.4946000     5.193000  0.5695000     -1.175000      0.7543000 
1 1 1 29 5  13 o 2.349000  0.5255000     2.349000  0.5810000     2.350000  0.8758000     -0.9704000E-03 1.051000  
1 1 1 29 5  14 o 2.000000  0.4988000     2.194000  0.6081000     1.806000  0.7908000     0.3879000      0.9976000 
1 1 1 29 5  15 o 1.339000  0.4349000     1.339000  0.6207000     1.339000  0.6095000     -0.5832000E-03 0.8699000 
1 1 1 29 5  16 o 2.905000  0.4831000     3.263000  0.6509000     2.548000  0.7141000     0.7143000      0.9662000 
1 1 1 29 5  17 o 1.908000  0.6194000     1.682000  0.8075000     2.134000  0.9394000     -0.4513000     1.239000  
1 1 1 29 5  18 o 1.608000  0.4764000     1.412000  0.6418000     1.805000  0.7042000     -0.3926000     0.9527000 
1 1 1 29 5  19 o 1.076000  0.3740000     1.270000  0.6006000     0.8826000 0.4459000     0.3869000      0.7481000 
1 1 1 29 6  1  o 12.09000  0.1760000     12.17000  0.2969000     12.02000  0.1892000     0.1560000      0.3520000 
1 1 1 29 6  2  o 1.993000  0.3833000     2.133000  0.5764000     1.853000  0.5052000     0.2796000      0.7665000 
1 1 1 29 6  3  o 5.497000  0.2362000     5.313000  0.4092000     5.680000  0.2362000     -0.3669000     0.4725000 
1 1 1 29 6  4  o 10.61000  0.1232000     10.57000  0.1588000     10.66000  0.1883000     -0.9478000E-01 0.2464000 
1 1 1 29 6  5  o 8.000000  0.1254000     7.914000  0.1699000     8.087000  0.1846000     -0.1736000     0.2509000 
1 1 1 29 6  6  o 3.714000  0.2053000     3.456000  0.2855000     3.971000  0.2950000     -0.5149000     0.4105000 
1 1 1 29 6  7  o 2.300000  0.4464000     1.645000  0.7767000     2.955000  0.4402000     -1.311000      0.8927000 
1 1 1 29 6  8  o 3.583000  0.2597000     3.484000  0.3339000     3.681000  0.3979000     -0.1968000     0.5195000 
1 1 1 29 6  9  o 2.137000  0.4500000     2.460000  0.5121000     1.813000  0.7401000     0.6465000      0.9000000 
1 1 1 29 6  10 o 2.223000  0.4376000     2.306000  0.5786000     2.140000  0.6566000     0.1664000      0.8751000 
1 1 1 29 6  11 o 5.910000  0.2217000     6.506000  0.2779000     5.315000  0.3456000     1.191000       0.4434000 
1 1 1 29 6  12 o 3.358000  0.6812000     3.717000  1.071000      3.000000  0.8421000     0.7166000      1.362000  
1 1 1 29 6  13 f 3.699000  0.4479000     3.724000  0.4054000     3.675000  0.7988000     0.4898000E-01  0.8958000 
1 1 1 29 6  14 o 2.967000  0.4471000     4.012000  0.3725000     1.922000  0.8130000     2.090000       0.8943000 
1 1 1 29 6  15 o 2.983000  0.4653000     3.772000  0.3962000     2.195000  0.8420000     1.577000       0.9306000 
1 1 1 29 6  16 o 2.263000  0.5302000     2.713000  0.7206000     1.813000  0.7778000     0.9005000      1.060000  
1 1 1 29 6  17 o 1.448000  0.4980000     1.574000  0.7629000     1.322000  0.6403000     0.2524000      0.9959000 
1 1 1 29 6  18 o 1.366000  0.4394000     1.245000  0.5929000     1.488000  0.6486000     -0.2434000     0.8788000 
1 1 1 29 6  19 o 1.281000  0.4245000     1.308000  0.6119000     1.253000  0.5887000     0.5424000E-01  0.8491000 
1 1 1 29 7  0  o 0.6102000 0.4196000     0.6102000 0.4196000     0.6102000 0.4196000     0.000000       0.000000  
1 1 1 29 7  1  o 6.248000  0.1617000     5.940000  0.2444000     6.556000  0.2118000     -0.6168000     0.3234000 
1 1 1 29 7  2  o 7.592000  0.1624000     7.426000  0.2915000     7.758000  0.1430000     -0.3322000     0.3247000 
1 1 1 29 7  3  o 8.669000  0.1053000     8.435000  0.1384000     8.904000  0.1587000     -0.4686000     0.2106000 
1 1 1 29 7  4  o 3.104000  0.1823000     3.349000  0.2262000     2.858000  0.2860000     0.4917000      0.3646000 
1 1 1 29 7  5  f 5.331000  0.1450000     5.269000  0.1935000     5.394000  0.2159000     -0.1249000     0.2899000 
1 1 1 29 7  6  o 5.012000  0.1676000     4.864000  0.2280000     5.159000  0.2458000     -0.2954000     0.3352000 
1 1 1 29 7  7  o 2.744000  0.3993000     1.690000  0.7165000     3.797000  0.3528000     -2.107000      0.7987000 
1 1 1 29 7  8  o 1.901000  0.4090000     2.111000  0.5278000     1.690000  0.6250000     0.4204000      0.8181000 
1 1 1 29 7  9  f 1.964000  0.3937000     2.508000  0.4932000     1.420000  0.6138000     1.088000       0.7874000 
1 1 1 29 7  10 o 3.138000  0.3481000     2.806000  0.5070000     3.470000  0.4771000     -0.6640000     0.6962000 
1 1 1 29 7  11 o 2.007000  0.4513000     2.261000  0.6200000     1.752000  0.6559000     0.5085000      0.9025000 
1 1 1 29 7  12 o 2.351000  0.6131000     3.496000  1.095000      1.207000  0.5520000     2.288000       1.226000  
1 1 1 29 7  13 o 1.660000  0.4420000     1.838000  0.6297000     1.483000  0.6205000     0.3549000      0.8840000 
1 1 1 29 7  14 f 1.225000  0.4110000     1.127000  0.5167000     1.322000  0.6393000     -0.1949000     0.8220000 
1 1 1 29 7  15 o 1.837000  0.5128000     1.609000  0.6080000     2.065000  0.8259000     -0.4558000     1.026000  
1 1 1 29 7  16 o 1.968000  0.5186000     1.867000  0.6290000     2.070000  0.8246000     -0.2031000     1.037000  
1 1 1 29 7  17 o 1.470000  0.4830000     1.755000  0.7698000     1.185000  0.5836000     0.5696000      0.9660000 
1 1 1 29 7  18 o 1.594000  0.4741000     1.341000  0.6232000     1.847000  0.7145000     -0.5058000     0.9481000 
1 1 1 29 7  19 o 1.407000  0.4444000     1.742000  0.7187000     1.071000  0.5228000     0.6705000      0.8888000 
1 1 1 29 8  0  o 7.923000  0.1771000     7.923000  0.1771000     7.923000  0.1771000     0.000000       0.000000  
1 1 1 29 8  1  o 11.61000  0.1127000     11.61000  0.1579000     11.62000  0.1609000     -0.1080000E-01 0.2254000 
1 1 1 29 8  2  o 5.919000  0.1117000     5.663000  0.1579000     6.174000  0.1580000     -0.5105000     0.2234000 
1 1 1 29 8  3  o 5.202000  0.1372000     5.040000  0.2024000     5.365000  0.1854000     -0.3245000     0.2745000 
1 1 1 29 8  4  o 7.599000  0.1220000     7.574000  0.1687000     7.625000  0.1762000     -0.5165000E-01 0.2439000 
1 1 1 29 8  5  o 3.364000  0.2042000     3.147000  0.2929000     3.582000  0.2847000     -0.4347000     0.4085000 
1 1 1 29 8  6  o 5.438000  0.1875000     5.012000  0.2286000     5.865000  0.2974000     -0.8534000     0.3751000 
1 1 1 29 8  7  o 5.328000  0.2420000     4.798000  0.4110000     5.858000  0.2558000     -1.061000      0.4841000 
1 1 1 29 8  8  o 4.208000  0.2331000     3.945000  0.3186000     4.470000  0.3402000     -0.5253000     0.4661000 
1 1 1 29 8  9  o 2.601000  0.3781000     3.162000  0.3964000     2.040000  0.6439000     1.122000       0.7561000 
1 1 1 29 8  10 o 1.332000  0.4081000     1.230000  0.5380000     1.434000  0.6137000     -0.2043000     0.8161000 
1 1 1 29 8  11 o 5.133000  0.2363000     5.103000  0.3058000     5.163000  0.3602000     -0.6009000E-01 0.4725000 
1 1 1 29 8  12 o 3.277000  0.4905000     2.606000  0.8842000     3.949000  0.4250000     -1.343000      0.9811000 
1 1 1 29 8  13 o 2.852000  0.3925000     2.910000  0.5123000     2.794000  0.5949000     0.1157000      0.7851000 
1 1 1 29 8  14 o 1.362000  0.4168000     1.421000  0.5878000     1.303000  0.5912000     0.1179000      0.8337000 
1 1 1 29 8  15 o 1.531000  0.4786000     1.219000  0.5391000     1.842000  0.7909000     -0.6221000     0.9572000 
1 1 1 29 8  16 o 2.103000  0.4427000     2.711000  0.5440000     1.495000  0.6986000     1.216000       0.8855000 
1 1 1 29 8  17 o 1.865000  0.5575000     1.768000  0.7691000     1.962000  0.8073000     -0.1942000     1.115000  
1 1 1 29 8  18 o 1.294000  0.4332000     1.063000  0.5028000     1.526000  0.7057000     -0.4633000     0.8665000 
1 1 1 29 8  19 o 1.150000  0.3981000     1.006000  0.4848000     1.295000  0.6315000     -0.2884000     0.7962000 
1 1 1 29 9  0  o 17.91000  0.2138000     17.91000  0.2138000     17.91000  0.2138000     0.000000       0.000000  
1 1 1 29 9  1  o 4.512000  0.1404000     4.419000  0.2406000     4.605000  0.1446000     -0.1865000     0.2807000 
1 1 1 29 9  2  o 8.965000  0.1187000     9.252000  0.1751000     8.677000  0.1602000     0.5743000      0.2373000 
1 1 1 29 9  3  o 4.037000  0.1890000     3.981000  0.2558000     4.092000  0.2784000     -0.1103000     0.3781000 
1 1 1 29 9  4  o 2.226000  0.2923000     2.145000  0.4193000     2.307000  0.4074000     -0.1622000     0.5846000 
1 1 1 29 9  5  o 4.804000  0.1632000     4.607000  0.2304000     5.001000  0.2314000     -0.3939000     0.3265000 
1 1 1 29 9  6  o 2.184000  0.4047000     1.854000  0.5691000     2.515000  0.5754000     -0.6606000     0.8093000 
1 1 1 29 9  7  o 2.414000  0.3516000     2.610000  0.4423000     2.218000  0.5466000     0.3918000      0.7031000 
1 1 1 29 9  8  o 6.438000  0.2256000     6.534000  0.2392000     6.342000  0.3827000     0.1921000      0.4513000 
1 1 1 29 9  9  o 3.134000  0.3410000     2.518000  0.5404000     3.749000  0.4161000     -1.231000      0.6821000 
1 1 1 29 9  10 o 1.884000  0.4334000     1.387000  0.5722000     2.381000  0.6510000     -0.9942000     0.8667000 
1 1 1 29 9  11 o 1.269000  0.4045000     1.184000  0.5425000     1.353000  0.6002000     -0.1688000     0.8090000 
1 1 1 29 9  12 o 2.893000  0.4605000     2.445000  0.7778000     3.342000  0.4932000     -0.8969000     0.9210000 
1 1 1 29 9  13 o 2.152000  0.4480000     1.912000  0.6331000     2.392000  0.6339000     -0.4797000     0.8959000 
1 1 1 29 9  14 o 1.766000  0.4536000     1.892000  0.6232000     1.641000  0.6592000     0.2509000      0.9072000 
1 1 1 29 9  15 o 1.833000  0.4527000     1.417000  0.5872000     2.248000  0.6891000     -0.8312000     0.9053000 
1 1 1 29 9  16 o 4.470000  0.2832000     4.458000  0.3582000     4.481000  0.4386000     -0.2333000E-01 0.5663000 
1 1 1 29 9  17 o 1.670000  0.5264000     1.626000  0.7291000     1.714000  0.7596000     -0.8856000E-01 1.053000  
1 1 1 29 9  18 o 1.446000  0.4711000     1.386000  0.5917000     1.506000  0.7332000     -0.1195000     0.9422000 
1 1 1 29 9  19 o 1.351000  0.4709000     1.038000  0.5009000     1.665000  0.7975000     -0.6271000     0.9418000 
1 1 1 29 10 0  o 12.61000  0.1663000     12.61000  0.1663000     12.61000  0.1663000     0.000000       0.000000  
1 1 1 29 10 1  o 11.40000  0.1191000     11.26000  0.1868000     11.53000  0.1478000     -0.2772000     0.2382000 
1 1 1 29 10 2  o 12.23000  0.1295000     12.21000  0.1973000     12.25000  0.1678000     -0.3978000E-01 0.2590000 
1 1 1 29 10 3  o 7.723000  0.1288000     7.424000  0.1713000     8.022000  0.1925000     -0.5984000     0.2577000 
1 1 1 29 10 4  o 3.215000  0.2154000     3.125000  0.3079000     3.304000  0.3013000     -0.1790000     0.4308000 
1 1 1 29 10 5  o 2.013000  0.3349000     2.456000  0.4017000     1.571000  0.5360000     0.8847000      0.6698000 
1 1 1 29 10 6  o 4.900000  0.3851000     4.426000  0.7301000     5.373000  0.2452000     -0.9466000     0.7702000 
1 1 1 29 10 7  o 1.377000  0.3802000     1.604000  0.5609000     1.150000  0.5134000     0.4541000      0.7604000 
1 1 1 29 10 8  o 3.068000  0.4019000     2.925000  0.4628000     3.212000  0.6573000     -0.2869000     0.8039000 
1 1 1 29 10 9  o 4.249000  0.2511000     3.696000  0.3746000     4.801000  0.3344000     -1.105000      0.5021000 
1 1 1 29 10 10 o 2.543000  0.3580000     3.759000  0.4092000     1.326000  0.5875000     2.433000       0.7160000 
1 1 1 29 10 11 o 1.413000  0.4210000     1.598000  0.6094000     1.228000  0.5809000     0.3698000      0.8419000 
1 1 1 29 10 12 o 2.083000  0.3918000     2.859000  0.5200000     1.307000  0.5861000     1.552000       0.7835000 
1 1 1 29 10 13 f 3.785000  0.3255000     3.929000  0.4004000     3.641000  0.5134000     0.2882000      0.6511000 
1 1 1 29 10 14 o 2.237000  0.4298000     2.717000  0.5634000     1.757000  0.6493000     0.9608000      0.8596000 
1 1 1 29 10 15 o 1.518000  0.4218000     1.796000  0.6189000     1.241000  0.5733000     0.5550000      0.8436000 
1 1 1 29 10 16 o 1.676000  0.4542000     1.524000  0.5976000     1.828000  0.6843000     -0.3043000     0.9085000 
1 1 1 29 10 17 o 1.427000  0.4293000     1.499000  0.6103000     1.355000  0.6039000     0.1440000      0.8585000 
1 1 1 29 10 18 o 1.818000  0.4430000     2.292000  0.6479000     1.345000  0.6045000     0.9463000      0.8861000 
1 1 1 29 10 19 o 1.077000  0.5379000     1.077000  0.5379000     ?         ?             ?              ?         
1 1 1 29 11 0  o 1.356000  0.5342000     1.356000  0.5342000     1.356000  0.5342000     -0.000000      0.000000  
1 1 1 29 11 1  o 4.460000  0.1313000     4.363000  0.1947000     4.557000  0.1764000     -0.1942000     0.2627000 
1 1 1 29 11 2  o 5.542000  0.1610000     5.317000  0.2657000     5.768000  0.1820000     -0.4516000     0.3220000 
1 1 1 29 11 3  o 4.695000  0.1494000     4.455000  0.2420000     4.936000  0.1752000     -0.4816000     0.2988000 
1 1 1 29 11 4  o 5.028000  0.1613000     4.701000  0.2372000     5.355000  0.2187000     -0.6536000     0.3226000 
1 1 1 29 11 5  o 7.596000  0.1670000     7.802000  0.1998000     7.389000  0.2677000     0.4128000      0.3340000 
1 1 1 29 11 6  o 10.35000  0.1692000     10.37000  0.2682000     10.33000  0.2063000     0.4410000E-01  0.3383000 
1 1 1 29 11 7  o 4.434000  0.2192000     4.136000  0.3095000     4.732000  0.3105000     -0.5959000     0.4384000 
1 1 1 29 11 8  o 1.787000  0.4820000     1.175000  0.5208000     2.398000  0.8112000     -1.223000      0.9640000 
1 1 1 29 11 9  o 3.524000  0.2917000     3.298000  0.4116000     3.751000  0.4133000     -0.4530000     0.5834000 
1 1 1 29 11 10 o 3.518000  0.3223000     3.800000  0.4121000     3.235000  0.4956000     0.5652000      0.6446000 
1 1 1 29 11 11 o 2.452000  0.4791000     2.580000  0.6322000     2.323000  0.7202000     0.2570000      0.9583000 
1 1 1 29 11 12 o 3.566000  0.3190000     3.592000  0.4253000     3.540000  0.4756000     0.5199000E-01  0.6380000 
1 1 1 29 11 13 o 1.696000  0.4705000     1.702000  0.6476000     1.689000  0.6826000     0.1391000E-01  0.9409000 
1 1 1 29 11 14 o 1.489000  0.4265000     1.190000  0.5396000     1.789000  0.6605000     -0.5990000     0.8529000 
1 1 1 29 11 15 o 3.239000  0.3764000     2.550000  0.5974000     3.927000  0.4580000     -1.377000      0.7527000 
1 1 1 29 11 16 o 1.678000  0.4382000     1.293000  0.5617000     2.062000  0.6726000     -0.7691000     0.8763000 
1 1 1 29 11 17 o 1.654000  0.4545000     1.465000  0.6003000     1.844000  0.6826000     -0.3784000     0.9090000 
1 1 1 29 11 18 o 1.541000  0.4615000     1.409000  0.6088000     1.672000  0.6937000     -0.2630000     0.9230000 
1 1 1 29 12 0  o 6.411000  0.1625000     6.411000  0.1625000     6.411000  0.1625000     0.000000       0.000000  
1 1 1 29 12 1  o 13.10000  0.1384000     12.94000  0.2106000     13.25000  0.1798000     -0.3060000     0.2769000 
1 1 1 29 12 2  o 5.199000  0.1479000     4.856000  0.2391000     5.541000  0.1742000     -0.6852000     0.2958000 
1 1 1 29 12 3  f 3.698000  0.1827000     3.687000  0.2901000     3.709000  0.2222000     -0.2193000E-01 0.3655000 
1 1 1 29 12 4  o 7.147000  0.1478000     7.225000  0.2173000     7.069000  0.2003000     0.1559000      0.2955000 
1 1 1 29 12 5  o 8.995000  0.2489000     9.040000  0.4532000     8.950000  0.2059000     0.9042000E-01  0.4977000 
1 1 1 29 12 6  o 6.961000  0.1574000     7.042000  0.2201000     6.880000  0.2250000     0.1621000      0.3148000 
1 1 1 29 12 7  o 6.084000  0.1792000     5.612000  0.2587000     6.555000  0.2481000     -0.9427000     0.3585000 
1 1 1 29 12 8  o 5.364000  0.2645000     5.459000  0.2806000     5.268000  0.4484000     0.1904000      0.5290000 
1 1 1 29 12 9  o 1.042000  0.3490000     1.059000  0.4929000     1.025000  0.4942000     0.3330000E-01  0.6980000 
1 1 1 29 12 10 f 1.271000  0.3985000     1.282000  0.5633000     1.260000  0.5638000     0.2216000E-01  0.7970000 
1 1 1 29 12 11 o 2.672000  0.4706000     2.922000  0.6322000     2.421000  0.6973000     0.5012000      0.9413000 
1 1 1 29 12 12 o 4.554000  0.2567000     4.389000  0.3613000     4.718000  0.3648000     -0.3285000     0.5134000 
1 1 1 29 12 13 o 2.294000  0.4241000     3.164000  0.5196000     1.424000  0.6704000     1.740000       0.8482000 
1 1 1 29 12 14 o 1.662000  0.4409000     1.893000  0.6319000     1.432000  0.6149000     0.4611000      0.8817000 
1 1 1 29 12 15 o 1.354000  0.4122000     1.352000  0.5752000     1.357000  0.5905000     -0.4959000E-02 0.8243000 
1 1 1 29 12 16 o 2.298000  0.4203000     2.958000  0.5066000     1.638000  0.6708000     1.320000       0.8406000 
1 1 1 29 12 17 o 1.612000  0.4516000     1.448000  0.5963000     1.776000  0.6783000     -0.3274000     0.9032000 
1 1 1 29 12 18 o 1.626000  0.4892000     1.758000  0.6539000     1.494000  0.7278000     0.2637000      0.9784000 
1 1 1 29 13 0  o 2.002000  0.5628000     2.002000  0.5628000     2.002000  0.5628000     -0.000000      0.000000  
1 1 1 29 13 1  o 5.617000  0.1834000     5.645000  0.2141000     5.589000  0.2979000     0.5624000E-01  0.3669000 
1 1 1 29 13 2  o 3.950000  0.1807000     4.240000  0.2189000     3.660000  0.2875000     0.5800000      0.3614000 
1 1 1 29 13 3  o 3.074000  0.2506000     2.808000  0.3854000     3.340000  0.3203000     -0.5319000     0.5012000 
1 1 1 29 13 4  o 7.371000  0.1615000     7.271000  0.2508000     7.472000  0.2035000     -0.2011000     0.3230000 
1 1 1 29 13 5  o 6.106000  0.1966000     6.320000  0.3104000     5.892000  0.2414000     0.4275000      0.3932000 
1 1 1 29 13 6  o 1.220000  0.3666000     1.188000  0.5097000     1.252000  0.5272000     -0.6405000E-01 0.7333000 
1 1 1 29 13 7  o 3.052000  0.3107000     3.307000  0.3895000     2.797000  0.4843000     0.5102000      0.6215000 
1 1 1 29 13 8  o 1.441000  0.3853000     1.826000  0.5834000     1.057000  0.5035000     0.7691000      0.7706000 
1 1 1 29 13 9  o 1.586000  0.4231000     1.209000  0.5373000     1.962000  0.6536000     -0.7528000     0.8461000 
1 1 1 29 13 10 o 2.403000  0.4263000     2.737000  0.5491000     2.069000  0.6523000     0.6678000      0.8527000 
1 1 1 29 13 11 o 2.573000  0.6298000     3.091000  1.071000      2.055000  0.6636000     1.036000       1.260000  
1 1 1 29 13 12 f 3.385000  0.3362000     3.215000  0.4704000     3.556000  0.4805000     -0.3406000     0.6724000 
1 1 1 29 13 13 o 2.927000  0.5129000     3.310000  0.5163000     2.543000  0.8864000     0.7663000      1.026000  
1 1 1 29 13 14 o 1.440000  0.4181000     1.044000  0.4953000     1.836000  0.6738000     -0.7920000     0.8363000 
1 1 1 29 13 15 o 3.209000  0.3694000     3.465000  0.4588000     2.952000  0.5792000     0.5136000      0.7389000 
1 1 1 29 13 16 o 3.270000  0.4263000     3.409000  0.5155000     3.132000  0.6790000     0.2770000      0.8526000 
1 1 1 29 13 17 o 1.819000  0.4679000     1.928000  0.6431000     1.711000  0.6798000     0.2168000      0.9359000 
1 1 1 29 13 18 o 1.498000  0.5079000     1.115000  0.5286000     1.881000  0.8674000     -0.7658000     1.016000  
1 1 1 29 14 0  o 0.9323000 0.6066000     0.9323000 0.6066000     0.9323000 0.6066000     0.000000       0.000000  
1 1 1 29 14 1  o 4.591000  0.1724000     4.649000  0.2315000     4.533000  0.2554000     0.1155000      0.3447000 
1 1 1 29 14 2  o 1.512000  0.3686000     1.449000  0.5134000     1.575000  0.5291000     -0.1257000     0.7373000 
1 1 1 29 14 3  o 2.272000  0.3253000     2.621000  0.3738000     1.924000  0.5324000     0.6968000      0.6505000 
1 1 1 29 14 4  f 3.105000  0.3165000     3.156000  0.5602000     3.054000  0.2947000     0.1025000      0.6330000 
1 1 1 29 14 5  o 3.463000  0.2315000     3.850000  0.3343000     3.077000  0.3204000     0.7737000      0.4631000 
1 1 1 29 14 6  o 3.515000  0.2586000     3.554000  0.3468000     3.475000  0.3837000     0.7903000E-01  0.5172000 
1 1 1 29 14 7  f 2.163000  0.4216000     2.360000  0.5517000     1.966000  0.6377000     0.3932000      0.8432000 
1 1 1 29 14 8  o 6.509000  0.1975000     6.529000  0.2752000     6.488000  0.2833000     0.4027000E-01  0.3950000 
1 1 1 29 14 9  f 1.527000  0.4342000     1.389000  0.5817000     1.665000  0.6447000     -0.2766000     0.8684000 
1 1 1 29 14 10 o 4.191000  0.2905000     4.249000  0.3605000     4.133000  0.4557000     0.1162000      0.5811000 
1 1 1 29 14 11 o 1.384000  0.4381000     1.650000  0.6999000     1.119000  0.5271000     0.5308000      0.8762000 
1 1 1 29 14 12 o 3.535000  0.3322000     3.799000  0.4158000     3.270000  0.5182000     0.5284000      0.6644000 
1 1 1 29 14 13 o 2.070000  0.4539000     2.624000  0.5740000     1.515000  0.7032000     1.109000       0.9077000 
1 1 1 29 14 14 o 2.557000  0.4131000     3.001000  0.4818000     2.114000  0.6713000     0.8872000      0.8263000 
1 1 1 29 14 15 o 1.131000  0.3706000     0.9526000 0.4605000     1.309000  0.5808000     -0.3568000     0.7412000 
1 1 1 29 14 16 o 1.122000  0.3974000     1.264000  0.6347000     0.9798000 0.4783000     0.2847000      0.7947000 
1 1 1 29 14 17 f 1.360000  0.4064000     1.676000  0.6367000     1.044000  0.5054000     0.6326000      0.8129000 
1 1 1 29 14 18 o 1.292000  0.4274000     1.226000  0.5518000     1.359000  0.6530000     -0.1327000     0.8549000 
1 1 1 29 15 0  o 3.745000  0.2623000     3.745000  0.2623000     3.745000  0.2623000     0.000000       0.000000  
1 1 1 29 15 1  o 3.791000  0.1892000     3.966000  0.2782000     3.615000  0.2565000     0.3509000      0.3784000 
1 1 1 29 15 2  o 4.872000  0.1641000     4.912000  0.2560000     4.832000  0.2053000     0.7992000E-01  0.3282000 
1 1 1 29 15 3  o 4.416000  0.1801000     4.536000  0.2747000     4.296000  0.2331000     0.2396000      0.3602000 
1 1 1 29 15 4  o 5.952000  0.1571000     5.878000  0.2487000     6.027000  0.1921000     -0.1495000     0.3143000 
1 1 1 29 15 5  o 5.364000  0.1751000     5.276000  0.2812000     5.452000  0.2086000     -0.1765000     0.3502000 
1 1 1 29 15 6  o 3.378000  0.2924000     3.143000  0.4426000     3.612000  0.3823000     -0.4688000     0.5849000 
1 1 1 29 15 7  f 4.301000  0.3013000     3.942000  0.3722000     4.660000  0.4739000     -0.7181000     0.6025000 
1 1 1 29 15 8  o 3.220000  0.3255000     3.015000  0.4568000     3.425000  0.4638000     -0.4099000     0.6510000 
1 1 1 29 15 9  o 1.872000  0.4437000     2.082000  0.6122000     1.662000  0.6424000     0.4204000      0.8875000 
1 1 1 29 15 10 o 1.216000  0.3875000     1.345000  0.5713000     1.086000  0.5236000     0.2591000      0.7749000 
1 1 1 29 15 11 o 3.108000  0.3596000     2.999000  0.5166000     3.216000  0.5003000     -0.2168000     0.7191000 
1 1 1 29 15 12 o 2.469000  0.4368000     2.582000  0.5641000     2.355000  0.6671000     0.2270000      0.8736000 
1 1 1 29 15 13 o 1.885000  0.4630000     2.137000  0.6288000     1.634000  0.6797000     0.5032000      0.9259000 
1 1 1 29 15 14 o 1.511000  0.4227000     1.664000  0.5961000     1.358000  0.5994000     0.3059000      0.8454000 
1 1 1 29 15 15 o 1.656000  0.4309000     1.951000  0.6244000     1.361000  0.5940000     0.5899000      0.8618000 
1 1 1 29 15 16 o 3.115000  0.4902000     1.931000  0.8941000     4.298000  0.4022000     -2.368000      0.9804000 
1 1 1 29 15 17 o 1.887000  0.4656000     1.817000  0.6396000     1.957000  0.6769000     -0.1401000     0.9313000 
1 1 1 29 15 18 o 1.516000  0.4426000     1.192000  0.5452000     1.840000  0.6973000     -0.6480000     0.8852000 
1 1 1 29 16 0  o 4.969000  0.2132000     4.969000  0.2132000     4.969000  0.2132000     0.000000       0.000000  
1 1 1 29 16 1  o 3.162000  0.2104000     3.191000  0.2995000     3.133000  0.2957000     0.5760000E-01  0.4209000 
1 1 1 29 16 2  o 9.844000  0.1260000     9.668000  0.1804000     10.02000  0.1760000     -0.3514000     0.2520000 
1 1 1 29 16 3  o 5.551000  0.1428000     5.576000  0.2019000     5.527000  0.2021000     0.4883000E-01  0.2857000 
1 1 1 29 16 4  o 4.769000  0.1690000     4.855000  0.2385000     4.683000  0.2394000     0.1721000      0.3380000 
1 1 1 29 16 5  o 6.643000  0.1584000     6.638000  0.2496000     6.647000  0.1951000     -0.8566000E-02 0.3168000 
1 1 1 29 16 6  o 3.910000  0.2505000     3.755000  0.4129000     4.065000  0.2836000     -0.3097000     0.5010000 
1 1 1 29 16 7  o 3.553000  0.3109000     3.749000  0.3585000     3.356000  0.5081000     0.3930000      0.6218000 
1 1 1 29 16 8  o 4.909000  0.2315000     4.965000  0.3110000     4.854000  0.3429000     0.1119000      0.4629000 
1 1 1 29 16 9  o 4.776000  0.2324000     4.894000  0.2994000     4.657000  0.3554000     0.2369000      0.4648000 
1 1 1 29 16 10 o 2.200000  0.4755000     2.738000  0.6988000     1.662000  0.6449000     1.076000       0.9510000 
1 1 1 29 16 11 f 1.286000  0.3989000     1.392000  0.5839000     1.180000  0.5436000     0.2121000      0.7978000 
1 1 1 29 16 12 o 1.438000  0.4319000     1.136000  0.5271000     1.741000  0.6842000     -0.6056000     0.8637000 
1 1 1 29 16 13 o 3.196000  0.3626000     3.024000  0.5132000     3.367000  0.5124000     -0.3427000     0.7252000 
1 1 1 29 16 14 f 2.152000  0.4482000     1.728000  0.6297000     2.577000  0.6380000     -0.8494000     0.8964000 
1 1 1 29 16 15 o 1.318000  0.4006000     1.526000  0.6067000     1.110000  0.5233000     0.4162000      0.8012000 
1 1 1 29 16 16 o 1.369000  0.4340000     1.349000  0.6275000     1.389000  0.5998000     -0.4010000E-01 0.8681000 
1 1 1 29 16 17 o 1.711000  0.4505000     1.400000  0.5984000     2.021000  0.6736000     -0.6203000     0.9010000 
1 1 1 29 16 18 o 1.803000  0.4768000     2.017000  0.6820000     1.589000  0.6666000     0.4281000      0.9537000 
1 1 1 29 17 0  o 11.20000  0.1831000     11.20000  0.1831000     11.20000  0.1831000     -0.000000      0.000000  
1 1 1 29 17 1  o 4.316000  0.1701000     4.153000  0.2523000     4.479000  0.2282000     -0.3254000     0.3402000 
1 1 1 29 17 2  o 5.593000  0.1486000     5.610000  0.2129000     5.576000  0.2073000     0.3403000E-01  0.2971000 
1 1 1 29 17 3  o 9.574000  0.1301000     9.572000  0.1853000     9.576000  0.1827000     -0.4248000E-02 0.2603000 
1 1 1 29 17 4  o 4.607000  0.1787000     4.635000  0.2513000     4.579000  0.2541000     0.5561000E-01  0.3574000 
1 1 1 29 17 5  o 5.032000  0.1747000     5.175000  0.2423000     4.890000  0.2516000     0.2853000      0.3493000 
1 1 1 29 17 6  o 2.643000  0.3607000     3.079000  0.4872000     2.207000  0.5320000     0.8724000      0.7214000 
1 1 1 29 17 7  o 3.126000  0.3058000     3.311000  0.4509000     2.941000  0.4133000     0.3698000      0.6117000 
1 1 1 29 17 8  o 6.384000  0.1925000     6.233000  0.2716000     6.535000  0.2728000     -0.3017000     0.3849000 
1 1 1 29 17 9  o 3.257000  0.3690000     3.345000  0.4315000     3.169000  0.5988000     0.1762000      0.7380000 
1 1 1 29 17 10 o 3.176000  0.4288000     2.396000  0.7402000     3.957000  0.4330000     -1.562000      0.8576000 
1 1 1 29 17 11 o 2.154000  0.4596000     2.050000  0.6414000     2.257000  0.6585000     -0.2068000     0.9192000 
1 1 1 29 17 12 o 1.721000  0.4940000     1.709000  0.6451000     1.733000  0.7483000     -0.2406000E-01 0.9880000 
1 1 1 29 17 13 f 1.965000  0.4574000     1.679000  0.6297000     2.252000  0.6635000     -0.5724000     0.9147000 
1 1 1 29 17 14 o 1.014000  0.3412000     1.103000  0.5074000     0.9259000 0.4563000     0.1771000      0.6824000 
1 1 1 29 17 15 o 1.236000  0.3940000     0.8619000 0.4282000     1.610000  0.6616000     -0.7477000     0.7881000 
1 1 1 29 17 16 o 1.655000  0.4544000     1.566000  0.6232000     1.745000  0.6615000     -0.1793000     0.9089000 
1 1 1 29 17 17 o 1.201000  0.3905000     1.221000  0.5533000     1.182000  0.5512000     0.3899000E-01  0.7810000 
1 1 1 29 17 18 o 1.435000  0.4060000     1.886000  0.6538000     0.9845000 0.4815000     0.9018000      0.8120000 
1 1 1 29 18 0  o 2.451000  0.4213000     2.451000  0.4213000     2.451000  0.4213000     0.000000       0.000000  
1 1 1 29 18 1  o 4.742000  0.1652000     4.624000  0.2404000     4.860000  0.2267000     -0.2368000     0.3305000 
1 1 1 29 18 2  o 4.000000  0.1933000     4.218000  0.2695000     3.782000  0.2773000     0.4357000      0.3867000 
1 1 1 29 18 3  o 5.751000  0.1534000     5.758000  0.2203000     5.744000  0.2135000     0.1424000E-01  0.3068000 
1 1 1 29 18 4  o 5.361000  0.1647000     5.219000  0.2377000     5.503000  0.2280000     -0.2834000     0.3293000 
1 1 1 29 18 5  o 1.445000  0.3787000     1.253000  0.5170000     1.637000  0.5535000     -0.3848000     0.7574000 
1 1 1 29 18 6  o 5.666000  0.2260000     5.440000  0.3555000     5.893000  0.2791000     -0.4533000     0.4519000 
1 1 1 29 18 7  o 6.388000  0.1855000     6.598000  0.2907000     6.178000  0.2305000     0.4207000      0.3711000 
1 1 1 29 18 8  f 7.639000  0.1897000     7.528000  0.2520000     7.749000  0.2836000     -0.2208000     0.3794000 
1 1 1 29 18 9  o 4.262000  0.3138000     4.509000  0.4241000     4.014000  0.4627000     0.4959000      0.6276000 
1 1 1 29 18 10 o 1.369000  0.4091000     1.057000  0.4972000     1.682000  0.6499000     -0.6249000     0.8183000 
1 1 1 29 18 11 o 2.562000  0.4272000     2.828000  0.5300000     2.296000  0.6702000     0.5321000      0.8544000 
1 1 1 29 18 12 o 2.613000  0.5168000     3.190000  0.5064000     2.036000  0.9010000     1.154000       1.034000  
1 1 1 29 18 13 o 2.749000  0.4120000     2.717000  0.5748000     2.782000  0.5904000     -0.6560000E-01 0.8240000 
1 1 1 29 18 14 o 1.761000  0.4301000     2.164000  0.6219000     1.357000  0.5943000     0.8067000      0.8602000 
1 1 1 29 18 15 o 1.694000  0.4364000     2.221000  0.6769000     1.166000  0.5509000     1.055000       0.8727000 
1 1 1 29 18 16 o 2.465000  0.4369000     2.901000  0.5648000     2.030000  0.6667000     0.8714000      0.8738000 
1 1 1 29 18 17 o 1.302000  0.4092000     0.9686000 0.4743000     1.635000  0.6668000     -0.6659000     0.8183000 
1 1 1 29 18 18 o 1.496000  0.7343000     1.496000  0.7343000     ?         ?             ?              ?         
1 1 1 29 19 0  o 4.750000  0.2426000     4.750000  0.2426000     4.750000  0.2426000     -0.000000      0.000000  
1 1 1 29 19 1  o 6.983000  0.1386000     7.061000  0.1980000     6.905000  0.1941000     0.1558000      0.2773000 
1 1 1 29 19 2  o 4.938000  0.1671000     4.665000  0.2459000     5.210000  0.2262000     -0.5455000     0.3341000 
1 1 1 29 19 3  o 5.145000  0.1681000     5.061000  0.2413000     5.229000  0.2342000     -0.1679000     0.3362000 
1 1 1 29 19 4  o 3.052000  0.2615000     2.863000  0.3887000     3.240000  0.3498000     -0.3775000     0.5230000 
1 1 1 29 19 5  o 2.796000  0.3263000     3.025000  0.4643000     2.567000  0.4585000     0.4584000      0.6525000 
1 1 1 29 19 6  o 3.835000  0.2338000     3.544000  0.3462000     4.126000  0.3142000     -0.5820000     0.4675000 
1 1 1 29 19 7  o 6.969000  0.1819000     7.181000  0.2851000     6.757000  0.2260000     0.4243000      0.3638000 
1 1 1 29 19 8  o 2.851000  0.3608000     3.054000  0.5424000     2.648000  0.4757000     0.4064000      0.7215000 
1 1 1 29 19 9  o 1.435000  0.4851000     1.949000  0.8592000     0.9210000 0.4507000     1.028000       0.9702000 
1 1 1 29 19 10 o 2.998000  0.3810000     2.931000  0.5174000     3.066000  0.5593000     -0.1347000     0.7620000 
1 1 1 29 19 11 o 4.468000  0.2635000     4.271000  0.3574000     4.665000  0.3875000     -0.3934000     0.5271000 
1 1 1 29 19 12 o 1.649000  0.4766000     1.686000  0.6251000     1.613000  0.7196000     0.7217000E-01  0.9532000 
1 1 1 29 19 13 o 2.494000  0.4188000     1.977000  0.6364000     3.011000  0.5446000     -1.033000      0.8376000 
1 1 1 29 19 14 o 1.695000  0.4303000     2.094000  0.6399000     1.297000  0.5755000     0.7973000      0.8606000 
1 1 1 29 19 15 o 3.097000  0.5784000     2.689000  1.052000      3.505000  0.4804000     -0.8160000     1.157000  
1 1 1 29 19 16 o 1.353000  0.4074000     1.049000  0.4983000     1.657000  0.6446000     -0.6080000     0.8147000 
1 1 1 29 19 17 o 1.295000  0.4162000     1.507000  0.6316000     1.083000  0.5422000     0.4241000      0.8324000 
1 1 1 29 20 0  o 4.613000  0.2536000     4.613000  0.2536000     4.613000  0.2536000     -0.000000      0.000000  
1 1 1 29 20 1  o 6.454000  0.1480000     6.536000  0.2090000     6.373000  0.2095000     0.1625000      0.2959000 
1 1 1 29 20 2  o 2.707000  0.2759000     2.774000  0.3780000     2.639000  0.4021000     0.1344000      0.5519000 
1 1 1 29 20 3  o 2.855000  0.2826000     2.665000  0.4312000     3.044000  0.3654000     -0.3796000     0.5652000 
1 1 1 29 20 4  o 5.508000  0.1719000     5.566000  0.2374000     5.450000  0.2486000     0.1166000      0.3437000 
1 1 1 29 20 5  o 1.794000  0.3933000     1.254000  0.5381000     2.334000  0.5737000     -1.080000      0.7865000 
1 1 1 29 20 6  o 4.456000  0.2148000     4.779000  0.2892000     4.134000  0.3176000     0.6449000      0.4295000 
1 1 1 29 20 7  o 3.069000  0.3035000     2.576000  0.5007000     3.562000  0.3433000     -0.9856000     0.6071000 
1 1 1 29 20 8  o 2.010000  0.4586000     1.952000  0.6967000     2.069000  0.5966000     -0.1171000     0.9172000 
1 1 1 29 20 9  o 1.806000  0.4491000     1.307000  0.6285000     2.305000  0.6418000     -0.9981000     0.8983000 
1 1 1 29 20 10 o 3.245000  0.3543000     3.751000  0.3938000     2.740000  0.5892000     1.011000       0.7087000 
1 1 1 29 20 11 o 2.501000  0.4378000     2.868000  0.5444000     2.135000  0.6858000     0.7329000      0.8756000 
1 1 1 29 20 12 o 1.897000  0.4301000     2.364000  0.5942000     1.431000  0.6219000     0.9328000      0.8601000 
1 1 1 29 20 13 o 1.164000  0.3793000     1.138000  0.5267000     1.190000  0.5460000     -0.5241000E-01 0.7586000 
1 1 1 29 20 14 o 1.755000  0.4130000     2.337000  0.6240000     1.173000  0.5414000     1.164000       0.8261000 
1 1 1 29 20 15 o 1.209000  0.4128000     1.426000  0.6709000     0.9924000 0.4811000     0.4339000      0.8256000 
1 1 1 29 20 16 o 1.553000  0.3956000     0.8964000 0.4426000     2.210000  0.6559000     -1.313000      0.7913000 
1 1 1 29 20 17 o 1.455000  0.4551000     1.596000  0.6506000     1.315000  0.6366000     0.2810000      0.9103000 
1 1 1 29 21 0  o 1.311000  0.6589000     1.311000  0.6589000     1.311000  0.6589000     -0.000000      0.000000  
1 1 1 29 21 1  o 1.795000  0.3795000     1.786000  0.5350000     1.805000  0.5383000     -0.1865000E-01 0.7590000 
1 1 1 29 21 2  o 3.952000  0.2080000     4.007000  0.2953000     3.897000  0.2929000     0.1093000      0.4159000 
1 1 1 29 21 3  o 4.848000  0.1894000     4.821000  0.2680000     4.875000  0.2677000     -0.5386000E-01 0.3788000 
1 1 1 29 21 4  o 4.843000  0.2172000     4.511000  0.3431000     5.175000  0.2665000     -0.6639000     0.4345000 
1 1 1 29 21 5  o 4.405000  0.2753000     4.335000  0.3654000     4.474000  0.4118000     -0.1389000     0.5506000 
1 1 1 29 21 6  o 5.509000  0.1867000     5.567000  0.2612000     5.451000  0.2669000     0.1160000      0.3734000 
1 1 1 29 21 7  o 3.721000  0.2713000     3.503000  0.3784000     3.939000  0.3890000     -0.4361000     0.5427000 
1 1 1 29 21 8  o 1.535000  0.4959000     1.649000  0.7868000     1.421000  0.6039000     0.2281000      0.9919000 
1 1 1 29 21 9  o 7.969000  0.1873000     8.143000  0.2872000     7.794000  0.2405000     0.3487000      0.3746000 
1 1 1 29 21 10 o 3.834000  0.2944000     3.996000  0.3868000     3.672000  0.4438000     0.3241000      0.5887000 
1 1 1 29 21 11 o 1.929000  0.4766000     2.364000  0.6553000     1.495000  0.6922000     0.8684000      0.9532000 
1 1 1 29 21 12 o 1.348000  0.4111000     1.410000  0.5819000     1.285000  0.5809000     0.1250000      0.8222000 
1 1 1 29 21 13 o 1.158000  0.3750000     0.9663000 0.4658000     1.350000  0.5877000     -0.3835000     0.7500000 
1 1 1 29 21 14 o 1.910000  0.4803000     1.998000  0.6503000     1.823000  0.7070000     0.1746000      0.9606000 
1 1 1 29 21 15 o 1.744000  0.4508000     2.138000  0.6751000     1.350000  0.5975000     0.7887000      0.9015000 
1 1 1 29 21 16 o 1.092000  0.3652000     1.156000  0.5361000     1.028000  0.4961000     0.1274000      0.7304000 
1 1 1 29 21 17 o 1.909000  0.4821000     2.100000  0.6723000     1.718000  0.6912000     0.3819000      0.9643000 
1 1 1 29 22 0  o 0.9048000 0.5675000     0.9048000 0.5675000     0.9048000 0.5675000     -0.000000      0.000000  
1 1 1 29 22 1  o 3.459000  0.2467000     3.591000  0.3378000     3.326000  0.3595000     0.2645000      0.4933000 
1 1 1 29 22 2  o 3.312000  0.2547000     3.491000  0.3332000     3.133000  0.3853000     0.3589000      0.5094000 
1 1 1 29 22 3  o 2.536000  0.3664000     2.250000  0.5999000     2.823000  0.4208000     -0.5739000     0.7328000 
1 1 1 29 22 4  o 6.482000  0.2004000     6.116000  0.2742000     6.849000  0.2923000     -0.7332000     0.4008000 
1 1 1 29 22 5  o 1.622000  0.4104000     1.691000  0.5776000     1.552000  0.5832000     0.1391000      0.8208000 
1 1 1 29 22 6  o 3.697000  0.2664000     3.699000  0.3453000     3.696000  0.4058000     0.2937000E-02  0.5328000 
1 1 1 29 22 7  o 2.382000  0.4320000     2.205000  0.5847000     2.559000  0.6360000     -0.3540000     0.8640000 
1 1 1 29 22 8  o 5.947000  0.2438000     5.249000  0.4174000     6.645000  0.2519000     -1.396000      0.4875000 
1 1 1 29 22 9  o 3.489000  0.3033000     3.699000  0.4665000     3.278000  0.3877000     0.4213000      0.6066000 
1 1 1 29 22 10 o 1.678000  0.4515000     1.428000  0.6128000     1.928000  0.6633000     -0.4999000     0.9031000 
1 1 1 29 22 11 o 1.297000  0.4193000     1.398000  0.5986000     1.195000  0.5873000     0.2030000      0.8386000 
1 1 1 29 22 12 o 4.080000  0.2915000     4.121000  0.3841000     4.038000  0.4386000     0.8355000E-01  0.5830000 
1 1 1 29 22 13 o 1.534000  0.4386000     1.378000  0.5851000     1.690000  0.6534000     -0.3119000     0.8771000 
1 1 1 29 22 14 o 1.641000  0.4705000     1.949000  0.7173000     1.333000  0.6090000     0.6156000      0.9409000 
1 1 1 29 22 15 o 1.397000  0.4247000     1.309000  0.5800000     1.484000  0.6206000     -0.1752000     0.8494000 
1 1 1 29 22 16 o 1.450000  0.4352000     1.541000  0.6328000     1.358000  0.5978000     0.1827000      0.8705000 
1 1 1 29 22 17 o 1.511000  0.4369000     1.886000  0.6931000     1.136000  0.5321000     0.7496000      0.8738000 
1 1 1 29 23 0  o 6.629000  0.2268000     6.629000  0.2268000     6.629000  0.2268000     0.000000       0.000000  
1 1 1 29 23 1  f 4.296000  0.2069000     4.166000  0.3005000     4.426000  0.2843000     -0.2601000     0.4137000 
1 1 1 29 23 2  o 4.760000  0.2149000     4.706000  0.3299000     4.814000  0.2753000     -0.1074000     0.4297000 
1 1 1 29 23 3  o 10.65000  0.1974000     10.52000  0.3138000     10.79000  0.2398000     -0.2678000     0.3949000 
1 1 1 29 23 4  o 6.099000  0.1793000     5.646000  0.2559000     6.552000  0.2512000     -0.9063000     0.3586000 
1 1 1 29 23 5  o 4.379000  0.2404000     4.340000  0.3120000     4.418000  0.3660000     -0.7775000E-01 0.4809000 
1 1 1 29 23 6  o 5.284000  0.2226000     5.188000  0.3009000     5.380000  0.3281000     -0.1917000     0.4452000 
1 1 1 29 23 7  o 8.472000  0.2235000     8.681000  0.3840000     8.263000  0.2289000     0.4175000      0.4471000 
1 1 1 29 23 8  o 5.381000  0.2082000     5.283000  0.3032000     5.478000  0.2854000     -0.1948000     0.4164000 
1 1 1 29 23 9  o 3.854000  0.2810000     3.876000  0.4518000     3.831000  0.3343000     0.4466000E-01  0.5620000 
1 1 1 29 23 10 o 2.375000  0.4190000     2.156000  0.6878000     2.594000  0.4789000     -0.4383000     0.8381000 
1 1 1 29 23 11 o 3.926000  0.3112000     3.683000  0.4361000     4.169000  0.4441000     -0.4861000     0.6224000 
1 1 1 29 23 12 o 1.304000  0.4080000     1.204000  0.5443000     1.405000  0.6080000     -0.2012000     0.8160000 
1 1 1 29 23 13 o 1.534000  0.4401000     1.448000  0.6002000     1.620000  0.6438000     -0.1719000     0.8802000 
1 1 1 29 23 14 o 1.372000  0.4664000     1.585000  0.7600000     1.158000  0.5408000     0.4267000      0.9327000 
1 1 1 29 23 15 o 1.292000  0.4074000     1.244000  0.5525000     1.341000  0.5989000     -0.9710000E-01 0.8149000 
1 1 1 29 23 16 o 1.209000  0.3972000     1.347000  0.5998000     1.072000  0.5209000     0.2752000      0.7944000 
1 1 1 29 23 17 o 2.037000  0.9214000     2.037000  0.9214000     ?         ?             ?              ?         
1 1 1 29 24 0  o 0.5906000 0.4230000     0.5906000 0.4230000     0.5906000 0.4230000     -0.000000      0.000000  
1 1 1 29 24 1  o 6.925000  0.1753000     6.943000  0.2644000     6.907000  0.2303000     0.3663000E-01  0.3507000 
1 1 1 29 24 2  o 3.132000  0.3343000     2.781000  0.5307000     3.483000  0.4066000     -0.7013000     0.6685000 
1 1 1 29 24 3  o 1.339000  0.3891000     1.083000  0.4961000     1.595000  0.5996000     -0.5120000     0.7782000 
1 1 1 29 24 4  o 3.017000  0.3290000     2.954000  0.4428000     3.081000  0.4867000     -0.1277000     0.6579000 
1 1 1 29 24 5  o 4.221000  0.3097000     3.758000  0.3789000     4.685000  0.4899000     -0.9269000     0.6193000 
1 1 1 29 24 6  o 5.275000  0.2522000     5.291000  0.3434000     5.259000  0.3695000     0.3171000E-01  0.5044000 
1 1 1 29 24 7  o 1.704000  0.4213000     1.797000  0.5944000     1.610000  0.5972000     0.1876000      0.8426000 
1 1 1 29 24 8  o 2.436000  0.3844000     2.960000  0.4685000     1.912000  0.6096000     1.048000       0.7689000 
1 1 1 29 24 9  o 2.486000  0.3837000     1.824000  0.6143000     3.148000  0.4600000     -1.324000      0.7674000 
1 1 1 29 24 10 o 1.270000  0.4118000     1.452000  0.6461000     1.087000  0.5106000     0.3650000      0.8235000 
1 1 1 29 24 11 o 1.730000  0.4275000     1.176000  0.5494000     2.283000  0.6552000     -1.107000      0.8551000 
1 1 1 29 24 12 o 1.582000  0.4471000     1.591000  0.6248000     1.572000  0.6397000     0.1886000E-01  0.8942000 
1 1 1 29 24 13 o 2.167000  0.3952000     1.154000  0.5326000     3.181000  0.5841000     -2.027000      0.7905000 
1 1 1 29 24 14 o 1.429000  0.4449000     1.408000  0.6384000     1.451000  0.6198000     -0.4268000E-01 0.8897000 
1 1 1 29 24 15 o 1.459000  0.4326000     1.280000  0.5704000     1.638000  0.6506000     -0.3581000     0.8652000 
1 1 1 29 24 16 o 1.637000  0.5069000     1.194000  0.5600000     2.080000  0.8451000     -0.8861000     1.014000  
1 1 1 29 25 0  o 0.7979000 0.5797000     0.7979000 0.5797000     0.7979000 0.5797000     0.000000       0.000000  
1 1 1 29 25 1  o 3.929000  0.3349000     3.565000  0.4988000     4.293000  0.4472000     -0.7275000     0.6699000 
1 1 1 29 25 2  o 5.179000  0.2386000     5.041000  0.3157000     5.316000  0.3579000     -0.2748000     0.4773000 
1 1 1 29 25 3  o 7.123000  0.1879000     6.919000  0.2674000     7.326000  0.2639000     -0.4070000     0.3757000 
1 1 1 29 25 4  o 3.689000  0.3103000     4.175000  0.3617000     3.202000  0.5044000     0.9731000      0.6207000 
1 1 1 29 25 5  o 1.648000  0.4547000     1.558000  0.6181000     1.737000  0.6671000     -0.1789000     0.9094000 
1 1 1 29 25 6  f 1.825000  0.3799000     2.418000  0.5332000     1.232000  0.5414000     1.186000       0.7598000 
1 1 1 29 25 7  o 2.021000  0.4151000     2.260000  0.5603000     1.783000  0.6127000     0.4772000      0.8302000 
1 1 1 29 25 8  o 1.783000  0.4130000     2.090000  0.5830000     1.477000  0.5851000     0.6134000      0.8260000 
1 1 1 29 25 9  o 1.531000  0.4055000     1.746000  0.5821000     1.316000  0.5646000     0.4294000      0.8109000 
1 1 1 29 25 10 o 1.810000  0.4570000     1.481000  0.6460000     2.140000  0.6465000     -0.6588000     0.9140000 
1 1 1 29 25 11 o 1.892000  0.4262000     2.480000  0.6586000     1.304000  0.5412000     1.177000       0.8525000 
1 1 1 29 25 12 o 1.312000  0.4059000     1.085000  0.5104000     1.540000  0.6313000     -0.4557000     0.8118000 
1 1 1 29 25 13 o 2.112000  0.5101000     2.510000  0.7521000     1.714000  0.6892000     0.7958000      1.020000  
1 1 1 29 25 14 o 1.700000  0.4620000     1.736000  0.6516000     1.664000  0.6550000     0.7205000E-01  0.9239000 
1 1 1 29 25 15 o 1.517000  0.4342000     1.718000  0.6430000     1.315000  0.5837000     0.4037000      0.8685000 
1 1 1 29 25 16 o 1.148000  0.3899000     1.155000  0.5374000     1.141000  0.5652000     0.1403000E-01  0.7799000 
1 1 1 29 26 0  o 1.115000  0.7050000     1.115000  0.7050000     1.115000  0.7050000     -0.000000      0.000000  
1 1 1 29 26 1  o 2.150000  0.4647000     1.761000  0.6320000     2.539000  0.6814000     -0.7782000     0.9294000 
1 1 1 29 26 2  o 6.010000  0.2177000     5.946000  0.3053000     6.073000  0.3103000     -0.1269000     0.4353000 
1 1 1 29 26 3  o 4.069000  0.2896000     3.936000  0.4162000     4.203000  0.4028000     -0.2668000     0.5792000 
1 1 1 29 26 4  o 4.198000  0.2626000     4.174000  0.4042000     4.222000  0.3353000     -0.4746000E-01 0.5252000 
1 1 1 29 26 5  o 6.665000  0.1771000     6.468000  0.2491000     6.863000  0.2518000     -0.3949000     0.3541000 
1 1 1 29 26 6  o 3.257000  0.3210000     2.619000  0.5216000     3.894000  0.3742000     -1.275000      0.6420000 
1 1 1 29 26 7  o 2.323000  0.3631000     1.425000  0.5758000     3.221000  0.4427000     -1.795000      0.7263000 
1 1 1 29 26 8  o 2.255000  0.4159000     2.373000  0.5661000     2.138000  0.6095000     0.2356000      0.8318000 
1 1 1 29 26 9  o 2.320000  0.4441000     2.202000  0.6833000     2.439000  0.5675000     -0.2373000     0.8882000 
1 1 1 29 26 10 o 1.471000  0.4141000     1.552000  0.5827000     1.389000  0.5885000     0.1629000      0.8281000 
1 1 1 29 26 11 o 3.847000  0.2884000     3.978000  0.4590000     3.717000  0.3495000     0.2610000      0.5769000 
1 1 1 29 26 12 o 2.473000  0.4545000     2.170000  0.6860000     2.776000  0.5965000     -0.6062000     0.9091000 
1 1 1 29 26 13 o 1.405000  0.4687000     1.522000  0.7342000     1.288000  0.5827000     0.2342000      0.9373000 
1 1 1 29 26 14 o 1.214000  0.3861000     1.457000  0.6091000     0.9717000 0.4747000     0.4848000      0.7722000 
1 1 1 29 26 15 o 1.660000  0.4528000     1.867000  0.6588000     1.454000  0.6214000     0.4134000      0.9057000 
1 1 1 29 26 16 o 1.644000  0.4812000     1.382000  0.5999000     1.906000  0.7526000     -0.5241000     0.9624000 
1 1 1 29 27 0  o 11.20000  0.2152000     11.20000  0.2152000     11.20000  0.2152000     0.000000       0.000000  
1 1 1 29 27 1  o 3.019000  0.3120000     3.039000  0.4322000     2.999000  0.4501000     0.3996000E-01  0.6240000 
1 1 1 29 27 2  o 6.953000  0.1724000     7.018000  0.2439000     6.888000  0.2438000     0.1295000      0.3449000 
1 1 1 29 27 3  o 2.745000  0.3458000     2.448000  0.5331000     3.043000  0.4407000     -0.5946000     0.6916000 
1 1 1 29 27 4  o 2.541000  0.3683000     2.266000  0.5626000     2.816000  0.4753000     -0.5507000     0.7365000 
1 1 1 29 27 5  o 5.173000  0.2060000     5.306000  0.2775000     5.041000  0.3046000     0.2643000      0.4121000 
1 1 1 29 27 6  o 5.430000  0.2036000     5.050000  0.3001000     5.810000  0.2752000     -0.7601000     0.4071000 
1 1 1 29 27 7  o 3.917000  0.2664000     4.357000  0.3364000     3.478000  0.4132000     0.8787000      0.5329000 
1 1 1 29 27 8  o 1.824000  0.4211000     2.143000  0.5949000     1.505000  0.5963000     0.6374000      0.8423000 
1 1 1 29 27 9  o 7.280000  0.2065000     7.753000  0.2738000     6.808000  0.3093000     0.9449000      0.4131000 
1 1 1 29 27 10 o 3.788000  0.2834000     4.139000  0.3621000     3.437000  0.4360000     0.7023000      0.5668000 
1 1 1 29 27 11 o 2.461000  0.4180000     1.951000  0.7085000     2.971000  0.4436000     -1.020000      0.8359000 
1 1 1 29 27 12 o 2.931000  0.4389000     2.842000  0.7366000     3.021000  0.4774000     -0.1784000     0.8778000 
1 1 1 29 27 13 o 1.223000  0.4028000     1.245000  0.5874000     1.201000  0.5513000     0.4403000E-01  0.8055000 
1 1 1 29 27 14 o 1.159000  0.3796000     1.266000  0.5675000     1.052000  0.5042000     0.2143000      0.7591000 
1 1 1 29 27 15 o 1.870000  0.4988000     1.897000  0.6930000     1.842000  0.7175000     0.5539000E-01  0.9975000 
1 1 1 29 28 0  o 0.7259000 0.4992000     0.7259000 0.4992000     0.7259000 0.4992000     -0.000000      0.000000  
1 1 1 29 28 1  o 6.593000  0.1762000     6.671000  0.2440000     6.515000  0.2542000     0.1560000      0.3523000 
1 1 1 29 28 2  o 3.728000  0.2688000     3.267000  0.4204000     4.189000  0.3351000     -0.9220000     0.5376000 
1 1 1 29 28 3  o 5.221000  0.1993000     5.259000  0.2781000     5.183000  0.2854000     0.7663000E-01  0.3985000 
1 1 1 29 28 4  o 4.086000  0.2503000     4.120000  0.3506000     4.053000  0.3572000     0.6677000E-01  0.5005000 
1 1 1 29 28 5  o 3.831000  0.2642000     3.948000  0.3660000     3.714000  0.3811000     0.2344000      0.5284000 
1 1 1 29 28 6  o 3.892000  0.2632000     3.736000  0.3916000     4.048000  0.3517000     -0.3116000     0.5264000 
1 1 1 29 28 7  o 2.949000  0.3565000     2.136000  0.6075000     3.761000  0.3733000     -1.624000      0.7131000 
1 1 1 29 28 8  f 3.976000  0.2997000     3.858000  0.4752000     4.093000  0.3654000     -0.2357000     0.5994000 
1 1 1 29 28 9  o 1.428000  0.4018000     1.622000  0.5835000     1.234000  0.5527000     0.3885000      0.8037000 
1 1 1 29 28 10 o 4.724000  0.2366000     4.813000  0.3221000     4.634000  0.3465000     0.1791000      0.4731000 
1 1 1 29 28 11 o 3.208000  0.3280000     2.798000  0.5003000     3.618000  0.4244000     -0.8199000     0.6560000 
1 1 1 29 28 12 o 1.473000  0.4571000     1.290000  0.6445000     1.656000  0.6483000     -0.3654000     0.9141000 
1 1 1 29 28 13 o 2.110000  0.4906000     2.261000  0.7165000     1.959000  0.6704000     0.3016000      0.9813000 
1 1 1 29 28 14 o 1.585000  0.4516000     1.378000  0.5988000     1.793000  0.6761000     -0.4148000     0.9032000 
1 1 1 29 28 15 o 1.546000  0.4930000     1.392000  0.6185000     1.699000  0.7679000     -0.3070000     0.9861000 
1 1 1 29 29 0  o 1.344000  0.6995000     1.344000  0.6995000     1.344000  0.6995000     -0.000000      0.000000  
1 1 1 29 29 1  f 2.524000  0.3771000     2.213000  0.5651000     2.834000  0.4995000     -0.6212000     0.7543000 
1 1 1 29 29 2  o 3.923000  0.2620000     3.900000  0.3677000     3.946000  0.3732000     -0.4562000E-01 0.5239000 
1 1 1 29 29 3  o 1.452000  0.4067000     1.409000  0.5720000     1.496000  0.5785000     -0.8676000E-01 0.8135000 
1 1 1 29 29 4  o 1.010000  0.3368000     0.8968000 0.4360000     1.124000  0.5133000     -0.2267000     0.6735000 
1 1 1 29 29 5  o 2.308000  0.4066000     2.108000  0.5984000     2.507000  0.5506000     -0.3985000     0.8131000 
1 1 1 29 29 6  o 9.486000  0.1667000     9.286000  0.2381000     9.687000  0.2335000     -0.4008000     0.3334000 
1 1 1 29 29 7  o 4.617000  0.2326000     4.793000  0.3207000     4.441000  0.3368000     0.3515000      0.4651000 
1 1 1 29 29 8  o 3.975000  0.3568000     4.400000  0.4999000     3.550000  0.5091000     0.8506000      0.7135000 
1 1 1 29 29 9  o 6.637000  0.1965000     6.380000  0.2814000     6.893000  0.2744000     -0.5133000     0.3931000 
1 1 1 29 29 10 o 3.443000  0.3036000     3.260000  0.4348000     3.626000  0.4237000     -0.3657000     0.6071000 
1 1 1 29 29 11 o 2.096000  0.4502000     2.325000  0.6167000     1.867000  0.6561000     0.4577000      0.9004000 
1 1 1 29 29 12 f 1.254000  0.4136000     1.367000  0.6491000     1.141000  0.5127000     0.2262000      0.8271000 
1 1 1 29 29 13 o 1.310000  0.4066000     1.531000  0.6451000     1.089000  0.4951000     0.4414000      0.8132000 
1 1 1 29 29 14 o 1.571000  0.4613000     1.711000  0.6615000     1.432000  0.6432000     0.2795000      0.9226000 
1 1 1 29 29 15 o 1.258000  0.4078000     1.342000  0.5930000     1.175000  0.5600000     0.1666000      0.8156000 
1 1 1 29 30 0  o 1.704000  0.7239000     1.704000  0.7239000     1.704000  0.7239000     -0.000000      0.000000  
1 1 1 29 30 1  o 6.742000  0.1792000     6.829000  0.2497000     6.654000  0.2572000     0.1744000      0.3585000 
1 1 1 29 30 2  o 1.900000  0.4266000     1.753000  0.6085000     2.047000  0.5980000     -0.2944000     0.8532000 
1 1 1 29 30 3  o 4.293000  0.2417000     3.886000  0.3728000     4.701000  0.3078000     -0.8147000     0.4834000 
1 1 1 29 30 4  o 1.491000  0.4158000     1.582000  0.6065000     1.400000  0.5689000     0.1811000      0.8316000 
1 1 1 29 30 5  o 6.078000  0.1942000     5.833000  0.2849000     6.323000  0.2640000     -0.4902000     0.3884000 
1 1 1 29 30 6  o 1.437000  0.4063000     1.685000  0.6141000     1.190000  0.5323000     0.4951000      0.8127000 
1 1 1 29 30 7  o 3.711000  0.3377000     3.060000  0.5801000     4.362000  0.3459000     -1.301000      0.6754000 
1 1 1 29 30 8  o 3.542000  0.3173000     3.848000  0.3907000     3.235000  0.5000000     0.6135000      0.6346000 
1 1 1 29 30 9  o 6.086000  0.2096000     5.904000  0.2997000     6.269000  0.2930000     -0.3650000     0.4191000 
1 1 1 29 30 10 o 1.612000  0.3877000     2.353000  0.6427000     0.8708000 0.4340000     1.482000       0.7755000 
1 1 1 29 30 11 o 2.069000  0.4676000     2.681000  0.6790000     1.457000  0.6432000     1.224000       0.9353000 
1 1 1 29 30 12 o 1.338000  0.4039000     1.278000  0.5607000     1.399000  0.5815000     -0.1207000     0.8078000 
1 1 1 29 30 13 o 1.485000  0.4336000     1.544000  0.6557000     1.427000  0.5675000     0.1169000      0.8672000 
1 1 1 29 30 14 o 2.216000  0.5294000     2.208000  0.7379000     2.224000  0.7594000     -0.1606000E-01 1.059000  
1 1 1 29 30 15 o 1.278000  0.4498000     1.319000  0.6492000     1.238000  0.6227000     0.8145000E-01  0.8995000 
1 1 1 29 31 0  o 4.923000  0.3069000     4.923000  0.3069000     4.923000  0.3069000     0.000000       0.000000  
1 1 1 29 31 1  o 4.958000  0.2187000     5.058000  0.3076000     4.858000  0.3111000     0.1997000      0.4374000 
1 1 1 29 31 2  o 5.589000  0.2026000     5.769000  0.2798000     5.409000  0.2930000     0.3606000      0.4052000 
1 1 1 29 31 3  o 6.108000  0.1907000     6.020000  0.2734000     6.195000  0.2658000     -0.1756000     0.3813000 
1 1 1 29 31 4  o 6.054000  0.1979000     5.802000  0.2915000     6.307000  0.2678000     -0.5051000     0.3959000 
1 1 1 29 31 5  o 4.265000  0.2539000     4.188000  0.3726000     4.342000  0.3451000     -0.1537000     0.5079000 
1 1 1 29 31 6  o 3.922000  0.2631000     4.067000  0.3622000     3.778000  0.3817000     0.2885000      0.5262000 
1 1 1 29 31 7  o 1.571000  0.4375000     1.226000  0.5526000     1.915000  0.6785000     -0.6888000     0.8750000 
1 1 1 29 31 8  o 1.520000  0.4018000     1.932000  0.6168000     1.107000  0.5151000     0.8250000      0.8036000 
1 1 1 29 31 9  o 4.465000  0.2500000     4.554000  0.3441000     4.377000  0.3627000     0.1765000      0.5000000 
1 1 1 29 31 10 o 2.669000  0.5386000     3.157000  0.5123000     2.180000  0.9476000     0.9771000      1.077000  
1 1 1 29 31 11 o 2.655000  0.4213000     2.656000  0.6332000     2.653000  0.5559000     0.3554000E-02  0.8426000 
1 1 1 29 31 12 o 2.176000  0.3894000     1.470000  0.5925000     2.881000  0.5054000     -1.411000      0.7788000 
1 1 1 29 31 13 f 1.292000  0.4055000     1.344000  0.6066000     1.239000  0.5382000     0.1044000      0.8109000 
1 1 1 29 31 14 o 2.417000  0.4919000     1.966000  0.7695000     2.867000  0.6128000     -0.9014000     0.9837000 
1 1 1 29 32 0  o 7.553000  0.2447000     7.553000  0.2447000     7.553000  0.2447000     0.000000       0.000000  
1 1 1 29 32 1  o 2.531000  0.3775000     2.216000  0.5789000     2.846000  0.4847000     -0.6297000     0.7551000 
1 1 1 29 32 2  o 3.235000  0.3123000     3.448000  0.4126000     3.022000  0.4690000     0.4262000      0.6247000 
1 1 1 29 32 3  f 1.731000  0.4169000     1.394000  0.5717000     2.069000  0.6069000     -0.6745000     0.8337000 
1 1 1 29 32 4  o 2.230000  0.4167000     2.326000  0.5885000     2.134000  0.5901000     0.1918000      0.8334000 
1 1 1 29 32 5  o 4.011000  0.2700000     3.807000  0.4016000     4.215000  0.3611000     -0.4083000     0.5401000 
1 1 1 29 32 6  f 2.868000  0.4333000     3.035000  0.6152000     2.700000  0.6103000     0.3351000      0.8666000 
1 1 1 29 32 7  o 1.624000  0.4004000     2.143000  0.6092000     1.105000  0.5197000     1.038000       0.8008000 
1 1 1 29 32 8  o 5.416000  0.2138000     5.573000  0.2988000     5.260000  0.3059000     0.3137000      0.4276000 
1 1 1 29 32 9  o 4.533000  0.2672000     4.622000  0.3428000     4.443000  0.4100000     0.1791000      0.5344000 
1 1 1 29 32 10 o 4.007000  0.3408000     3.684000  0.4961000     4.330000  0.4674000     -0.6455000     0.6816000 
1 1 1 29 32 11 o 2.439000  0.4017000     2.530000  0.5443000     2.349000  0.5909000     0.1815000      0.8034000 
1 1 1 29 32 12 o 1.062000  0.3533000     1.074000  0.5052000     1.050000  0.4941000     0.2466000E-01  0.7066000 
1 1 1 29 32 13 o 1.821000  0.4431000     1.680000  0.6312000     1.961000  0.6222000     -0.2804000     0.8863000 
1 1 1 29 32 14 o 1.629000  0.4605000     1.643000  0.6828000     1.614000  0.6181000     0.2866000E-01  0.9211000 
1 1 1 29 33 0  o 0.9575000 0.6109000     0.9575000 0.6109000     0.9575000 0.6109000     -0.000000      0.000000  
1 1 1 29 33 1  o 3.809000  0.2775000     3.531000  0.4171000     4.088000  0.3663000     -0.5566000     0.5551000 
1 1 1 29 33 2  o 3.844000  0.2773000     3.946000  0.3804000     3.742000  0.4035000     0.2041000      0.5546000 
1 1 1 29 33 3  o 2.150000  0.4253000     2.017000  0.6097000     2.282000  0.5933000     -0.2653000     0.8507000 
1 1 1 29 33 4  o 2.545000  0.3995000     2.455000  0.5743000     2.634000  0.5555000     -0.1793000     0.7990000 
1 1 1 29 33 5  o 1.503000  0.4399000     1.642000  0.6650000     1.364000  0.5762000     0.2780000      0.8799000 
1 1 1 29 33 6  o 5.924000  0.2313000     5.976000  0.3164000     5.872000  0.3375000     0.1041000      0.4627000 
1 1 1 29 33 7  o 5.083000  0.2303000     5.337000  0.3077000     4.829000  0.3426000     0.5075000      0.4606000 
1 1 1 29 33 8  o 1.485000  0.4228000     1.130000  0.5149000     1.839000  0.6707000     -0.7091000     0.8456000 
1 1 1 29 33 9  o 1.788000  0.4694000     1.883000  0.6429000     1.693000  0.6841000     0.1895000      0.9388000 
1 1 1 29 33 10 o 3.048000  0.4146000     2.584000  0.7024000     3.512000  0.4406000     -0.9277000     0.8291000 
1 1 1 29 33 11 o 2.182000  0.4281000     2.452000  0.5930000     1.912000  0.6177000     0.5403000      0.8563000 
1 1 1 29 33 12 o 1.675000  0.4401000     1.554000  0.6111000     1.795000  0.6335000     -0.2415000     0.8802000 
1 1 1 29 33 13 o 1.346000  0.4255000     1.594000  0.6807000     1.099000  0.5109000     0.4952000      0.8511000 
1 1 1 29 34 0  o 6.234000  0.2772000     6.234000  0.2772000     6.234000  0.2772000     -0.000000      0.000000  
1 1 1 29 34 1  o 3.965000  0.2795000     3.465000  0.4359000     4.465000  0.3498000     -1.000000      0.5590000 
1 1 1 29 34 2  o 1.466000  0.4139000     1.681000  0.6161000     1.251000  0.5530000     0.4297000      0.8279000 
1 1 1 29 34 3  o 2.298000  0.4130000     1.954000  0.6176000     2.642000  0.5484000     -0.6884000     0.8259000 
1 1 1 29 34 4  o 2.962000  0.3993000     2.893000  0.6295000     3.031000  0.4913000     -0.1377000     0.7985000 
1 1 1 29 34 5  o 1.122000  0.3763000     1.132000  0.5297000     1.112000  0.5346000     0.2041000E-01  0.7525000 
1 1 1 29 34 6  o 1.539000  0.4056000     1.852000  0.5960000     1.226000  0.5502000     0.6262000      0.8111000 
1 1 1 29 34 7  o 1.199000  0.3859000     1.200000  0.5362000     1.197000  0.5551000     0.2956000E-02  0.7718000 
1 1 1 29 34 8  o 1.217000  0.3961000     1.212000  0.5466000     1.222000  0.5735000     -0.9439000E-02 0.7923000 
1 1 1 29 34 9  o 1.748000  0.4396000     1.493000  0.6189000     2.003000  0.6245000     -0.5094000     0.8793000 
1 1 1 29 34 10 o 1.168000  0.3734000     1.299000  0.5631000     1.038000  0.4905000     0.2602000      0.7467000 
1 1 1 29 34 11 o 3.164000  0.3422000     3.430000  0.4453000     2.899000  0.5196000     0.5313000      0.6843000 
1 1 1 29 34 12 o 1.784000  0.4433000     1.720000  0.6249000     1.848000  0.6288000     -0.1280000     0.8865000 
1 1 1 29 34 13 o 1.519000  0.4435000     1.694000  0.6415000     1.344000  0.6127000     0.3508000      0.8870000 
1 1 1 29 35 0  f 2.779000  0.5654000     2.779000  0.5654000     2.779000  0.5654000     0.000000       0.000000  
1 1 1 29 35 1  o 1.686000  0.4343000     1.497000  0.6007000     1.875000  0.6275000     -0.3784000     0.8687000 
1 1 1 29 35 2  o 1.475000  0.4330000     1.619000  0.6504000     1.331000  0.5717000     0.2887000      0.8659000 
1 1 1 29 35 3  o 3.208000  0.4033000     3.552000  0.5253000     2.864000  0.6120000     0.6875000      0.8065000 
1 1 1 29 35 4  f 3.525000  0.3777000     3.692000  0.4635000     3.359000  0.5966000     0.3325000      0.7555000 
1 1 1 29 35 5  o 2.441000  0.4228000     2.620000  0.5462000     2.263000  0.6454000     0.3579000      0.8455000 
1 1 1 29 35 6  o 2.634000  0.4369000     2.755000  0.5440000     2.512000  0.6839000     0.2424000      0.8738000 
1 1 1 29 35 7  o 6.416000  0.2381000     6.253000  0.3137000     6.578000  0.3584000     -0.3249000     0.4763000 
1 1 1 29 35 8  o 1.949000  0.4605000     1.974000  0.6717000     1.924000  0.6300000     0.5032000E-01  0.9210000 
1 1 1 29 35 9  o 1.324000  0.4007000     1.231000  0.5452000     1.417000  0.5874000     -0.1866000     0.8014000 
1 1 1 29 35 10 o 1.244000  0.3894000     1.346000  0.5758000     1.142000  0.5244000     0.2047000      0.7788000 
1 1 1 29 35 11 o 2.140000  0.4191000     2.664000  0.5580000     1.616000  0.6254000     1.047000       0.8381000 
1 1 1 29 35 12 o 1.534000  0.4509000     1.562000  0.6700000     1.505000  0.6036000     0.5729000E-01  0.9018000 
1 1 1 29 36 0  o 1.253000  0.7418000     1.253000  0.7418000     1.253000  0.7418000     0.000000       0.000000  
1 1 1 29 36 1  o 2.099000  0.4657000     1.905000  0.6845000     2.294000  0.6318000     -0.3887000     0.9315000 
1 1 1 29 36 2  o 1.239000  0.4077000     1.137000  0.5539000     1.342000  0.5985000     -0.2047000     0.8155000 
1 1 1 29 36 3  o 4.422000  0.4095000     4.197000  0.4290000     4.646000  0.6975000     -0.4490000     0.8189000 
1 1 1 29 36 4  o 1.430000  0.4402000     1.278000  0.5610000     1.581000  0.6786000     -0.3032000     0.8804000 
1 1 1 29 36 5  o 1.802000  0.4672000     1.792000  0.6393000     1.813000  0.6815000     -0.2047000E-01 0.9344000 
1 1 1 29 36 6  o 2.045000  0.4686000     2.302000  0.6309000     1.787000  0.6929000     0.5154000      0.9371000 
1 1 1 29 36 7  o 4.629000  0.2742000     4.252000  0.4380000     5.006000  0.3299000     -0.7548000     0.5483000 
1 1 1 29 36 8  o 2.204000  0.4328000     2.453000  0.5941000     1.955000  0.6296000     0.4980000      0.8657000 
1 1 1 29 36 9  o 1.585000  0.4329000     1.431000  0.5906000     1.740000  0.6330000     -0.3097000     0.8657000 
1 1 1 29 36 10 o 1.322000  0.3945000     1.568000  0.6075000     1.076000  0.5033000     0.4916000      0.7889000 
1 1 1 29 36 11 o 1.175000  0.3757000     1.336000  0.5743000     1.015000  0.4844000     0.3205000      0.7513000 
1 1 1 29 36 12 o 1.327000  0.4166000     1.470000  0.6231000     1.185000  0.5533000     0.2852000      0.8333000 
1 1 1 29 37 0  o 1.457000  0.8340000     1.457000  0.8340000     1.457000  0.8340000     -0.000000      0.000000  
1 1 1 29 37 1  o 1.632000  0.5267000     1.173000  0.5541000     2.092000  0.8958000     -0.9187000     1.053000  
1 1 1 29 37 2  o 1.759000  0.5352000     1.395000  0.6004000     2.123000  0.8861000     -0.7281000     1.070000  
1 1 1 29 37 3  o 2.121000  0.4632000     2.469000  0.6267000     1.773000  0.6823000     0.6965000      0.9264000 
1 1 1 29 37 4  o 1.836000  0.4771000     1.949000  0.6758000     1.724000  0.6737000     0.2244000      0.9543000 
1 1 1 29 37 5  o 1.934000  0.4830000     1.881000  0.6709000     1.987000  0.6950000     -0.1056000     0.9660000 
1 1 1 29 37 6  o 5.754000  0.2432000     5.902000  0.3589000     5.607000  0.3282000     0.2954000      0.4863000 
1 1 1 29 37 7  o 1.553000  0.4252000     1.876000  0.6467000     1.230000  0.5522000     0.6468000      0.8504000 
1 1 1 29 37 8  o 2.251000  0.4150000     2.832000  0.5451000     1.671000  0.6260000     1.161000       0.8300000 
1 1 1 29 37 9  o 3.498000  0.3285000     3.202000  0.4943000     3.795000  0.4328000     -0.5928000     0.6570000 
1 1 1 29 37 10 o 1.212000  0.3849000     1.142000  0.5251000     1.282000  0.5630000     -0.1397000     0.7698000 
1 1 1 29 37 11 o 1.351000  0.4227000     1.394000  0.6237000     1.308000  0.5707000     0.8630000E-01  0.8454000 
1 1 1 29 38 0  o 0.8516000 0.5834000     0.8516000 0.5834000     0.8516000 0.5834000     -0.000000      0.000000  
1 1 1 29 38 1  o 1.419000  0.4312000     1.235000  0.5669000     1.602000  0.6499000     -0.3665000     0.8624000 
1 1 1 29 38 2  f 3.990000  0.3033000     4.076000  0.4344000     3.903000  0.4233000     0.1728000      0.6065000 
1 1 1 29 38 3  o 2.173000  0.4529000     1.738000  0.6725000     2.607000  0.6069000     -0.8694000     0.9059000 
1 1 1 29 38 4  f 4.921000  0.2647000     4.684000  0.4123000     5.158000  0.3322000     -0.4746000     0.5295000 
1 1 1 29 38 5  o 3.456000  0.3273000     3.703000  0.4254000     3.209000  0.4975000     0.4942000      0.6546000 
1 1 1 29 38 6  o 6.666000  0.2081000     6.868000  0.2873000     6.465000  0.3010000     0.4025000      0.4161000 
1 1 1 29 38 7  o 5.707000  0.2234000     5.697000  0.3188000     5.718000  0.3130000     -0.2060000E-01 0.4468000 
1 1 1 29 38 8  o 3.738000  0.3043000     4.184000  0.3871000     3.292000  0.4697000     0.8916000      0.6087000 
1 1 1 29 38 9  o 1.275000  0.3961000     1.183000  0.5345000     1.368000  0.5847000     -0.1852000     0.7922000 
1 1 1 29 38 10 o 1.695000  0.4485000     1.521000  0.6165000     1.870000  0.6515000     -0.3488000     0.8970000 
1 1 1 29 38 11 o 1.076000  0.3645000     1.042000  0.5031000     1.110000  0.5276000     -0.6749000E-01 0.7291000 
1 1 1 29 39 0  o 3.928000  0.4143000     3.928000  0.4143000     3.928000  0.4143000     -0.000000      0.000000  
1 1 1 29 39 1  o 4.290000  0.2784000     4.452000  0.3802000     4.128000  0.4069000     0.3244000      0.5569000 
1 1 1 29 39 2  o 2.498000  0.4305000     2.684000  0.5765000     2.311000  0.6394000     0.3731000      0.8609000 
1 1 1 29 39 3  o 1.429000  0.4228000     1.354000  0.5804000     1.504000  0.6150000     -0.1508000     0.8456000 
1 1 1 29 39 4  o 1.955000  0.4523000     1.867000  0.6403000     2.043000  0.6389000     -0.1758000     0.9046000 
1 1 1 29 39 5  o 4.308000  0.2706000     4.249000  0.3853000     4.368000  0.3800000     -0.1181000     0.5412000 
1 1 1 29 39 6  o 3.163000  0.3716000     3.815000  0.4199000     2.511000  0.6132000     1.304000       0.7432000 
1 1 1 29 39 7  o 3.233000  0.3443000     3.129000  0.5076000     3.336000  0.4653000     -0.2068000     0.6886000 
1 1 1 29 39 8  o 1.912000  0.4523000     1.997000  0.6512000     1.828000  0.6280000     0.1690000      0.9047000 
1 1 1 29 39 9  o 1.063000  0.3549000     1.089000  0.5114000     1.036000  0.4921000     0.5383000E-01  0.7097000 
1 1 1 29 39 10 o 1.492000  0.4175000     1.074000  0.5225000     1.909000  0.6514000     -0.8352000     0.8351000 
1 1 1 29 40 0  o 3.005000  0.5572000     3.005000  0.5572000     3.005000  0.5572000     -0.000000      0.000000  
1 1 1 29 40 1  o 2.442000  0.4355000     2.481000  0.6133000     2.403000  0.6186000     0.7801000E-01  0.8711000 
1 1 1 29 40 2  o 1.039000  0.3509000     1.047000  0.4982000     1.031000  0.4942000     0.1583000E-01  0.7017000 
1 1 1 29 40 3  o 3.537000  0.3327000     2.966000  0.5287000     4.108000  0.4039000     -1.142000      0.6654000 
1 1 1 29 40 4  o 3.482000  0.3280000     3.689000  0.4336000     3.276000  0.4922000     0.4134000      0.6560000 
1 1 1 29 40 5  f 3.291000  0.3484000     3.161000  0.5073000     3.421000  0.4777000     -0.2604000     0.6968000 
1 1 1 29 40 6  o 5.513000  0.2342000     5.425000  0.3329000     5.601000  0.3295000     -0.1763000     0.4684000 
1 1 1 29 40 7  o 5.757000  0.2254000     5.756000  0.3177000     5.757000  0.3199000     -0.9317000E-03 0.4509000 
1 1 1 29 40 8  o 3.408000  0.3489000     3.823000  0.4348000     2.992000  0.5459000     0.8306000      0.6979000 
1 1 1 29 40 9  o 1.515000  0.4332000     1.351000  0.5837000     1.678000  0.6403000     -0.3268000     0.8664000 
1 1 1 29 40 10 o 2.309000  0.5349000     2.167000  0.7323000     2.450000  0.7798000     -0.2829000     1.070000  
1 1 1 29 41 0  o 0.7538000 0.5242000     0.7538000 0.5242000     0.7538000 0.5242000     -0.000000      0.000000  
1 1 1 29 41 1  o 1.097000  0.3646000     1.036000  0.4945000     1.158000  0.5359000     -0.1210000     0.7292000 
1 1 1 29 41 2  o 2.612000  0.4175000     3.129000  0.5179000     2.095000  0.6549000     1.034000       0.8349000 
1 1 1 29 41 3  o 2.663000  0.4247000     2.586000  0.6035000     2.741000  0.5976000     -0.1552000     0.8493000 
1 1 1 29 41 4  o 4.031000  0.2921000     3.918000  0.4209000     4.145000  0.4051000     -0.2276000     0.5841000 
1 1 1 29 41 5  o 3.969000  0.2970000     4.085000  0.4121000     3.854000  0.4277000     0.2301000      0.5939000 
1 1 1 29 41 6  o 3.559000  0.3363000     3.888000  0.4247000     3.229000  0.5216000     0.6589000      0.6727000 
1 1 1 29 41 7  o 2.515000  0.4292000     2.257000  0.6353000     2.774000  0.5772000     -0.5168000     0.8584000 
1 1 1 29 41 8  o 1.162000  0.3791000     1.041000  0.4956000     1.284000  0.5738000     -0.2436000     0.7582000 
1 1 1 29 41 9  o 1.379000  0.4221000     1.841000  0.7100000     0.9167000 0.4566000     0.9245000      0.8442000 
1 1 1 29 42 0  o 3.587000  0.4688000     3.587000  0.4688000     3.587000  0.4688000     0.000000       0.000000  
1 1 1 29 42 1  o 2.737000  0.4101000     2.943000  0.5424000     2.531000  0.6152000     0.4118000      0.8201000 
1 1 1 29 42 2  o 1.136000  0.3727000     1.211000  0.5479000     1.061000  0.5055000     0.1492000      0.7455000 
1 1 1 29 42 3  o 3.190000  0.3648000     3.079000  0.5241000     3.302000  0.5076000     -0.2232000     0.7296000 
1 1 1 29 42 4  o 6.352000  0.2185000     6.066000  0.3195000     6.639000  0.2981000     -0.5736000     0.4369000 
1 1 1 29 42 5  o 3.247000  0.3583000     3.297000  0.5062000     3.198000  0.5074000     0.9877000E-01  0.7167000 
1 1 1 29 42 6  o 2.347000  0.4502000     2.375000  0.6363000     2.318000  0.6370000     0.5696000E-01  0.9004000 
1 1 1 29 42 7  o 1.501000  0.4276000     1.741000  0.6424000     1.261000  0.5644000     0.4807000      0.8551000 
1 1 1 29 42 8  o 1.306000  0.4151000     1.227000  0.5786000     1.384000  0.5953000     -0.1576000     0.8302000 
1 1 1 29 43 0  f 1.868000  0.7920000     1.868000  0.7920000     1.868000  0.7920000     -0.000000      0.000000  
1 1 1 29 43 1  o 1.841000  0.4520000     1.597000  0.6219000     2.086000  0.6561000     -0.4884000     0.9040000 
1 1 1 29 43 2  o 3.026000  0.3865000     2.875000  0.5501000     3.178000  0.5431000     -0.3028000     0.7730000 
1 1 1 29 43 3  o 3.764000  0.3239000     3.519000  0.4794000     4.009000  0.4357000     -0.4901000     0.6478000 
1 1 1 29 43 4  o 1.165000  0.3803000     1.171000  0.5403000     1.159000  0.5354000     0.1256000E-01  0.7606000 
1 1 1 29 43 5  o 3.252000  0.3708000     2.895000  0.5743000     3.609000  0.4692000     -0.7145000     0.7416000 
1 1 1 29 43 6  o 2.588000  0.4427000     2.836000  0.5865000     2.340000  0.6633000     0.4966000      0.8855000 
1 1 1 29 43 7  f 3.720000  0.3896000     3.211000  0.6550000     4.229000  0.4219000     -1.018000      0.7791000 
1 1 1 29 44 0  o 0.9787000 0.6342000     0.9787000 0.6342000     0.9787000 0.6342000     0.000000       0.000000  
1 1 1 29 44 1  o 1.089000  0.3637000     0.9291000 0.4554000     1.249000  0.5672000     -0.3197000     0.7274000 
1 1 1 29 44 2  o 3.113000  0.3756000     3.010000  0.5386000     3.217000  0.5237000     -0.2071000     0.7512000 
1 1 1 29 44 3  o 1.279000  0.4044000     1.345000  0.5873000     1.214000  0.5560000     0.1311000      0.8088000 
1 1 1 29 44 4  o 2.666000  0.4371000     2.918000  0.5764000     2.413000  0.6572000     0.5053000      0.8742000 
1 1 1 29 44 5  o 4.183000  0.2987000     4.436000  0.3947000     3.931000  0.4484000     0.5052000      0.5974000 
1 1 1 29 44 6  o 2.262000  0.4844000     1.980000  0.7310000     2.544000  0.6357000     -0.5643000     0.9687000 
1 1 1 29 45 0  o 3.778000  0.4760000     3.778000  0.4760000     3.778000  0.4760000     0.000000       0.000000  
1 1 1 29 45 1  o 1.773000  0.4626000     1.808000  0.6566000     1.739000  0.6518000     0.6918000E-01  0.9252000 
1 1 1 29 45 2  o 1.180000  0.3799000     1.426000  0.6052000     0.9352000 0.4593000     0.4905000      0.7597000 
1 1 1 29 45 3  o 1.119000  0.3715000     1.081000  0.5126000     1.157000  0.5380000     -0.7593000E-01 0.7431000 
1 1 1 29 45 4  o 2.214000  0.4547000     2.617000  0.6172000     1.812000  0.6677000     0.8054000      0.9093000 
1 1 1 29 45 5  o 1.442000  0.4445000     1.469000  0.6497000     1.415000  0.6066000     0.5387000E-01  0.8889000 
1 1 1 29 46 0  o 0.9808000 0.6401000     0.9808000 0.6401000     0.9808000 0.6401000     0.000000       0.000000  
1 1 1 29 46 1  o 2.292000  0.4720000     2.093000  0.6800000     2.490000  0.6547000     -0.3968000     0.9439000 
1 1 1 29 46 2  o 1.268000  0.3996000     1.458000  0.6128000     1.077000  0.5130000     0.3808000      0.7992000 
1 1 1 29 46 3  o 1.328000  0.4078000     1.612000  0.6395000     1.045000  0.5063000     0.5669000      0.8156000 
1 1 1 30 0  2  o 10.92000  0.1989000     10.92000  0.1989000     10.92000  0.1989000     0.000000       0.000000  
1 1 1 30 0  3  o 6.550000  0.2179000     6.550000  0.2179000     6.550000  0.2179000     0.000000       0.000000  
1 1 1 30 0  4  o 0.8505000 0.5578000     0.8505000 0.5578000     0.8505000 0.5578000     0.000000       0.000000  
1 1 1 30 0  5  o 9.340000  0.1408000     9.340000  0.1408000     9.340000  0.1408000     0.000000       0.000000  
1 1 1 30 0  6  o 0.7410000 0.4656000     0.7410000 0.4656000     0.7410000 0.4656000     0.000000       0.000000  
1 1 1 30 0  7  o 2.935000  0.3336000     2.935000  0.3336000     2.935000  0.3336000     0.000000       0.000000  
1 1 1 30 0  8  o 0.7351000 0.5229000     0.7351000 0.5229000     0.7351000 0.5229000     -0.000000      0.000000  
1 1 1 30 0  9  o 4.007000  0.7492000     4.007000  0.7492000     4.007000  0.7492000     0.000000       0.000000  
1 1 1 30 0  10 f 0.8699000 0.5830000     0.8699000 0.5830000     0.8699000 0.5830000     0.000000       0.000000  
1 1 1 30 0  11 o 1.081000  0.6686000     1.081000  0.6686000     1.081000  0.6686000     0.000000       0.000000  
1 1 1 30 0  12 o 3.363000  0.4779000     3.363000  0.4779000     3.363000  0.4779000     0.000000       0.000000  
1 1 1 30 0  13 f 0.9601000 0.6305000     0.9601000 0.6305000     0.9601000 0.6305000     0.000000       0.000000  
1 1 1 30 0  14 o 2.640000  0.8456000     2.640000  0.8456000     2.640000  0.8456000     0.000000       0.000000  
1 1 1 30 0  15 o 1.667000  0.8204000     1.667000  0.8204000     1.667000  0.8204000     0.000000       0.000000  
1 1 1 30 0  16 o 5.943000  0.3384000     5.943000  0.3384000     5.943000  0.3384000     0.000000       0.000000  
1 1 1 30 0  17 o 2.881000  0.7699000     2.881000  0.7699000     2.881000  0.7699000     0.000000       0.000000  
1 1 1 30 0  18 o 1.830000  0.8509000     1.830000  0.8509000     1.830000  0.8509000     0.000000       0.000000  
1 1 1 30 1  2  f 5.915000  0.1394000     6.114000  0.2122000     5.716000  0.1809000     0.3982000      0.2788000 
1 1 1 30 1  3  o 8.884000  0.1502000     8.849000  0.2103000     8.920000  0.2145000     -0.7102000E-01 0.3004000 
1 1 1 30 1  4  o 5.474000  0.2099000     5.192000  0.2706000     5.756000  0.3209000     -0.5639000     0.4198000 
1 1 1 30 1  5  o 2.440000  0.1439000     2.338000  0.2178000     2.543000  0.1882000     -0.2053000     0.2879000 
1 1 1 30 1  6  o 5.342000  0.1279000     5.504000  0.1949000     5.179000  0.1656000     0.3256000      0.2557000 
1 1 1 30 1  7  f 4.162000  0.1728000     4.377000  0.2312000     3.946000  0.2568000     0.4314000      0.3455000 
1 1 1 30 1  8  o 2.470000  0.4099000     1.918000  0.5445000     3.021000  0.6130000     -1.104000      0.8199000 
1 1 1 30 1  9  o 4.218000  0.3409000     3.753000  0.3238000     4.683000  0.6000000     -0.9306000     0.6818000 
1 1 1 30 1  10 o 1.775000  0.4591000     1.867000  0.6161000     1.682000  0.6809000     0.1855000      0.9182000 
1 1 1 30 1  11 o 3.288000  0.3260000     3.423000  0.4258000     3.154000  0.4939000     0.2689000      0.6521000 
1 1 1 30 1  12 o 1.389000  0.4144000     1.497000  0.6067000     1.281000  0.5645000     0.2159000      0.8287000 
1 1 1 30 1  13 o 3.004000  0.3829000     2.937000  0.5480000     3.071000  0.5348000     -0.1340000     0.7657000 
1 1 1 30 1  14 o 1.628000  0.4793000     1.530000  0.6650000     1.725000  0.6904000     -0.1951000     0.9586000 
1 1 1 30 1  15 o 1.913000  0.4764000     1.782000  0.6723000     2.044000  0.6753000     -0.2625000     0.9529000 
1 1 1 30 1  16 o 1.353000  0.4232000     1.300000  0.5871000     1.406000  0.6097000     -0.1058000     0.8464000 
1 1 1 30 1  17 o 1.558000  0.4666000     1.828000  0.7166000     1.287000  0.5979000     0.5417000      0.9332000 
1 1 1 30 1  18 o 1.217000  0.4019000     1.301000  0.5967000     1.132000  0.5385000     0.1694000      0.8037000 
1 1 1 30 2  2  o 8.241000  0.1270000     8.349000  0.1731000     8.134000  0.1860000     0.2150000      0.2540000 
1 1 1 30 2  3  o 4.985000  0.1713000     4.532000  0.2486000     5.438000  0.2357000     -0.9057000     0.3426000 
1 1 1 30 2  5  o 3.175000  0.1280000     2.998000  0.1974000     3.352000  0.1630000     -0.3541000     0.2560000 
1 1 1 30 2  6  o 0.9477000 0.2874000     0.8426000 0.3880000     1.053000  0.4241000     -0.2102000     0.5748000 
1 1 1 30 2  7  o 2.381000  0.3271000     2.799000  0.3490000     1.962000  0.5533000     0.8371000      0.6542000 
1 1 1 30 2  8  o 1.873000  0.4356000     1.573000  0.5226000     2.174000  0.6971000     -0.6012000     0.8712000 
1 1 1 30 2  9  o 3.839000  0.4408000     4.480000  0.2887000     3.198000  0.8331000     1.282000       0.8817000 
1 1 1 30 2  10 o 1.950000  0.4424000     1.535000  0.5324000     2.366000  0.7067000     -0.8314000     0.8848000 
1 1 1 30 2  11 o 1.635000  0.4344000     1.047000  0.4706000     2.222000  0.7304000     -1.175000      0.8688000 
1 1 1 30 2  12 o 1.615000  0.4301000     1.948000  0.6323000     1.281000  0.5831000     0.6666000      0.8602000 
1 1 1 30 2  13 o 1.936000  0.4561000     1.659000  0.6472000     2.214000  0.6428000     -0.5544000     0.9121000 
1 1 1 30 2  14 o 1.699000  0.4863000     1.500000  0.6608000     1.898000  0.7137000     -0.3978000     0.9726000 
1 1 1 30 2  15 o 1.622000  0.4554000     1.719000  0.6586000     1.526000  0.6291000     0.1937000      0.9107000 
1 1 1 30 2  16 o 1.303000  0.4082000     1.064000  0.5127000     1.542000  0.6354000     -0.4774000     0.8165000 
1 1 1 30 2  17 o 1.501000  0.4512000     1.148000  0.5498000     1.855000  0.7155000     -0.7074000     0.9023000 
1 1 1 30 2  18 o 1.544000  0.4508000     1.828000  0.6900000     1.260000  0.5804000     0.5674000      0.9017000 
1 1 1 30 3  2  o 1.129000  0.3075000     1.289000  0.4381000     0.9690000 0.4318000     0.3200000      0.6151000 
1 1 1 30 3  3  o 7.205000  0.1406000     6.974000  0.2034000     7.435000  0.1942000     -0.4610000     0.2812000 
1 1 1 30 3  4  o 2.355000  0.5754000     ?         ?             2.355000  0.5754000     ?              ?         
1 1 1 30 3  5  o 2.660000  0.1566000     2.722000  0.2308000     2.598000  0.2118000     0.1239000      0.3132000 
1 1 1 30 3  6  o 2.435000  0.2925000     2.838000  0.3098000     2.033000  0.4962000     0.8046000      0.5850000 
1 1 1 30 3  7  o 6.492000  0.1471000     6.489000  0.1903000     6.495000  0.2244000     -0.5295000E-02 0.2942000 
1 1 1 30 3  8  o 3.483000  0.2528000     3.419000  0.3353000     3.547000  0.3785000     -0.1281000     0.5056000 
1 1 1 30 3  9  o 1.729000  0.4711000     1.641000  0.5624000     1.818000  0.7559000     -0.1769000     0.9422000 
1 1 1 30 3  10 o 1.637000  0.3803000     2.073000  0.5099000     1.202000  0.5643000     0.8715000      0.7605000 
1 1 1 30 3  11 o 1.907000  0.4475000     1.901000  0.5483000     1.912000  0.7073000     -0.1117000E-01 0.8950000 
1 1 1 30 3  12 o 1.473000  0.4088000     1.739000  0.5690000     1.207000  0.5870000     0.5324000      0.8175000 
1 1 1 30 3  13 o 2.060000  0.4549000     1.735000  0.6586000     2.386000  0.6276000     -0.6513000     0.9098000 
1 1 1 30 3  14 f 1.564000  0.4693000     1.767000  0.7120000     1.360000  0.6115000     0.4065000      0.9386000 
1 1 1 30 3  15 o 1.194000  0.3902000     1.302000  0.5859000     1.087000  0.5155000     0.2142000      0.7804000 
1 1 1 30 3  16 o 1.559000  0.4484000     1.424000  0.6169000     1.693000  0.6508000     -0.2696000     0.8967000 
1 1 1 30 3  17 o 1.484000  0.4554000     1.351000  0.6125000     1.617000  0.6741000     -0.2654000     0.9108000 
1 1 1 30 3  18 o 1.622000  0.4597000     1.379000  0.6106000     1.866000  0.6874000     -0.4863000     0.9195000 
1 1 1 30 4  2  o 6.109000  0.1242000     6.082000  0.1686000     6.136000  0.1823000     -0.5388000E-01 0.2483000 
1 1 1 30 4  3  o 2.828000  0.3791000     3.195000  0.6094000     2.461000  0.4512000     0.7339000      0.7583000 
1 1 1 30 4  5  f 5.205000  0.1281000     5.137000  0.1722000     5.273000  0.1896000     -0.1360000     0.2562000 
1 1 1 30 4  6  o 3.724000  0.1867000     3.595000  0.2495000     3.853000  0.2777000     -0.2573000     0.3733000 
1 1 1 30 4  7  o 4.355000  0.1903000     4.023000  0.2608000     4.686000  0.2771000     -0.6631000     0.3806000 
1 1 1 30 4  8  o 1.763000  0.4093000     1.779000  0.5418000     1.747000  0.6135000     0.3196000E-01  0.8185000 
1 1 1 30 4  9  o 1.905000  0.4675000     1.785000  0.5576000     2.025000  0.7504000     -0.2398000     0.9349000 
1 1 1 30 4  10 o 4.905000  0.2051000     4.895000  0.2689000     4.915000  0.3098000     -0.2077000E-01 0.4102000 
1 1 1 30 4  11 o 1.197000  0.3816000     1.208000  0.5159000     1.186000  0.5625000     0.2196000E-01  0.7632000 
1 1 1 30 4  12 o 1.393000  0.4436000     1.151000  0.5099000     1.635000  0.7260000     -0.4840000     0.8872000 
1 1 1 30 4  13 o 3.033000  0.3946000     2.577000  0.4749000     3.489000  0.6304000     -0.9119000     0.7892000 
1 1 1 30 4  14 o 1.728000  0.5171000     1.849000  0.7336000     1.608000  0.7289000     0.2409000      1.034000  
1 1 1 30 4  15 o 1.178000  0.3875000     1.148000  0.5397000     1.208000  0.5561000     -0.5936000E-01 0.7750000 
1 1 1 30 4  16 o 1.789000  0.4708000     1.985000  0.6906000     1.593000  0.6401000     0.3921000      0.9416000 
1 1 1 30 4  17 o 1.327000  0.4217000     1.632000  0.6775000     1.023000  0.5023000     0.6087000      0.8434000 
1 1 1 30 4  18 o 0.9993000 0.3455000     0.9396000 0.4666000     1.059000  0.5098000     -0.1194000     0.6911000 
1 1 1 30 5  1  o 5.435000  0.1836000     ?         ?             5.435000  0.1836000     ?              ?         
1 1 1 30 5  2  o 2.092000  0.3553000     2.196000  0.5323000     1.989000  0.4707000     0.2065000      0.7106000 
1 1 1 30 5  3  o 4.342000  0.2918000     3.994000  0.5259000     4.690000  0.2531000     -0.6964000     0.5837000 
1 1 1 30 5  4  o 6.348000  0.1775000     ?         ?             6.348000  0.1775000     ?              ?         
1 1 1 30 5  5  o 4.075000  0.1487000     4.050000  0.1951000     4.101000  0.2244000     -0.5147000E-01 0.2974000 
1 1 1 30 5  6  o 5.230000  0.1516000     5.332000  0.1976000     5.127000  0.2301000     0.2056000      0.3033000 
1 1 1 30 5  7  o 2.079000  0.3676000     2.566000  0.3851000     1.593000  0.6264000     0.9729000      0.7353000 
1 1 1 30 5  8  o 2.868000  0.3236000     3.288000  0.3560000     2.448000  0.5405000     0.8405000      0.6472000 
1 1 1 30 5  9  o 4.468000  0.2883000     4.322000  0.3015000     4.614000  0.4916000     -0.2921000     0.5767000 
1 1 1 30 5  10 o 1.242000  0.3830000     1.164000  0.5126000     1.320000  0.5693000     -0.1559000     0.7661000 
1 1 1 30 5  11 o 1.822000  0.4212000     1.815000  0.5680000     1.828000  0.6222000     -0.1311000E-01 0.8425000 
1 1 1 30 5  12 o 1.633000  0.4661000     1.582000  0.5831000     1.683000  0.7274000     -0.1003000     0.9322000 
1 1 1 30 5  13 o 2.573000  0.4165000     3.191000  0.3806000     1.955000  0.7409000     1.236000       0.8329000 
1 1 1 30 5  14 o 1.576000  0.4387000     1.819000  0.5968000     1.333000  0.6433000     0.4868000      0.8775000 
1 1 1 30 5  15 o 1.466000  0.4280000     1.521000  0.5677000     1.410000  0.6408000     0.1114000      0.8561000 
1 1 1 30 5  16 o 1.976000  0.4810000     2.019000  0.6851000     1.933000  0.6753000     0.8598000E-01  0.9620000 
1 1 1 30 5  17 o 1.333000  0.4295000     1.529000  0.6635000     1.136000  0.5456000     0.3935000      0.8590000 
1 1 1 30 5  18 f 1.152000  0.3842000     1.117000  0.5339000     1.187000  0.5525000     -0.6985000E-01 0.7683000 
1 1 1 30 6  1  o 2.882000  0.2112000     2.695000  0.3277000     3.070000  0.2664000     -0.3745000     0.4223000 
1 1 1 30 6  2  o 4.245000  0.2237000     3.635000  0.3851000     4.855000  0.2276000     -1.221000      0.4473000 
1 1 1 30 6  3  o 3.651000  0.2908000     3.967000  0.4666000     3.335000  0.3472000     0.6313000      0.5816000 
1 1 1 30 6  4  o 1.700000  0.2695000     2.099000  0.2772000     1.301000  0.4624000     0.7980000      0.5391000 
1 1 1 30 6  5  o 7.185000  0.1237000     7.026000  0.1690000     7.345000  0.1806000     -0.3194000     0.2474000 
1 1 1 30 6  6  o 2.489000  0.2879000     2.730000  0.3313000     2.249000  0.4710000     0.4808000      0.5758000 
1 1 1 30 6  7  o 3.109000  0.3242000     3.594000  0.3250000     2.625000  0.5611000     0.9686000      0.6484000 
1 1 1 30 6  8  o 2.406000  0.3670000     2.627000  0.4488000     2.186000  0.5807000     0.4408000      0.7339000 
1 1 1 30 6  9  o 2.590000  0.3898000     3.119000  0.3791000     2.062000  0.6812000     1.057000       0.7795000 
1 1 1 30 6  10 o 3.434000  0.3033000     3.853000  0.3394000     3.015000  0.5027000     0.8376000      0.6066000 
1 1 1 30 6  11 o 2.425000  0.3883000     2.951000  0.4555000     1.898000  0.6290000     1.053000       0.7767000 
1 1 1 30 6  12 f 3.618000  0.3290000     3.458000  0.4708000     3.778000  0.4599000     -0.3202000     0.6581000 
1 1 1 30 6  13 o 1.866000  0.3979000     2.420000  0.5086000     1.312000  0.6122000     1.108000       0.7959000 
1 1 1 30 6  14 o 3.765000  0.3870000     3.307000  0.3714000     4.224000  0.6790000     -0.9173000     0.7740000 
1 1 1 30 6  15 o 2.034000  0.4750000     1.670000  0.5766000     2.397000  0.7551000     -0.7271000     0.9501000 
1 1 1 30 6  16 o 1.714000  0.4650000     1.683000  0.5902000     1.745000  0.7189000     -0.6189000E-01 0.9301000 
1 1 1 30 6  17 o 1.456000  0.4775000     1.303000  0.6210000     1.608000  0.7254000     -0.3043000     0.9550000 
1 1 1 30 6  18 o 1.614000  0.4537000     1.370000  0.6060000     1.858000  0.6754000     -0.4881000     0.9074000 
1 1 1 30 7  0  o 0.9880000 0.5343000     0.9880000 0.5343000     0.9880000 0.5343000     0.000000       0.000000  
1 1 1 30 7  1  o 5.377000  0.1561000     5.278000  0.2438000     5.477000  0.1950000     -0.1990000     0.3123000 
1 1 1 30 7  2  o 6.281000  0.1818000     6.327000  0.2974000     6.236000  0.2092000     0.9073000E-01  0.3636000 
1 1 1 30 7  3  o 8.008000  0.1844000     7.730000  0.3347000     8.286000  0.1547000     -0.5561000     0.3687000 
1 1 1 30 7  4  o 3.010000  0.1816000     2.909000  0.2515000     3.112000  0.2619000     -0.2025000     0.3631000 
1 1 1 30 7  5  o 1.695000  0.3293000     1.610000  0.4525000     1.780000  0.4786000     -0.1705000     0.6586000 
1 1 1 30 7  6  o 7.664000  0.1360000     7.457000  0.1856000     7.872000  0.1989000     -0.4155000     0.2721000 
1 1 1 30 7  7  o 3.897000  0.5050000     3.490000  0.9651000     4.305000  0.2979000     -0.8148000     1.010000  
1 1 1 30 7  8  o 5.612000  0.1861000     5.553000  0.2473000     5.670000  0.2781000     -0.1169000     0.3721000 
1 1 1 30 7  9  o 7.295000  0.1699000     7.192000  0.2288000     7.399000  0.2513000     -0.2069000     0.3399000 
1 1 1 30 7  10 o 2.243000  0.4188000     2.346000  0.5471000     2.139000  0.6341000     0.2076000      0.8375000 
1 1 1 30 7  11 o 3.203000  0.3428000     2.512000  0.5359000     3.893000  0.4275000     -1.382000      0.6855000 
1 1 1 30 7  12 o 2.010000  0.4958000     1.556000  0.7579000     2.465000  0.6393000     -0.9098000     0.9916000 
1 1 1 30 7  13 o 2.624000  0.3858000     3.199000  0.4290000     2.049000  0.6414000     1.150000       0.7716000 
1 1 1 30 7  14 o 1.550000  0.4563000     1.251000  0.5309000     1.849000  0.7424000     -0.5984000     0.9127000 
1 1 1 30 7  15 o 1.679000  0.4629000     1.363000  0.5465000     1.995000  0.7474000     -0.6316000     0.9259000 
1 1 1 30 7  16 o 1.144000  0.3693000     1.261000  0.5357000     1.027000  0.5086000     0.2339000      0.7387000 
1 1 1 30 7  17 o 1.504000  0.4600000     1.086000  0.5392000     1.921000  0.7454000     -0.8352000     0.9200000 
1 1 1 30 7  18 o 1.334000  0.4196000     1.327000  0.5581000     1.341000  0.6267000     -0.1442000E-01 0.8391000 
1 1 1 30 8  0  o 9.487000  0.1437000     9.487000  0.1437000     9.487000  0.1437000     0.000000       0.000000  
1 1 1 30 8  1  o 4.192000  0.1587000     4.520000  0.1611000     3.864000  0.2736000     0.6558000      0.3175000 
1 1 1 30 8  2  o 8.651000  0.1278000     8.494000  0.2064000     8.807000  0.1507000     -0.3132000     0.2556000 
1 1 1 30 8  3  o 1.182000  0.3010000     1.412000  0.4427000     0.9531000 0.4080000     0.4587000      0.6020000 
1 1 1 30 8  4  o 3.132000  0.1869000     3.158000  0.2524000     3.106000  0.2757000     0.5236000E-01  0.3738000 
1 1 1 30 8  5  o 5.147000  0.1471000     5.092000  0.1976000     5.201000  0.2179000     -0.1084000     0.2942000 
1 1 1 30 8  6  o 1.704000  0.3406000     2.137000  0.4477000     1.270000  0.5135000     0.8671000      0.6812000 
1 1 1 30 8  7  o 2.820000  0.3696000     2.863000  0.6001000     2.777000  0.4317000     0.8527000E-01  0.7392000 
1 1 1 30 8  8  o 3.624000  0.2697000     3.996000  0.3083000     3.252000  0.4427000     0.7442000      0.5395000 
1 1 1 30 8  9  o 7.259000  0.1700000     7.190000  0.2282000     7.328000  0.2519000     -0.1381000     0.3399000 
1 1 1 30 8  10 o 5.751000  0.1976000     5.570000  0.2649000     5.932000  0.2934000     -0.3620000     0.3953000 
1 1 1 30 8  11 o 1.392000  0.3989000     1.625000  0.5958000     1.160000  0.5305000     0.4641000      0.7977000 
1 1 1 30 8  12 o 2.955000  0.5783000     2.816000  1.051000      3.095000  0.4829000     -0.2789000     1.157000  
1 1 1 30 8  13 o 1.656000  0.4342000     1.711000  0.6148000     1.601000  0.6133000     0.1104000      0.8684000 
1 1 1 30 8  14 o 1.308000  0.4007000     1.331000  0.5692000     1.285000  0.5641000     0.4559000E-01  0.8014000 
1 1 1 30 8  15 o 1.080000  0.3518000     1.127000  0.5045000     1.033000  0.4904000     0.9352000E-01  0.7036000 
1 1 1 30 8  16 o 1.090000  0.3737000     0.8195000 0.4032000     1.360000  0.6293000     -0.5405000     0.7474000 
1 1 1 30 8  17 o 1.872000  0.4974000     1.390000  0.6336000     2.355000  0.7670000     -0.9659000     0.9948000 
1 1 1 30 8  18 o 1.876000  0.4550000     1.034000  0.4845000     2.718000  0.7703000     -1.684000      0.9100000 
1 1 1 30 9  0  o 23.29000  0.2666000     23.29000  0.2666000     23.29000  0.2666000     -0.000000      0.000000  
1 1 1 30 9  1  o 6.942000  0.1038000     6.970000  0.1666000     6.913000  0.1239000     0.5742000E-01  0.2076000 
1 1 1 30 9  2  o 11.98000  0.1288000     11.89000  0.1889000     12.07000  0.1753000     -0.1871000     0.2577000 
1 1 1 30 9  3  o 4.531000  0.1699000     4.436000  0.2280000     4.625000  0.2519000     -0.1891000     0.3397000 
1 1 1 30 9  4  o 5.335000  0.1401000     5.341000  0.1952000     5.330000  0.2011000     0.1149000E-01  0.2802000 
1 1 1 30 9  5  o 8.380000  0.1530000     8.294000  0.1819000     8.465000  0.2461000     -0.1714000     0.3060000 
1 1 1 30 9  6  o 1.352000  0.3855000     1.054000  0.4620000     1.650000  0.6173000     -0.5956000     0.7711000 
1 1 1 30 9  7  o 1.243000  0.3674000     1.206000  0.5021000     1.279000  0.5365000     -0.7324000E-01 0.7348000 
1 1 1 30 9  8  o 1.659000  0.4103000     1.917000  0.5685000     1.401000  0.5918000     0.5159000      0.8206000 
1 1 1 30 9  9  o 1.438000  0.4110000     1.430000  0.5699000     1.447000  0.5925000     -0.1720000E-01 0.8221000 
1 1 1 30 9  10 o 1.374000  0.4057000     1.422000  0.5708000     1.325000  0.5766000     0.9657000E-01  0.8113000 
1 1 1 30 9  11 o 1.446000  0.4176000     1.427000  0.5793000     1.465000  0.6015000     -0.3834000E-01 0.8351000 
1 1 1 30 9  12 o 2.591000  0.5001000     2.279000  0.8294000     2.903000  0.5590000     -0.6244000     1.000000  
1 1 1 30 9  13 o 2.812000  0.3802000     2.585000  0.5500000     3.040000  0.5252000     -0.4550000     0.7604000 
1 1 1 30 9  14 o 1.461000  0.4040000     1.734000  0.5999000     1.187000  0.5412000     0.5468000      0.8080000 
1 1 1 30 9  15 o 2.331000  0.4335000     2.017000  0.6289000     2.644000  0.5968000     -0.6272000     0.8670000 
1 1 1 30 9  16 o 1.682000  0.4239000     1.324000  0.5636000     2.040000  0.6335000     -0.7157000     0.8479000 
1 1 1 30 9  17 o 1.505000  0.4508000     1.808000  0.7149000     1.203000  0.5494000     0.6049000      0.9016000 
1 1 1 30 9  18 o 1.806000  0.4774000     1.985000  0.6149000     1.627000  0.7303000     0.3581000      0.9547000 
1 1 1 30 10 0  o 11.02000  0.1419000     11.02000  0.1419000     11.02000  0.1419000     0.000000       0.000000  
1 1 1 30 10 1  o 2.535000  0.2343000     2.130000  0.4117000     2.941000  0.2237000     -0.8114000     0.4685000 
1 1 1 30 10 2  o 1.109000  0.3097000     1.404000  0.5024000     0.8136000 0.3624000     0.5907000      0.6195000 
1 1 1 30 10 3  o 4.707000  0.1557000     4.628000  0.2178000     4.786000  0.2225000     -0.1579000     0.3114000 
1 1 1 30 10 4  o 3.799000  0.1789000     3.699000  0.2558000     3.898000  0.2503000     -0.1985000     0.3579000 
1 1 1 30 10 5  o 8.332000  0.1563000     8.246000  0.1875000     8.419000  0.2501000     -0.1736000     0.3126000 
1 1 1 30 10 6  o 6.726000  0.1657000     6.789000  0.2552000     6.664000  0.2113000     0.1243000      0.3313000 
1 1 1 30 10 7  f 5.484000  0.1764000     5.543000  0.2436000     5.426000  0.2552000     0.1176000      0.3528000 
1 1 1 30 10 8  o 5.199000  0.2541000     5.342000  0.2796000     5.056000  0.4245000     0.2857000      0.5083000 
1 1 1 30 10 9  o 3.673000  0.2740000     3.812000  0.3463000     3.533000  0.4248000     0.2787000      0.5480000 
1 1 1 30 10 10 o 1.358000  0.3956000     1.571000  0.5900000     1.145000  0.5272000     0.4256000      0.7912000 
1 1 1 30 10 11 f 1.189000  0.3770000     1.176000  0.5217000     1.203000  0.5443000     -0.2708000E-01 0.7539000 
1 1 1 30 10 12 o 3.394000  0.3292000     3.611000  0.4175000     3.178000  0.5091000     0.4333000      0.6584000 
1 1 1 30 10 13 o 1.296000  0.4093000     1.107000  0.5166000     1.485000  0.6349000     -0.3778000     0.8185000 
1 1 1 30 10 14 f 2.486000  0.4021000     2.622000  0.5342000     2.350000  0.6012000     0.2721000      0.8043000 
1 1 1 30 10 15 o 1.932000  0.4485000     1.939000  0.6211000     1.926000  0.6471000     0.1343000E-01  0.8969000 
1 1 1 30 10 16 o 1.810000  0.4323000     1.419000  0.5806000     2.200000  0.6407000     -0.7809000     0.8647000 
1 1 1 30 10 17 o 1.216000  0.4017000     1.201000  0.5768000     1.230000  0.5594000     -0.2881000E-01 0.8035000 
1 1 1 30 10 18 o 2.524000  0.4426000     3.150000  0.5543000     1.897000  0.6901000     1.253000       0.8852000 
1 1 1 30 11 0  o 6.221000  0.1535000     6.221000  0.1535000     6.221000  0.1535000     -0.000000      0.000000  
1 1 1 30 11 1  o 3.449000  0.1759000     3.357000  0.2858000     3.540000  0.2053000     -0.1831000     0.3519000 
1 1 1 30 11 2  o 4.031000  0.1953000     4.057000  0.3222000     4.004000  0.2210000     0.5268000E-01  0.3907000 
1 1 1 30 11 3  o 6.406000  0.1392000     6.366000  0.2015000     6.446000  0.1920000     -0.8017000E-01 0.2783000 
1 1 1 30 11 4  o 1.892000  0.3436000     1.936000  0.4730000     1.848000  0.4984000     0.8829000E-01  0.6872000 
1 1 1 30 11 5  o 8.462000  0.1638000     8.627000  0.2114000     8.296000  0.2504000     0.3310000      0.3277000 
1 1 1 30 11 6  o 7.804000  0.1764000     7.370000  0.2847000     8.238000  0.2085000     -0.8684000     0.3529000 
1 1 1 30 11 7  o 3.602000  0.2528000     3.657000  0.3438000     3.546000  0.3708000     0.1105000      0.5057000 
1 1 1 30 11 8  o 3.049000  0.4191000     3.123000  0.4246000     2.974000  0.7228000     0.1497000      0.8383000 
1 1 1 30 11 9  o 5.190000  0.2694000     4.546000  0.4568000     5.835000  0.2856000     -1.289000      0.5388000 
1 1 1 30 11 10 o 3.425000  0.3035000     3.649000  0.3811000     3.201000  0.4724000     0.4482000      0.6070000 
1 1 1 30 11 11 o 2.334000  0.4415000     2.271000  0.5898000     2.398000  0.6572000     -0.1270000     0.8831000 
1 1 1 30 11 12 o 1.799000  0.4456000     1.826000  0.6182000     1.772000  0.6420000     0.5454000E-01  0.8913000 
1 1 1 30 11 13 o 1.258000  0.3985000     1.367000  0.5803000     1.148000  0.5463000     0.2192000      0.7970000 
1 1 1 30 11 14 o 3.352000  0.3306000     3.013000  0.4808000     3.690000  0.4538000     -0.6763000     0.6612000 
1 1 1 30 11 15 o 1.866000  0.4424000     2.016000  0.6222000     1.716000  0.6292000     0.3001000      0.8849000 
1 1 1 30 11 16 o 2.324000  0.4220000     1.891000  0.6340000     2.758000  0.5572000     -0.8677000     0.8441000 
1 1 1 30 11 17 o 1.379000  0.4048000     1.725000  0.6404000     1.033000  0.4953000     0.6926000      0.8096000 
1 1 1 30 11 18 o 1.610000  0.4971000     1.420000  0.6103000     1.800000  0.7848000     -0.3802000     0.9942000 
1 1 1 30 12 0  o 2.195000  0.3718000     2.195000  0.3718000     2.195000  0.3718000     0.000000       0.000000  
1 1 1 30 12 1  o 2.618000  0.2511000     2.388000  0.4284000     2.849000  0.2620000     -0.4611000     0.5022000 
1 1 1 30 12 2  o 1.953000  0.3309000     1.507000  0.5746000     2.398000  0.3282000     -0.8909000     0.6617000 
1 1 1 30 12 3  o 2.357000  0.2739000     2.291000  0.4464000     2.423000  0.3175000     -0.1326000     0.5478000 
1 1 1 30 12 4  o 2.413000  0.3678000     2.125000  0.4692000     2.701000  0.5666000     -0.5761000     0.7356000 
1 1 1 30 12 5  f 1.630000  0.3915000     1.557000  0.5717000     1.704000  0.5351000     -0.1471000     0.7831000 
1 1 1 30 12 6  o 1.983000  0.3841000     1.828000  0.5499000     2.137000  0.5364000     -0.3093000     0.7682000 
1 1 1 30 12 7  o 5.654000  0.1800000     5.486000  0.2513000     5.822000  0.2579000     -0.3359000     0.3600000 
1 1 1 30 12 8  o 3.809000  0.2994000     3.556000  0.3553000     4.063000  0.4819000     -0.5065000     0.5988000 
1 1 1 30 12 9  o 3.608000  0.2731000     3.329000  0.3943000     3.887000  0.3781000     -0.5580000     0.5462000 
1 1 1 30 12 10 o 5.029000  0.2148000     5.209000  0.2838000     4.848000  0.3224000     0.3609000      0.4295000 
1 1 1 30 12 11 o 1.712000  0.4570000     1.397000  0.6100000     2.027000  0.6808000     -0.6301000     0.9141000 
1 1 1 30 12 12 o 1.559000  0.4334000     1.541000  0.5959000     1.577000  0.6294000     -0.3619000E-01 0.8667000 
1 1 1 30 12 13 o 1.535000  0.4699000     1.414000  0.5878000     1.655000  0.7334000     -0.2412000     0.9399000 
1 1 1 30 12 14 o 1.236000  0.3922000     1.174000  0.5321000     1.298000  0.5764000     -0.1240000     0.7844000 
1 1 1 30 12 15 o 1.639000  0.4250000     1.235000  0.5460000     2.044000  0.6515000     -0.8094000     0.8500000 
1 1 1 30 12 16 o 1.105000  0.3671000     1.135000  0.5226000     1.075000  0.5158000     0.5955000E-01  0.7343000 
1 1 1 30 12 17 o 2.062000  0.4581000     2.251000  0.6284000     1.873000  0.6668000     0.3778000      0.9162000 
1 1 1 30 12 18 o 1.660000  0.6459000     1.660000  0.6459000     ?         ?             ?              ?         
1 1 1 30 13 0  o 6.825000  0.1977000     6.825000  0.1977000     6.825000  0.1977000     0.000000       0.000000  
1 1 1 30 13 1  o 5.742000  0.1447000     5.722000  0.2151000     5.763000  0.1936000     -0.4100000E-01 0.2894000 
1 1 1 30 13 2  o 2.004000  0.2949000     2.154000  0.4036000     1.854000  0.4301000     0.3002000      0.5898000 
1 1 1 30 13 3  o 1.146000  0.3413000     1.073000  0.4716000     1.218000  0.4934000     -0.1450000     0.6825000 
1 1 1 30 13 4  o 1.578000  0.3714000     1.682000  0.5692000     1.475000  0.4773000     0.2076000      0.7429000 
1 1 1 30 13 5  o 4.467000  0.2291000     4.223000  0.3826000     4.712000  0.2521000     -0.4891000     0.4582000 
1 1 1 30 13 6  o 6.527000  0.1609000     6.496000  0.2263000     6.558000  0.2289000     -0.6167000E-01 0.3218000 
1 1 1 30 13 7  o 5.144000  0.1904000     4.923000  0.2630000     5.366000  0.2754000     -0.4428000     0.3808000 
1 1 1 30 13 8  o 2.427000  0.3883000     2.270000  0.5188000     2.584000  0.5779000     -0.3144000     0.7766000 
1 1 1 30 13 9  o 6.081000  0.1889000     5.729000  0.2639000     6.433000  0.2703000     -0.7032000     0.3777000 
1 1 1 30 13 10 o 3.600000  0.3422000     3.295000  0.5694000     3.905000  0.3798000     -0.6102000     0.6844000 
1 1 1 30 13 11 o 1.488000  0.5069000     1.934000  0.8852000     1.042000  0.4943000     0.8918000      1.014000  
1 1 1 30 13 12 o 2.003000  0.4175000     2.476000  0.5572000     1.531000  0.6218000     0.9444000      0.8349000 
1 1 1 30 13 13 o 2.839000  0.4985000     3.084000  0.4859000     2.594000  0.8706000     0.4908000      0.9970000 
1 1 1 30 13 14 o 1.215000  0.3860000     1.289000  0.5592000     1.140000  0.5321000     0.1496000      0.7719000 
1 1 1 30 13 15 o 2.155000  0.4482000     2.229000  0.6155000     2.082000  0.6518000     0.1475000      0.8965000 
1 1 1 30 13 16 o 1.647000  0.4620000     1.715000  0.6596000     1.578000  0.6471000     0.1369000      0.9241000 
1 1 1 30 13 17 o 1.393000  0.4173000     1.452000  0.5965000     1.333000  0.5838000     0.1195000      0.8346000 
1 1 1 30 14 0  o 6.756000  0.2501000     6.756000  0.2501000     6.756000  0.2501000     -0.000000      0.000000  
1 1 1 30 14 1  o 5.309000  0.1464000     5.144000  0.2144000     5.474000  0.1994000     -0.3306000     0.2928000 
1 1 1 30 14 2  o 8.402000  0.1374000     8.725000  0.1894000     8.079000  0.1991000     0.6459000      0.2748000 
1 1 1 30 14 3  o 2.869000  0.2952000     2.512000  0.4981000     3.226000  0.3169000     -0.7142000     0.5903000 
1 1 1 30 14 4  o 2.422000  0.3836000     2.925000  0.5696000     1.920000  0.5138000     1.005000       0.7671000 
1 1 1 30 14 5  o 3.584000  0.2444000     3.794000  0.3371000     3.375000  0.3540000     0.4190000      0.4889000 
1 1 1 30 14 6  o 2.731000  0.3201000     2.780000  0.4294000     2.682000  0.4749000     0.9849000E-01  0.6402000 
1 1 1 30 14 7  o 1.218000  0.3774000     1.159000  0.5045000     1.278000  0.5613000     -0.1186000     0.7547000 
1 1 1 30 14 8  o 4.577000  0.2158000     4.396000  0.2991000     4.758000  0.3111000     -0.3619000     0.4316000 
1 1 1 30 14 9  o 1.786000  0.4321000     1.914000  0.5960000     1.658000  0.6257000     0.2558000      0.8642000 
1 1 1 30 14 10 o 2.522000  0.3927000     2.466000  0.5351000     2.579000  0.5751000     -0.1136000     0.7855000 
1 1 1 30 14 11 o 3.029000  0.4190000     2.874000  0.6827000     3.184000  0.4859000     -0.3098000     0.8380000 
1 1 1 30 14 12 o 2.039000  0.4389000     1.782000  0.6175000     2.295000  0.6239000     -0.5139000     0.8778000 
1 1 1 30 14 13 o 2.122000  0.4600000     2.046000  0.5861000     2.198000  0.7093000     -0.1521000     0.9201000 
1 1 1 30 14 14 o 0.9667000 0.3307000     0.8170000 0.4033000     1.116000  0.5243000     -0.2995000     0.6615000 
1 1 1 30 14 15 o 1.568000  0.4000000     1.031000  0.4896000     2.106000  0.6327000     -1.075000      0.8000000 
1 1 1 30 14 16 o 1.971000  0.4919000     2.284000  0.7189000     1.658000  0.6715000     0.6269000      0.9837000 
1 1 1 30 14 17 f 1.443000  0.4264000     1.540000  0.6142000     1.347000  0.5917000     0.1926000      0.8529000 
1 1 1 30 15 0  o 3.007000  0.3397000     3.007000  0.3397000     3.007000  0.3397000     -0.000000      0.000000  
1 1 1 30 15 1  o 6.993000  0.1441000     6.916000  0.2013000     7.069000  0.2063000     -0.1538000     0.2882000 
1 1 1 30 15 2  o 5.684000  0.1636000     5.281000  0.2442000     6.087000  0.2177000     -0.8061000     0.3272000 
1 1 1 30 15 3  o 6.854000  0.1821000     6.534000  0.3169000     7.174000  0.1796000     -0.6400000     0.3642000 
1 1 1 30 15 4  o 4.783000  0.1771000     4.832000  0.2835000     4.734000  0.2122000     0.9851000E-01  0.3541000 
1 1 1 30 15 5  o 2.928000  0.2667000     3.056000  0.4134000     2.800000  0.3371000     0.2562000      0.5335000 
1 1 1 30 15 6  o 3.218000  0.2772000     3.127000  0.3950000     3.309000  0.3890000     -0.1827000     0.5543000 
1 1 1 30 15 7  o 5.753000  0.2356000     5.659000  0.2775000     5.848000  0.3809000     -0.1885000     0.4712000 
1 1 1 30 15 8  o 3.613000  0.2622000     3.189000  0.3850000     4.038000  0.3561000     -0.8498000     0.5244000 
1 1 1 30 15 9  o 2.944000  0.3428000     3.194000  0.4172000     2.695000  0.5441000     0.4986000      0.6856000 
1 1 1 30 15 10 o 3.972000  0.2854000     3.947000  0.3611000     3.997000  0.4421000     -0.4948000E-01 0.5709000 
1 1 1 30 15 11 o 5.855000  0.2083000     5.643000  0.2953000     6.068000  0.2938000     -0.4252000     0.4165000 
1 1 1 30 15 12 o 3.219000  0.3460000     3.255000  0.4445000     3.182000  0.5304000     0.7353000E-01  0.6920000 
1 1 1 30 15 13 o 4.164000  0.2908000     4.273000  0.3439000     4.055000  0.4689000     0.2180000      0.5815000 
1 1 1 30 15 14 o 1.545000  0.4332000     1.338000  0.5684000     1.751000  0.6540000     -0.4128000     0.8665000 
1 1 1 30 15 15 o 1.303000  0.4038000     1.194000  0.5423000     1.411000  0.5984000     -0.2167000     0.8076000 
1 1 1 30 15 16 o 1.365000  0.4571000     1.444000  0.7100000     1.286000  0.5761000     0.1573000      0.9143000 
1 1 1 30 15 17 f 1.226000  0.3907000     1.350000  0.5819000     1.102000  0.5214000     0.2487000      0.7813000 
1 1 1 30 16 0  o 3.791000  0.2579000     3.791000  0.2579000     3.791000  0.2579000     0.000000       0.000000  
1 1 1 30 16 1  o 3.843000  0.1820000     3.663000  0.2705000     4.022000  0.2435000     -0.3591000     0.3640000 
1 1 1 30 16 2  f 2.530000  0.2673000     2.956000  0.3300000     2.104000  0.4206000     0.8524000      0.5347000 
1 1 1 30 16 3  o 7.160000  0.1314000     7.359000  0.1861000     6.962000  0.1854000     0.3968000      0.2627000 
1 1 1 30 16 4  o 5.892000  0.1487000     5.763000  0.2188000     6.022000  0.2014000     -0.2589000     0.2974000 
1 1 1 30 16 5  o 5.489000  0.1718000     5.510000  0.2744000     5.468000  0.2068000     0.4236000E-01  0.3436000 
1 1 1 30 16 6  o 2.012000  0.3691000     1.556000  0.6031000     2.469000  0.4256000     -0.9129000     0.7382000 
1 1 1 30 16 7  o 3.486000  0.2865000     3.698000  0.3534000     3.275000  0.4509000     0.4229000      0.5729000 
1 1 1 30 16 8  o 2.190000  0.4022000     2.338000  0.5138000     2.041000  0.6188000     0.2975000      0.8043000 
1 1 1 30 16 9  o 4.279000  0.2440000     3.973000  0.3472000     4.586000  0.3430000     -0.6129000     0.4881000 
1 1 1 30 16 10 o 3.182000  0.4071000     3.352000  0.5722000     3.011000  0.5793000     0.3406000      0.8142000 
1 1 1 30 16 11 o 1.756000  0.4402000     1.850000  0.6153000     1.662000  0.6297000     0.1880000      0.8804000 
1 1 1 30 16 12 f 3.161000  0.3768000     2.633000  0.5670000     3.689000  0.4966000     -1.056000      0.7537000 
1 1 1 30 16 13 o 1.666000  0.4283000     1.832000  0.5968000     1.500000  0.6145000     0.3317000      0.8566000 
1 1 1 30 16 14 o 1.486000  0.4274000     1.535000  0.6075000     1.437000  0.6015000     0.9749000E-01  0.8549000 
1 1 1 30 16 15 o 1.775000  0.4605000     1.677000  0.6348000     1.872000  0.6674000     -0.1953000     0.9211000 
1 1 1 30 16 16 o 2.059000  0.5035000     1.779000  0.7644000     2.338000  0.6555000     -0.5592000     1.007000  
1 1 1 30 16 17 o 1.467000  0.4323000     1.376000  0.5902000     1.558000  0.6317000     -0.1822000     0.8645000 
1 1 1 30 17 0  o 3.457000  0.2947000     3.457000  0.2947000     3.457000  0.2947000     0.000000       0.000000  
1 1 1 30 17 1  o 6.234000  0.1348000     6.263000  0.1923000     6.205000  0.1889000     0.5767000E-01  0.2695000 
1 1 1 30 17 2  o 7.060000  0.1338000     6.915000  0.1952000     7.205000  0.1829000     -0.2897000     0.2675000 
1 1 1 30 17 3  o 5.665000  0.1503000     5.597000  0.2203000     5.733000  0.2044000     -0.1364000     0.3005000 
1 1 1 30 17 4  o 6.496000  0.1442000     6.521000  0.2084000     6.470000  0.1992000     0.5119000E-01  0.2883000 
1 1 1 30 17 5  o 6.010000  0.1743000     5.897000  0.2751000     6.123000  0.2143000     -0.2263000     0.3487000 
1 1 1 30 17 6  o 4.786000  0.2927000     4.242000  0.5311000     5.330000  0.2464000     -1.089000      0.5855000 
1 1 1 30 17 7  o 3.077000  0.3338000     2.960000  0.5083000     3.194000  0.4329000     -0.2343000     0.6677000 
1 1 1 30 17 8  o 2.034000  0.4188000     2.312000  0.5620000     1.756000  0.6212000     0.5563000      0.8377000 
1 1 1 30 17 9  o 7.509000  0.1872000     7.695000  0.2723000     7.323000  0.2569000     0.3719000      0.3744000 
1 1 1 30 17 10 o 4.474000  0.5302000     3.570000  1.012000      5.379000  0.3178000     -1.809000      1.060000  
1 1 1 30 17 11 o 1.833000  0.4480000     1.780000  0.6138000     1.886000  0.6529000     -0.1068000     0.8961000 
1 1 1 30 17 12 o 3.904000  0.4023000     3.854000  0.4352000     3.954000  0.6768000     -0.1005000     0.8046000 
1 1 1 30 17 13 f 3.090000  0.3888000     3.375000  0.4358000     2.806000  0.6440000     0.5691000      0.7776000 
1 1 1 30 17 14 o 1.390000  0.4130000     1.167000  0.5296000     1.613000  0.6338000     -0.4459000     0.8260000 
1 1 1 30 17 15 o 2.219000  0.4324000     2.670000  0.5602000     1.768000  0.6589000     0.9015000      0.8648000 
1 1 1 30 17 16 o 1.226000  0.3921000     1.416000  0.6053000     1.036000  0.4986000     0.3800000      0.7842000 
1 1 1 30 17 17 o 2.165000  0.4688000     1.672000  0.6493000     2.657000  0.6764000     -0.9843000     0.9376000 
1 1 1 30 18 0  o 5.011000  0.2222000     5.011000  0.2222000     5.011000  0.2222000     -0.000000      0.000000  
1 1 1 30 18 1  o 4.028000  0.1806000     4.098000  0.2571000     3.958000  0.2535000     0.1397000      0.3611000 
1 1 1 30 18 2  o 6.920000  0.1377000     6.835000  0.1997000     7.004000  0.1897000     -0.1692000     0.2755000 
1 1 1 30 18 3  o 11.49000  0.1356000     11.64000  0.1937000     11.33000  0.1899000     0.3129000      0.2712000 
1 1 1 30 18 4  o 8.806000  0.1377000     8.753000  0.1974000     8.858000  0.1920000     -0.1054000     0.2754000 
1 1 1 30 18 5  o 6.024000  0.1837000     5.971000  0.2351000     6.077000  0.2824000     -0.1064000     0.3675000 
1 1 1 30 18 6  o 4.006000  0.2715000     3.988000  0.4165000     4.025000  0.3483000     -0.3711000E-01 0.5430000 
1 1 1 30 18 7  o 4.236000  0.2356000     4.012000  0.3914000     4.459000  0.2622000     -0.4470000     0.4711000 
1 1 1 30 18 8  f 3.823000  0.2656000     4.328000  0.3221000     3.318000  0.4225000     1.010000       0.5313000 
1 1 1 30 18 9  o 3.506000  0.3280000     3.556000  0.3915000     3.455000  0.5265000     0.1004000      0.6561000 
1 1 1 30 18 10 o 3.117000  0.3473000     2.475000  0.5526000     3.759000  0.4209000     -1.284000      0.6946000 
1 1 1 30 18 11 o 2.034000  0.4407000     1.654000  0.6119000     2.414000  0.6344000     -0.7600000     0.8814000 
1 1 1 30 18 12 o 2.603000  0.4337000     3.571000  0.4715000     1.636000  0.7281000     1.935000       0.8674000 
1 1 1 30 18 13 o 1.639000  0.4166000     1.977000  0.6075000     1.300000  0.5701000     0.6766000      0.8332000 
1 1 1 30 18 14 f 3.595000  0.3121000     3.302000  0.4644000     3.887000  0.4171000     -0.5849000     0.6242000 
1 1 1 30 18 15 o 1.182000  0.3860000     1.074000  0.5048000     1.289000  0.5841000     -0.2142000     0.7720000 
1 1 1 30 18 16 o 2.154000  0.4576000     2.314000  0.6254000     1.995000  0.6681000     0.3195000      0.9152000 
1 1 1 30 18 17 o 1.401000  0.4331000     1.497000  0.6246000     1.305000  0.6002000     0.1920000      0.8662000 
1 1 1 30 19 0  o 3.218000  0.3243000     3.218000  0.3243000     3.218000  0.3243000     0.000000       0.000000  
1 1 1 30 19 1  o 1.861000  0.3415000     1.413000  0.5152000     2.310000  0.4485000     -0.8961000     0.6830000 
1 1 1 30 19 2  o 1.324000  0.3501000     1.617000  0.5326000     1.031000  0.4546000     0.5865000      0.7002000 
1 1 1 30 19 3  o 3.265000  0.2314000     3.318000  0.3311000     3.213000  0.3234000     0.1056000      0.4629000 
1 1 1 30 19 4  o 4.298000  0.1934000     4.240000  0.2795000     4.356000  0.2674000     -0.1165000     0.3868000 
1 1 1 30 19 5  o 4.139000  0.2333000     3.860000  0.3801000     4.419000  0.2705000     -0.5592000     0.4665000 
1 1 1 30 19 6  o 8.640000  0.1464000     8.938000  0.2097000     8.342000  0.2044000     0.5951000      0.2929000 
1 1 1 30 19 7  o 8.842000  0.1747000     8.510000  0.2649000     9.174000  0.2279000     -0.6641000     0.3494000 
1 1 1 30 19 8  o 3.834000  0.2894000     4.113000  0.4102000     3.556000  0.4082000     0.5568000      0.5787000 
1 1 1 30 19 9  o 4.880000  0.4414000     4.817000  0.8243000     4.943000  0.3159000     -0.1258000     0.8827000 
1 1 1 30 19 10 f 3.816000  0.2858000     3.901000  0.3747000     3.732000  0.4317000     0.1686000      0.5717000 
1 1 1 30 19 11 o 1.959000  0.4486000     1.806000  0.6108000     2.111000  0.6572000     -0.3048000     0.8972000 
1 1 1 30 19 12 o 1.315000  0.4077000     1.245000  0.5413000     1.384000  0.6099000     -0.1382000     0.8154000 
1 1 1 30 19 13 o 2.305000  0.4451000     2.207000  0.6303000     2.402000  0.6285000     -0.1950000     0.8901000 
1 1 1 30 19 14 o 1.345000  0.4073000     1.132000  0.5234000     1.557000  0.6243000     -0.4249000     0.8147000 
1 1 1 30 19 15 o 1.505000  0.4550000     1.437000  0.6352000     1.573000  0.6516000     -0.1368000     0.9100000 
1 1 1 30 19 16 o 1.987000  0.4661000     1.798000  0.6530000     2.177000  0.6653000     -0.3800000     0.9323000 
1 1 1 30 19 17 o 1.158000  0.4178000     1.090000  0.5560000     1.227000  0.6239000     -0.1377000     0.8357000 
1 1 1 30 20 0  o 1.794000  0.6291000     1.794000  0.6291000     1.794000  0.6291000     0.000000       0.000000  
1 1 1 30 20 1  o 4.955000  0.1683000     4.963000  0.2384000     4.947000  0.2376000     0.1555000E-01  0.3366000 
1 1 1 30 20 2  o 5.734000  0.1583000     5.791000  0.2233000     5.678000  0.2245000     0.1127000      0.3166000 
1 1 1 30 20 3  o 6.559000  0.1504000     6.533000  0.2145000     6.586000  0.2108000     -0.5302000E-01 0.3007000 
1 1 1 30 20 4  f 6.052000  0.1589000     6.079000  0.2261000     6.025000  0.2233000     0.5409000E-01  0.3178000 
1 1 1 30 20 5  o 3.701000  0.2607000     3.921000  0.3483000     3.480000  0.3881000     0.4410000      0.5215000 
1 1 1 30 20 6  o 1.315000  0.3797000     1.305000  0.5417000     1.325000  0.5323000     -0.1975000E-01 0.7595000 
1 1 1 30 20 7  o 4.019000  0.2514000     3.950000  0.4076000     4.088000  0.2942000     -0.1381000     0.5027000 
1 1 1 30 20 8  o 1.309000  0.4002000     1.321000  0.5836000     1.298000  0.5477000     0.2284000E-01  0.8004000 
1 1 1 30 20 9  o 1.889000  0.4667000     1.912000  0.6868000     1.866000  0.6322000     0.4515000E-01  0.9335000 
1 1 1 30 20 10 o 2.956000  0.3625000     2.914000  0.5051000     2.998000  0.5201000     -0.8396000E-01 0.7250000 
1 1 1 30 20 11 o 1.421000  0.4191000     1.563000  0.5971000     1.279000  0.5882000     0.2844000      0.8382000 
1 1 1 30 20 12 o 2.853000  0.3965000     2.517000  0.5835000     3.189000  0.5370000     -0.6718000     0.7931000 
1 1 1 30 20 13 o 1.570000  0.4375000     1.366000  0.5870000     1.774000  0.6490000     -0.4081000     0.8751000 
1 1 1 30 20 14 o 2.138000  0.4572000     1.990000  0.6474000     2.286000  0.6456000     -0.2962000     0.9143000 
1 1 1 30 20 15 o 2.205000  0.5987000     2.425000  0.9960000     1.984000  0.6645000     0.4418000      1.197000  
1 1 1 30 20 16 o 1.536000  0.4433000     1.580000  0.6281000     1.493000  0.6258000     0.8731000E-01  0.8867000 
1 1 1 30 21 0  o 1.318000  0.6617000     1.318000  0.6617000     1.318000  0.6617000     -0.000000      0.000000  
1 1 1 30 21 1  o 8.306000  0.1402000     8.414000  0.1981000     8.198000  0.1985000     0.2158000      0.2804000 
1 1 1 30 21 2  o 6.200000  0.1582000     6.048000  0.2291000     6.352000  0.2181000     -0.3045000     0.3163000 
1 1 1 30 21 3  o 4.150000  0.2103000     4.278000  0.2922000     4.022000  0.3026000     0.2562000      0.4206000 
1 1 1 30 21 4  o 2.629000  0.3523000     2.570000  0.5529000     2.687000  0.4368000     -0.1171000     0.7046000 
1 1 1 30 21 5  o 5.939000  0.1791000     6.098000  0.2481000     5.781000  0.2584000     0.3173000      0.3582000 
1 1 1 30 21 6  o 3.112000  0.2887000     3.325000  0.3954000     2.900000  0.4206000     0.4245000      0.5773000 
1 1 1 30 21 7  o 3.585000  0.2742000     3.397000  0.3986000     3.773000  0.3767000     -0.3751000     0.5484000 
1 1 1 30 21 8  o 2.149000  0.4709000     2.255000  0.7118000     2.044000  0.6167000     0.2106000      0.9418000 
1 1 1 30 21 9  o 1.158000  0.3670000     1.189000  0.5441000     1.127000  0.4927000     0.6191000E-01  0.7340000 
1 1 1 30 21 10 o 6.225000  0.2649000     5.942000  0.3859000     6.509000  0.3631000     -0.5669000     0.5299000 
1 1 1 30 21 11 o 1.972000  0.5269000     1.584000  0.6262000     2.360000  0.8476000     -0.7767000     1.054000  
1 1 1 30 21 12 o 2.518000  0.4101000     1.774000  0.6298000     3.262000  0.5253000     -1.489000      0.8201000 
1 1 1 30 21 13 o 1.775000  0.4339000     1.330000  0.5670000     2.220000  0.6570000     -0.8902000     0.8679000 
1 1 1 30 21 14 o 1.664000  0.4381000     2.027000  0.6399000     1.302000  0.5986000     0.7252000      0.8762000 
1 1 1 30 21 15 o 2.939000  0.4596000     2.365000  0.7690000     3.512000  0.5037000     -1.148000      0.9193000 
1 1 1 30 21 16 o 1.258000  0.3914000     1.633000  0.6488000     0.8825000 0.4381000     0.7508000      0.7829000 
1 1 1 30 22 0  o 1.529000  0.6808000     1.529000  0.6808000     1.529000  0.6808000     0.000000       0.000000  
1 1 1 30 22 1  o 4.038000  0.2099000     4.050000  0.2911000     4.026000  0.3026000     0.2376000E-01  0.4199000 
1 1 1 30 22 2  o 6.599000  0.1569000     6.279000  0.2254000     6.920000  0.2184000     -0.6417000     0.3139000 
1 1 1 30 22 3  o 5.342000  0.1995000     5.606000  0.2995000     5.077000  0.2638000     0.5294000      0.3991000 
1 1 1 30 22 4  o 5.300000  0.2196000     5.129000  0.3066000     5.471000  0.3146000     -0.3425000     0.4392000 
1 1 1 30 22 5  o 1.164000  0.3627000     1.193000  0.5232000     1.134000  0.5025000     0.5915000E-01  0.7254000 
1 1 1 30 22 6  o 1.117000  0.3566000     1.088000  0.4998000     1.146000  0.5089000     -0.5792000E-01 0.7133000 
1 1 1 30 22 7  o 4.383000  0.3097000     4.731000  0.3207000     4.034000  0.5299000     0.6970000      0.6194000 
1 1 1 30 22 8  o 2.821000  0.4449000     3.317000  0.7360000     2.324000  0.5001000     0.9927000      0.8898000 
1 1 1 30 22 9  o 8.176000  0.1858000     8.177000  0.2939000     8.175000  0.2275000     0.2251000E-02  0.3717000 
1 1 1 30 22 10 o 2.727000  0.3835000     2.412000  0.5751000     3.043000  0.5074000     -0.6307000     0.7669000 
1 1 1 30 22 11 o 3.277000  0.4476000     3.363000  0.4864000     3.192000  0.7516000     0.1706000      0.8952000 
1 1 1 30 22 12 o 2.573000  0.4334000     2.715000  0.5659000     2.431000  0.6567000     0.2837000      0.8669000 
1 1 1 30 22 13 f 1.579000  0.4238000     1.138000  0.5255000     2.019000  0.6652000     -0.8814000     0.8477000 
1 1 1 30 22 14 o 1.787000  0.4743000     1.946000  0.6708000     1.627000  0.6707000     0.3187000      0.9486000 
1 1 1 30 22 15 o 2.473000  0.4180000     1.716000  0.6493000     3.230000  0.5266000     -1.514000      0.8360000 
1 1 1 30 22 16 o 1.690000  0.4484000     1.303000  0.5854000     2.076000  0.6794000     -0.7731000     0.8968000 
1 1 1 30 23 0  o 1.665000  0.6930000     1.665000  0.6930000     1.665000  0.6930000     -0.000000      0.000000  
1 1 1 30 23 1  o 5.850000  0.1671000     5.742000  0.2388000     5.958000  0.2337000     -0.2158000     0.3342000 
1 1 1 30 23 2  o 4.635000  0.2202000     4.511000  0.3419000     4.760000  0.2776000     -0.2486000     0.4404000 
1 1 1 30 23 3  o 1.272000  0.3882000     1.467000  0.5949000     1.077000  0.4990000     0.3902000      0.7764000 
1 1 1 30 23 4  o 6.516000  0.1720000     6.225000  0.2473000     6.807000  0.2390000     -0.5821000     0.3439000 
1 1 1 30 23 5  o 6.450000  0.1719000     6.403000  0.2528000     6.496000  0.2331000     -0.9328000E-01 0.3439000 
1 1 1 30 23 6  o 3.266000  0.3349000     2.721000  0.5386000     3.811000  0.3982000     -1.090000      0.6699000 
1 1 1 30 23 7  o 2.590000  0.4396000     2.614000  0.6132000     2.566000  0.6302000     0.4737000E-01  0.8793000 
1 1 1 30 23 8  o 3.443000  0.2808000     3.747000  0.3758000     3.138000  0.4174000     0.6093000      0.5616000 
1 1 1 30 23 9  o 2.393000  0.4022000     2.387000  0.6322000     2.400000  0.4975000     -0.1321000E-01 0.8044000 
1 1 1 30 23 10 o 2.097000  0.4374000     2.413000  0.6629000     1.781000  0.5707000     0.6325000      0.8747000 
1 1 1 30 23 11 o 2.446000  0.4273000     2.981000  0.4987000     1.912000  0.6939000     1.069000       0.8546000 
1 1 1 30 23 12 o 1.823000  0.4542000     1.743000  0.6229000     1.902000  0.6612000     -0.1595000     0.9084000 
1 1 1 30 23 13 o 1.996000  0.4624000     1.783000  0.6369000     2.209000  0.6704000     -0.4259000     0.9247000 
1 1 1 30 23 14 o 1.358000  0.4713000     1.656000  0.7941000     1.060000  0.5077000     0.5959000      0.9425000 
1 1 1 30 23 15 o 1.462000  0.4314000     1.617000  0.6364000     1.307000  0.5826000     0.3102000      0.8628000 
1 1 1 30 23 16 o 1.866000  0.5007000     1.862000  0.6916000     1.871000  0.7241000     -0.8839000E-02 1.001000  
1 1 1 30 24 0  f 0.7422000 0.5037000     0.7422000 0.5037000     0.7422000 0.5037000     0.000000       0.000000  
1 1 1 30 24 1  o 2.801000  0.3487000     1.869000  0.6156000     3.734000  0.3275000     -1.864000      0.6973000 
1 1 1 30 24 2  o 4.394000  0.2539000     3.784000  0.4102000     5.003000  0.2991000     -1.220000      0.5077000 
1 1 1 30 24 3  o 2.125000  0.4053000     2.286000  0.5561000     1.965000  0.5897000     0.3202000      0.8105000 
1 1 1 30 24 4  o 3.827000  0.2721000     4.258000  0.3203000     3.396000  0.4399000     0.8614000      0.5442000 
1 1 1 30 24 5  o 2.011000  0.4407000     2.075000  0.6278000     1.947000  0.6186000     0.1286000      0.8813000 
1 1 1 30 24 6  o 2.934000  0.4001000     2.913000  0.5725000     2.956000  0.5591000     -0.4296000E-01 0.8002000 
1 1 1 30 24 7  f 2.548000  0.3654000     2.353000  0.5454000     2.742000  0.4862000     -0.3891000     0.7307000 
1 1 1 30 24 8  o 3.823000  0.2554000     4.078000  0.3325000     3.567000  0.3876000     0.5111000      0.5107000 
1 1 1 30 24 9  o 2.005000  0.4257000     2.369000  0.6399000     1.642000  0.5616000     0.7271000      0.8513000 
1 1 1 30 24 10 o 1.448000  0.4242000     1.254000  0.5820000     1.641000  0.6172000     -0.3870000     0.8483000 
1 1 1 30 24 11 o 4.025000  0.2827000     3.535000  0.4168000     4.515000  0.3820000     -0.9802000     0.5653000 
1 1 1 30 24 12 o 2.780000  0.4103000     2.782000  0.5558000     2.777000  0.6036000     0.4464000E-02  0.8205000 
1 1 1 30 24 13 o 1.776000  0.4592000     1.441000  0.6005000     2.111000  0.6949000     -0.6702000     0.9185000 
1 1 1 30 24 14 o 1.041000  0.3584000     1.022000  0.5044000     1.060000  0.5092000     -0.3796000E-01 0.7168000 
1 1 1 30 24 15 o 1.415000  0.4127000     1.719000  0.6358000     1.111000  0.5265000     0.6086000      0.8255000 
1 1 1 30 25 0  o 1.645000  0.8207000     1.645000  0.8207000     1.645000  0.8207000     -0.000000      0.000000  
1 1 1 30 25 1  o 4.153000  0.2946000     4.118000  0.3905000     4.188000  0.4411000     -0.7056000E-01 0.5892000 
1 1 1 30 25 2  o 3.589000  0.3148000     3.860000  0.3544000     3.319000  0.5205000     0.5406000      0.6297000 
1 1 1 30 25 3  o 1.452000  0.4110000     1.265000  0.5554000     1.638000  0.6060000     -0.3735000     0.8221000 
1 1 1 30 25 4  o 2.021000  0.4452000     1.715000  0.6286000     2.326000  0.6306000     -0.6106000     0.8904000 
1 1 1 30 25 5  o 1.723000  0.4573000     1.661000  0.6398000     1.786000  0.6535000     -0.1254000     0.9146000 
1 1 1 30 25 6  o 1.821000  0.4188000     2.041000  0.5932000     1.602000  0.5912000     0.4385000      0.8375000 
1 1 1 30 25 7  o 4.481000  0.2228000     4.385000  0.3223000     4.578000  0.3077000     -0.1927000     0.4456000 
1 1 1 30 25 8  o 4.443000  0.2282000     4.447000  0.3209000     4.439000  0.3246000     0.8202000E-02  0.4564000 
1 1 1 30 25 9  o 2.531000  0.3615000     3.062000  0.4281000     2.000000  0.5826000     1.063000       0.7230000 
1 1 1 30 25 10 o 2.756000  0.4082000     1.737000  0.7028000     3.775000  0.4152000     -2.037000      0.8163000 
1 1 1 30 25 11 o 1.790000  0.4357000     1.697000  0.6580000     1.883000  0.5712000     -0.1861000     0.8714000 
1 1 1 30 25 12 o 2.489000  0.4222000     2.941000  0.5214000     2.036000  0.6642000     0.9057000      0.8443000 
1 1 1 30 25 13 o 1.618000  0.4626000     1.416000  0.6109000     1.820000  0.6948000     -0.4043000     0.9251000 
1 1 1 30 25 14 o 1.729000  0.4537000     1.913000  0.6417000     1.545000  0.6414000     0.3684000      0.9073000 
1 1 1 30 25 15 o 1.080000  0.3632000     1.124000  0.5253000     1.036000  0.5017000     0.8763000E-01  0.7264000 
1 1 1 30 26 0  o 1.390000  0.8020000     1.390000  0.8020000     1.390000  0.8020000     -0.000000      0.000000  
1 1 1 30 26 1  o 1.706000  0.4710000     1.657000  0.6563000     1.756000  0.6758000     -0.9901000E-01 0.9420000 
1 1 1 30 26 2  o 2.959000  0.4177000     2.458000  0.6963000     3.461000  0.4618000     -1.003000      0.8355000 
1 1 1 30 26 3  o 2.524000  0.4356000     2.443000  0.6326000     2.605000  0.5991000     -0.1627000     0.8713000 
1 1 1 30 26 4  o 2.883000  0.3807000     1.952000  0.6739000     3.814000  0.3545000     -1.862000      0.7614000 
1 1 1 30 26 5  o 1.978000  0.4192000     1.903000  0.5998000     2.053000  0.5859000     -0.1496000     0.8385000 
1 1 1 30 26 6  f 2.297000  0.3925000     2.089000  0.5823000     2.504000  0.5264000     -0.4158000     0.7850000 
1 1 1 30 26 7  o 1.021000  0.3390000     1.114000  0.5113000     0.9273000 0.4451000     0.1868000      0.6780000 
1 1 1 30 26 8  o 1.436000  0.4084000     1.376000  0.5678000     1.497000  0.5871000     -0.1217000     0.8168000 
1 1 1 30 26 9  o 4.523000  0.2659000     4.383000  0.4283000     4.662000  0.3152000     -0.2792000     0.5318000 
1 1 1 30 26 10 o 2.108000  0.4356000     2.503000  0.6537000     1.713000  0.5759000     0.7907000      0.8712000 
1 1 1 30 26 11 o 2.278000  0.4144000     1.877000  0.6816000     2.680000  0.4714000     -0.8034000     0.8287000 
1 1 1 30 26 12 o 1.315000  0.3976000     1.556000  0.6097000     1.073000  0.5104000     0.4830000      0.7951000 
1 1 1 30 26 13 o 1.667000  0.5027000     1.635000  0.7679000     1.698000  0.6489000     -0.6333000E-01 1.005000  
1 1 1 30 26 14 o 1.154000  0.3804000     1.164000  0.5385000     1.144000  0.5375000     0.1944000E-01  0.7608000 
1 1 1 30 26 15 o 1.471000  0.4383000     1.383000  0.5995000     1.558000  0.6396000     -0.1750000     0.8767000 
1 1 1 30 27 0  o 0.6900000 0.4812000     0.6900000 0.4812000     0.6900000 0.4812000     0.000000       0.000000  
1 1 1 30 27 1  o 2.905000  0.3370000     2.405000  0.5503000     3.406000  0.3890000     -1.001000      0.6740000 
1 1 1 30 27 2  o 3.097000  0.3181000     2.970000  0.4792000     3.223000  0.4186000     -0.2529000     0.6363000 
1 1 1 30 27 3  o 3.641000  0.2676000     3.450000  0.4022000     3.832000  0.3531000     -0.3825000     0.5352000 
1 1 1 30 27 4  o 3.270000  0.3035000     3.825000  0.3547000     2.716000  0.4926000     1.110000       0.6070000 
1 1 1 30 27 5  f 5.557000  0.1983000     5.304000  0.2928000     5.810000  0.2675000     -0.5057000     0.3966000 
1 1 1 30 27 6  o 2.216000  0.3792000     1.687000  0.5914000     2.745000  0.4747000     -1.058000      0.7584000 
1 1 1 30 27 7  o 1.085000  0.3514000     1.124000  0.5095000     1.046000  0.4839000     0.7810000E-01  0.7027000 
1 1 1 30 27 8  o 4.678000  0.2258000     4.484000  0.3294000     4.871000  0.3089000     -0.3871000     0.4516000 
1 1 1 30 27 9  o 1.973000  0.4435000     1.866000  0.6195000     2.080000  0.6348000     -0.2136000     0.8869000 
1 1 1 30 27 10 o 1.671000  0.4271000     1.740000  0.5977000     1.603000  0.6103000     0.1374000      0.8543000 
1 1 1 30 27 11 o 2.895000  0.3846000     2.655000  0.6534000     3.135000  0.4060000     -0.4806000     0.7693000 
1 1 1 30 27 12 o 4.110000  0.2864000     4.343000  0.4363000     3.877000  0.3710000     0.4658000      0.5727000 
1 1 1 30 27 13 o 2.189000  0.4923000     2.257000  0.7311000     2.122000  0.6594000     0.1350000      0.9845000 
1 1 1 30 27 14 o 2.267000  0.4699000     2.179000  0.6547000     2.355000  0.6743000     -0.1758000     0.9398000 
1 1 1 30 27 15 o 1.207000  0.6039000     1.207000  0.6039000     ?         ?             ?              ?         
1 1 1 30 28 0  o 4.371000  0.3279000     4.371000  0.3279000     4.371000  0.3279000     0.000000       0.000000  
1 1 1 30 28 1  o 3.621000  0.2728000     3.846000  0.3630000     3.396000  0.4075000     0.4496000      0.5457000 
1 1 1 30 28 2  o 5.006000  0.2118000     4.768000  0.3134000     5.245000  0.2850000     -0.4778000     0.4236000 
1 1 1 30 28 3  o 3.742000  0.2625000     3.920000  0.3509000     3.564000  0.3906000     0.3564000      0.5251000 
1 1 1 30 28 4  o 3.673000  0.2654000     3.739000  0.3754000     3.606000  0.3753000     0.1335000      0.5308000 
1 1 1 30 28 5  o 1.179000  0.3648000     1.382000  0.5653000     0.9755000 0.4614000     0.4065000      0.7297000 
1 1 1 30 28 6  o 2.661000  0.3574000     2.729000  0.4927000     2.594000  0.5178000     0.1351000      0.7148000 
1 1 1 30 28 7  o 2.249000  0.3826000     2.831000  0.4958000     1.666000  0.5829000     1.165000       0.7652000 
1 1 1 30 28 8  o 2.513000  0.4266000     2.795000  0.6121000     2.231000  0.5944000     0.5640000      0.8533000 
1 1 1 30 28 9  o 3.760000  0.2786000     3.579000  0.3824000     3.941000  0.4052000     -0.3617000     0.5571000 
1 1 1 30 28 10 o 3.200000  0.3208000     3.399000  0.4064000     3.002000  0.4965000     0.3975000      0.6416000 
1 1 1 30 28 11 o 1.460000  0.4232000     1.436000  0.6241000     1.483000  0.5716000     -0.4665000E-01 0.8463000 
1 1 1 30 28 12 o 3.296000  0.4115000     3.636000  0.6097000     2.957000  0.5528000     0.6791000      0.8230000 
1 1 1 30 28 13 o 2.341000  0.4451000     2.556000  0.5860000     2.127000  0.6702000     0.4294000      0.8902000 
1 1 1 30 28 14 o 1.828000  0.4273000     2.389000  0.6324000     1.266000  0.5747000     1.123000       0.8545000 
1 1 1 30 29 0  o 1.098000  0.6498000     1.098000  0.6498000     1.098000  0.6498000     -0.000000      0.000000  
1 1 1 30 29 1  o 2.612000  0.3707000     2.466000  0.5437000     2.759000  0.5040000     -0.2938000     0.7414000 
1 1 1 30 29 2  o 5.343000  0.2054000     5.338000  0.2902000     5.348000  0.2908000     -0.9288000E-02 0.4108000 
1 1 1 30 29 3  o 2.023000  0.3942000     1.558000  0.5852000     2.489000  0.5284000     -0.9310000     0.7885000 
1 1 1 30 29 4  o 3.548000  0.2787000     3.777000  0.3798000     3.319000  0.4079000     0.4573000      0.5573000 
1 1 1 30 29 5  o 4.669000  0.2252000     4.662000  0.3199000     4.675000  0.3171000     -0.1322000E-01 0.4504000 
1 1 1 30 29 6  o 4.477000  0.2289000     4.630000  0.3163000     4.323000  0.3311000     0.3075000      0.4579000 
1 1 1 30 29 7  o 1.398000  0.3918000     1.662000  0.5906000     1.135000  0.5150000     0.5271000      0.7836000 
1 1 1 30 29 8  o 3.142000  0.3625000     2.673000  0.5730000     3.611000  0.4443000     -0.9380000     0.7251000 
1 1 1 30 29 9  o 2.626000  0.3715000     3.078000  0.4511000     2.173000  0.5905000     0.9052000      0.7431000 
1 1 1 30 29 10 o 1.575000  0.4175000     1.367000  0.5692000     1.783000  0.6109000     -0.4164000     0.8349000 
1 1 1 30 29 11 o 3.452000  0.3207000     3.683000  0.4008000     3.220000  0.5008000     0.4631000      0.6415000 
1 1 1 30 29 12 f 1.851000  0.4965000     2.430000  0.8322000     1.273000  0.5417000     1.156000       0.9930000 
1 1 1 30 29 13 o 1.566000  0.4473000     1.765000  0.6974000     1.367000  0.5602000     0.3981000      0.8945000 
1 1 1 30 29 14 o 1.919000  0.4435000     1.339000  0.5876000     2.500000  0.6646000     -1.161000      0.8871000 
1 1 1 30 30 0  o 3.001000  0.4651000     3.001000  0.4651000     3.001000  0.4651000     -0.000000      0.000000  
1 1 1 30 30 1  o 5.072000  0.2105000     5.173000  0.2881000     4.970000  0.3069000     0.2025000      0.4209000 
1 1 1 30 30 2  o 4.479000  0.2313000     4.201000  0.3419000     4.757000  0.3116000     -0.5565000     0.4626000 
1 1 1 30 30 3  o 3.434000  0.2845000     3.460000  0.4005000     3.407000  0.4041000     0.5307000E-01  0.5689000 
1 1 1 30 30 4  o 2.057000  0.4169000     2.386000  0.5781000     1.728000  0.6008000     0.6576000      0.8337000 
1 1 1 30 30 5  o 3.908000  0.2604000     3.806000  0.3823000     4.009000  0.3536000     -0.2033000     0.5208000 
1 1 1 30 30 6  o 8.014000  0.1701000     7.838000  0.2431000     8.190000  0.2380000     -0.3520000     0.3402000 
1 1 1 30 30 7  o 1.329000  0.4058000     1.477000  0.6180000     1.180000  0.5262000     0.2969000      0.8117000 
1 1 1 30 30 8  o 2.696000  0.3770000     2.554000  0.5381000     2.838000  0.5282000     -0.2842000     0.7540000 
1 1 1 30 30 9  o 2.646000  0.3822000     2.599000  0.5412000     2.694000  0.5399000     -0.9545000E-01 0.7644000 
1 1 1 30 30 10 o 2.246000  0.4110000     2.129000  0.5871000     2.363000  0.5754000     -0.2343000     0.8220000 
1 1 1 30 30 11 o 2.397000  0.4726000     2.515000  0.6225000     2.278000  0.7113000     0.2373000      0.9452000 
1 1 1 30 30 12 o 2.126000  0.4498000     1.918000  0.7193000     2.334000  0.5401000     -0.4158000     0.8995000 
1 1 1 30 30 13 o 3.071000  0.4007000     2.532000  0.7076000     3.610000  0.3763000     -1.078000      0.8014000 
1 1 1 30 30 14 o 1.076000  0.5454000     1.076000  0.5454000     ?         ?             ?              ?         
1 1 1 30 31 0  o 6.689000  0.2591000     6.689000  0.2591000     6.689000  0.2591000     0.000000       0.000000  
1 1 1 30 31 1  o 2.061000  0.3749000     1.336000  0.5614000     2.787000  0.4970000     -1.452000      0.7498000 
1 1 1 30 31 2  f 4.333000  0.2384000     4.093000  0.3513000     4.573000  0.3224000     -0.4794000     0.4768000 
1 1 1 30 31 3  o 2.884000  0.3378000     2.589000  0.5235000     3.179000  0.4270000     -0.5899000     0.6756000 
1 1 1 30 31 4  f 2.451000  0.3849000     2.168000  0.5903000     2.733000  0.4942000     -0.5647000     0.7698000 
1 1 1 30 31 5  o 3.588000  0.2829000     3.590000  0.4017000     3.587000  0.3984000     0.3705000E-02  0.5658000 
1 1 1 30 31 6  o 4.209000  0.2432000     4.013000  0.3503000     4.404000  0.3375000     -0.3911000     0.4864000 
1 1 1 30 31 7  o 4.766000  0.2479000     4.591000  0.3510000     4.942000  0.3500000     -0.3513000     0.4957000 
1 1 1 30 31 8  o 4.385000  0.2432000     4.187000  0.3579000     4.582000  0.3294000     -0.3950000     0.4864000 
1 1 1 30 31 9  o 1.530000  0.4121000     1.757000  0.6009000     1.303000  0.5642000     0.4533000      0.8242000 
1 1 1 30 31 10 o 1.385000  0.4103000     1.191000  0.5340000     1.579000  0.6230000     -0.3878000     0.8205000 
1 1 1 30 31 11 o 2.452000  0.4042000     1.893000  0.6586000     3.011000  0.4689000     -1.119000      0.8085000 
1 1 1 30 31 12 o 1.017000  0.3411000     1.067000  0.4992000     0.9672000 0.4651000     0.9991000E-01  0.6823000 
1 1 1 30 31 13 o 1.357000  0.4194000     1.493000  0.6508000     1.220000  0.5292000     0.2727000      0.8388000 
1 1 1 30 32 0  o 3.484000  0.4057000     3.484000  0.4057000     3.484000  0.4057000     -0.000000      0.000000  
1 1 1 30 32 1  o 2.586000  0.3764000     3.066000  0.4593000     2.105000  0.5966000     0.9616000      0.7529000 
1 1 1 30 32 2  f 3.393000  0.2935000     3.559000  0.3957000     3.227000  0.4337000     0.3319000      0.5871000 
1 1 1 30 32 3  o 4.832000  0.2220000     4.697000  0.3217000     4.967000  0.3060000     -0.2693000     0.4440000 
1 1 1 30 32 4  f 4.153000  0.2542000     4.166000  0.3663000     4.141000  0.3525000     0.2476000E-01  0.5084000 
1 1 1 30 32 5  o 1.710000  0.3973000     2.141000  0.5720000     1.280000  0.5515000     0.8607000      0.7946000 
1 1 1 30 32 6  o 2.673000  0.4587000     2.436000  0.7266000     2.910000  0.5599000     -0.4739000     0.9173000 
1 1 1 30 32 7  o 3.051000  0.3454000     3.176000  0.4276000     2.926000  0.5425000     0.2499000      0.6907000 
1 1 1 30 32 8  o 1.963000  0.3887000     1.298000  0.5556000     2.629000  0.5437000     -1.332000      0.7773000 
1 1 1 30 32 9  o 2.038000  0.4178000     2.536000  0.5491000     1.540000  0.6299000     0.9958000      0.8357000 
1 1 1 30 32 10 o 2.168000  0.4405000     1.399000  0.6080000     2.937000  0.6376000     -1.539000      0.8810000 
1 1 1 30 32 11 o 2.912000  0.3560000     3.318000  0.4530000     2.507000  0.5493000     0.8112000      0.7120000 
1 1 1 30 32 12 o 2.028000  0.4021000     2.606000  0.5409000     1.449000  0.5952000     1.157000       0.8042000 
1 1 1 30 32 13 o 1.898000  0.4629000     2.473000  0.7401000     1.324000  0.5563000     1.148000       0.9259000 
1 1 1 30 33 0  o 1.060000  0.6458000     1.060000  0.6458000     1.060000  0.6458000     0.000000       0.000000  
1 1 1 30 33 1  o 6.887000  0.1849000     6.907000  0.2610000     6.867000  0.2618000     0.3985000E-01  0.3697000 
1 1 1 30 33 2  o 6.375000  0.1963000     6.460000  0.2745000     6.291000  0.2807000     0.1696000      0.3926000 
1 1 1 30 33 3  o 5.745000  0.2016000     5.898000  0.2792000     5.593000  0.2909000     0.3054000      0.4032000 
1 1 1 30 33 4  o 1.429000  0.3945000     1.809000  0.6145000     1.050000  0.4947000     0.7589000      0.7889000 
1 1 1 30 33 5  o 1.754000  0.4079000     1.229000  0.5666000     2.279000  0.5869000     -1.050000      0.8158000 
1 1 1 30 33 6  o 4.773000  0.2535000     4.996000  0.3304000     4.550000  0.3845000     0.4463000      0.5069000 
1 1 1 30 33 7  o 7.146000  0.1875000     7.202000  0.2616000     7.090000  0.2685000     0.1120000      0.3749000 
1 1 1 30 33 8  o 1.422000  0.4137000     1.483000  0.5804000     1.361000  0.5898000     0.1220000      0.8275000 
1 1 1 30 33 9  o 1.935000  0.4729000     1.947000  0.6340000     1.922000  0.7020000     0.2532000E-01  0.9459000 
1 1 1 30 33 10 o 2.075000  0.3876000     1.364000  0.5772000     2.785000  0.5175000     -1.420000      0.7753000 
1 1 1 30 33 11 o 1.335000  0.3958000     1.551000  0.6019000     1.118000  0.5141000     0.4326000      0.7916000 
1 1 1 30 33 12 o 1.329000  0.3805000     1.797000  0.6308000     0.8616000 0.4256000     0.9356000      0.7609000 
1 1 1 30 34 0  o 2.359000  0.6804000     2.359000  0.6804000     2.359000  0.6804000     0.000000       0.000000  
1 1 1 30 34 1  o 2.193000  0.4200000     1.832000  0.6163000     2.554000  0.5707000     -0.7225000     0.8400000 
1 1 1 30 34 2  o 2.451000  0.4069000     2.709000  0.5201000     2.194000  0.6259000     0.5155000      0.8138000 
1 1 1 30 34 3  f 1.707000  0.4309000     1.842000  0.6130000     1.571000  0.6058000     0.2710000      0.8619000 
1 1 1 30 34 4  o 5.892000  0.2311000     6.253000  0.3470000     5.531000  0.3053000     0.7223000      0.4622000 
1 1 1 30 34 5  o 2.386000  0.4608000     1.976000  0.6526000     2.797000  0.6509000     -0.8207000     0.9217000 
1 1 1 30 34 6  o 1.102000  0.3547000     1.250000  0.5389000     0.9532000 0.4614000     0.2968000      0.7095000 
1 1 1 30 34 7  o 1.911000  0.4371000     1.429000  0.5880000     2.393000  0.6469000     -0.9638000     0.8742000 
1 1 1 30 34 8  o 3.922000  0.3278000     3.717000  0.4304000     4.127000  0.4945000     -0.4099000     0.6555000 
1 1 1 30 34 9  o 1.346000  0.4112000     1.417000  0.6066000     1.276000  0.5554000     0.1412000      0.8224000 
1 1 1 30 34 10 o 1.148000  0.3623000     0.8588000 0.4235000     1.437000  0.5880000     -0.5782000     0.7246000 
1 1 1 30 34 11 o 2.469000  0.4094000     2.099000  0.6276000     2.839000  0.5257000     -0.7394000     0.8187000 
1 1 1 30 34 12 o 0.8554000 0.2992000     0.9076000 0.4443000     0.8032000 0.4009000     0.1044000      0.5984000 
1 1 1 30 35 0  o 1.713000  0.7605000     1.713000  0.7605000     1.713000  0.7605000     0.000000       0.000000  
1 1 1 30 35 1  o 3.279000  0.3278000     3.294000  0.4531000     3.264000  0.4739000     0.3014000E-01  0.6556000 
1 1 1 30 35 2  o 5.201000  0.2503000     5.173000  0.3805000     5.229000  0.3254000     -0.5567000E-01 0.5006000 
1 1 1 30 35 3  o 5.103000  0.2720000     4.845000  0.4051000     5.362000  0.3631000     -0.5172000     0.5441000 
1 1 1 30 35 4  o 2.637000  0.4551000     2.756000  0.5776000     2.518000  0.7034000     0.2385000      0.9102000 
1 1 1 30 35 5  o 5.582000  0.2314000     5.895000  0.2907000     5.269000  0.3601000     0.6261000      0.4628000 
1 1 1 30 35 6  o 3.015000  0.3937000     3.270000  0.4583000     2.759000  0.6402000     0.5108000      0.7873000 
1 1 1 30 35 7  o 4.242000  0.3364000     4.876000  0.3745000     3.608000  0.5589000     1.268000       0.6727000 
1 1 1 30 35 8  o 1.482000  0.4276000     1.613000  0.6368000     1.352000  0.5708000     0.2610000      0.8551000 
1 1 1 30 35 9  o 1.707000  0.4390000     1.801000  0.6285000     1.613000  0.6129000     0.1887000      0.8779000 
1 1 1 30 35 10 o 1.437000  0.4180000     1.440000  0.5915000     1.434000  0.5906000     0.6036000E-02  0.8359000 
1 1 1 30 35 11 o 1.342000  0.4023000     1.567000  0.6164000     1.117000  0.5172000     0.4498000      0.8047000 
1 1 1 30 36 0  o 0.6861000 0.4916000     0.6861000 0.4916000     0.6861000 0.4916000     0.000000       0.000000  
1 1 1 30 36 1  o 2.035000  0.4769000     2.125000  0.6947000     1.944000  0.6537000     0.1806000      0.9539000 
1 1 1 30 36 2  o 1.591000  0.4601000     1.320000  0.6198000     1.862000  0.6802000     -0.5419000     0.9202000 
1 1 1 30 36 3  o 2.386000  0.5019000     2.415000  0.6441000     2.356000  0.7700000     0.5860000E-01  1.004000  
1 1 1 30 36 4  o 2.101000  0.3744000     3.010000  0.4889000     1.193000  0.5670000     1.817000       0.7487000 
1 1 1 30 36 5  o 3.525000  0.3465000     3.399000  0.4731000     3.652000  0.5063000     -0.2539000     0.6929000 
1 1 1 30 36 6  o 4.738000  0.2846000     4.579000  0.3810000     4.896000  0.4230000     -0.3177000     0.5693000 
1 1 1 30 36 7  o 1.261000  0.3997000     1.429000  0.6173000     1.094000  0.5080000     0.3347000      0.7994000 
1 1 1 30 36 8  o 1.231000  0.3849000     1.284000  0.5578000     1.179000  0.5305000     0.1056000      0.7698000 
1 1 1 30 36 9  o 2.402000  0.4038000     1.807000  0.6356000     2.997000  0.4982000     -1.190000      0.8076000 
1 1 1 30 36 10 o 1.153000  0.3714000     1.012000  0.4814000     1.293000  0.5656000     -0.2813000     0.7427000 
1 1 1 30 36 11 o 1.688000  0.4140000     1.199000  0.5446000     2.178000  0.6238000     -0.9790000     0.8281000 
1 1 1 30 37 0  o 1.343000  0.7962000     1.343000  0.7962000     1.343000  0.7962000     0.000000       0.000000  
1 1 1 30 37 1  o 3.425000  0.4768000     3.892000  0.5474000     2.958000  0.7809000     0.9336000      0.9536000 
1 1 1 30 37 2  o 4.496000  0.3399000     4.142000  0.4485000     4.851000  0.5109000     -0.7091000     0.6798000 
1 1 1 30 37 3  o 3.634000  0.3524000     3.427000  0.4899000     3.842000  0.5068000     -0.4152000     0.7048000 
1 1 1 30 37 4  o 1.613000  0.4601000     1.596000  0.6372000     1.630000  0.6639000     -0.3431000E-01 0.9203000 
1 1 1 30 37 5  o 2.126000  0.4893000     2.104000  0.6744000     2.149000  0.7090000     -0.4476000E-01 0.9786000 
1 1 1 30 37 6  o 3.155000  0.3709000     3.249000  0.5400000     3.061000  0.5087000     0.1878000      0.7419000 
1 1 1 30 37 7  o 1.786000  0.4423000     1.660000  0.6188000     1.912000  0.6321000     -0.2524000     0.8845000 
1 1 1 30 37 8  o 3.388000  0.3246000     3.393000  0.4596000     3.383000  0.4584000     0.1021000E-01  0.6491000 
1 1 1 30 37 9  o 2.123000  0.4209000     1.657000  0.6142000     2.590000  0.5758000     -0.9333000     0.8418000 
1 1 1 30 37 10 o 1.049000  0.3502000     0.9936000 0.4765000     1.105000  0.5132000     -0.1112000     0.7003000 
1 1 1 30 38 0  o 2.528000  0.7463000     2.528000  0.7463000     2.528000  0.7463000     0.000000       0.000000  
1 1 1 30 38 1  o 3.415000  0.3874000     3.302000  0.5568000     3.527000  0.5388000     -0.2255000     0.7748000 
1 1 1 30 38 2  o 3.688000  0.3636000     3.671000  0.5105000     3.705000  0.5180000     -0.3406000E-01 0.7273000 
1 1 1 30 38 3  o 4.289000  0.2972000     4.550000  0.4270000     4.028000  0.4133000     0.5222000      0.5943000 
1 1 1 30 38 4  o 3.277000  0.3680000     3.395000  0.5373000     3.158000  0.5030000     0.2371000      0.7360000 
1 1 1 30 38 5  o 1.195000  0.3797000     1.045000  0.4924000     1.344000  0.5782000     -0.2985000     0.7594000 
1 1 1 30 38 6  o 6.109000  0.2122000     5.850000  0.3070000     6.368000  0.2929000     -0.5184000     0.4243000 
1 1 1 30 38 7  o 3.594000  0.3104000     3.764000  0.4102000     3.424000  0.4659000     0.3398000      0.6207000 
1 1 1 30 38 8  o 3.200000  0.3532000     3.551000  0.4385000     2.850000  0.5537000     0.7015000      0.7063000 
1 1 1 30 38 9  f 1.046000  0.3519000     1.039000  0.4946000     1.053000  0.5007000     -0.1375000E-01 0.7038000 
1 1 1 30 38 10 o 1.422000  0.4897000     1.197000  0.5840000     1.647000  0.7862000     -0.4497000     0.9794000 
1 1 1 30 39 0  o 1.892000  0.7793000     1.892000  0.7793000     1.892000  0.7793000     -0.000000      0.000000  
1 1 1 30 39 1  o 2.054000  0.4412000     2.245000  0.6068000     1.863000  0.6407000     0.3814000      0.8825000 
1 1 1 30 39 2  o 2.092000  0.4008000     2.819000  0.5477000     1.366000  0.5853000     1.453000       0.8015000 
1 1 1 30 39 3  o 1.444000  0.4225000     1.511000  0.6067000     1.376000  0.5882000     0.1353000      0.8450000 
1 1 1 30 39 4  o 3.548000  0.3109000     3.502000  0.4428000     3.595000  0.4366000     -0.9386000E-01 0.6218000 
1 1 1 30 39 5  o 1.356000  0.4094000     1.356000  0.5734000     1.356000  0.5846000     -0.5566000E-03 0.8189000 
1 1 1 30 39 6  o 1.112000  0.3634000     1.287000  0.5662000     0.9370000 0.4558000     0.3502000      0.7269000 
1 1 1 30 39 7  o 2.364000  0.4427000     2.429000  0.6233000     2.299000  0.6287000     0.1297000      0.8853000 
1 1 1 30 39 8  o 1.026000  0.3472000     1.043000  0.4956000     1.009000  0.4864000     0.3462000E-01  0.6944000 
1 1 1 30 39 9  o 1.440000  0.4212000     1.564000  0.6178000     1.316000  0.5726000     0.2480000      0.8424000 
1 1 1 30 40 0  o 0.7922000 0.5446000     0.7922000 0.5446000     0.7922000 0.5446000     -0.000000      0.000000  
1 1 1 30 40 1  o 1.080000  0.3581000     1.113000  0.5155000     1.048000  0.4972000     0.6507000E-01  0.7162000 
1 1 1 30 40 2  o 2.496000  0.4169000     2.074000  0.6374000     2.918000  0.5376000     -0.8437000     0.8338000 
1 1 1 30 40 3  o 2.841000  0.3863000     2.243000  0.6273000     3.439000  0.4510000     -1.196000      0.7726000 
1 1 1 30 40 4  o 1.299000  0.3991000     1.142000  0.5241000     1.457000  0.6019000     -0.3147000     0.7981000 
1 1 1 30 40 5  o 2.919000  0.3815000     2.582000  0.5887000     3.257000  0.4853000     -0.6749000     0.7629000 
1 1 1 30 40 6  o 4.308000  0.2711000     4.104000  0.3962000     4.511000  0.3703000     -0.4066000     0.5422000 
1 1 1 30 40 7  o 1.246000  0.3954000     1.304000  0.5767000     1.188000  0.5410000     0.1160000      0.7908000 
1 1 1 30 40 8  o 2.140000  0.4566000     2.247000  0.6324000     2.034000  0.6588000     0.2135000      0.9132000 
1 1 1 30 41 0  o 1.345000  0.7463000     1.345000  0.7463000     1.345000  0.7463000     0.000000       0.000000  
1 1 1 30 41 1  o 2.390000  0.4317000     2.184000  0.6243000     2.597000  0.5964000     -0.4136000     0.8634000 
1 1 1 30 41 2  o 1.709000  0.4366000     1.314000  0.5747000     2.104000  0.6573000     -0.7896000     0.8731000 
1 1 1 30 41 3  o 2.461000  0.4244000     2.703000  0.5666000     2.220000  0.6319000     0.4830000      0.8487000 
1 1 1 30 41 4  o 2.483000  0.4224000     2.818000  0.5622000     2.147000  0.6304000     0.6716000      0.8447000 
1 1 1 30 41 5  o 1.258000  0.3973000     1.221000  0.5493000     1.296000  0.5741000     -0.7468000E-01 0.7946000 
1 1 1 30 41 6  o 1.230000  0.3850000     0.9682000 0.4701000     1.492000  0.6098000     -0.5234000     0.7699000 
1 1 1 30 41 7  o 2.421000  0.4196000     3.034000  0.5159000     1.808000  0.6619000     1.225000       0.8392000 
1 1 1 30 42 0  o 1.848000  0.7838000     1.848000  0.7838000     1.848000  0.7838000     -0.000000      0.000000  
1 1 1 30 42 1  o 1.399000  0.4079000     1.693000  0.6285000     1.104000  0.5201000     0.5895000      0.8158000 
1 1 1 30 42 2  o 1.912000  0.4594000     1.880000  0.6470000     1.945000  0.6524000     -0.6469000E-01 0.9188000 
1 1 1 30 42 3  o 1.606000  0.4138000     2.117000  0.6476000     1.096000  0.5152000     1.021000       0.8275000 
1 1 1 30 42 4  f 1.916000  0.4564000     2.147000  0.6503000     1.685000  0.6405000     0.4626000      0.9128000 
1 1 1 30 42 5  o 1.650000  0.4445000     1.952000  0.6702000     1.348000  0.5841000     0.6047000      0.8890000 
1 1 1 30 42 6  o 1.461000  0.4222000     1.677000  0.6343000     1.244000  0.5575000     0.4327000      0.8445000 
1 1 1 30 43 0  o 3.810000  0.4366000     3.810000  0.4366000     3.810000  0.4366000     -0.000000      0.000000  
1 1 1 30 43 1  o 1.360000  0.4136000     1.466000  0.6042000     1.254000  0.5649000     0.2123000      0.8271000 
1 1 1 30 43 2  o 2.635000  0.4307000     2.514000  0.6189000     2.756000  0.5991000     -0.2424000     0.8614000 
1 1 1 30 43 3  o 1.832000  0.4596000     1.677000  0.6406000     1.987000  0.6591000     -0.3103000     0.9191000 
1 1 1 30 43 4  o 2.631000  0.4213000     2.293000  0.6366000     2.969000  0.5519000     -0.6753000     0.8426000 
1 1 1 30 43 5  f 1.627000  0.4457000     1.717000  0.6395000     1.537000  0.6211000     0.1795000      0.8915000 
1 1 1 30 44 0  o 1.675000  0.8024000     1.675000  0.8024000     1.675000  0.8024000     -0.000000      0.000000  
1 1 1 30 44 1  o 4.794000  0.2701000     4.955000  0.3665000     4.632000  0.3969000     0.3233000      0.5402000 
1 1 1 30 44 2  o 1.223000  0.3926000     1.260000  0.5646000     1.186000  0.5456000     0.7451000E-01  0.7851000 
1 1 1 30 44 3  o 1.650000  0.4525000     1.766000  0.6522000     1.534000  0.6276000     0.2313000      0.9051000 
1 1 1 30 44 4  o 1.146000  0.5605000     1.146000  0.5605000     ?         ?             ?              ?         
1 1 1 30 45 0  o 0.9979000 0.6684000     0.9979000 0.6684000     0.9979000 0.6684000     -0.000000      0.000000  
1 1 1 30 45 1  o 1.597000  0.5445000     1.432000  0.7043000     1.763000  0.8305000     -0.3310000     1.089000  
1 1 1 31 0  2  o 2.864000  0.2416000     2.864000  0.2416000     2.864000  0.2416000     -0.000000      0.000000  
1 1 1 31 0  3  o 0.7354000 0.4867000     0.7354000 0.4867000     0.7354000 0.4867000     -0.000000      0.000000  
1 1 1 31 0  4  o 1.727000  0.6821000     1.727000  0.6821000     1.727000  0.6821000     0.000000       0.000000  
1 1 1 31 0  5  o 3.979000  0.3684000     3.979000  0.3684000     3.979000  0.3684000     0.000000       0.000000  
1 1 1 31 0  6  o 4.281000  0.1794000     4.281000  0.1794000     4.281000  0.1794000     -0.000000      0.000000  
1 1 1 31 0  7  o 7.433000  0.1776000     7.433000  0.1776000     7.433000  0.1776000     -0.000000      0.000000  
1 1 1 31 0  8  o 1.192000  0.7045000     1.192000  0.7045000     1.192000  0.7045000     0.000000       0.000000  
1 1 1 31 0  9  o 3.942000  0.3534000     3.942000  0.3534000     3.942000  0.3534000     0.000000       0.000000  
1 1 1 31 0  10 o 1.484000  0.7048000     1.484000  0.7048000     1.484000  0.7048000     0.000000       0.000000  
1 1 1 31 0  11 o 2.087000  0.6831000     2.087000  0.6831000     2.087000  0.6831000     0.000000       0.000000  
1 1 1 31 0  12 o 1.267000  0.7146000     1.267000  0.7146000     1.267000  0.7146000     0.000000       0.000000  
1 1 1 31 0  13 o 0.8701000 0.5813000     0.8701000 0.5813000     0.8701000 0.5813000     0.000000       0.000000  
1 1 1 31 0  14 o 2.162000  0.8658000     2.162000  0.8658000     2.162000  0.8658000     0.000000       0.000000  
1 1 1 31 0  15 o 1.506000  0.7877000     1.506000  0.7877000     1.506000  0.7877000     0.000000       0.000000  
1 1 1 31 0  16 o 1.028000  0.6628000     1.028000  0.6628000     1.028000  0.6628000     0.000000       0.000000  
1 1 1 31 0  17 o 1.195000  0.7469000     1.195000  0.7469000     1.195000  0.7469000     0.000000       0.000000  
1 1 1 31 1  2  o 14.15000  0.1691000     14.14000  0.2372000     14.15000  0.2410000     -0.1153000E-01 0.3382000 
1 1 1 31 1  3  o 7.068000  0.1494000     7.113000  0.2111000     7.023000  0.2116000     0.8988000E-01  0.2989000 
1 1 1 31 1  4  o 2.000000  0.3931000     2.027000  0.5507000     1.974000  0.5611000     0.5336000E-01  0.7862000 
1 1 1 31 1  5  o 5.865000  0.2005000     5.750000  0.2785000     5.980000  0.2885000     -0.2300000     0.4010000 
1 1 1 31 1  6  o 4.445000  0.1286000     4.377000  0.1971000     4.512000  0.1653000     -0.1343000     0.2572000 
1 1 1 31 1  7  o 4.900000  0.1433000     5.062000  0.2182000     4.738000  0.1859000     0.3239000      0.2867000 
1 1 1 31 1  8  o 6.311000  0.2290000     5.671000  0.3237000     6.951000  0.3241000     -1.280000      0.4580000 
1 1 1 31 1  9  o 2.140000  0.4641000     2.323000  0.4917000     1.957000  0.7872000     0.3663000      0.9281000 
1 1 1 31 1  10 o 3.865000  0.2689000     4.025000  0.2583000     3.706000  0.4718000     0.3193000      0.5379000 
1 1 1 31 1  11 o 3.141000  0.3481000     2.776000  0.4688000     3.506000  0.5145000     -0.7296000     0.6961000 
1 1 1 31 1  12 o 2.093000  0.4321000     2.146000  0.6136000     2.040000  0.6087000     0.1063000      0.8643000 
1 1 1 31 1  13 o 1.749000  0.3791000     2.498000  0.5865000     1.000000  0.4805000     1.498000       0.7582000 
1 1 1 31 1  14 o 1.712000  0.4764000     1.933000  0.7056000     1.491000  0.6404000     0.4424000      0.9529000 
1 1 1 31 1  15 o 2.056000  0.4543000     1.719000  0.6471000     2.393000  0.6379000     -0.6748000     0.9086000 
1 1 1 31 1  16 o 1.639000  0.4455000     1.988000  0.6757000     1.290000  0.5807000     0.6986000      0.8909000 
1 1 1 31 1  17 o 1.688000  0.4834000     1.974000  0.7282000     1.402000  0.6359000     0.5720000      0.9668000 
1 1 1 31 2  2  o 3.437000  0.1589000     3.736000  0.1878000     3.137000  0.2565000     0.5985000      0.3179000 
1 1 1 31 2  3  o 3.629000  0.2059000     3.521000  0.2877000     3.738000  0.2946000     -0.2167000     0.4117000 
1 1 1 31 2  4  o 6.145000  0.1978000     6.073000  0.2476000     6.216000  0.3085000     -0.1429000     0.3956000 
1 1 1 31 2  5  o 1.549000  0.4564000     1.543000  0.7119000     1.555000  0.5715000     -0.1274000E-01 0.9129000 
1 1 1 31 2  6  o 2.936000  0.1787000     3.095000  0.2614000     2.777000  0.2439000     0.3180000      0.3575000 
1 1 1 31 2  7  o 2.585000  0.2403000     2.539000  0.3771000     2.630000  0.2979000     -0.9014000E-01 0.4806000 
1 1 1 31 2  8  o 4.522000  0.2719000     4.263000  0.4701000     4.780000  0.2732000     -0.5171000     0.5438000 
1 1 1 31 2  9  o 4.043000  0.4159000     4.575000  0.2792000     3.512000  0.7836000     1.063000       0.8318000 
1 1 1 31 2  10 o 2.599000  0.3616000     3.369000  0.3018000     1.829000  0.6573000     1.539000       0.7233000 
1 1 1 31 2  11 o 2.110000  0.3784000     2.680000  0.3849000     1.540000  0.6515000     1.141000       0.7567000 
1 1 1 31 2  12 o 2.914000  0.4154000     2.992000  0.4797000     2.835000  0.6783000     0.1567000      0.8308000 
1 1 1 31 2  13 o 2.159000  0.4442000     2.171000  0.6265000     2.146000  0.6298000     0.2486000E-01  0.8883000 
1 1 1 31 2  14 o 1.472000  0.4425000     1.784000  0.6926000     1.161000  0.5509000     0.6234000      0.8850000 
1 1 1 31 2  15 o 2.209000  0.4520000     1.862000  0.6596000     2.555000  0.6183000     -0.6933000     0.9041000 
1 1 1 31 2  16 o 1.244000  0.4008000     1.243000  0.5685000     1.244000  0.5650000     -0.6464000E-03 0.8015000 
1 1 1 31 2  17 o 1.448000  0.4531000     1.434000  0.6378000     1.463000  0.6436000     -0.2913000E-01 0.9061000 
1 1 1 31 3  2  o 6.336000  0.1243000     6.316000  0.1611000     6.356000  0.1894000     -0.3997000E-01 0.2486000 
1 1 1 31 3  3  o 4.360000  0.1857000     4.564000  0.2381000     4.157000  0.2851000     0.4068000      0.3714000 
1 1 1 31 3  4  o 5.766000  0.2524000     ?         ?             5.766000  0.2524000     ?              ?         
1 1 1 31 3  5  o 2.109000  0.4048000     1.801000  0.7857000     2.418000  0.1953000     -0.6168000     0.8096000 
1 1 1 31 3  6  o 4.400000  0.1326000     4.444000  0.2021000     4.355000  0.1719000     0.8818000E-01  0.2653000 
1 1 1 31 3  7  o 1.570000  0.3636000     1.624000  0.4810000     1.516000  0.5455000     0.1080000      0.7273000 
1 1 1 31 3  8  o 3.257000  0.3541000     3.315000  0.5929000     3.199000  0.3871000     0.1158000      0.7081000 
1 1 1 31 3  9  o 2.112000  0.4554000     2.083000  0.5191000     2.141000  0.7485000     -0.5752000E-01 0.9109000 
1 1 1 31 3  10 o 2.492000  0.3742000     2.756000  0.3571000     2.227000  0.6577000     0.5292000      0.7484000 
1 1 1 31 3  11 o 3.934000  0.2622000     3.879000  0.2722000     3.988000  0.4481000     -0.1088000     0.5243000 
1 1 1 31 3  12 o 1.294000  0.4025000     0.8935000 0.4238000     1.694000  0.6843000     -0.8006000     0.8049000 
1 1 1 31 3  13 o 1.754000  0.4532000     1.475000  0.5416000     2.032000  0.7269000     -0.5570000     0.9064000 
1 1 1 31 3  14 o 1.900000  0.4200000     1.135000  0.5467000     2.665000  0.6377000     -1.530000      0.8400000 
1 1 1 31 3  15 o 1.631000  0.4476000     1.524000  0.6267000     1.739000  0.6392000     -0.2152000     0.8952000 
1 1 1 31 3  16 o 1.905000  0.4061000     2.692000  0.6198000     1.119000  0.5248000     1.573000       0.8121000 
1 1 1 31 3  17 o 1.295000  0.4133000     1.606000  0.6686000     0.9839000 0.4860000     0.6225000      0.8266000 
1 1 1 31 4  2  o 8.519000  0.1334000     8.542000  0.1743000     8.495000  0.2021000     0.4747000E-01  0.2668000 
1 1 1 31 4  3  o 9.160000  0.1922000     9.193000  0.3341000     9.128000  0.1900000     0.6556000E-01  0.3844000 
1 1 1 31 4  4  o 9.859000  0.4112000     ?         ?             9.859000  0.4112000     ?              ?         
1 1 1 31 4  5  o 3.056000  0.1364000     2.948000  0.2098000     3.163000  0.1744000     -0.2143000     0.2728000 
1 1 1 31 4  6  o 3.888000  0.1635000     3.582000  0.2232000     4.195000  0.2390000     -0.6128000     0.3270000 
1 1 1 31 4  7  o 5.023000  0.1627000     5.068000  0.2022000     4.979000  0.2550000     0.8893000E-01  0.3255000 
1 1 1 31 4  8  o 4.955000  0.1864000     4.841000  0.2654000     5.068000  0.2616000     -0.2266000     0.3727000 
1 1 1 31 4  9  o 1.211000  0.3940000     0.8399000 0.4052000     1.582000  0.6760000     -0.7417000     0.7881000 
1 1 1 31 4  10 o 1.956000  0.3876000     2.258000  0.5070000     1.653000  0.5864000     0.6050000      0.7752000 
1 1 1 31 4  11 o 4.409000  0.2487000     4.541000  0.2562000     4.278000  0.4263000     0.2628000      0.4973000 
1 1 1 31 4  12 o 2.347000  0.4191000     2.885000  0.3828000     1.809000  0.7456000     1.075000       0.8382000 
1 1 1 31 4  13 o 2.615000  0.4225000     2.633000  0.4460000     2.597000  0.7177000     0.3514000E-01  0.8450000 
1 1 1 31 4  14 o 1.295000  0.4234000     1.163000  0.5193000     1.428000  0.6690000     -0.2650000     0.8468000 
1 1 1 31 4  15 o 2.985000  0.3986000     3.116000  0.5462000     2.854000  0.5806000     0.2629000      0.7971000 
1 1 1 31 4  16 o 3.116000  0.3844000     2.968000  0.5837000     3.264000  0.5003000     -0.2960000     0.7687000 
1 1 1 31 4  17 o 1.904000  0.4962000     2.201000  0.7286000     1.607000  0.6737000     0.5939000      0.9923000 
1 1 1 31 5  1  o 1.105000  0.4126000     ?         ?             1.105000  0.4126000     ?              ?         
1 1 1 31 5  2  o 4.182000  0.1941000     4.238000  0.3124000     4.125000  0.2306000     0.1130000      0.3883000 
1 1 1 31 5  3  o 5.597000  0.2162000     5.631000  0.3683000     5.564000  0.2265000     0.6766000E-01  0.4324000 
1 1 1 31 5  5  o 1.219000  0.2973000     1.332000  0.4047000     1.107000  0.4356000     0.2250000      0.5946000 
1 1 1 31 5  6  o 7.950000  0.1265000     7.974000  0.1701000     7.926000  0.1874000     0.4854000E-01  0.2531000 
1 1 1 31 5  7  o 1.138000  0.3315000     1.293000  0.4830000     0.9831000 0.4543000     0.3101000      0.6630000 
1 1 1 31 5  8  o 2.137000  0.3525000     2.553000  0.4127000     1.722000  0.5715000     0.8306000      0.7049000 
1 1 1 31 5  9  o 1.801000  0.3847000     2.297000  0.4745000     1.305000  0.6057000     0.9923000      0.7695000 
1 1 1 31 5  10 o 2.747000  0.3177000     2.530000  0.4518000     2.963000  0.4466000     -0.4322000     0.6353000 
1 1 1 31 5  11 o 1.560000  0.4013000     1.761000  0.5686000     1.359000  0.5664000     0.4025000      0.8026000 
1 1 1 31 5  12 o 2.224000  0.4838000     2.201000  0.5414000     2.247000  0.8019000     -0.4654000E-01 0.9676000 
1 1 1 31 5  13 o 5.278000  0.2487000     5.462000  0.2514000     5.094000  0.4291000     0.3681000      0.4973000 
1 1 1 31 5  14 o 1.803000  0.4162000     2.333000  0.5628000     1.274000  0.6132000     1.059000       0.8323000 
1 1 1 31 5  15 o 2.156000  0.4135000     2.700000  0.4753000     1.612000  0.6768000     1.088000       0.8270000 
1 1 1 31 5  16 o 1.401000  0.4295000     1.198000  0.5232000     1.603000  0.6813000     -0.4055000     0.8590000 
1 1 1 31 5  17 o 1.127000  0.3820000     1.328000  0.6087000     0.9254000 0.4618000     0.4030000      0.7640000 
1 1 1 31 6  1  o 5.534000  0.1290000     5.665000  0.1933000     5.402000  0.1710000     0.2628000      0.2581000 
1 1 1 31 6  2  o 3.870000  0.2205000     3.736000  0.3636000     4.005000  0.2495000     -0.2685000     0.4410000 
1 1 1 31 6  3  o 2.610000  0.3823000     2.426000  0.6589000     2.793000  0.3880000     -0.3674000     0.7647000 
1 1 1 31 6  4  f 3.898000  0.2016000     ?         ?             3.898000  0.2016000     ?              ?         
1 1 1 31 6  5  f 6.014000  0.1265000     5.951000  0.1783000     6.077000  0.1796000     -0.1263000     0.2531000 
1 1 1 31 6  6  o 4.680000  0.1566000     4.551000  0.2138000     4.810000  0.2288000     -0.2589000     0.3131000 
1 1 1 31 6  7  o 8.050000  0.1781000     8.092000  0.2528000     8.009000  0.2511000     0.8221000E-01  0.3563000 
1 1 1 31 6  8  o 6.099000  0.1631000     6.167000  0.2184000     6.031000  0.2422000     0.1353000      0.3262000 
1 1 1 31 6  9  o 1.400000  0.4119000     0.8697000 0.4174000     1.931000  0.7103000     -1.061000      0.8239000 
1 1 1 31 6  10 o 2.557000  0.3490000     3.168000  0.3609000     1.947000  0.5976000     1.222000       0.6981000 
1 1 1 31 6  11 o 1.558000  0.4109000     1.549000  0.5611000     1.568000  0.6004000     -0.1931000E-01 0.8217000 
1 1 1 31 6  12 f 1.527000  0.4299000     1.535000  0.6023000     1.519000  0.6138000     0.1691000E-01  0.8599000 
1 1 1 31 6  13 o 2.251000  0.3763000     1.518000  0.5608000     2.984000  0.5019000     -1.466000      0.7526000 
1 1 1 31 6  14 f 2.506000  0.4874000     2.508000  0.4814000     2.503000  0.8476000     0.4643000E-02  0.9748000 
1 1 1 31 6  15 o 1.607000  0.4494000     1.344000  0.5408000     1.870000  0.7179000     -0.5255000     0.8988000 
1 1 1 31 6  16 o 1.331000  0.4007000     1.460000  0.5632000     1.202000  0.5702000     0.2584000      0.8014000 
1 1 1 31 6  17 o 1.071000  0.3707000     0.9792000 0.4691000     1.163000  0.5742000     -0.1842000     0.7415000 
1 1 1 31 7  0  f 6.757000  0.1752000     6.757000  0.1752000     6.757000  0.1752000     -0.000000      0.000000  
1 1 1 31 7  1  o 5.300000  0.1515000     5.323000  0.2354000     5.276000  0.1909000     0.4695000E-01  0.3031000 
1 1 1 31 7  2  o 2.889000  0.2942000     2.993000  0.4590000     2.785000  0.3682000     0.2081000      0.5884000 
1 1 1 31 7  3  o 1.813000  0.4184000     1.674000  0.6446000     1.951000  0.5334000     -0.2762000     0.8367000 
1 1 1 31 7  4  o 6.027000  0.1121000     5.923000  0.1476000     6.130000  0.1688000     -0.2070000     0.2242000 
1 1 1 31 7  5  o 2.950000  0.1987000     2.947000  0.2669000     2.954000  0.2944000     -0.6429000E-02 0.3974000 
1 1 1 31 7  6  o 1.105000  0.3267000     1.199000  0.4697000     1.011000  0.4541000     0.1879000      0.6533000 
1 1 1 31 7  7  o 1.443000  0.3735000     1.864000  0.5648000     1.022000  0.4889000     0.8421000      0.7470000 
1 1 1 31 7  8  o 1.617000  0.3992000     1.663000  0.5459000     1.570000  0.5826000     0.9273000E-01  0.7984000 
1 1 1 31 7  9  o 2.903000  0.3135000     2.816000  0.4163000     2.990000  0.4688000     -0.1742000     0.6270000 
1 1 1 31 7  10 o 3.519000  0.2619000     3.644000  0.3279000     3.393000  0.4085000     0.2505000      0.5238000 
1 1 1 31 7  11 o 2.698000  0.3483000     2.704000  0.4589000     2.692000  0.5240000     0.1261000E-01  0.6965000 
1 1 1 31 7  12 o 1.525000  0.4422000     1.745000  0.6739000     1.305000  0.5727000     0.4402000      0.8844000 
1 1 1 31 7  13 o 1.376000  0.4002000     1.511000  0.5863000     1.242000  0.5448000     0.2692000      0.8003000 
1 1 1 31 7  14 o 2.913000  0.3622000     2.867000  0.5001000     2.958000  0.5241000     -0.9051000E-01 0.7244000 
1 1 1 31 7  15 o 2.043000  0.4481000     2.273000  0.5373000     1.813000  0.7172000     0.4603000      0.8961000 
1 1 1 31 7  16 o 1.712000  0.4507000     1.117000  0.5026000     2.306000  0.7484000     -1.189000      0.9015000 
1 1 1 31 7  17 o 1.883000  0.5475000     2.071000  0.7990000     1.696000  0.7488000     0.3753000      1.095000  
1 1 1 31 8  0  o 5.828000  0.1792000     5.828000  0.1792000     5.828000  0.1792000     -0.000000      0.000000  
1 1 1 31 8  1  o 6.785000  0.1203000     7.024000  0.1477000     6.545000  0.1899000     0.4794000      0.2405000 
1 1 1 31 8  2  o 2.544000  0.3401000     2.433000  0.5549000     2.656000  0.3935000     -0.2226000     0.6803000 
1 1 1 31 8  3  o 5.486000  0.1437000     5.405000  0.2340000     5.567000  0.1667000     -0.1620000     0.2874000 
1 1 1 31 8  4  o 1.143000  0.3118000     1.148000  0.4402000     1.138000  0.4416000     0.1027000E-01  0.6235000 
1 1 1 31 8  5  o 2.763000  0.2269000     2.877000  0.2927000     2.650000  0.3468000     0.2268000      0.4538000 
1 1 1 31 8  6  o 3.772000  0.1929000     3.770000  0.2576000     3.774000  0.2872000     -0.4389000E-02 0.3859000 
1 1 1 31 8  7  o 4.066000  0.4035000     4.503000  0.7360000     3.629000  0.3312000     0.8739000      0.8071000 
1 1 1 31 8  8  o 2.786000  0.3277000     3.159000  0.3672000     2.413000  0.5429000     0.7459000      0.6554000 
1 1 1 31 8  9  o 3.719000  0.2460000     3.715000  0.3256000     3.723000  0.3688000     -0.8688000E-02 0.4919000 
1 1 1 31 8  10 o 2.867000  0.3827000     2.529000  0.6275000     3.205000  0.4382000     -0.6763000     0.7654000 
1 1 1 31 8  11 o 2.502000  0.3727000     2.914000  0.4201000     2.091000  0.6157000     0.8230000      0.7454000 
1 1 1 31 8  12 o 1.965000  0.5817000     2.375000  0.9889000     1.555000  0.6130000     0.8192000      1.163000  
1 1 1 31 8  13 o 2.632000  0.3766000     3.084000  0.4483000     2.181000  0.6052000     0.9027000      0.7532000 
1 1 1 31 8  14 o 3.456000  0.2985000     3.465000  0.3994000     3.447000  0.4438000     0.1783000E-01  0.5970000 
1 1 1 31 8  15 o 1.682000  0.4262000     1.355000  0.5690000     2.009000  0.6347000     -0.6540000     0.8524000 
1 1 1 31 8  16 o 1.333000  0.3953000     1.160000  0.5155000     1.506000  0.5994000     -0.3461000     0.7906000 
1 1 1 31 8  17 o 1.689000  0.4865000     2.278000  0.8087000     1.100000  0.5412000     1.178000       0.9731000 
1 1 1 31 9  0  o 9.988000  0.1482000     9.988000  0.1482000     9.988000  0.1482000     -0.000000      0.000000  
1 1 1 31 9  1  o 3.071000  0.1511000     3.180000  0.2255000     2.963000  0.2011000     0.2175000      0.3021000 
1 1 1 31 9  2  o 1.291000  0.2961000     1.059000  0.4238000     1.522000  0.4135000     -0.4632000     0.5921000 
1 1 1 31 9  3  o 5.420000  0.1413000     5.322000  0.1914000     5.518000  0.2079000     -0.1959000     0.2826000 
1 1 1 31 9  4  o 3.282000  0.1829000     3.294000  0.2546000     3.270000  0.2627000     0.2434000E-01  0.3658000 
1 1 1 31 9  5  o 9.227000  0.1357000     9.083000  0.1995000     9.372000  0.1840000     -0.2898000     0.2714000 
1 1 1 31 9  6  o 5.986000  0.1741000     5.848000  0.2040000     6.123000  0.2822000     -0.2748000     0.3482000 
1 1 1 31 9  7  o 5.154000  0.2215000     4.619000  0.3718000     5.689000  0.2410000     -1.070000      0.4430000 
1 1 1 31 9  8  o 3.675000  0.2596000     3.623000  0.3429000     3.726000  0.3899000     -0.1031000     0.5192000 
1 1 1 31 9  9  o 4.731000  0.2060000     4.679000  0.2761000     4.784000  0.3058000     -0.1055000     0.4120000 
1 1 1 31 9  10 o 4.412000  0.2461000     4.768000  0.2765000     4.056000  0.4072000     0.7119000      0.4922000 
1 1 1 31 9  11 o 3.532000  0.2826000     3.132000  0.4134000     3.931000  0.3855000     -0.7991000     0.5652000 
1 1 1 31 9  12 o 2.115000  0.5470000     1.975000  0.8994000     2.254000  0.6230000     -0.2787000     1.094000  
1 1 1 31 9  13 o 2.087000  0.4438000     1.996000  0.6018000     2.178000  0.6524000     -0.1814000     0.8876000 
1 1 1 31 9  14 o 2.270000  0.4193000     2.176000  0.5891000     2.364000  0.5967000     -0.1882000     0.8385000 
1 1 1 31 9  15 o 1.035000  0.3435000     1.066000  0.4935000     1.005000  0.4780000     0.6088000E-01  0.6870000 
1 1 1 31 9  16 o 1.305000  0.4008000     1.276000  0.5507000     1.334000  0.5824000     -0.5832000E-01 0.8015000 
1 1 1 31 9  17 o 1.392000  0.4520000     1.520000  0.7085000     1.265000  0.5614000     0.2555000      0.9039000 
1 1 1 31 10 0  o 11.65000  0.1857000     11.65000  0.1857000     11.65000  0.1857000     -0.000000      0.000000  
1 1 1 31 10 1  o 7.325000  0.1072000     7.328000  0.1722000     7.321000  0.1278000     0.7483000E-02  0.2144000 
1 1 1 31 10 2  o 7.228000  0.1191000     7.115000  0.1770000     7.342000  0.1595000     -0.2270000     0.2383000 
1 1 1 31 10 3  o 1.353000  0.3482000     1.495000  0.5185000     1.212000  0.4650000     0.2836000      0.6965000 
1 1 1 31 10 4  o 2.870000  0.2218000     2.846000  0.3163000     2.895000  0.3112000     -0.4842000E-01 0.4437000 
1 1 1 31 10 5  o 1.147000  0.3349000     1.109000  0.4632000     1.185000  0.4837000     -0.7660000E-01 0.6697000 
1 1 1 31 10 6  o 3.721000  0.2546000     3.557000  0.3314000     3.884000  0.3867000     -0.3272000     0.5093000 
1 1 1 31 10 7  o 3.136000  0.2767000     3.178000  0.3862000     3.094000  0.3964000     0.8411000E-01  0.5534000 
1 1 1 31 10 8  f 1.877000  0.4365000     1.336000  0.5488000     2.418000  0.6791000     -1.082000      0.8731000 
1 1 1 31 10 9  o 1.989000  0.4032000     2.265000  0.5247000     1.713000  0.6123000     0.5518000      0.8063000 
1 1 1 31 10 10 o 3.642000  0.2632000     3.397000  0.3721000     3.887000  0.3722000     -0.4903000     0.5263000 
1 1 1 31 10 11 o 1.834000  0.4098000     2.173000  0.5631000     1.496000  0.5956000     0.6776000      0.8196000 
1 1 1 31 10 12 o 1.801000  0.4639000     1.734000  0.6862000     1.868000  0.6244000     -0.1339000     0.9277000 
1 1 1 31 10 13 o 1.361000  0.4140000     1.435000  0.5913000     1.287000  0.5796000     0.1475000      0.8280000 
1 1 1 31 10 14 o 1.841000  0.4240000     2.025000  0.5799000     1.658000  0.6188000     0.3668000      0.8481000 
1 1 1 31 10 15 o 1.273000  0.3920000     1.250000  0.5440000     1.297000  0.5646000     -0.4660000E-01 0.7841000 
1 1 1 31 10 16 o 1.496000  0.4290000     1.523000  0.6067000     1.470000  0.6066000     0.5265000E-01  0.8579000 
1 1 1 31 10 17 o 0.9504000 0.3342000     0.9560000 0.4852000     0.9448000 0.4597000     0.1116000E-01  0.6684000 
1 1 1 31 11 0  o 5.959000  0.1514000     5.959000  0.1514000     5.959000  0.1514000     0.000000       0.000000  
1 1 1 31 11 1  o 1.839000  0.2968000     1.828000  0.4776000     1.850000  0.3524000     -0.2190000E-01 0.5936000 
1 1 1 31 11 2  o 2.428000  0.2502000     2.767000  0.3518000     2.089000  0.3559000     0.6779000      0.5004000 
1 1 1 31 11 3  o 3.638000  0.1791000     3.599000  0.2540000     3.678000  0.2527000     -0.7900000E-01 0.3583000 
1 1 1 31 11 4  o 3.017000  0.2260000     3.436000  0.2740000     2.598000  0.3594000     0.8375000      0.4519000 
1 1 1 31 11 5  o 3.606000  0.2022000     3.491000  0.2854000     3.720000  0.2864000     -0.2290000     0.4043000 
1 1 1 31 11 6  o 5.058000  0.3411000     4.820000  0.6432000     5.296000  0.2272000     -0.4762000     0.6822000 
1 1 1 31 11 7  o 1.210000  0.3603000     1.059000  0.4735000     1.361000  0.5431000     -0.3014000     0.7205000 
1 1 1 31 11 8  o 2.104000  0.4351000     2.304000  0.5361000     1.904000  0.6855000     0.3999000      0.8702000 
1 1 1 31 11 9  o 2.859000  0.3136000     2.546000  0.4644000     3.171000  0.4216000     -0.6257000     0.6272000 
1 1 1 31 11 10 o 1.108000  0.3563000     0.9233000 0.4410000     1.293000  0.5598000     -0.3697000     0.7126000 
1 1 1 31 11 11 o 1.427000  0.4124000     1.507000  0.5737000     1.347000  0.5926000     0.1596000      0.8248000 
1 1 1 31 11 12 o 5.349000  0.2100000     5.228000  0.2876000     5.470000  0.3060000     -0.2417000     0.4200000 
1 1 1 31 11 13 o 1.521000  0.4586000     1.440000  0.5863000     1.603000  0.7054000     -0.1630000     0.9172000 
1 1 1 31 11 14 f 1.213000  0.3797000     1.123000  0.5056000     1.303000  0.5667000     -0.1799000     0.7595000 
1 1 1 31 11 15 o 1.696000  0.4394000     1.755000  0.6216000     1.636000  0.6213000     0.1186000      0.8788000 
1 1 1 31 11 16 o 1.578000  0.4305000     1.740000  0.6178000     1.416000  0.5998000     0.3236000      0.8611000 
1 1 1 31 11 17 o 1.765000  0.4815000     1.925000  0.7326000     1.605000  0.6252000     0.3196000      0.9631000 
1 1 1 31 12 0  o 9.275000  0.1735000     9.275000  0.1735000     9.275000  0.1735000     -0.000000      0.000000  
1 1 1 31 12 1  o 10.33000  0.1243000     10.24000  0.1920000     10.42000  0.1579000     -0.1764000     0.2486000 
1 1 1 31 12 2  o 3.006000  0.2619000     2.865000  0.4519000     3.146000  0.2649000     -0.2804000     0.5238000 
1 1 1 31 12 3  f 3.814000  0.1755000     3.728000  0.2896000     3.900000  0.1981000     -0.1714000     0.3509000 
1 1 1 31 12 4  o 7.338000  0.1413000     7.417000  0.2057000     7.260000  0.1936000     0.1572000      0.2825000 
1 1 1 31 12 5  o 6.202000  0.2064000     6.490000  0.2636000     5.914000  0.3176000     0.5765000      0.4128000 
1 1 1 31 12 6  o 1.154000  0.3653000     1.336000  0.5748000     0.9729000 0.4509000     0.3630000      0.7305000 
1 1 1 31 12 7  o 1.584000  0.3938000     1.635000  0.5490000     1.534000  0.5648000     0.1013000      0.7877000 
1 1 1 31 12 8  f 1.998000  0.4346000     1.939000  0.5295000     2.057000  0.6894000     -0.1178000     0.8693000 
1 1 1 31 12 9  o 1.496000  0.4042000     1.368000  0.5383000     1.624000  0.6033000     -0.2557000     0.8085000 
1 1 1 31 12 10 o 1.134000  0.3778000     1.169000  0.5495000     1.100000  0.5185000     0.6902000E-01  0.7555000 
1 1 1 31 12 11 o 4.367000  0.2599000     4.450000  0.3206000     4.283000  0.4091000     0.1666000      0.5197000 
1 1 1 31 12 12 o 1.628000  0.4256000     1.747000  0.5966000     1.509000  0.6071000     0.2386000      0.8512000 
1 1 1 31 12 13 o 2.213000  0.5685000     1.872000  0.6137000     2.553000  0.9571000     -0.6815000     1.137000  
1 1 1 31 12 14 o 1.519000  0.4235000     1.496000  0.5850000     1.543000  0.6126000     -0.4657000E-01 0.8471000 
1 1 1 31 12 15 o 1.466000  0.4173000     1.549000  0.5934000     1.384000  0.5869000     0.1653000      0.8346000 
1 1 1 31 12 16 o 2.127000  0.4426000     2.125000  0.6127000     2.129000  0.6389000     -0.4351000E-02 0.8852000 
1 1 1 31 12 17 o 1.577000  0.4323000     1.725000  0.6246000     1.429000  0.5978000     0.2968000      0.8646000 
1 1 1 31 13 0  o 2.465000  0.4140000     2.465000  0.4140000     2.465000  0.4140000     0.000000       0.000000  
1 1 1 31 13 1  o 4.560000  0.1574000     4.716000  0.2300000     4.404000  0.2149000     0.3115000      0.3148000 
1 1 1 31 13 2  o 1.204000  0.3347000     1.203000  0.5024000     1.206000  0.4423000     -0.3099000E-02 0.6694000 
1 1 1 31 13 3  o 5.645000  0.1411000     5.785000  0.2248000     5.505000  0.1706000     0.2798000      0.2822000 
1 1 1 31 13 4  o 3.904000  0.2454000     3.934000  0.2959000     3.874000  0.3916000     0.6065000E-01  0.4909000 
1 1 1 31 13 5  o 1.950000  0.4009000     1.564000  0.6664000     2.336000  0.4459000     -0.7721000     0.8018000 
1 1 1 31 13 6  o 1.650000  0.3608000     1.911000  0.4983000     1.389000  0.5219000     0.5226000      0.7215000 
1 1 1 31 13 7  o 4.548000  0.1968000     4.258000  0.2790000     4.839000  0.2777000     -0.5801000     0.3936000 
1 1 1 31 13 8  o 1.831000  0.4124000     1.747000  0.5540000     1.915000  0.6109000     -0.1679000     0.8247000 
1 1 1 31 13 9  o 2.270000  0.3906000     2.112000  0.5497000     2.429000  0.5551000     -0.3177000     0.7812000 
1 1 1 31 13 10 o 1.278000  0.3865000     1.243000  0.5315000     1.313000  0.5614000     -0.6939000E-01 0.7730000 
1 1 1 31 13 11 o 1.397000  0.4281000     1.350000  0.5949000     1.444000  0.6157000     -0.9450000E-01 0.8562000 
1 1 1 31 13 12 o 4.066000  0.2643000     4.287000  0.3341000     3.844000  0.4095000     0.4427000      0.5285000 
1 1 1 31 13 13 o 1.770000  0.4421000     2.166000  0.6031000     1.375000  0.6465000     0.7910000      0.8841000 
1 1 1 31 13 14 o 1.931000  0.4421000     2.132000  0.6169000     1.730000  0.6333000     0.4023000      0.8842000 
1 1 1 31 13 15 o 1.583000  0.4343000     1.549000  0.6000000     1.617000  0.6282000     -0.6779000E-01 0.8687000 
1 1 1 31 13 16 o 1.088000  0.3633000     0.9588000 0.4626000     1.217000  0.5602000     -0.2582000     0.7265000 
1 1 1 31 13 17 o 1.060000  0.3605000     1.168000  0.5440000     0.9522000 0.4731000     0.2155000      0.7209000 
1 1 1 31 14 0  o 1.292000  0.6767000     1.292000  0.6767000     1.292000  0.6767000     -0.000000      0.000000  
1 1 1 31 14 1  o 6.386000  0.1528000     6.259000  0.1980000     6.514000  0.2327000     -0.2546000     0.3055000 
1 1 1 31 14 2  o 1.991000  0.3226000     2.385000  0.3760000     1.598000  0.5243000     0.7866000      0.6452000 
1 1 1 31 14 3  o 3.686000  0.2231000     3.999000  0.3309000     3.374000  0.2992000     0.6242000      0.4461000 
1 1 1 31 14 4  o 3.034000  0.3356000     ?         ?             3.034000  0.3356000     ?              ?         
1 1 1 31 14 5  o 0.9646000 0.3130000     0.9119000 0.4282000     1.017000  0.4566000     -0.1056000     0.6260000 
1 1 1 31 14 6  o 3.716000  0.2232000     3.852000  0.2958000     3.580000  0.3343000     0.2718000      0.4463000 
1 1 1 31 14 7  o 1.264000  0.3789000     1.227000  0.5120000     1.302000  0.5586000     -0.7504000E-01 0.7577000 
1 1 1 31 14 8  o 1.952000  0.3918000     2.147000  0.5187000     1.756000  0.5874000     0.3914000      0.7836000 
1 1 1 31 14 9  o 2.243000  0.3807000     2.640000  0.4645000     1.846000  0.6034000     0.7947000      0.7615000 
1 1 1 31 14 10 o 3.399000  0.3452000     3.274000  0.5465000     3.525000  0.4220000     -0.2516000     0.6904000 
1 1 1 31 14 11 o 3.330000  0.5394000     2.479000  1.014000      4.181000  0.3692000     -1.702000      1.079000  
1 1 1 31 14 12 o 2.974000  0.3545000     3.070000  0.4586000     2.877000  0.5408000     0.1928000      0.7091000 
1 1 1 31 14 13 o 1.677000  0.4374000     1.808000  0.6074000     1.547000  0.6297000     0.2612000      0.8749000 
1 1 1 31 14 14 o 2.431000  0.4163000     2.566000  0.5692000     2.295000  0.6075000     0.2709000      0.8325000 
1 1 1 31 14 15 o 2.074000  0.4537000     2.000000  0.6386000     2.148000  0.6447000     -0.1478000     0.9075000 
1 1 1 31 14 16 f 1.076000  0.3629000     0.8510000 0.4253000     1.301000  0.5882000     -0.4503000     0.7259000 
1 1 1 31 15 0  o 5.940000  0.1998000     5.940000  0.1998000     5.940000  0.1998000     0.000000       0.000000  
1 1 1 31 15 1  o 6.329000  0.1478000     6.452000  0.2030000     6.207000  0.2149000     0.2453000      0.2956000 
1 1 1 31 15 2  o 4.528000  0.1831000     4.555000  0.2609000     4.501000  0.2570000     0.5453000E-01  0.3662000 
1 1 1 31 15 3  o 6.579000  0.1507000     6.365000  0.2267000     6.793000  0.1985000     -0.4284000     0.3013000 
1 1 1 31 15 4  o 5.081000  0.1676000     5.229000  0.2718000     4.932000  0.1962000     0.2978000      0.3352000 
1 1 1 31 15 5  o 2.983000  0.2587000     2.963000  0.4250000     3.003000  0.2952000     -0.4021000E-01 0.5174000 
1 1 1 31 15 6  o 1.889000  0.3883000     1.794000  0.5587000     1.985000  0.5394000     -0.1909000     0.7766000 
1 1 1 31 15 7  o 5.329000  0.2119000     5.067000  0.2718000     5.590000  0.3251000     -0.5229000     0.4238000 
1 1 1 31 15 8  o 2.802000  0.3177000     2.652000  0.4424000     2.952000  0.4562000     -0.3006000     0.6355000 
1 1 1 31 15 9  f 2.716000  0.3466000     2.891000  0.4336000     2.540000  0.5409000     0.3516000      0.6933000 
1 1 1 31 15 10 o 1.463000  0.4074000     1.733000  0.5982000     1.193000  0.5533000     0.5397000      0.8148000 
1 1 1 31 15 11 o 3.151000  0.4072000     2.706000  0.6912000     3.597000  0.4308000     -0.8904000     0.8144000 
1 1 1 31 15 12 o 2.642000  0.3888000     3.175000  0.4530000     2.109000  0.6320000     1.066000       0.7776000 
1 1 1 31 15 13 f 2.411000  0.4176000     2.727000  0.5364000     2.096000  0.6401000     0.6307000      0.8351000 
1 1 1 31 15 14 o 1.645000  0.3878000     2.263000  0.6001000     1.026000  0.4912000     1.237000       0.7756000 
1 1 1 31 15 15 o 1.230000  0.3907000     1.105000  0.5171000     1.356000  0.5858000     -0.2509000     0.7814000 
1 1 1 31 15 16 o 1.384000  0.4453000     1.280000  0.6425000     1.488000  0.6168000     -0.2077000     0.8907000 
1 1 1 31 16 0  o 5.596000  0.1976000     5.596000  0.1976000     5.596000  0.1976000     0.000000       0.000000  
1 1 1 31 16 1  o 3.687000  0.1798000     3.801000  0.2544000     3.573000  0.2542000     0.2287000      0.3597000 
1 1 1 31 16 2  o 5.578000  0.1428000     5.555000  0.2110000     5.602000  0.1925000     -0.4774000E-01 0.2856000 
1 1 1 31 16 3  o 3.293000  0.2189000     3.366000  0.3281000     3.220000  0.2900000     0.1463000      0.4379000 
1 1 1 31 16 4  o 5.733000  0.1592000     5.627000  0.2606000     5.839000  0.1830000     -0.2128000     0.3185000 
1 1 1 31 16 5  o 1.263000  0.3600000     1.587000  0.5801000     0.9403000 0.4264000     0.6463000      0.7200000 
1 1 1 31 16 6  o 2.054000  0.3606000     2.695000  0.4740000     1.413000  0.5436000     1.282000       0.7212000 
1 1 1 31 16 7  o 1.846000  0.4004000     1.346000  0.5412000     2.346000  0.5904000     -0.9998000     0.8009000 
1 1 1 31 16 8  o 3.727000  0.2803000     3.658000  0.3305000     3.796000  0.4527000     -0.1375000     0.5605000 
1 1 1 31 16 9  o 1.453000  0.3965000     1.690000  0.5766000     1.215000  0.5444000     0.4744000      0.7930000 
1 1 1 31 16 10 o 1.943000  0.4619000     1.584000  0.6438000     2.303000  0.6626000     -0.7189000     0.9239000 
1 1 1 31 16 11 o 1.613000  0.4327000     1.770000  0.6267000     1.456000  0.5968000     0.3131000      0.8654000 
1 1 1 31 16 12 o 3.848000  0.3071000     3.047000  0.4888000     4.649000  0.3721000     -1.602000      0.6143000 
1 1 1 31 16 13 o 1.783000  0.4313000     2.088000  0.6145000     1.478000  0.6054000     0.6100000      0.8626000 
1 1 1 31 16 14 o 1.199000  0.3763000     0.8888000 0.4359000     1.509000  0.6135000     -0.6199000     0.7525000 
1 1 1 31 16 15 o 2.110000  0.4517000     1.975000  0.6340000     2.245000  0.6436000     -0.2703000     0.9034000 
1 1 1 31 16 16 o 1.316000  0.4432000     1.372000  0.6833000     1.260000  0.5647000     0.1120000      0.8864000 
1 1 1 31 17 0  o 4.967000  0.2180000     4.967000  0.2180000     4.967000  0.2180000     -0.000000      0.000000  
1 1 1 31 17 1  o 2.889000  0.2311000     2.883000  0.3337000     2.895000  0.3197000     -0.1227000E-01 0.4621000 
1 1 1 31 17 2  o 2.617000  0.2733000     2.388000  0.4402000     2.846000  0.3241000     -0.4589000     0.5466000 
1 1 1 31 17 3  o 2.251000  0.3073000     2.539000  0.3984000     1.962000  0.4679000     0.5772000      0.6145000 
1 1 1 31 17 4  o 3.510000  0.2104000     3.709000  0.2957000     3.312000  0.2994000     0.3963000      0.4208000 
1 1 1 31 17 5  o 4.376000  0.2003000     4.392000  0.3216000     4.360000  0.2388000     0.3224000E-01  0.4006000 
1 1 1 31 17 6  o 4.255000  0.2134000     3.961000  0.3420000     4.549000  0.2554000     -0.5882000     0.4269000 
1 1 1 31 17 7  o 2.370000  0.3632000     2.235000  0.5119000     2.504000  0.5155000     -0.2681000     0.7265000 
1 1 1 31 17 8  o 3.078000  0.3087000     3.056000  0.4018000     3.100000  0.4688000     -0.4415000E-01 0.6174000 
1 1 1 31 17 9  o 1.464000  0.4035000     1.184000  0.5207000     1.744000  0.6167000     -0.5597000     0.8071000 
1 1 1 31 17 10 o 2.169000  0.5459000     2.155000  0.8973000     2.182000  0.6219000     -0.2764000E-01 1.092000  
1 1 1 31 17 11 o 1.353000  0.4053000     1.163000  0.5297000     1.542000  0.6135000     -0.3787000     0.8105000 
1 1 1 31 17 12 o 1.977000  0.4975000     2.148000  0.6551000     1.805000  0.7489000     0.3431000      0.9950000 
1 1 1 31 17 13 o 1.592000  0.4400000     1.699000  0.6329000     1.485000  0.6113000     0.2135000      0.8799000 
1 1 1 31 17 14 o 1.386000  0.4164000     1.408000  0.5912000     1.365000  0.5866000     0.4341000E-01  0.8328000 
1 1 1 31 17 15 o 2.159000  0.4277000     2.598000  0.5602000     1.720000  0.6465000     0.8772000      0.8554000 
1 1 1 31 17 16 o 1.196000  0.4001000     1.296000  0.6113000     1.096000  0.5164000     0.2007000      0.8002000 
1 1 1 31 18 0  o 3.986000  0.2636000     3.986000  0.2636000     3.986000  0.2636000     -0.000000      0.000000  
1 1 1 31 18 1  o 3.834000  0.1872000     3.834000  0.2695000     3.834000  0.2599000     -0.4587000E-03 0.3744000 
1 1 1 31 18 2  o 1.170000  0.3312000     1.446000  0.5168000     0.8936000 0.4144000     0.5527000      0.6624000 
1 1 1 31 18 3  o 4.005000  0.1881000     3.899000  0.2813000     4.112000  0.2499000     -0.2125000     0.3763000 
1 1 1 31 18 4  o 6.626000  0.1416000     6.618000  0.2049000     6.634000  0.1954000     -0.1581000E-01 0.2831000 
1 1 1 31 18 5  o 1.866000  0.3349000     2.444000  0.4449000     1.289000  0.5008000     1.154000       0.6699000 
1 1 1 31 18 6  o 6.412000  0.2078000     5.992000  0.3256000     6.832000  0.2584000     -0.8401000     0.4156000 
1 1 1 31 18 7  o 2.759000  0.3278000     3.097000  0.4927000     2.421000  0.4325000     0.6760000      0.6556000 
1 1 1 31 18 8  o 1.985000  0.4150000     1.833000  0.5812000     2.137000  0.5925000     -0.3042000     0.8299000 
1 1 1 31 18 9  o 1.296000  0.4000000     0.9868000 0.4640000     1.605000  0.6516000     -0.6182000     0.7999000 
1 1 1 31 18 10 o 2.855000  0.4056000     2.534000  0.6513000     3.177000  0.4835000     -0.6431000     0.8112000 
1 1 1 31 18 11 o 2.242000  0.4326000     2.210000  0.6011000     2.274000  0.6223000     -0.6466000E-01 0.8652000 
1 1 1 31 18 12 o 2.236000  0.5193000     2.069000  0.6606000     2.404000  0.8015000     -0.3355000     1.039000  
1 1 1 31 18 13 o 1.239000  0.3830000     0.9617000 0.4643000     1.517000  0.6092000     -0.5551000     0.7659000 
1 1 1 31 18 14 o 1.637000  0.4384000     1.730000  0.6192000     1.543000  0.6209000     0.1863000      0.8769000 
1 1 1 31 18 15 o 1.306000  0.4090000     1.398000  0.5949000     1.214000  0.5613000     0.1840000      0.8180000 
1 1 1 31 18 16 f 1.213000  0.3825000     1.472000  0.6064000     0.9545000 0.4663000     0.5172000      0.7650000 
1 1 1 31 19 0  o 1.465000  0.6240000     1.465000  0.6240000     1.465000  0.6240000     -0.000000      0.000000  
1 1 1 31 19 1  o 1.470000  0.3549000     1.676000  0.5113000     1.264000  0.4922000     0.4122000      0.7097000 
1 1 1 31 19 2  f 1.527000  0.3503000     1.889000  0.5117000     1.166000  0.4784000     0.7229000      0.7005000 
1 1 1 31 19 3  o 4.510000  0.1761000     4.608000  0.2500000     4.411000  0.2481000     0.1975000      0.3522000 
1 1 1 31 19 4  o 3.543000  0.2217000     3.501000  0.3285000     3.584000  0.2978000     -0.8300000E-01 0.4434000 
1 1 1 31 19 5  o 4.253000  0.2245000     3.985000  0.3684000     4.520000  0.2567000     -0.5352000     0.4490000 
1 1 1 31 19 6  o 4.389000  0.2181000     4.657000  0.3321000     4.121000  0.2827000     0.5357000      0.4361000 
1 1 1 31 19 7  o 2.192000  0.3942000     2.350000  0.6060000     2.033000  0.5042000     0.3170000      0.7883000 
1 1 1 31 19 8  o 1.277000  0.3856000     1.265000  0.5370000     1.288000  0.5535000     -0.2260000E-01 0.7712000 
1 1 1 31 19 9  o 4.887000  0.2540000     4.910000  0.3951000     4.865000  0.3194000     0.4483000E-01  0.5081000 
1 1 1 31 19 10 o 1.736000  0.4316000     1.479000  0.5780000     1.993000  0.6411000     -0.5141000     0.8632000 
1 1 1 31 19 11 o 1.381000  0.4060000     1.587000  0.6065000     1.176000  0.5401000     0.4107000      0.8121000 
1 1 1 31 19 12 o 1.171000  0.3812000     0.9619000 0.4623000     1.380000  0.6063000     -0.4186000     0.7625000 
1 1 1 31 19 13 o 1.563000  0.4356000     1.695000  0.6288000     1.432000  0.6029000     0.2631000      0.8711000 
1 1 1 31 19 14 o 1.365000  0.4145000     1.461000  0.6049000     1.270000  0.5668000     0.1912000      0.8289000 
1 1 1 31 19 15 o 1.558000  0.4617000     1.791000  0.7048000     1.325000  0.5965000     0.4656000      0.9234000 
1 1 1 31 19 16 o 1.551000  0.4606000     1.677000  0.6665000     1.425000  0.6358000     0.2521000      0.9211000 
1 1 1 31 20 0  o 1.056000  0.5943000     1.056000  0.5943000     1.056000  0.5943000     -0.000000      0.000000  
1 1 1 31 20 1  o 1.380000  0.3558000     1.119000  0.4808000     1.642000  0.5247000     -0.5232000     0.7117000 
1 1 1 31 20 2  o 1.762000  0.3718000     1.726000  0.5449000     1.797000  0.5061000     -0.7093000E-01 0.7437000 
1 1 1 31 20 3  o 1.162000  0.3465000     1.116000  0.4815000     1.208000  0.4985000     -0.9179000E-01 0.6930000 
1 1 1 31 20 4  o 3.813000  0.2189000     3.258000  0.3520000     4.368000  0.2601000     -1.110000      0.4377000 
1 1 1 31 20 5  o 4.018000  0.2392000     3.857000  0.3501000     4.179000  0.3262000     -0.3220000     0.4785000 
1 1 1 31 20 6  o 1.216000  0.3638000     1.318000  0.5387000     1.114000  0.4891000     0.2041000      0.7277000 
1 1 1 31 20 7  o 2.809000  0.3203000     3.116000  0.4717000     2.502000  0.4334000     0.6140000      0.6406000 
1 1 1 31 20 8  o 4.738000  0.2308000     4.442000  0.3752000     5.034000  0.2691000     -0.5928000     0.4617000 
1 1 1 31 20 9  o 1.362000  0.4084000     1.161000  0.5474000     1.563000  0.6064000     -0.4024000     0.8169000 
1 1 1 31 20 10 o 1.035000  0.3434000     1.142000  0.5172000     0.9277000 0.4519000     0.2144000      0.6868000 
1 1 1 31 20 11 o 1.467000  0.4295000     1.566000  0.6098000     1.367000  0.6050000     0.1994000      0.8590000 
1 1 1 31 20 12 o 1.282000  0.4014000     1.202000  0.5429000     1.362000  0.5916000     -0.1592000     0.8029000 
1 1 1 31 20 13 o 1.444000  0.4256000     1.469000  0.5974000     1.419000  0.6063000     0.4984000E-01  0.8512000 
1 1 1 31 20 14 o 1.413000  0.4177000     1.167000  0.5361000     1.659000  0.6407000     -0.4921000     0.8354000 
1 1 1 31 20 15 o 2.300000  0.6222000     2.528000  1.052000      2.071000  0.6643000     0.4570000      1.244000  
1 1 1 31 21 0  o 1.853000  0.6052000     1.853000  0.6052000     1.853000  0.6052000     -0.000000      0.000000  
1 1 1 31 21 1  o 1.510000  0.3753000     1.523000  0.5358000     1.496000  0.5255000     0.2790000E-01  0.7505000 
1 1 1 31 21 2  o 6.049000  0.1538000     5.934000  0.2244000     6.163000  0.2103000     -0.2285000     0.3075000 
1 1 1 31 21 3  o 1.503000  0.3796000     1.621000  0.5488000     1.385000  0.5247000     0.2361000      0.7593000 
1 1 1 31 21 4  o 2.380000  0.3645000     2.455000  0.5592000     2.305000  0.4677000     0.1498000      0.7290000 
1 1 1 31 21 5  o 6.818000  0.1749000     6.651000  0.2542000     6.986000  0.2404000     -0.3342000     0.3499000 
1 1 1 31 21 6  o 1.994000  0.3922000     2.001000  0.5633000     1.988000  0.5458000     0.1289000E-01  0.7844000 
1 1 1 31 21 7  o 2.507000  0.3566000     3.295000  0.4527000     1.718000  0.5510000     1.578000       0.7131000 
1 1 1 31 21 8  o 3.155000  0.3743000     2.944000  0.6200000     3.365000  0.4196000     -0.4216000     0.7486000 
1 1 1 31 21 9  o 1.312000  0.4027000     1.258000  0.5616000     1.367000  0.5774000     -0.1088000     0.8055000 
1 1 1 31 21 10 f 1.617000  0.4298000     1.746000  0.6132000     1.489000  0.6023000     0.2565000      0.8595000 
1 1 1 31 21 11 o 2.403000  0.5169000     1.795000  0.6416000     3.011000  0.8106000     -1.216000      1.034000  
1 1 1 31 21 12 o 1.688000  0.4325000     1.291000  0.5630000     2.084000  0.6568000     -0.7926000     0.8650000 
1 1 1 31 21 13 o 1.521000  0.4070000     1.957000  0.6287000     1.085000  0.5171000     0.8716000      0.8140000 
1 1 1 31 21 14 o 1.508000  0.4234000     1.814000  0.6399000     1.202000  0.5548000     0.6125000      0.8469000 
1 1 1 31 21 15 o 1.921000  0.4615000     1.499000  0.6682000     2.342000  0.6367000     -0.8430000     0.9230000 
1 1 1 31 22 0  o 2.072000  0.5692000     2.072000  0.5692000     2.072000  0.5692000     0.000000       0.000000  
1 1 1 31 22 1  o 1.846000  0.3702000     1.599000  0.5449000     2.092000  0.5014000     -0.4934000     0.7405000 
1 1 1 31 22 2  o 3.308000  0.2460000     3.127000  0.3672000     3.490000  0.3276000     -0.3633000     0.4921000 
1 1 1 31 22 3  o 3.004000  0.3412000     3.488000  0.4120000     2.521000  0.5441000     0.9672000      0.6825000 
1 1 1 31 22 4  o 6.936000  0.1850000     6.722000  0.2547000     7.151000  0.2684000     -0.4297000     0.3700000 
1 1 1 31 22 5  o 4.766000  0.1964000     4.836000  0.2778000     4.695000  0.2778000     0.1408000      0.3928000 
1 1 1 31 22 6  o 3.363000  0.2662000     3.590000  0.3542000     3.136000  0.3973000     0.4533000      0.5323000 
1 1 1 31 22 7  o 2.710000  0.3741000     1.926000  0.6168000     3.494000  0.4237000     -1.568000      0.7483000 
1 1 1 31 22 8  o 2.599000  0.4367000     2.387000  0.7781000     2.810000  0.3966000     -0.4237000     0.8733000 
1 1 1 31 22 9  o 1.547000  0.3943000     1.251000  0.5682000     1.844000  0.5469000     -0.5929000     0.7886000 
1 1 1 31 22 10 o 1.803000  0.4123000     1.262000  0.5537000     2.343000  0.6111000     -1.081000      0.8246000 
1 1 1 31 22 11 o 1.142000  0.3836000     1.144000  0.5280000     1.140000  0.5567000     0.3360000E-02  0.7673000 
1 1 1 31 22 12 o 1.702000  0.4512000     1.548000  0.6055000     1.857000  0.6692000     -0.3088000     0.9024000 
1 1 1 31 22 13 o 1.859000  0.4161000     1.206000  0.5425000     2.512000  0.6310000     -1.305000      0.8321000 
1 1 1 31 22 14 o 1.699000  0.4735000     1.614000  0.6307000     1.785000  0.7063000     -0.1716000     0.9469000 
1 1 1 31 22 15 o 1.314000  0.4132000     1.279000  0.5727000     1.349000  0.5957000     -0.6942000E-01 0.8263000 
1 1 1 31 23 0  o 1.061000  0.6214000     1.061000  0.6214000     1.061000  0.6214000     -0.000000      0.000000  
1 1 1 31 23 1  o 4.484000  0.1943000     4.311000  0.2885000     4.658000  0.2602000     -0.3466000     0.3886000 
1 1 1 31 23 2  o 2.084000  0.3862000     2.598000  0.5443000     1.570000  0.5479000     1.028000       0.7723000 
1 1 1 31 23 3  o 4.672000  0.2313000     4.591000  0.3410000     4.753000  0.3126000     -0.1626000     0.4626000 
1 1 1 31 23 4  o 2.322000  0.3710000     2.512000  0.4892000     2.133000  0.5580000     0.3793000      0.7421000 
1 1 1 31 23 5  o 2.540000  0.3464000     2.137000  0.5595000     2.943000  0.4086000     -0.8060000     0.6928000 
1 1 1 31 23 6  o 1.421000  0.4042000     1.492000  0.5728000     1.349000  0.5704000     0.1428000      0.8084000 
1 1 1 31 23 7  o 1.517000  0.4313000     1.701000  0.6322000     1.333000  0.5867000     0.3679000      0.8625000 
1 1 1 31 23 8  o 2.797000  0.3418000     2.885000  0.5256000     2.710000  0.4371000     0.1758000      0.6836000 
1 1 1 31 23 9  o 3.070000  0.3486000     2.907000  0.5879000     3.233000  0.3749000     -0.3260000     0.6972000 
1 1 1 31 23 10 o 2.734000  0.4031000     1.660000  0.6589000     3.807000  0.4644000     -2.147000      0.8061000 
1 1 1 31 23 11 o 2.068000  0.4569000     2.143000  0.6165000     1.992000  0.6744000     0.1511000      0.9137000 
1 1 1 31 23 12 o 1.412000  0.4203000     1.357000  0.5772000     1.467000  0.6110000     -0.1104000     0.8405000 
1 1 1 31 23 13 o 1.085000  0.3619000     1.144000  0.5276000     1.026000  0.4956000     0.1180000      0.7239000 
1 1 1 31 23 14 o 1.649000  0.4745000     1.759000  0.7073000     1.540000  0.6327000     0.2193000      0.9489000 
1 1 1 31 23 15 o 1.704000  0.4586000     1.476000  0.6172000     1.932000  0.6785000     -0.4565000     0.9172000 
1 1 1 31 24 0  o 4.017000  0.3149000     4.017000  0.3149000     4.017000  0.3149000     -0.000000      0.000000  
1 1 1 31 24 1  o 1.429000  0.4002000     1.635000  0.6130000     1.224000  0.5147000     0.4106000      0.8004000 
1 1 1 31 24 2  o 2.537000  0.3796000     2.441000  0.5706000     2.633000  0.5008000     -0.1918000     0.7592000 
1 1 1 31 24 3  o 2.857000  0.3277000     2.618000  0.4953000     3.097000  0.4291000     -0.4799000     0.6554000 
1 1 1 31 24 4  o 1.805000  0.4209000     1.662000  0.5778000     1.949000  0.6122000     -0.2867000     0.8418000 
1 1 1 31 24 5  o 1.400000  0.3991000     1.175000  0.5281000     1.626000  0.5985000     -0.4519000     0.7982000 
1 1 1 31 24 6  o 2.710000  0.3969000     3.001000  0.4958000     2.419000  0.6200000     0.5814000      0.7939000 
1 1 1 31 24 7  o 1.764000  0.3772000     1.209000  0.5241000     2.318000  0.5426000     -1.109000      0.7544000 
1 1 1 31 24 8  o 1.941000  0.3879000     2.398000  0.5239000     1.484000  0.5722000     0.9135000      0.7758000 
1 1 1 31 24 9  o 1.865000  0.3844000     1.355000  0.5952000     2.375000  0.4865000     -1.021000      0.7687000 
1 1 1 31 24 10 o 3.009000  0.4118000     3.633000  0.5741000     2.385000  0.5906000     1.248000       0.8237000 
1 1 1 31 24 11 o 1.916000  0.4239000     2.330000  0.5875000     1.501000  0.6112000     0.8288000      0.8478000 
1 1 1 31 24 12 o 1.353000  0.4093000     1.159000  0.5314000     1.548000  0.6227000     -0.3890000     0.8186000 
1 1 1 31 24 13 o 1.291000  0.4037000     1.309000  0.5689000     1.272000  0.5731000     0.3673000E-01  0.8075000 
1 1 1 31 24 14 o 0.9326000 0.3295000     0.8814000 0.4507000     0.9837000 0.4807000     -0.1022000     0.6589000 
1 1 1 31 25 0  o 2.525000  0.7785000     2.525000  0.7785000     2.525000  0.7785000     -0.000000      0.000000  
1 1 1 31 25 1  o 3.465000  0.3359000     3.353000  0.4373000     3.578000  0.5099000     -0.2251000     0.6718000 
1 1 1 31 25 2  o 1.609000  0.4313000     1.333000  0.5459000     1.885000  0.6678000     -0.5521000     0.8626000 
1 1 1 31 25 3  o 5.987000  0.2000000     5.831000  0.2792000     6.142000  0.2865000     -0.3113000     0.4000000 
1 1 1 31 25 4  o 1.506000  0.3779000     1.026000  0.4824000     1.987000  0.5818000     -0.9609000     0.7558000 
1 1 1 31 25 5  o 2.699000  0.4138000     2.515000  0.6092000     2.883000  0.5602000     -0.3688000     0.8276000 
1 1 1 31 25 6  o 5.755000  0.2020000     5.788000  0.3124000     5.722000  0.2562000     0.6570000E-01  0.4040000 
1 1 1 31 25 7  f 4.089000  0.2372000     4.054000  0.3426000     4.123000  0.3282000     -0.6895000E-01 0.4744000 
1 1 1 31 25 8  o 1.259000  0.3708000     1.561000  0.5869000     0.9573000 0.4533000     0.6039000      0.7416000 
1 1 1 31 25 9  o 2.005000  0.4021000     2.019000  0.5933000     1.992000  0.5430000     0.2699000E-01  0.8043000 
1 1 1 31 25 10 o 1.103000  0.3687000     1.174000  0.5573000     1.032000  0.4827000     0.1420000      0.7373000 
1 1 1 31 25 11 o 1.372000  0.4216000     1.488000  0.6282000     1.256000  0.5623000     0.2325000      0.8431000 
1 1 1 31 25 12 o 1.086000  0.3611000     0.9753000 0.4695000     1.197000  0.5489000     -0.2215000     0.7223000 
1 1 1 31 25 13 o 2.074000  0.4472000     2.604000  0.6078000     1.544000  0.6563000     1.059000       0.8945000 
1 1 1 31 25 14 o 1.327000  0.4162000     1.207000  0.5537000     1.448000  0.6216000     -0.2413000     0.8324000 
1 1 1 31 26 0  o 1.295000  0.7599000     1.295000  0.7599000     1.295000  0.7599000     0.000000       0.000000  
1 1 1 31 26 1  o 2.503000  0.4273000     2.287000  0.5876000     2.718000  0.6204000     -0.4305000     0.8545000 
1 1 1 31 26 2  o 2.686000  0.3762000     2.672000  0.5275000     2.699000  0.5367000     -0.2633000E-01 0.7525000 
1 1 1 31 26 3  o 3.242000  0.3489000     3.239000  0.5035000     3.246000  0.4831000     -0.7063000E-02 0.6977000 
1 1 1 31 26 4  o 2.965000  0.3846000     3.151000  0.4964000     2.779000  0.5875000     0.3720000      0.7691000 
1 1 1 31 26 5  o 5.222000  0.1999000     5.214000  0.2878000     5.231000  0.2775000     -0.1685000E-01 0.3998000 
1 1 1 31 26 6  o 1.844000  0.4055000     1.944000  0.5744000     1.744000  0.5726000     0.2001000      0.8110000 
1 1 1 31 26 7  o 1.291000  0.3850000     1.406000  0.5668000     1.175000  0.5211000     0.2313000      0.7699000 
1 1 1 31 26 8  f 1.743000  0.4074000     1.483000  0.5766000     2.002000  0.5757000     -0.5188000     0.8147000 
1 1 1 31 26 9  o 2.152000  0.4334000     1.853000  0.6751000     2.450000  0.5437000     -0.5968000     0.8668000 
1 1 1 31 26 10 o 1.483000  0.4241000     1.610000  0.6465000     1.357000  0.5493000     0.2531000      0.8483000 
1 1 1 31 26 11 o 1.198000  0.3826000     1.246000  0.5724000     1.150000  0.5077000     0.9580000E-01  0.7651000 
1 1 1 31 26 12 o 2.087000  0.4218000     2.616000  0.5685000     1.558000  0.6232000     1.058000       0.8435000 
1 1 1 31 26 13 o 1.928000  0.4907000     2.390000  0.7668000     1.467000  0.6124000     0.9222000      0.9813000 
1 1 1 31 26 14 o 1.523000  0.4370000     1.750000  0.6492000     1.296000  0.5851000     0.4534000      0.8740000 
1 1 1 31 27 0  o 3.124000  0.4310000     3.124000  0.4310000     3.124000  0.4310000     0.000000       0.000000  
1 1 1 31 27 1  o 3.731000  0.2752000     3.439000  0.4473000     4.024000  0.3208000     -0.5847000     0.5505000 
1 1 1 31 27 2  o 2.745000  0.3561000     2.716000  0.5460000     2.775000  0.4574000     -0.5937000E-01 0.7123000 
1 1 1 31 27 3  o 6.711000  0.1708000     6.597000  0.2474000     6.826000  0.2357000     -0.2294000     0.3417000 
1 1 1 31 27 4  o 3.241000  0.2929000     3.012000  0.4489000     3.470000  0.3762000     -0.4581000     0.5857000 
1 1 1 31 27 5  o 1.363000  0.3821000     1.093000  0.4972000     1.633000  0.5805000     -0.5397000     0.7643000 
1 1 1 31 27 6  o 1.475000  0.3869000     1.802000  0.5831000     1.148000  0.5088000     0.6540000      0.7739000 
1 1 1 31 27 7  o 1.260000  0.3829000     1.315000  0.5570000     1.204000  0.5256000     0.1117000      0.7658000 
1 1 1 31 27 8  o 2.019000  0.3981000     2.450000  0.5313000     1.589000  0.5929000     0.8610000      0.7961000 
1 1 1 31 27 9  o 1.090000  0.3564000     1.032000  0.4859000     1.148000  0.5216000     -0.1155000     0.7129000 
1 1 1 31 27 10 o 1.728000  0.4091000     1.758000  0.5830000     1.698000  0.5742000     0.5980000E-01  0.8183000 
1 1 1 31 27 11 o 2.060000  0.4159000     1.611000  0.6653000     2.508000  0.4992000     -0.8964000     0.8318000 
1 1 1 31 27 12 o 1.930000  0.4931000     1.959000  0.6923000     1.902000  0.7022000     0.5651000E-01  0.9861000 
1 1 1 31 27 13 o 1.389000  0.4219000     1.129000  0.5419000     1.650000  0.6468000     -0.5207000     0.8438000 
1 1 1 31 27 14 o 1.069000  0.3850000     1.083000  0.5488000     1.054000  0.5401000     0.2849000E-01  0.7700000 
1 1 1 31 28 0  o 1.402000  0.7052000     1.402000  0.7052000     1.402000  0.7052000     -0.000000      0.000000  
1 1 1 31 28 1  o 6.992000  0.1714000     7.296000  0.2368000     6.689000  0.2479000     0.6074000      0.3428000 
1 1 1 31 28 2  f 6.654000  0.1728000     6.700000  0.2426000     6.609000  0.2461000     0.9038000E-01  0.3455000 
1 1 1 31 28 3  o 1.093000  0.3501000     1.040000  0.4805000     1.146000  0.5092000     -0.1061000     0.7001000 
1 1 1 31 28 4  o 3.020000  0.3216000     2.579000  0.5195000     3.462000  0.3793000     -0.8831000     0.6433000 
1 1 1 31 28 5  o 2.913000  0.3303000     3.146000  0.4350000     2.680000  0.4972000     0.4662000      0.6606000 
1 1 1 31 28 6  o 2.413000  0.3728000     2.739000  0.4900000     2.087000  0.5620000     0.6514000      0.7456000 
1 1 1 31 28 7  o 1.474000  0.4075000     1.557000  0.5881000     1.390000  0.5642000     0.1667000      0.8150000 
1 1 1 31 28 8  o 3.619000  0.3111000     3.721000  0.4761000     3.517000  0.4006000     0.2039000      0.6222000 
1 1 1 31 28 9  o 4.200000  0.2629000     4.437000  0.3443000     3.963000  0.3975000     0.4743000      0.5259000 
1 1 1 31 28 10 o 2.384000  0.4032000     2.311000  0.5770000     2.456000  0.5633000     -0.1452000     0.8064000 
1 1 1 31 28 11 f 1.629000  0.4439000     1.836000  0.6902000     1.422000  0.5584000     0.4138000      0.8878000 
1 1 1 31 28 12 o 1.514000  0.4558000     1.919000  0.7456000     1.110000  0.5246000     0.8090000      0.9117000 
1 1 1 31 28 13 o 1.273000  0.4023000     1.342000  0.5842000     1.205000  0.5532000     0.1369000      0.8046000 
1 1 1 31 29 0  o 4.757000  0.3021000     4.757000  0.3021000     4.757000  0.3021000     -0.000000      0.000000  
1 1 1 31 29 1  o 2.162000  0.4037000     2.405000  0.5403000     1.918000  0.6000000     0.4860000      0.8075000 
1 1 1 31 29 2  o 1.458000  0.3871000     1.128000  0.5053000     1.788000  0.5865000     -0.6594000     0.7742000 
1 1 1 31 29 3  f 3.054000  0.3030000     3.150000  0.4090000     2.958000  0.4471000     0.1921000      0.6059000 
1 1 1 31 29 4  o 1.872000  0.4153000     1.784000  0.5953000     1.959000  0.5792000     -0.1750000     0.8306000 
1 1 1 31 29 5  o 1.394000  0.3978000     1.490000  0.5776000     1.299000  0.5472000     0.1911000      0.7956000 
1 1 1 31 29 6  o 6.427000  0.1810000     6.380000  0.2609000     6.474000  0.2511000     -0.9350000E-01 0.3621000 
1 1 1 31 29 7  o 2.585000  0.3682000     2.269000  0.5771000     2.901000  0.4572000     -0.6321000     0.7363000 
1 1 1 31 29 8  o 1.539000  0.4296000     1.654000  0.6225000     1.423000  0.5922000     0.2310000      0.8592000 
1 1 1 31 29 9  o 3.056000  0.3123000     3.162000  0.4211000     2.949000  0.4612000     0.2127000      0.6245000 
1 1 1 31 29 10 o 1.024000  0.3404000     0.9349000 0.4516000     1.114000  0.5096000     -0.1787000     0.6809000 
1 1 1 31 29 11 o 1.068000  0.3496000     0.9525000 0.4566000     1.184000  0.5294000     -0.2318000     0.6991000 
1 1 1 31 29 12 o 1.467000  0.4585000     1.599000  0.7319000     1.335000  0.5523000     0.2643000      0.9169000 
1 1 1 31 29 13 o 3.250000  0.4121000     3.421000  0.5949000     3.079000  0.5704000     0.3420000      0.8242000 
1 1 1 31 30 0  o 5.202000  0.2910000     5.202000  0.2910000     5.202000  0.2910000     0.000000       0.000000  
1 1 1 31 30 1  o 3.212000  0.3120000     2.676000  0.5122000     3.748000  0.3563000     -1.072000      0.6239000 
1 1 1 31 30 2  o 1.548000  0.4082000     1.376000  0.5609000     1.721000  0.5931000     -0.3448000     0.8164000 
1 1 1 31 30 3  f 5.243000  0.2038000     4.873000  0.3042000     5.613000  0.2712000     -0.7396000     0.4076000 
1 1 1 31 30 4  o 4.090000  0.2453000     3.990000  0.3526000     4.190000  0.3412000     -0.1998000     0.4906000 
1 1 1 31 30 5  o 3.421000  0.2830000     3.707000  0.3581000     3.135000  0.4384000     0.5719000      0.5661000 
1 1 1 31 30 6  o 2.664000  0.3589000     3.212000  0.4218000     2.117000  0.5807000     1.095000       0.7177000 
1 1 1 31 30 7  o 2.149000  0.4481000     2.369000  0.6602000     1.930000  0.6061000     0.4389000      0.8962000 
1 1 1 31 30 8  o 2.283000  0.4139000     2.593000  0.5158000     1.972000  0.6476000     0.6208000      0.8279000 
1 1 1 31 30 9  o 1.934000  0.4091000     2.424000  0.5664000     1.444000  0.5906000     0.9794000      0.8182000 
1 1 1 31 30 10 o 3.105000  0.3258000     3.077000  0.4620000     3.133000  0.4595000     -0.5656000E-01 0.6516000 
1 1 1 31 30 11 o 1.024000  0.3509000     1.044000  0.4975000     1.005000  0.4950000     0.3973000E-01  0.7018000 
1 1 1 31 30 12 o 1.468000  0.3730000     0.9419000 0.4695000     1.994000  0.5798000     -1.052000      0.7461000 
1 1 1 31 31 0  o 1.845000  0.7126000     1.845000  0.7126000     1.845000  0.7126000     -0.000000      0.000000  
1 1 1 31 31 1  o 3.248000  0.3041000     3.115000  0.4459000     3.382000  0.4137000     -0.2670000     0.6083000 
1 1 1 31 31 2  f 3.741000  0.2584000     3.700000  0.3657000     3.782000  0.3653000     -0.8166000E-01 0.5169000 
1 1 1 31 31 3  o 4.007000  0.2528000     4.124000  0.3457000     3.890000  0.3688000     0.2334000      0.5056000 
1 1 1 31 31 4  o 7.382000  0.1743000     7.360000  0.2488000     7.403000  0.2442000     -0.4235000E-01 0.3487000 
1 1 1 31 31 5  o 2.171000  0.4063000     2.110000  0.5730000     2.231000  0.5763000     -0.1211000     0.8126000 
1 1 1 31 31 6  f 3.199000  0.3055000     3.098000  0.4378000     3.299000  0.4261000     -0.2016000     0.6109000 
1 1 1 31 31 7  o 2.850000  0.3951000     2.451000  0.6017000     3.250000  0.5123000     -0.7988000     0.7903000 
1 1 1 31 31 8  o 1.224000  0.3737000     1.442000  0.5742000     1.006000  0.4785000     0.4356000      0.7474000 
1 1 1 31 31 9  o 2.534000  0.3762000     2.863000  0.4699000     2.205000  0.5877000     0.6586000      0.7524000 
1 1 1 31 31 10 o 1.150000  0.3742000     1.109000  0.5168000     1.191000  0.5414000     -0.8141000E-01 0.7484000 
1 1 1 31 31 11 o 1.057000  0.3559000     1.250000  0.5710000     0.8649000 0.4251000     0.3850000      0.7119000 
1 1 1 31 31 12 f 1.881000  0.4215000     1.880000  0.6054000     1.882000  0.5867000     -0.2296000E-02 0.8431000 
1 1 1 31 32 0  o 0.8863000 0.5775000     0.8863000 0.5775000     0.8863000 0.5775000     -0.000000      0.000000  
1 1 1 31 32 1  o 2.288000  0.4001000     2.054000  0.5985000     2.522000  0.5310000     -0.4683000     0.8001000 
1 1 1 31 32 2  o 4.446000  0.2368000     4.651000  0.3203000     4.241000  0.3489000     0.4099000      0.4737000 
1 1 1 31 32 3  o 6.821000  0.1818000     6.757000  0.2595000     6.885000  0.2545000     -0.1285000     0.3635000 
1 1 1 31 32 4  o 1.530000  0.4092000     1.388000  0.5663000     1.672000  0.5909000     -0.2836000     0.8185000 
1 1 1 31 32 5  o 1.957000  0.3856000     1.313000  0.5522000     2.600000  0.5385000     -1.287000      0.7713000 
1 1 1 31 32 6  o 3.253000  0.4127000     3.563000  0.6053000     2.943000  0.5611000     0.6198000      0.8254000 
1 1 1 31 32 7  o 3.427000  0.3134000     3.319000  0.4188000     3.535000  0.4662000     -0.2155000     0.6267000 
1 1 1 31 32 8  o 2.464000  0.3864000     2.883000  0.4857000     2.045000  0.6010000     0.8372000      0.7728000 
1 1 1 31 32 9  o 1.148000  0.3706000     1.134000  0.5121000     1.161000  0.5358000     -0.2757000E-01 0.7412000 
1 1 1 31 32 10 o 1.753000  0.4701000     2.095000  0.7012000     1.412000  0.6264000     0.6830000      0.9402000 
1 1 1 31 32 11 o 1.206000  0.3792000     1.294000  0.5583000     1.118000  0.5133000     0.1755000      0.7584000 
1 1 1 31 33 0  o 1.092000  0.6588000     1.092000  0.6588000     1.092000  0.6588000     0.000000       0.000000  
1 1 1 31 33 1  o 1.460000  0.4009000     1.743000  0.6051000     1.176000  0.5261000     0.5679000      0.8018000 
1 1 1 31 33 2  o 1.497000  0.4103000     1.602000  0.5885000     1.391000  0.5720000     0.2109000      0.8207000 
1 1 1 31 33 3  o 1.386000  0.3887000     1.720000  0.6031000     1.051000  0.4907000     0.6688000      0.7775000 
1 1 1 31 33 4  o 2.033000  0.4205000     2.270000  0.5804000     1.796000  0.6087000     0.4745000      0.8410000 
1 1 1 31 33 5  o 2.007000  0.4590000     1.896000  0.6841000     2.118000  0.6120000     -0.2223000     0.9179000 
1 1 1 31 33 6  o 3.041000  0.3876000     3.909000  0.4130000     2.174000  0.6560000     1.735000       0.7751000 
1 1 1 31 33 7  o 3.440000  0.2986000     3.346000  0.4287000     3.535000  0.4158000     -0.1888000     0.5972000 
1 1 1 31 33 8  f 1.335000  0.4029000     1.455000  0.5802000     1.216000  0.5590000     0.2392000      0.8057000 
1 1 1 31 33 9  o 3.266000  0.4032000     2.758000  0.5907000     3.775000  0.5490000     -1.017000      0.8064000 
1 1 1 31 33 10 o 2.264000  0.4454000     2.085000  0.6745000     2.443000  0.5819000     -0.3577000     0.8908000 
1 1 1 31 33 11 o 1.414000  0.4110000     1.372000  0.5730000     1.457000  0.5894000     -0.8554000E-01 0.8221000 
1 1 1 31 34 0  o 0.7354000 0.5079000     0.7354000 0.5079000     0.7354000 0.5079000     0.000000       0.000000  
1 1 1 31 34 1  f 1.502000  0.4187000     1.441000  0.5834000     1.563000  0.6008000     -0.1221000     0.8374000 
1 1 1 31 34 2  o 4.030000  0.2635000     3.744000  0.3920000     4.316000  0.3522000     -0.5728000     0.5270000 
1 1 1 31 34 3  f 5.172000  0.2211000     5.229000  0.3100000     5.115000  0.3152000     0.1144000      0.4421000 
1 1 1 31 34 4  o 2.085000  0.4683000     2.193000  0.6946000     1.978000  0.6283000     0.2154000      0.9366000 
1 1 1 31 34 5  o 2.517000  0.4617000     2.007000  0.6636000     3.028000  0.6422000     -1.021000      0.9235000 
1 1 1 31 34 6  o 1.292000  0.3945000     1.182000  0.5301000     1.402000  0.5843000     -0.2195000     0.7889000 
1 1 1 31 34 7  o 1.777000  0.4377000     2.025000  0.6097000     1.528000  0.6283000     0.4969000      0.8755000 
1 1 1 31 34 8  o 1.739000  0.4625000     1.930000  0.6448000     1.549000  0.6632000     0.3805000      0.9250000 
1 1 1 31 34 9  o 1.300000  0.4014000     1.469000  0.6125000     1.130000  0.5190000     0.3387000      0.8028000 
1 1 1 31 34 10 o 1.620000  0.4237000     1.860000  0.6184000     1.379000  0.5794000     0.4810000      0.8474000 
1 1 1 31 35 0  f 2.611000  0.6012000     2.611000  0.6012000     2.611000  0.6012000     0.000000       0.000000  
1 1 1 31 35 1  o 1.585000  0.4278000     1.409000  0.5792000     1.761000  0.6296000     -0.3525000     0.8555000 
1 1 1 31 35 2  o 2.858000  0.3964000     3.310000  0.5223000     2.405000  0.5965000     0.9057000      0.7929000 
1 1 1 31 35 3  f 3.389000  0.3684000     3.388000  0.5461000     3.391000  0.4948000     -0.2915000E-02 0.7369000 
1 1 1 31 35 4  o 4.766000  0.3087000     5.307000  0.3482000     4.224000  0.5097000     1.083000       0.6173000 
1 1 1 31 35 5  f 1.878000  0.4341000     2.204000  0.6053000     1.552000  0.6225000     0.6522000      0.8683000 
1 1 1 31 35 6  o 1.989000  0.4507000     1.548000  0.6075000     2.430000  0.6660000     -0.8822000     0.9015000 
1 1 1 31 35 7  o 2.329000  0.4625000     2.676000  0.6035000     1.983000  0.7009000     0.6927000      0.9249000 
1 1 1 31 35 8  o 1.160000  0.3724000     0.9967000 0.4795000     1.322000  0.5700000     -0.3257000     0.7448000 
1 1 1 31 35 9  o 2.837000  0.3691000     3.046000  0.4861000     2.628000  0.5556000     0.4175000      0.7382000 
1 1 1 31 35 10 o 1.609000  0.4149000     1.232000  0.5440000     1.986000  0.6267000     -0.7543000     0.8299000 
1 1 1 31 36 0  o 0.8181000 0.5654000     0.8181000 0.5654000     0.8181000 0.5654000     -0.000000      0.000000  
1 1 1 31 36 1  o 1.949000  0.4581000     1.735000  0.6705000     2.163000  0.6244000     -0.4281000     0.9162000 
1 1 1 31 36 2  o 1.471000  0.4355000     1.201000  0.5733000     1.742000  0.6557000     -0.5409000     0.8710000 
1 1 1 31 36 3  o 1.600000  0.4593000     1.171000  0.5412000     2.029000  0.7422000     -0.8581000     0.9186000 
1 1 1 31 36 4  o 1.701000  0.4378000     1.996000  0.6047000     1.406000  0.6332000     0.5902000      0.8756000 
1 1 1 31 36 5  o 1.516000  0.4450000     1.471000  0.6108000     1.561000  0.6473000     -0.9015000E-01 0.8899000 
1 1 1 31 36 6  o 3.693000  0.3413000     3.421000  0.4765000     3.966000  0.4887000     -0.5452000     0.6826000 
1 1 1 31 36 7  o 4.288000  0.3175000     4.099000  0.5215000     4.477000  0.3623000     -0.3781000     0.6350000 
1 1 1 31 36 8  o 3.934000  0.2874000     3.519000  0.4346000     4.349000  0.3762000     -0.8303000     0.5748000 
1 1 1 31 36 9  o 1.563000  0.4307000     1.582000  0.6115000     1.544000  0.6066000     0.3725000E-01  0.8613000 
1 1 1 31 37 0  o 0.9946000 0.6657000     0.9946000 0.6657000     0.9946000 0.6657000     0.000000       0.000000  
1 1 1 31 37 1  o 1.295000  0.4266000     1.284000  0.5919000     1.307000  0.6145000     -0.2345000E-01 0.8532000 
1 1 1 31 37 2  o 2.049000  0.4843000     2.332000  0.6500000     1.766000  0.7180000     0.5658000      0.9685000 
1 1 1 31 37 3  o 2.341000  0.4594000     2.808000  0.5883000     1.874000  0.7057000     0.9340000      0.9187000 
1 1 1 31 37 4  o 3.005000  0.4144000     3.355000  0.4913000     2.655000  0.6675000     0.7001000      0.8288000 
1 1 1 31 37 5  o 3.232000  0.4189000     3.028000  0.6090000     3.436000  0.5753000     -0.4084000     0.8377000 
1 1 1 31 37 6  o 1.337000  0.4077000     1.642000  0.6513000     1.032000  0.4908000     0.6105000      0.8155000 
1 1 1 31 37 7  o 1.432000  0.4103000     1.609000  0.6038000     1.255000  0.5556000     0.3548000      0.8205000 
1 1 1 31 37 8  o 1.367000  0.4100000     1.392000  0.5823000     1.341000  0.5772000     0.5106000E-01  0.8199000 
1 1 1 31 37 9  o 1.863000  0.4679000     2.144000  0.6798000     1.581000  0.6433000     0.5623000      0.9359000 
1 1 1 31 38 0  o 1.194000  0.7189000     1.194000  0.7189000     1.194000  0.7189000     0.000000       0.000000  
1 1 1 31 38 1  o 3.217000  0.4307000     3.182000  0.5489000     3.251000  0.6640000     -0.6873000E-01 0.8615000 
1 1 1 31 38 2  o 1.980000  0.4284000     2.668000  0.6226000     1.293000  0.5887000     1.375000       0.8569000 
1 1 1 31 38 3  o 1.866000  0.4552000     2.114000  0.6643000     1.617000  0.6225000     0.4976000      0.9104000 
1 1 1 31 38 4  o 3.441000  0.3568000     3.027000  0.5860000     3.855000  0.4072000     -0.8281000     0.7136000 
1 1 1 31 38 5  o 2.177000  0.4421000     2.321000  0.6092000     2.033000  0.6408000     0.2877000      0.8841000 
1 1 1 31 38 6  o 1.225000  0.3853000     1.154000  0.5260000     1.295000  0.5632000     -0.1404000     0.7706000 
1 1 1 31 38 7  o 2.187000  0.4316000     1.749000  0.6363000     2.624000  0.5833000     -0.8742000     0.8632000 
1 1 1 31 38 8  o 3.119000  0.3623000     3.061000  0.5103000     3.176000  0.5145000     -0.1150000     0.7247000 
1 1 1 31 39 0  o 1.056000  0.6495000     1.056000  0.6495000     1.056000  0.6495000     0.000000       0.000000  
1 1 1 31 39 1  o 1.205000  0.3831000     1.013000  0.4835000     1.398000  0.5945000     -0.3846000     0.7663000 
1 1 1 31 39 2  o 2.311000  0.4408000     2.117000  0.6335000     2.505000  0.6132000     -0.3883000     0.8816000 
1 1 1 31 39 3  o 3.126000  0.3486000     2.924000  0.5214000     3.329000  0.4628000     -0.4046000     0.6972000 
1 1 1 31 39 4  o 3.280000  0.3228000     3.378000  0.4421000     3.183000  0.4705000     0.1951000      0.6456000 
1 1 1 31 39 5  o 1.941000  0.4118000     2.541000  0.5861000     1.340000  0.5787000     1.201000       0.8236000 
1 1 1 31 39 6  o 1.220000  0.3859000     1.336000  0.5740000     1.104000  0.5159000     0.2319000      0.7718000 
1 1 1 31 39 7  o 1.348000  0.4067000     1.596000  0.6299000     1.101000  0.5146000     0.4951000      0.8134000 
1 1 1 31 40 0  o 1.932000  0.7690000     1.932000  0.7690000     1.932000  0.7690000     -0.000000      0.000000  
1 1 1 31 40 1  o 1.409000  0.4186000     1.290000  0.5681000     1.529000  0.6150000     -0.2388000     0.8372000 
1 1 1 31 40 2  o 2.987000  0.3858000     2.235000  0.6358000     3.740000  0.4371000     -1.505000      0.7715000 
1 1 1 31 40 3  o 3.734000  0.3054000     3.844000  0.4206000     3.625000  0.4430000     0.2196000      0.6109000 
1 1 1 31 40 4  o 1.829000  0.4456000     1.580000  0.6147000     2.077000  0.6454000     -0.4965000     0.8913000 
1 1 1 31 40 5  o 1.300000  0.3934000     1.600000  0.6228000     1.001000  0.4807000     0.5985000      0.7867000 
1 1 1 31 40 6  o 1.197000  0.3815000     1.321000  0.5722000     1.073000  0.5048000     0.2479000      0.7630000 
1 1 1 31 41 0  o 2.379000  0.7260000     2.379000  0.7260000     2.379000  0.7260000     0.000000       0.000000  
1 1 1 31 41 1  o 3.204000  0.3571000     2.918000  0.5425000     3.491000  0.4646000     -0.5733000     0.7142000 
1 1 1 31 41 2  o 2.200000  0.4512000     2.348000  0.6247000     2.053000  0.6511000     0.2950000      0.9023000 
1 1 1 31 41 3  o 1.417000  0.4169000     1.179000  0.5374000     1.656000  0.6374000     -0.4765000     0.8338000 
1 1 1 31 41 4  o 1.479000  0.4209000     1.740000  0.6363000     1.218000  0.5510000     0.5218000      0.8417000 
1 1 1 31 41 5  o 1.925000  0.4551000     1.958000  0.6462000     1.892000  0.6412000     0.6602000E-01  0.9103000 
1 1 1 31 42 0  o 0.7814000 0.5388000     0.7814000 0.5388000     0.7814000 0.5388000     0.000000       0.000000  
1 1 1 31 42 1  o 1.255000  0.3905000     1.040000  0.4941000     1.469000  0.6049000     -0.4287000     0.7810000 
1 1 1 31 42 2  o 1.395000  0.4177000     1.508000  0.6099000     1.282000  0.5708000     0.2268000      0.8353000 
1 1 1 31 42 3  o 3.155000  0.3657000     2.743000  0.5629000     3.567000  0.4671000     -0.8249000     0.7315000 
1 1 1 31 42 4  o 1.973000  0.8646000     1.973000  0.8646000     ?         ?             ?              ?         
1 1 1 31 43 0  o 0.9218000 0.6253000     0.9218000 0.6253000     0.9218000 0.6253000     0.000000       0.000000  
1 1 1 31 43 1  o 1.808000  0.4701000     1.261000  0.5878000     2.354000  0.7337000     -1.093000      0.9401000 
1 1 1 32 0  2  o 4.025000  0.1719000     4.025000  0.1719000     4.025000  0.1719000     0.000000       0.000000  
1 1 1 32 0  3  o 2.847000  0.3481000     2.847000  0.3481000     2.847000  0.3481000     -0.000000      0.000000  
1 1 1 32 0  4  o 0.6666000 0.4635000     0.6666000 0.4635000     0.6666000 0.4635000     0.000000       0.000000  
1 1 1 32 0  5  o 2.933000  0.4981000     2.933000  0.4981000     2.933000  0.4981000     0.000000       0.000000  
1 1 1 32 0  6  o 3.876000  0.1778000     3.876000  0.1778000     3.876000  0.1778000     -0.000000      0.000000  
1 1 1 32 0  7  o 11.13000  0.2038000     11.13000  0.2038000     11.13000  0.2038000     0.000000       0.000000  
1 1 1 32 0  8  o 4.444000  0.4511000     4.444000  0.4511000     4.444000  0.4511000     0.000000       0.000000  
1 1 1 32 0  9  o 0.5525000 0.3962000     0.5525000 0.3962000     0.5525000 0.3962000     0.000000       0.000000  
1 1 1 32 0  10 o 0.5859000 0.4105000     0.5859000 0.4105000     0.5859000 0.4105000     0.000000       0.000000  
1 1 1 32 0  11 o 0.8677000 0.5632000     0.8677000 0.5632000     0.8677000 0.5632000     0.000000       0.000000  
1 1 1 32 0  12 o 0.6488000 0.4596000     0.6488000 0.4596000     0.6488000 0.4596000     0.000000       0.000000  
1 1 1 32 0  13 o 1.835000  0.8462000     1.835000  0.8462000     1.835000  0.8462000     0.000000       0.000000  
1 1 1 32 0  14 o 0.8994000 0.6114000     0.8994000 0.6114000     0.8994000 0.6114000     0.000000       0.000000  
1 1 1 32 0  15 o 1.506000  0.7788000     1.506000  0.7788000     1.506000  0.7788000     0.000000       0.000000  
1 1 1 32 0  16 o 1.873000  0.8214000     1.873000  0.8214000     1.873000  0.8214000     0.000000       0.000000  
1 1 1 32 0  17 o 1.332000  0.8146000     1.332000  0.8146000     1.332000  0.8146000     0.000000       0.000000  
1 1 1 32 1  2  o 11.96000  0.1460000     11.90000  0.2032000     12.01000  0.2099000     -0.1061000     0.2921000 
1 1 1 32 1  3  o 5.335000  0.1605000     4.992000  0.2291000     5.679000  0.2250000     -0.6876000     0.3211000 
1 1 1 32 1  4  o 6.778000  0.1673000     6.504000  0.2371000     7.051000  0.2361000     -0.5469000     0.3346000 
1 1 1 32 1  5  o 2.063000  0.4060000     2.459000  0.5368000     1.667000  0.6094000     0.7925000      0.8120000 
1 1 1 32 1  6  o 3.229000  0.1596000     3.395000  0.2115000     3.062000  0.2391000     0.3331000      0.3192000 
1 1 1 32 1  7  o 4.227000  0.1527000     4.272000  0.2348000     4.182000  0.1952000     0.9016000E-01  0.3054000 
1 1 1 32 1  8  o 2.246000  0.4797000     2.749000  0.6669000     1.743000  0.6896000     1.006000       0.9593000 
1 1 1 32 1  9  o 4.603000  0.2062000     4.737000  0.2906000     4.470000  0.2927000     0.2665000      0.4125000 
1 1 1 32 1  10 o 2.293000  0.3538000     2.912000  0.3124000     1.675000  0.6349000     1.237000       0.7076000 
1 1 1 32 1  11 o 2.431000  0.3755000     2.529000  0.3680000     2.333000  0.6545000     0.1952000      0.7509000 
1 1 1 32 1  12 o 2.056000  0.3994000     1.587000  0.6005000     2.526000  0.5267000     -0.9387000     0.7988000 
1 1 1 32 1  13 o 1.275000  0.4078000     1.201000  0.5394000     1.348000  0.6117000     -0.1471000     0.8155000 
1 1 1 32 1  14 o 2.295000  0.4798000     2.623000  0.6633000     1.967000  0.6933000     0.6564000      0.9595000 
1 1 1 32 1  15 o 2.423000  0.4412000     2.594000  0.6032000     2.251000  0.6441000     0.3429000      0.8824000 
1 1 1 32 1  16 o 1.627000  0.4544000     1.567000  0.6365000     1.686000  0.6488000     -0.1196000     0.9089000 
1 1 1 32 1  17 o 1.257000  0.4222000     1.332000  0.6219000     1.182000  0.5713000     0.1503000      0.8445000 
1 1 1 32 2  2  o 1.808000  0.2563000     2.023000  0.2881000     1.594000  0.4241000     0.4286000      0.5127000 
1 1 1 32 2  3  o 2.454000  0.2937000     1.887000  0.4797000     3.021000  0.3391000     -1.134000      0.5875000 
1 1 1 32 2  4  o 1.942000  0.3853000     1.623000  0.5571000     2.261000  0.5324000     -0.6370000     0.7706000 
1 1 1 32 2  5  o 5.812000  0.2836000     6.033000  0.5130000     5.592000  0.2420000     0.4417000      0.5673000 
1 1 1 32 2  6  o 4.864000  0.1158000     4.817000  0.1779000     4.911000  0.1484000     -0.9371000E-01 0.2317000 
1 1 1 32 2  7  o 1.093000  0.2954000     0.8252000 0.3903000     1.361000  0.4436000     -0.5353000     0.5908000 
1 1 1 32 2  8  o 1.552000  0.4908000     1.933000  0.8290000     1.172000  0.5255000     0.7611000      0.9816000 
1 1 1 32 2  9  o 3.610000  0.3374000     3.134000  0.3376000     4.086000  0.5843000     -0.9521000     0.6749000 
1 1 1 32 2  10 o 1.935000  0.3847000     2.219000  0.4197000     1.652000  0.6448000     0.5675000      0.7693000 
1 1 1 32 2  11 o 1.069000  0.3479000     0.7563000 0.3658000     1.382000  0.5920000     -0.6261000     0.6959000 
1 1 1 32 2  12 f 1.698000  0.4146000     1.798000  0.5093000     1.598000  0.6544000     0.2003000      0.8292000 
1 1 1 32 2  13 o 2.037000  0.4712000     1.916000  0.6195000     2.157000  0.7100000     -0.2407000     0.9423000 
1 1 1 32 2  14 o 1.318000  0.4206000     1.395000  0.6161000     1.240000  0.5728000     0.1548000      0.8413000 
1 1 1 32 2  15 o 1.366000  0.4175000     1.404000  0.5977000     1.328000  0.5829000     0.7511000E-01  0.8349000 
1 1 1 32 2  16 o 1.016000  0.3471000     0.8845000 0.4396000     1.147000  0.5372000     -0.2623000     0.6941000 
1 1 1 32 2  17 o 1.090000  0.3793000     0.9803000 0.4906000     1.200000  0.5785000     -0.2199000     0.7585000 
1 1 1 32 3  2  o 7.769000  0.1230000     7.946000  0.1622000     7.592000  0.1849000     0.3538000      0.2459000 
1 1 1 32 3  3  o 3.904000  0.1992000     3.975000  0.2665000     3.834000  0.2961000     0.1412000      0.3983000 
1 1 1 32 3  4  o 2.456000  0.4547000     2.682000  0.7561000     2.230000  0.5051000     0.4523000      0.9093000 
1 1 1 32 3  5  o 1.787000  0.4522000     1.642000  0.7238000     1.932000  0.5424000     -0.2895000     0.9045000 
1 1 1 32 3  6  o 5.225000  0.1197000     5.215000  0.1841000     5.236000  0.1532000     -0.2119000E-01 0.2395000 
1 1 1 32 3  7  o 4.574000  0.1699000     4.828000  0.2233000     4.319000  0.2562000     0.5089000      0.3398000 
1 1 1 32 3  8  o 1.881000  0.4494000     1.609000  0.7441000     2.153000  0.5042000     -0.5442000     0.8988000 
1 1 1 32 3  9  o 1.623000  0.4141000     1.764000  0.5219000     1.481000  0.6431000     0.2831000      0.8283000 
1 1 1 32 3  10 o 1.899000  0.3732000     1.923000  0.4727000     1.875000  0.5775000     0.4837000E-01  0.7463000 
1 1 1 32 3  11 o 3.171000  0.3308000     3.629000  0.2747000     2.713000  0.6018000     0.9160000      0.6615000 
1 1 1 32 3  12 o 3.279000  0.3155000     3.246000  0.3283000     3.313000  0.5389000     -0.6771000E-01 0.6310000 
1 1 1 32 3  13 o 1.785000  0.4143000     0.9995000 0.4579000     2.571000  0.6905000     -1.572000      0.8285000 
1 1 1 32 3  14 o 2.183000  0.5379000     1.878000  0.6997000     2.487000  0.8171000     -0.6086000     1.076000  
1 1 1 32 3  15 o 1.854000  0.4618000     1.984000  0.6626000     1.724000  0.6434000     0.2597000      0.9236000 
1 1 1 32 3  16 o 1.773000  0.4588000     1.961000  0.6665000     1.586000  0.6307000     0.3756000      0.9176000 
1 1 1 32 3  17 o 1.164000  0.4005000     1.029000  0.5121000     1.299000  0.6159000     -0.2701000     0.8010000 
1 1 1 32 4  2  o 0.8083000 0.2662000     0.6776000 0.3242000     0.9390000 0.4224000     -0.2614000     0.5325000 
1 1 1 32 4  3  o 2.911000  0.3178000     3.409000  0.2939000     2.413000  0.5636000     0.9961000      0.6356000 
1 1 1 32 4  4  o 2.843000  0.4355000     ?         ?             2.843000  0.4355000     ?              ?         
1 1 1 32 4  5  o 2.934000  0.4114000     2.718000  0.8102000     3.151000  0.1434000     -0.4333000     0.8227000 
1 1 1 32 4  6  o 3.377000  0.1835000     3.354000  0.2500000     3.400000  0.2688000     -0.4611000E-01 0.3671000 
1 1 1 32 4  7  o 4.581000  0.1670000     4.461000  0.2321000     4.701000  0.2400000     -0.2400000     0.3339000 
1 1 1 32 4  8  o 2.530000  0.4000000     2.270000  0.6891000     2.790000  0.4063000     -0.5200000     0.8000000 
1 1 1 32 4  9  o 2.200000  0.4181000     2.215000  0.4444000     2.185000  0.7083000     0.2997000E-01  0.8362000 
1 1 1 32 4  10 f 1.558000  0.3819000     1.731000  0.5277000     1.386000  0.5522000     0.3449000      0.7638000 
1 1 1 32 4  11 o 1.859000  0.3410000     1.116000  0.4788000     2.602000  0.4855000     -1.485000      0.6819000 
1 1 1 32 4  12 o 2.909000  0.4245000     3.150000  0.3454000     2.668000  0.7756000     0.4820000      0.8491000 
1 1 1 32 4  13 o 1.174000  0.3773000     1.160000  0.5026000     1.188000  0.5629000     -0.2859000E-01 0.7546000 
1 1 1 32 4  14 o 1.362000  0.4247000     1.370000  0.5589000     1.353000  0.6395000     0.1724000E-01  0.8493000 
1 1 1 32 4  15 o 1.719000  0.4434000     1.807000  0.5699000     1.631000  0.6794000     0.1761000      0.8868000 
1 1 1 32 4  16 o 1.523000  0.4386000     1.773000  0.6682000     1.272000  0.5684000     0.5009000      0.8773000 
1 1 1 32 4  17 o 1.230000  0.4339000     1.281000  0.6361000     1.178000  0.5904000     0.1026000      0.8679000 
1 1 1 32 5  2  o 1.801000  0.3106000     1.464000  0.4316000     2.137000  0.4467000     -0.6723000     0.6212000 
1 1 1 32 5  3  o 4.189000  0.2656000     3.760000  0.4722000     4.619000  0.2432000     -0.8586000     0.5312000 
1 1 1 32 5  5  o 2.803000  0.1383000     2.604000  0.2188000     3.002000  0.1693000     -0.3987000     0.2767000 
1 1 1 32 5  6  o 3.958000  0.1576000     3.933000  0.2047000     3.984000  0.2396000     -0.5089000E-01 0.3152000 
1 1 1 32 5  7  o 2.563000  0.2500000     2.489000  0.3306000     2.637000  0.3752000     -0.1481000     0.5000000 
1 1 1 32 5  8  o 4.810000  0.1985000     4.410000  0.3132000     5.211000  0.2440000     -0.8001000     0.3970000 
1 1 1 32 5  9  o 2.885000  0.3594000     2.652000  0.4017000     3.119000  0.5960000     -0.4674000     0.7188000 
1 1 1 32 5  10 o 1.526000  0.3932000     1.469000  0.5446000     1.583000  0.5674000     -0.1144000     0.7864000 
1 1 1 32 5  11 o 1.355000  0.3828000     1.136000  0.4983000     1.574000  0.5813000     -0.4382000     0.7657000 
1 1 1 32 5  12 o 1.958000  0.4205000     1.773000  0.5900000     2.142000  0.5993000     -0.3688000     0.8410000 
1 1 1 32 5  13 o 2.350000  0.4195000     2.720000  0.4374000     1.980000  0.7160000     0.7393000      0.8391000 
1 1 1 32 5  14 o 1.365000  0.4280000     1.242000  0.5219000     1.488000  0.6785000     -0.2463000     0.8560000 
1 1 1 32 5  15 o 1.620000  0.4154000     1.933000  0.5709000     1.307000  0.6035000     0.6259000      0.8307000 
1 1 1 32 5  16 o 1.795000  0.4601000     1.789000  0.5864000     1.801000  0.7092000     -0.1244000E-01 0.9202000 
1 1 1 32 6  1  o 6.648000  0.1763000     ?         ?             6.648000  0.1763000     ?              ?         
1 1 1 32 6  2  o 2.056000  0.3524000     2.038000  0.5473000     2.075000  0.4440000     -0.3652000E-01 0.7048000 
1 1 1 32 6  3  o 2.335000  0.3865000     2.112000  0.6566000     2.558000  0.4079000     -0.4454000     0.7729000 
1 1 1 32 6  4  o 2.222000  0.8434000     ?         ?             2.222000  0.8434000     ?              ?         
1 1 1 32 6  5  o 3.457000  0.1451000     3.452000  0.1842000     3.462000  0.2242000     -0.9970000E-02 0.2901000 
1 1 1 32 6  6  o 6.159000  0.1262000     5.894000  0.1697000     6.425000  0.1869000     -0.5306000     0.2525000 
1 1 1 32 6  7  o 2.861000  0.2457000     3.020000  0.3038000     2.702000  0.3863000     0.3174000      0.4914000 
1 1 1 32 6  8  o 1.066000  0.3358000     0.9431000 0.4345000     1.189000  0.5121000     -0.2456000     0.6717000 
1 1 1 32 6  9  o 2.852000  0.3285000     3.127000  0.3487000     2.577000  0.5568000     0.5505000      0.6570000 
1 1 1 32 6  10 o 2.704000  0.3215000     3.029000  0.3687000     2.380000  0.5268000     0.6491000      0.6430000 
1 1 1 32 6  11 o 3.313000  0.2739000     3.555000  0.3475000     3.071000  0.4234000     0.4839000      0.5478000 
1 1 1 32 6  12 o 2.386000  0.3907000     2.627000  0.4689000     2.146000  0.6251000     0.4807000      0.7814000 
1 1 1 32 6  13 o 1.093000  0.3531000     1.151000  0.5117000     1.036000  0.4868000     0.1150000      0.7063000 
1 1 1 32 6  14 o 1.667000  0.4475000     1.601000  0.5595000     1.733000  0.6985000     -0.1317000     0.8950000 
1 1 1 32 6  15 o 1.099000  0.3517000     1.287000  0.5349000     0.9117000 0.4568000     0.3749000      0.7034000 
1 1 1 32 6  16 o 1.481000  0.3962000     1.851000  0.5791000     1.111000  0.5409000     0.7397000      0.7924000 
1 1 1 32 7  1  o 3.148000  0.1898000     3.143000  0.2758000     3.152000  0.2609000     -0.9223000E-02 0.3797000 
1 1 1 32 7  2  o 1.911000  0.3824000     2.047000  0.5791000     1.776000  0.4995000     0.2717000      0.7648000 
1 1 1 32 7  3  o 4.145000  0.2639000     3.955000  0.4567000     4.336000  0.2644000     -0.3808000     0.5277000 
1 1 1 32 7  4  o 3.969000  0.1689000     3.701000  0.2851000     4.237000  0.1813000     -0.5363000     0.3379000 
1 1 1 32 7  5  o 3.521000  0.1585000     3.508000  0.2148000     3.535000  0.2331000     -0.2658000E-01 0.3170000 
1 1 1 32 7  6  o 1.700000  0.3185000     1.247000  0.4707000     2.152000  0.4290000     -0.9052000     0.6369000 
1 1 1 32 7  7  o 3.755000  0.2295000     3.774000  0.2564000     3.735000  0.3806000     0.3943000E-01  0.4590000 
1 1 1 32 7  8  o 1.798000  0.3517000     1.272000  0.5036000     2.324000  0.4910000     -1.052000      0.7033000 
1 1 1 32 7  9  o 3.544000  0.2344000     3.228000  0.3356000     3.860000  0.3275000     -0.6320000     0.4689000 
1 1 1 32 7  10 o 4.077000  0.2599000     4.531000  0.2655000     3.622000  0.4468000     0.9088000      0.5197000 
1 1 1 32 7  11 o 4.267000  0.2212000     4.391000  0.2876000     4.142000  0.3361000     0.2494000      0.4423000 
1 1 1 32 7  12 o 1.586000  0.4287000     1.614000  0.5995000     1.558000  0.6130000     0.5529000E-01  0.8574000 
1 1 1 32 7  13 o 2.316000  0.3938000     2.244000  0.5486000     2.389000  0.5650000     -0.1452000     0.7875000 
1 1 1 32 7  14 o 1.535000  0.4107000     1.630000  0.5754000     1.441000  0.5861000     0.1896000      0.8213000 
1 1 1 32 7  15 o 1.330000  0.3939000     1.281000  0.5333000     1.379000  0.5797000     -0.9734000E-01 0.7877000 
1 1 1 32 7  16 o 0.9551000 0.3291000     0.9611000 0.4559000     0.9491000 0.4747000     0.1205000E-01  0.6582000 
1 1 1 32 8  0  o 4.367000  0.2390000     4.367000  0.2390000     4.367000  0.2390000     -0.000000      0.000000  
1 1 1 32 8  1  o 1.621000  0.3573000     1.887000  0.5150000     1.356000  0.4955000     0.5302000      0.7147000 
1 1 1 32 8  2  o 1.176000  0.3622000     1.244000  0.5440000     1.107000  0.4785000     0.1363000      0.7244000 
1 1 1 32 8  3  o 6.580000  0.1911000     6.552000  0.3497000     6.608000  0.1540000     -0.5551000E-01 0.3821000 
1 1 1 32 8  4  o 6.530000  0.1110000     6.232000  0.1511000     6.829000  0.1626000     -0.5961000     0.2219000 
1 1 1 32 8  5  o 10.14000  0.1223000     10.07000  0.1653000     10.21000  0.1803000     -0.1440000     0.2446000 
1 1 1 32 8  6  o 5.181000  0.1510000     5.093000  0.2058000     5.270000  0.2211000     -0.1766000     0.3021000 
1 1 1 32 8  7  o 2.350000  0.3857000     2.467000  0.4849000     2.233000  0.5998000     0.2346000      0.7713000 
1 1 1 32 8  8  o 1.752000  0.3709000     1.913000  0.4904000     1.591000  0.5565000     0.3223000      0.7417000 
1 1 1 32 8  9  o 1.487000  0.3831000     1.197000  0.5024000     1.777000  0.5786000     -0.5798000     0.7662000 
1 1 1 32 8  10 o 2.543000  0.3332000     2.472000  0.4428000     2.613000  0.4980000     -0.1413000     0.6664000 
1 1 1 32 8  11 f 2.753000  0.3274000     2.153000  0.5111000     3.353000  0.4094000     -1.200000      0.6548000 
1 1 1 32 8  12 o 2.419000  0.4556000     2.219000  0.6656000     2.618000  0.6223000     -0.3993000     0.9112000 
1 1 1 32 8  13 o 1.637000  0.4326000     1.646000  0.6179000     1.627000  0.6057000     0.1937000E-01  0.8653000 
1 1 1 32 8  14 o 1.453000  0.4003000     1.140000  0.5118000     1.766000  0.6157000     -0.6254000     0.8006000 
1 1 1 32 8  15 o 1.160000  0.3698000     1.130000  0.5105000     1.190000  0.5351000     -0.6027000E-01 0.7396000 
1 1 1 32 8  16 o 1.059000  0.3482000     1.114000  0.5066000     1.004000  0.4778000     0.1105000      0.6964000 
1 1 1 32 9  0  o 2.242000  0.2846000     2.242000  0.2846000     2.242000  0.2846000     -0.000000      0.000000  
1 1 1 32 9  1  o 2.997000  0.2259000     3.276000  0.2410000     2.718000  0.3822000     0.5578000      0.4518000 
1 1 1 32 9  2  o 3.214000  0.1929000     3.054000  0.3301000     3.375000  0.1999000     -0.3214000     0.3859000 
1 1 1 32 9  3  o 5.263000  0.1349000     5.010000  0.1775000     5.516000  0.2033000     -0.5064000     0.2699000 
1 1 1 32 9  4  o 3.711000  0.1582000     3.868000  0.2112000     3.554000  0.2356000     0.3144000      0.3164000 
1 1 1 32 9  5  o 3.820000  0.1720000     3.843000  0.2402000     3.797000  0.2464000     0.4635000E-01  0.3441000 
1 1 1 32 9  6  o 8.548000  0.1443000     8.296000  0.2013000     8.800000  0.2067000     -0.5046000     0.2885000 
1 1 1 32 9  7  o 3.379000  0.4702000     3.154000  0.8838000     3.605000  0.3212000     -0.4508000     0.9404000 
1 1 1 32 9  8  o 5.112000  0.2212000     4.516000  0.3501000     5.708000  0.2705000     -1.192000      0.4425000 
1 1 1 32 9  9  o 4.058000  0.2865000     3.208000  0.4955000     4.909000  0.2877000     -1.701000      0.5730000 
1 1 1 32 9  10 o 2.771000  0.4187000     2.497000  0.6146000     3.045000  0.5687000     -0.5474000     0.8374000 
1 1 1 32 9  11 o 4.546000  0.2098000     4.126000  0.2911000     4.965000  0.3021000     -0.8393000     0.4195000 
1 1 1 32 9  12 f 2.097000  0.5485000     2.081000  0.9124000     2.112000  0.6092000     -0.3052000E-01 1.097000  
1 1 1 32 9  13 o 1.243000  0.3886000     1.029000  0.4786000     1.457000  0.6122000     -0.4282000     0.7771000 
1 1 1 32 9  14 o 1.181000  0.3716000     1.213000  0.5328000     1.149000  0.5182000     0.6435000E-01  0.7432000 
1 1 1 32 9  15 o 1.494000  0.4186000     1.302000  0.5516000     1.687000  0.6298000     -0.3849000     0.8372000 
1 1 1 32 9  16 o 1.277000  0.3946000     1.281000  0.5486000     1.272000  0.5674000     0.9354000E-02  0.7892000 
1 1 1 32 10 0  o 1.216000  0.5464000     1.216000  0.5464000     1.216000  0.5464000     0.000000       0.000000  
1 1 1 32 10 1  o 2.596000  0.1885000     2.297000  0.3275000     2.894000  0.1868000     -0.5976000     0.3771000 
1 1 1 32 10 2  o 1.347000  0.2988000     1.631000  0.4235000     1.063000  0.4216000     0.5675000      0.5976000 
1 1 1 32 10 3  o 4.169000  0.3482000     3.977000  0.2210000     4.360000  0.6603000     -0.3824000     0.6964000 
1 1 1 32 10 4  o 2.769000  0.2142000     2.753000  0.2950000     2.785000  0.3106000     -0.3270000E-01 0.4283000 
1 1 1 32 10 5  o 2.603000  0.2596000     3.004000  0.3031000     2.201000  0.4216000     0.8037000      0.5192000 
1 1 1 32 10 6  o 4.560000  0.1997000     4.435000  0.2358000     4.684000  0.3223000     -0.2487000     0.3994000 
1 1 1 32 10 7  o 5.619000  0.1858000     5.467000  0.2901000     5.772000  0.2322000     -0.3050000     0.3716000 
1 1 1 32 10 8  o 4.621000  0.2828000     4.130000  0.4331000     5.112000  0.3638000     -0.9822000     0.5656000 
1 1 1 32 10 9  f 5.185000  0.2376000     5.098000  0.3329000     5.272000  0.3391000     -0.1743000     0.4752000 
1 1 1 32 10 10 o 2.824000  0.3179000     2.861000  0.4160000     2.788000  0.4808000     0.7277000E-01  0.6358000 
1 1 1 32 10 11 o 2.400000  0.3647000     2.430000  0.4756000     2.371000  0.5531000     0.5838000E-01  0.7294000 
1 1 1 32 10 12 o 2.034000  0.4880000     2.685000  0.7862000     1.384000  0.5783000     1.302000       0.9759000 
1 1 1 32 10 13 o 3.901000  0.2933000     4.102000  0.3779000     3.700000  0.4486000     0.4021000      0.5866000 
1 1 1 32 10 14 o 3.248000  0.3188000     3.371000  0.4034000     3.125000  0.4936000     0.2460000      0.6375000 
1 1 1 32 10 15 o 1.446000  0.4150000     1.390000  0.5698000     1.501000  0.6035000     -0.1104000     0.8300000 
1 1 1 32 10 16 o 1.575000  0.4058000     2.033000  0.6246000     1.117000  0.5183000     0.9162000      0.8117000 
1 1 1 32 11 0  o 4.473000  0.1941000     4.473000  0.1941000     4.473000  0.1941000     -0.000000      0.000000  
1 1 1 32 11 1  o 3.814000  0.1520000     3.864000  0.2477000     3.764000  0.1763000     0.9988000E-01  0.3041000 
1 1 1 32 11 2  o 5.178000  0.1333000     5.081000  0.2171000     5.274000  0.1548000     -0.1928000     0.2666000 
1 1 1 32 11 3  o 5.382000  0.1306000     5.230000  0.1846000     5.534000  0.1848000     -0.3042000     0.2613000 
1 1 1 32 11 4  o 5.869000  0.1390000     5.587000  0.2050000     6.151000  0.1878000     -0.5635000     0.2780000 
1 1 1 32 11 5  o 3.462000  0.1948000     3.642000  0.2662000     3.282000  0.2844000     0.3600000      0.3895000 
1 1 1 32 11 6  o 1.501000  0.3749000     1.768000  0.5612000     1.234000  0.4972000     0.5341000      0.7498000 
1 1 1 32 11 7  o 1.956000  0.3582000     1.971000  0.4955000     1.940000  0.5173000     0.3071000E-01  0.7163000 
1 1 1 32 11 8  o 2.537000  0.4160000     3.088000  0.3710000     1.985000  0.7447000     1.103000       0.8320000 
1 1 1 32 11 9  o 3.724000  0.2403000     3.871000  0.3088000     3.577000  0.3683000     0.2943000      0.4807000 
1 1 1 32 11 10 o 2.706000  0.3403000     3.169000  0.3680000     2.243000  0.5725000     0.9255000      0.6806000 
1 1 1 32 11 11 o 1.379000  0.3881000     1.100000  0.4935000     1.659000  0.5990000     -0.5594000     0.7761000 
1 1 1 32 11 12 o 2.704000  0.4180000     2.187000  0.7047000     3.220000  0.4498000     -1.033000      0.8361000 
1 1 1 32 11 13 f 1.674000  0.4504000     1.926000  0.6207000     1.422000  0.6529000     0.5040000      0.9009000 
1 1 1 32 11 14 o 1.291000  0.3903000     1.021000  0.4783000     1.562000  0.6169000     -0.5410000     0.7805000 
1 1 1 32 11 15 o 0.9937000 0.3361000     0.9699000 0.4645000     1.017000  0.4858000     -0.4753000E-01 0.6721000 
1 1 1 32 11 16 o 1.462000  0.4197000     1.474000  0.5879000     1.450000  0.5991000     0.2434000E-01  0.8394000 
1 1 1 32 12 0  o 3.119000  0.2396000     3.119000  0.2396000     3.119000  0.2396000     -0.000000      0.000000  
1 1 1 32 12 1  o 2.237000  0.2626000     2.191000  0.4361000     2.282000  0.2926000     -0.9031000E-01 0.5251000 
1 1 1 32 12 2  o 2.213000  0.3284000     1.964000  0.5767000     2.462000  0.3144000     -0.4976000     0.6568000 
1 1 1 32 12 3  o 7.061000  0.1340000     7.012000  0.2010000     7.111000  0.1773000     -0.9923000E-01 0.2680000 
1 1 1 32 12 4  o 2.777000  0.2315000     3.004000  0.2855000     2.550000  0.3645000     0.4542000      0.4630000 
1 1 1 32 12 5  f 1.706000  0.3936000     1.614000  0.4993000     1.798000  0.6086000     -0.1833000     0.7872000 
1 1 1 32 12 6  o 2.311000  0.3641000     1.798000  0.6197000     2.824000  0.3825000     -1.026000      0.7282000 
1 1 1 32 12 7  o 5.849000  0.1733000     5.888000  0.2576000     5.810000  0.2319000     0.7740000E-01  0.3466000 
1 1 1 32 12 8  o 2.719000  0.3782000     2.806000  0.3969000     2.631000  0.6440000     0.1741000      0.7565000 
1 1 1 32 12 9  o 1.789000  0.3990000     1.547000  0.5529000     2.031000  0.5755000     -0.4834000     0.7980000 
1 1 1 32 12 10 o 4.999000  0.2254000     5.046000  0.2672000     4.953000  0.3631000     0.9297000E-01  0.4508000 
1 1 1 32 12 11 o 1.132000  0.3620000     1.223000  0.5242000     1.042000  0.4994000     0.1806000      0.7240000 
1 1 1 32 12 12 o 1.676000  0.4209000     1.809000  0.5944000     1.544000  0.5962000     0.2655000      0.8418000 
1 1 1 32 12 13 o 2.101000  0.5293000     2.181000  0.6375000     2.022000  0.8450000     0.1589000      1.059000  
1 1 1 32 12 14 o 1.585000  0.4196000     1.276000  0.5471000     1.894000  0.6362000     -0.6174000     0.8391000 
1 1 1 32 12 15 o 1.935000  0.4099000     2.424000  0.5567000     1.446000  0.6017000     0.9779000      0.8198000 
1 1 1 32 12 16 o 1.449000  0.4208000     1.389000  0.5782000     1.510000  0.6117000     -0.1204000     0.8417000 
1 1 1 32 13 0  o 3.636000  0.2815000     3.636000  0.2815000     3.636000  0.2815000     -0.000000      0.000000  
1 1 1 32 13 1  f 4.893000  0.1377000     4.657000  0.1998000     5.128000  0.1895000     -0.4710000     0.2754000 
1 1 1 32 13 2  o 3.246000  0.2012000     3.271000  0.3191000     3.222000  0.2450000     0.4892000E-01  0.4023000 
1 1 1 32 13 3  o 6.079000  0.1385000     6.023000  0.2211000     6.134000  0.1669000     -0.1105000     0.2770000 
1 1 1 32 13 4  o 5.821000  0.1840000     5.626000  0.2516000     6.015000  0.2684000     -0.3893000     0.3679000 
1 1 1 32 13 5  o 1.507000  0.3803000     1.773000  0.5815000     1.242000  0.4902000     0.5310000      0.7606000 
1 1 1 32 13 6  o 2.845000  0.2588000     2.962000  0.3413000     2.727000  0.3892000     0.2354000      0.5176000 
1 1 1 32 13 7  o 2.032000  0.3675000     2.196000  0.4881000     1.869000  0.5495000     0.3278000      0.7350000 
1 1 1 32 13 8  o 1.133000  0.3561000     0.9371000 0.4378000     1.330000  0.5617000     -0.3924000     0.7122000 
1 1 1 32 13 9  o 1.303000  0.3797000     1.389000  0.5432000     1.218000  0.5306000     0.1702000      0.7594000 
1 1 1 32 13 10 o 5.089000  0.2056000     5.143000  0.2855000     5.035000  0.2959000     0.1077000      0.4111000 
1 1 1 32 13 11 o 3.544000  0.3420000     3.974000  0.4540000     3.114000  0.5116000     0.8604000      0.6840000 
1 1 1 32 13 12 o 1.676000  0.4232000     1.480000  0.5772000     1.872000  0.6190000     -0.3923000     0.8463000 
1 1 1 32 13 13 o 1.485000  0.4571000     1.381000  0.5795000     1.589000  0.7070000     -0.2081000     0.9141000 
1 1 1 32 13 14 o 1.576000  0.4232000     1.762000  0.6135000     1.389000  0.5829000     0.3731000      0.8463000 
1 1 1 32 13 15 o 1.110000  0.3645000     1.042000  0.4936000     1.177000  0.5366000     -0.1343000     0.7291000 
1 1 1 32 13 16 o 1.362000  0.4095000     1.558000  0.6085000     1.165000  0.5481000     0.3921000      0.8190000 
1 1 1 32 14 0  o 0.7357000 0.4783000     0.7357000 0.4783000     0.7357000 0.4783000     -0.000000      0.000000  
1 1 1 32 14 1  o 4.155000  0.1969000     4.242000  0.2522000     4.069000  0.3024000     0.1726000      0.3937000 
1 1 1 32 14 2  o 1.669000  0.3682000     1.743000  0.5302000     1.596000  0.5112000     0.1476000      0.7365000 
1 1 1 32 14 3  o 4.767000  0.1686000     4.808000  0.2564000     4.727000  0.2191000     0.8107000E-01  0.3372000 
1 1 1 32 14 4  o 5.294000  0.1808000     5.549000  0.2827000     5.038000  0.2254000     0.5106000      0.3615000 
1 1 1 32 14 5  o 2.659000  0.3216000     2.344000  0.5460000     2.975000  0.3400000     -0.6311000     0.6432000 
1 1 1 32 14 6  o 2.889000  0.2690000     2.674000  0.3978000     3.104000  0.3622000     -0.4297000     0.5380000 
1 1 1 32 14 7  o 1.101000  0.3488000     0.9493000 0.4419000     1.253000  0.5397000     -0.3041000     0.6975000 
1 1 1 32 14 8  o 1.752000  0.4169000     1.439000  0.6037000     2.065000  0.5750000     -0.6267000     0.8337000 
1 1 1 32 14 9  o 2.659000  0.3373000     2.879000  0.4169000     2.439000  0.5303000     0.4403000      0.6745000 
1 1 1 32 14 10 o 3.874000  0.2462000     4.039000  0.3175000     3.709000  0.3764000     0.3302000      0.4924000 
1 1 1 32 14 11 o 2.525000  0.5755000     2.719000  1.006000      2.332000  0.5589000     0.3870000      1.151000  
1 1 1 32 14 12 o 1.168000  0.3633000     1.423000  0.5737000     0.9139000 0.4459000     0.5088000      0.7266000 
1 1 1 32 14 13 o 2.425000  0.4242000     2.154000  0.5925000     2.697000  0.6072000     -0.5437000     0.8484000 
1 1 1 32 14 14 o 1.060000  0.3516000     1.119000  0.5131000     1.001000  0.4809000     0.1178000      0.7032000 
1 1 1 32 14 15 o 1.173000  0.3769000     1.199000  0.5385000     1.148000  0.5275000     0.5081000E-01  0.7538000 
1 1 1 32 14 16 o 1.213000  0.4201000     1.135000  0.5610000     1.292000  0.6254000     -0.1565000     0.8401000 
1 1 1 32 15 0  f 4.372000  0.2896000     4.372000  0.2896000     4.372000  0.2896000     0.000000       0.000000  
1 1 1 32 15 1  o 6.101000  0.1476000     6.017000  0.2025000     6.186000  0.2149000     -0.1696000     0.2953000 
1 1 1 32 15 2  o 4.226000  0.1833000     4.517000  0.2403000     3.935000  0.2769000     0.5819000      0.3666000 
1 1 1 32 15 3  o 1.514000  0.4049000     1.597000  0.6278000     1.431000  0.5115000     0.1663000      0.8098000 
1 1 1 32 15 4  o 4.881000  0.2340000     4.373000  0.4261000     5.389000  0.1937000     -1.016000      0.4680000 
1 1 1 32 15 5  o 2.575000  0.3181000     2.480000  0.4956000     2.671000  0.3990000     -0.1912000     0.6363000 
1 1 1 32 15 6  o 1.338000  0.3586000     1.025000  0.4594000     1.652000  0.5506000     -0.6268000     0.7171000 
1 1 1 32 15 7  o 1.860000  0.4146000     1.990000  0.5449000     1.730000  0.6251000     0.2599000      0.8292000 
1 1 1 32 15 8  o 2.123000  0.3779000     1.809000  0.5484000     2.437000  0.5202000     -0.6278000     0.7559000 
1 1 1 32 15 9  o 2.305000  0.3542000     1.483000  0.5646000     3.128000  0.4279000     -1.645000      0.7085000 
1 1 1 32 15 10 o 1.398000  0.3987000     1.249000  0.5316000     1.548000  0.5944000     -0.2992000     0.7974000 
1 1 1 32 15 11 o 2.550000  0.4257000     2.262000  0.6962000     2.837000  0.4901000     -0.5757000     0.8514000 
1 1 1 32 15 12 o 2.157000  0.4264000     2.295000  0.5847000     2.018000  0.6207000     0.2772000      0.8527000 
1 1 1 32 15 13 o 1.293000  0.3874000     1.506000  0.5884000     1.079000  0.5040000     0.4267000      0.7748000 
1 1 1 32 15 14 o 1.716000  0.4122000     2.132000  0.5949000     1.301000  0.5706000     0.8315000      0.8243000 
1 1 1 32 15 15 o 1.090000  0.3594000     1.206000  0.5418000     0.9745000 0.4725000     0.2320000      0.7189000 
1 1 1 32 16 0  f 0.6843000 0.4535000     0.6843000 0.4535000     0.6843000 0.4535000     0.000000       0.000000  
1 1 1 32 16 1  o 7.714000  0.1244000     7.507000  0.1779000     7.921000  0.1739000     -0.4139000     0.2487000 
1 1 1 32 16 2  o 6.762000  0.1382000     6.739000  0.2130000     6.784000  0.1760000     -0.4504000E-01 0.2763000 
1 1 1 32 16 3  o 5.075000  0.1469000     5.011000  0.2167000     5.140000  0.1983000     -0.1287000     0.2937000 
1 1 1 32 16 4  o 4.122000  0.1935000     4.156000  0.3167000     4.089000  0.2225000     0.6690000E-01  0.3870000 
1 1 1 32 16 5  o 2.123000  0.3478000     2.103000  0.5612000     2.144000  0.4110000     -0.4161000E-01 0.6956000 
1 1 1 32 16 6  o 1.339000  0.3582000     1.001000  0.4550000     1.678000  0.5533000     -0.6774000     0.7164000 
1 1 1 32 16 7  o 4.160000  0.2420000     4.448000  0.3146000     3.873000  0.3677000     0.5746000      0.4840000 
1 1 1 32 16 8  o 3.614000  0.2411000     3.354000  0.3494000     3.874000  0.3324000     -0.5201000     0.4823000 
1 1 1 32 16 9  o 1.318000  0.3848000     1.406000  0.5525000     1.229000  0.5357000     0.1766000      0.7696000 
1 1 1 32 16 10 o 1.311000  0.4013000     1.196000  0.5284000     1.425000  0.6042000     -0.2284000     0.8026000 
1 1 1 32 16 11 o 1.609000  0.4190000     1.826000  0.6084000     1.392000  0.5764000     0.4341000      0.8380000 
1 1 1 32 16 12 o 1.808000  0.4359000     1.409000  0.5740000     2.207000  0.6563000     -0.7988000     0.8719000 
1 1 1 32 16 13 o 1.289000  0.3965000     1.320000  0.5623000     1.258000  0.5592000     0.6147000E-01  0.7930000 
1 1 1 32 16 14 o 1.698000  0.4254000     1.913000  0.5937000     1.484000  0.6094000     0.4293000      0.8508000 
1 1 1 32 16 15 o 1.118000  0.3677000     1.044000  0.4939000     1.192000  0.5449000     -0.1478000     0.7354000 
1 1 1 32 17 0  o 1.277000  0.6006000     1.277000  0.6006000     1.277000  0.6006000     0.000000       0.000000  
1 1 1 32 17 1  o 1.678000  0.3252000     1.308000  0.4891000     2.049000  0.4286000     -0.7407000     0.6503000 
1 1 1 32 17 2  o 6.488000  0.1332000     6.417000  0.1916000     6.560000  0.1852000     -0.1431000     0.2665000 
1 1 1 32 17 3  o 8.183000  0.1284000     8.193000  0.1846000     8.173000  0.1785000     0.1968000E-01  0.2567000 
1 1 1 32 17 4  o 4.029000  0.2063000     3.887000  0.3449000     4.170000  0.2263000     -0.2829000     0.4126000 
1 1 1 32 17 5  o 2.441000  0.3235000     2.241000  0.5475000     2.640000  0.3448000     -0.3983000     0.6470000 
1 1 1 32 17 6  o 5.227000  0.1901000     5.066000  0.3082000     5.389000  0.2225000     -0.3233000     0.3801000 
1 1 1 32 17 7  o 1.492000  0.3959000     1.338000  0.5356000     1.647000  0.5833000     -0.3090000     0.7918000 
1 1 1 32 17 8  o 1.435000  0.3677000     0.9574000 0.4450000     1.913000  0.5855000     -0.9561000     0.7354000 
1 1 1 32 17 9  o 3.391000  0.2753000     3.292000  0.3780000     3.490000  0.4004000     -0.1975000     0.5507000 
1 1 1 32 17 10 o 2.450000  0.4345000     2.367000  0.6728000     2.533000  0.5500000     -0.1655000     0.8690000 
1 1 1 32 17 11 o 1.632000  0.4297000     1.599000  0.5989000     1.665000  0.6164000     -0.6593000E-01 0.8595000 
1 1 1 32 17 12 f 1.225000  0.4085000     1.131000  0.5257000     1.319000  0.6254000     -0.1877000     0.8171000 
1 1 1 32 17 13 o 1.952000  0.4137000     2.398000  0.5605000     1.505000  0.6087000     0.8928000      0.8274000 
1 1 1 32 17 14 o 1.311000  0.3906000     1.545000  0.5948000     1.077000  0.5064000     0.4685000      0.7811000 
1 1 1 32 17 15 o 2.288000  0.4431000     2.151000  0.6353000     2.425000  0.6177000     -0.2744000     0.8861000 
1 1 1 32 18 0  o 0.9908000 0.5696000     0.9908000 0.5696000     0.9908000 0.5696000     -0.000000      0.000000  
1 1 1 32 18 1  o 2.431000  0.2846000     2.868000  0.3303000     1.995000  0.4635000     0.8731000      0.5691000 
1 1 1 32 18 2  o 4.130000  0.1808000     4.091000  0.2662000     4.169000  0.2447000     -0.7798000E-01 0.3616000 
1 1 1 32 18 3  o 6.307000  0.1409000     6.353000  0.2017000     6.260000  0.1967000     0.9380000E-01  0.2817000 
1 1 1 32 18 4  o 3.592000  0.2053000     3.475000  0.3050000     3.710000  0.2749000     -0.2359000     0.4107000 
1 1 1 32 18 5  o 4.877000  0.1826000     4.799000  0.2999000     4.955000  0.2084000     -0.1555000     0.3653000 
1 1 1 32 18 6  o 1.391000  0.3903000     1.717000  0.6234000     1.064000  0.4697000     0.6536000      0.7806000 
1 1 1 32 18 7  o 1.784000  0.4155000     1.620000  0.6001000     1.948000  0.5749000     -0.3273000     0.8311000 
1 1 1 32 18 8  o 1.798000  0.3950000     1.403000  0.5450000     2.193000  0.5718000     -0.7899000     0.7899000 
1 1 1 32 18 9  o 2.022000  0.4400000     1.964000  0.5732000     2.080000  0.6678000     -0.1162000     0.8801000 
1 1 1 32 18 10 o 2.002000  0.4611000     1.367000  0.6050000     2.636000  0.6961000     -1.269000      0.9223000 
1 1 1 32 18 11 o 1.688000  0.4265000     1.381000  0.5741000     1.996000  0.6308000     -0.6149000     0.8529000 
1 1 1 32 18 12 o 1.712000  0.4883000     1.587000  0.6266000     1.838000  0.7490000     -0.2514000     0.9765000 
1 1 1 32 18 13 o 1.805000  0.4370000     1.616000  0.6046000     1.993000  0.6311000     -0.3773000     0.8739000 
1 1 1 32 18 14 o 2.770000  0.3943000     3.019000  0.5036000     2.522000  0.6070000     0.4969000      0.7887000 
1 1 1 32 18 15 o 1.351000  0.4188000     1.355000  0.5842000     1.347000  0.6003000     0.8374000E-02  0.8377000 
1 1 1 32 19 0  o 0.8748000 0.5441000     0.8748000 0.5441000     0.8748000 0.5441000     -0.000000      0.000000  
1 1 1 32 19 1  o 3.917000  0.1902000     3.589000  0.2886000     4.244000  0.2478000     -0.6550000     0.3804000 
1 1 1 32 19 2  o 4.665000  0.1696000     4.762000  0.2445000     4.568000  0.2351000     0.1939000      0.3392000 
1 1 1 32 19 3  o 7.452000  0.1369000     7.290000  0.1975000     7.614000  0.1897000     -0.3241000     0.2739000 
1 1 1 32 19 4  o 2.097000  0.3408000     1.930000  0.5124000     2.264000  0.4494000     -0.3340000     0.6815000 
1 1 1 32 19 5  o 2.251000  0.3561000     1.911000  0.5950000     2.592000  0.3916000     -0.6818000     0.7123000 
1 1 1 32 19 6  o 2.393000  0.3522000     2.194000  0.5817000     2.591000  0.3970000     -0.3966000     0.7043000 
1 1 1 32 19 7  o 3.442000  0.2635000     3.532000  0.4312000     3.353000  0.3031000     0.1790000      0.5271000 
1 1 1 32 19 8  o 1.659000  0.4082000     1.504000  0.5566000     1.814000  0.5972000     -0.3106000     0.8164000 
1 1 1 32 19 9  o 2.810000  0.4301000     3.364000  0.5406000     2.255000  0.6689000     1.109000       0.8601000 
1 1 1 32 19 10 o 2.967000  0.3427000     2.709000  0.5119000     3.224000  0.4557000     -0.5144000     0.6854000 
1 1 1 32 19 11 o 2.829000  0.3757000     3.108000  0.4684000     2.549000  0.5874000     0.5596000      0.7513000 
1 1 1 32 19 12 o 1.639000  0.4430000     1.711000  0.6090000     1.567000  0.6436000     0.1442000      0.8861000 
1 1 1 32 19 13 f 2.235000  0.4102000     1.654000  0.6209000     2.816000  0.5362000     -1.162000      0.8204000 
1 1 1 32 19 14 f 1.177000  0.3792000     1.331000  0.5784000     1.023000  0.4904000     0.3078000      0.7583000 
1 1 1 32 19 15 o 0.9381000 0.3280000     0.9726000 0.4761000     0.9037000 0.4514000     0.6884000E-01  0.6561000 
1 1 1 32 20 0  o 2.380000  0.4808000     2.380000  0.4808000     2.380000  0.4808000     0.000000       0.000000  
1 1 1 32 20 1  o 2.062000  0.3260000     2.455000  0.4145000     1.669000  0.5032000     0.7863000      0.6519000 
1 1 1 32 20 2  o 1.402000  0.3456000     1.788000  0.5245000     1.016000  0.4502000     0.7714000      0.6912000 
1 1 1 32 20 3  o 1.670000  0.3554000     1.366000  0.5234000     1.975000  0.4808000     -0.6089000     0.7107000 
1 1 1 32 20 4  o 3.506000  0.2218000     3.512000  0.3127000     3.500000  0.3146000     0.1187000E-01  0.4436000 
1 1 1 32 20 5  o 2.949000  0.3102000     2.704000  0.4778000     3.194000  0.3958000     -0.4898000     0.6204000 
1 1 1 32 20 6  o 4.103000  0.2188000     4.399000  0.3431000     3.808000  0.2717000     0.5913000      0.4377000 
1 1 1 32 20 7  o 0.9565000 0.3166000     0.9435000 0.4532000     0.9695000 0.4422000     -0.2605000E-01 0.6332000 
1 1 1 32 20 8  o 2.068000  0.4580000     2.040000  0.6441000     2.095000  0.6514000     -0.5497000E-01 0.9161000 
1 1 1 32 20 9  o 1.972000  0.4965000     2.285000  0.7798000     1.659000  0.6148000     0.6261000      0.9930000 
1 1 1 32 20 10 o 1.187000  0.3702000     1.380000  0.5671000     0.9933000 0.4759000     0.3871000      0.7404000 
1 1 1 32 20 11 o 1.157000  0.3774000     1.074000  0.4987000     1.239000  0.5665000     -0.1655000     0.7547000 
1 1 1 32 20 12 o 1.595000  0.4265000     1.230000  0.5450000     1.959000  0.6562000     -0.7293000     0.8530000 
1 1 1 32 20 13 o 1.499000  0.4304000     1.416000  0.5872000     1.582000  0.6296000     -0.1660000     0.8609000 
1 1 1 32 20 14 o 1.230000  0.3906000     1.098000  0.5127000     1.361000  0.5894000     -0.2632000     0.7812000 
1 1 1 32 21 0  o 4.155000  0.2738000     4.155000  0.2738000     4.155000  0.2738000     0.000000       0.000000  
1 1 1 32 21 1  o 1.416000  0.3572000     1.122000  0.4817000     1.710000  0.5275000     -0.5874000     0.7144000 
1 1 1 32 21 2  o 6.376000  0.1502000     6.182000  0.2190000     6.570000  0.2055000     -0.3878000     0.3003000 
1 1 1 32 21 3  o 4.957000  0.1726000     4.737000  0.2505000     5.178000  0.2376000     -0.4412000     0.3453000 
1 1 1 32 21 4  f 2.391000  0.3577000     2.358000  0.5685000     2.425000  0.4341000     -0.6724000E-01 0.7153000 
1 1 1 32 21 5  o 3.152000  0.2679000     3.198000  0.3637000     3.106000  0.3934000     0.9208000E-01  0.5358000 
1 1 1 32 21 6  o 1.471000  0.3836000     1.515000  0.5516000     1.427000  0.5332000     0.8845000E-01  0.7672000 
1 1 1 32 21 7  o 3.252000  0.2755000     3.169000  0.4489000     3.335000  0.3196000     -0.1665000     0.5511000 
1 1 1 32 21 8  o 3.493000  0.3341000     4.027000  0.4762000     2.959000  0.4687000     1.069000       0.6682000 
1 1 1 32 21 9  o 2.549000  0.4008000     2.900000  0.4736000     2.199000  0.6466000     0.7004000      0.8015000 
1 1 1 32 21 10 o 2.315000  0.4056000     2.781000  0.5010000     1.850000  0.6380000     0.9306000      0.8112000 
1 1 1 32 21 11 o 1.440000  0.4522000     1.133000  0.5233000     1.747000  0.7377000     -0.6143000     0.9045000 
1 1 1 32 21 12 o 2.100000  0.4157000     2.531000  0.5464000     1.669000  0.6267000     0.8613000      0.8315000 
1 1 1 32 21 13 o 1.532000  0.4308000     1.768000  0.6400000     1.296000  0.5767000     0.4723000      0.8615000 
1 1 1 32 21 14 o 1.080000  0.3582000     1.075000  0.5046000     1.085000  0.5084000     -0.1044000E-01 0.7163000 
1 1 1 32 22 0  o 3.999000  0.2873000     3.999000  0.2873000     3.999000  0.2873000     -0.000000      0.000000  
1 1 1 32 22 1  o 1.619000  0.3792000     1.731000  0.5397000     1.507000  0.5327000     0.2235000      0.7584000 
1 1 1 32 22 2  o 4.381000  0.1880000     4.396000  0.2709000     4.367000  0.2608000     0.2927000E-01  0.3760000 
1 1 1 32 22 3  o 2.088000  0.3849000     1.793000  0.6106000     2.384000  0.4688000     -0.5912000     0.7698000 
1 1 1 32 22 4  o 4.423000  0.2185000     4.750000  0.2962000     4.095000  0.3212000     0.6552000      0.4369000 
1 1 1 32 22 5  o 3.257000  0.2577000     3.066000  0.3969000     3.447000  0.3287000     -0.3809000     0.5154000 
1 1 1 32 22 6  o 4.532000  0.1963000     4.279000  0.2953000     4.784000  0.2588000     -0.5047000     0.3927000 
1 1 1 32 22 7  o 5.969000  0.2275000     5.827000  0.3675000     6.110000  0.2682000     -0.2821000     0.4550000 
1 1 1 32 22 8  o 2.554000  0.4702000     2.572000  0.7807000     2.537000  0.5241000     0.3494000E-01  0.9403000 
1 1 1 32 22 9  o 3.939000  0.3012000     4.686000  0.3786000     3.193000  0.4686000     1.493000       0.6024000 
1 1 1 32 22 10 o 1.378000  0.3979000     1.613000  0.5992000     1.143000  0.5237000     0.4700000      0.7958000 
1 1 1 32 22 11 o 4.666000  0.3183000     5.165000  0.3355000     4.167000  0.5411000     0.9981000      0.6367000 
1 1 1 32 22 12 o 1.369000  0.4121000     1.417000  0.5843000     1.321000  0.5811000     0.9595000E-01  0.8241000 
1 1 1 32 22 13 o 1.512000  0.4289000     1.293000  0.5646000     1.731000  0.6456000     -0.4381000     0.8577000 
1 1 1 32 22 14 o 1.457000  0.4349000     1.082000  0.5113000     1.832000  0.7035000     -0.7498000     0.8697000 
1 1 1 32 23 0  o 1.522000  0.6636000     1.522000  0.6636000     1.522000  0.6636000     -0.000000      0.000000  
1 1 1 32 23 1  o 1.613000  0.3493000     2.120000  0.5036000     1.107000  0.4841000     1.014000       0.6986000 
1 1 1 32 23 2  o 1.239000  0.3678000     1.547000  0.5938000     0.9309000 0.4342000     0.6159000      0.7356000 
1 1 1 32 23 3  o 2.453000  0.3706000     2.044000  0.5909000     2.862000  0.4473000     -0.8177000     0.7411000 
1 1 1 32 23 4  o 1.611000  0.3874000     1.331000  0.5282000     1.891000  0.5668000     -0.5603000     0.7747000 
1 1 1 32 23 5  o 2.833000  0.2913000     2.950000  0.4072000     2.716000  0.4168000     0.2342000      0.5826000 
1 1 1 32 23 6  o 3.080000  0.3134000     3.483000  0.3495000     2.677000  0.5204000     0.8057000      0.6268000 
1 1 1 32 23 7  o 1.828000  0.4098000     1.260000  0.5407000     2.397000  0.6159000     -1.138000      0.8196000 
1 1 1 32 23 8  o 2.438000  0.3841000     2.266000  0.6436000     2.610000  0.4195000     -0.3432000     0.7682000 
1 1 1 32 23 9  o 1.913000  0.4057000     1.585000  0.6481000     2.241000  0.4882000     -0.6561000     0.8114000 
1 1 1 32 23 10 o 1.641000  0.4184000     2.023000  0.6083000     1.259000  0.5747000     0.7632000      0.8369000 
1 1 1 32 23 11 o 1.261000  0.3936000     1.104000  0.5037000     1.419000  0.6049000     -0.3154000     0.7871000 
1 1 1 32 23 12 o 1.686000  0.4193000     1.197000  0.5386000     2.175000  0.6427000     -0.9782000     0.8386000 
1 1 1 32 23 13 o 1.300000  0.4003000     1.421000  0.5858000     1.179000  0.5457000     0.2426000      0.8006000 
1 1 1 32 23 14 o 1.474000  0.4669000     1.688000  0.7266000     1.259000  0.5865000     0.4290000      0.9338000 
1 1 1 32 24 0  o 1.127000  0.6251000     1.127000  0.6251000     1.127000  0.6251000     0.000000       0.000000  
1 1 1 32 24 1  f 1.857000  0.3849000     2.415000  0.5647000     1.299000  0.5230000     1.116000       0.7697000 
1 1 1 32 24 2  o 0.9138000 0.3112000     0.8958000 0.4357000     0.9318000 0.4446000     -0.3605000E-01 0.6225000 
1 1 1 32 24 3  o 4.669000  0.2140000     4.521000  0.3251000     4.818000  0.2784000     -0.2971000     0.4280000 
1 1 1 32 24 4  o 2.289000  0.3577000     2.493000  0.4748000     2.086000  0.5352000     0.4064000      0.7155000 
1 1 1 32 24 5  o 3.610000  0.2670000     3.675000  0.3487000     3.545000  0.4044000     0.1302000      0.5340000 
1 1 1 32 24 6  o 3.974000  0.2698000     4.135000  0.3435000     3.813000  0.4162000     0.3219000      0.5396000 
1 1 1 32 24 7  o 1.125000  0.3464000     0.8306000 0.4120000     1.419000  0.5570000     -0.5880000     0.6928000 
1 1 1 32 24 8  o 3.246000  0.2676000     3.462000  0.3795000     3.029000  0.3773000     0.4333000      0.5352000 
1 1 1 32 24 9  o 3.957000  0.2741000     3.956000  0.4559000     3.958000  0.3046000     -0.1812000E-02 0.5483000 
1 1 1 32 24 10 o 3.025000  0.4037000     3.142000  0.6377000     2.908000  0.4951000     0.2342000      0.8074000 
1 1 1 32 24 11 o 1.662000  0.4388000     1.712000  0.6147000     1.611000  0.6262000     0.1013000      0.8775000 
1 1 1 32 24 12 o 1.732000  0.4491000     1.753000  0.6251000     1.712000  0.6449000     0.4104000E-01  0.8981000 
1 1 1 32 24 13 o 1.123000  0.3719000     1.112000  0.5161000     1.133000  0.5355000     -0.2117000E-01 0.7437000 
1 1 1 32 25 0  o 0.8965000 0.6039000     0.8965000 0.6039000     0.8965000 0.6039000     -0.000000      0.000000  
1 1 1 32 25 1  o 1.398000  0.4187000     1.210000  0.5384000     1.586000  0.6413000     -0.3755000     0.8373000 
1 1 1 32 25 2  o 1.457000  0.3843000     1.957000  0.6092000     0.9570000 0.4685000     1.000000       0.7685000 
1 1 1 32 25 3  o 4.334000  0.2316000     4.750000  0.2838000     3.917000  0.3661000     0.8333000      0.4632000 
1 1 1 32 25 4  o 6.524000  0.1933000     6.418000  0.2692000     6.629000  0.2774000     -0.2114000     0.3866000 
1 1 1 32 25 5  o 1.539000  0.4254000     1.629000  0.6034000     1.450000  0.5997000     0.1793000      0.8507000 
1 1 1 32 25 6  o 2.014000  0.4466000     2.189000  0.6975000     1.839000  0.5580000     0.3505000      0.8932000 
1 1 1 32 25 7  o 1.657000  0.4008000     1.719000  0.5672000     1.594000  0.5664000     0.1257000      0.8016000 
1 1 1 32 25 8  o 2.005000  0.4054000     2.125000  0.5618000     1.884000  0.5847000     0.2418000      0.8108000 
1 1 1 32 25 9  o 1.521000  0.4177000     1.680000  0.6406000     1.363000  0.5363000     0.3177000      0.8354000 
1 1 1 32 25 10 o 1.889000  0.4020000     1.277000  0.5939000     2.500000  0.5419000     -1.223000      0.8040000 
1 1 1 32 25 11 o 2.707000  0.3961000     2.613000  0.5511000     2.801000  0.5690000     -0.1875000     0.7921000 
1 1 1 32 25 12 f 1.803000  0.4521000     1.834000  0.6305000     1.773000  0.6482000     0.6123000E-01  0.9042000 
1 1 1 32 25 13 o 2.041000  0.4602000     1.465000  0.6101000     2.618000  0.6893000     -1.153000      0.9205000 
1 1 1 32 26 0  o 1.884000  0.8297000     1.884000  0.8297000     1.884000  0.8297000     0.000000       0.000000  
1 1 1 32 26 1  o 1.791000  0.3937000     0.9739000 0.4775000     2.608000  0.6261000     -1.634000      0.7874000 
1 1 1 32 26 2  o 1.789000  0.4249000     1.596000  0.5894000     1.981000  0.6122000     -0.3855000     0.8498000 
1 1 1 32 26 3  o 1.600000  0.4216000     1.365000  0.5660000     1.835000  0.6250000     -0.4699000     0.8432000 
1 1 1 32 26 4  o 3.133000  0.3524000     3.408000  0.4349000     2.858000  0.5547000     0.5501000      0.7049000 
1 1 1 32 26 5  o 1.591000  0.4132000     1.555000  0.6032000     1.627000  0.5648000     -0.7152000E-01 0.8264000 
1 1 1 32 26 6  o 3.598000  0.2483000     3.609000  0.3619000     3.586000  0.3402000     0.2298000E-01  0.4967000 
1 1 1 32 26 7  o 1.705000  0.3690000     2.271000  0.5360000     1.138000  0.5072000     1.133000       0.7379000 
1 1 1 32 26 8  o 2.119000  0.3950000     1.886000  0.5817000     2.352000  0.5344000     -0.4666000     0.7899000 
1 1 1 32 26 9  o 1.638000  0.4339000     1.554000  0.6397000     1.722000  0.5863000     -0.1682000     0.8677000 
1 1 1 32 26 10 o 1.944000  0.4284000     1.678000  0.6647000     2.210000  0.5406000     -0.5326000     0.8568000 
1 1 1 32 26 11 o 0.9793000 0.3343000     1.068000  0.5151000     0.8902000 0.4262000     0.1782000      0.6686000 
1 1 1 32 26 12 o 2.520000  0.4185000     3.091000  0.5112000     1.950000  0.6626000     1.141000       0.8369000 
1 1 1 32 26 13 o 1.664000  0.4727000     1.599000  0.6904000     1.729000  0.6459000     -0.1305000     0.9455000 
1 1 1 32 27 0  o 1.253000  0.6701000     1.253000  0.6701000     1.253000  0.6701000     -0.000000      0.000000  
1 1 1 32 27 1  o 3.829000  0.2589000     3.852000  0.3892000     3.806000  0.3414000     0.4579000E-01  0.5177000 
1 1 1 32 27 2  o 4.833000  0.2161000     4.893000  0.3251000     4.773000  0.2849000     0.1203000      0.4323000 
1 1 1 32 27 3  o 2.625000  0.3547000     2.703000  0.5236000     2.547000  0.4787000     0.1567000      0.7094000 
1 1 1 32 27 4  o 5.056000  0.1931000     4.949000  0.2759000     5.162000  0.2702000     -0.2134000     0.3862000 
1 1 1 32 27 5  o 5.812000  0.1803000     5.825000  0.2594000     5.799000  0.2506000     0.2590000E-01  0.3607000 
1 1 1 32 27 6  o 2.472000  0.3554000     2.896000  0.4471000     2.048000  0.5525000     0.8479000      0.7107000 
1 1 1 32 27 7  o 1.280000  0.3778000     1.135000  0.5105000     1.425000  0.5572000     -0.2907000     0.7557000 
1 1 1 32 27 8  o 3.080000  0.3111000     3.697000  0.3505000     2.463000  0.5142000     1.235000       0.6223000 
1 1 1 32 27 9  o 3.389000  0.3193000     3.862000  0.3873000     2.916000  0.5078000     0.9458000      0.6386000 
1 1 1 32 27 10 o 1.969000  0.4425000     2.263000  0.6796000     1.676000  0.5669000     0.5872000      0.8850000 
1 1 1 32 27 11 o 1.828000  0.4225000     1.530000  0.6440000     2.126000  0.5471000     -0.5953000     0.8451000 
1 1 1 32 27 12 o 2.447000  0.4568000     1.863000  0.6526000     3.031000  0.6395000     -1.168000      0.9137000 
1 1 1 32 28 0  o 1.679000  0.7150000     1.679000  0.7150000     1.679000  0.7150000     0.000000       0.000000  
1 1 1 32 28 1  o 1.528000  0.3762000     1.078000  0.4913000     1.979000  0.5700000     -0.9009000     0.7525000 
1 1 1 32 28 2  o 1.609000  0.4055000     1.637000  0.5751000     1.581000  0.5718000     0.5577000E-01  0.8110000 
1 1 1 32 28 3  o 2.678000  0.3400000     3.296000  0.3885000     2.061000  0.5582000     1.235000       0.6801000 
1 1 1 32 28 4  o 2.531000  0.3529000     2.210000  0.5480000     2.851000  0.4449000     -0.6411000     0.7059000 
1 1 1 32 28 5  o 3.744000  0.2471000     3.889000  0.3435000     3.598000  0.3553000     0.2904000      0.4942000 
1 1 1 32 28 6  o 1.510000  0.3883000     1.192000  0.5239000     1.828000  0.5733000     -0.6363000     0.7766000 
1 1 1 32 28 7  o 1.739000  0.4122000     1.727000  0.5754000     1.752000  0.5905000     -0.2452000E-01 0.8244000 
1 1 1 32 28 8  o 1.986000  0.4323000     2.439000  0.6422000     1.533000  0.5787000     0.9062000      0.8645000 
1 1 1 32 28 9  o 4.349000  0.2377000     4.246000  0.3351000     4.453000  0.3373000     -0.2069000     0.4754000 
1 1 1 32 28 10 o 2.860000  0.3359000     2.705000  0.4963000     3.015000  0.4527000     -0.3107000     0.6717000 
1 1 1 32 28 11 o 2.473000  0.4244000     2.305000  0.7051000     2.642000  0.4725000     -0.3371000     0.8488000 
1 1 1 32 28 12 o 1.242000  0.4080000     1.015000  0.5041000     1.468000  0.6417000     -0.4532000     0.8160000 
1 1 1 32 29 0  o 2.112000  0.6776000     2.112000  0.6776000     2.112000  0.6776000     0.000000       0.000000  
1 1 1 32 29 1  o 4.208000  0.2344000     4.464000  0.3180000     3.952000  0.3443000     0.5121000      0.4687000 
1 1 1 32 29 2  o 4.271000  0.2312000     4.265000  0.3301000     4.278000  0.3239000     -0.1254000E-01 0.4625000 
1 1 1 32 29 3  o 1.241000  0.3738000     1.329000  0.5458000     1.153000  0.5108000     0.1761000      0.7475000 
1 1 1 32 29 4  o 2.821000  0.3292000     2.672000  0.4858000     2.971000  0.4442000     -0.2995000     0.6583000 
1 1 1 32 29 5  o 1.489000  0.3712000     1.028000  0.4774000     1.949000  0.5685000     -0.9215000     0.7423000 
1 1 1 32 29 6  o 2.792000  0.3383000     3.177000  0.4176000     2.407000  0.5324000     0.7694000      0.6767000 
1 1 1 32 29 7  o 3.374000  0.2863000     3.654000  0.3723000     3.094000  0.4351000     0.5600000      0.5726000 
1 1 1 32 29 8  o 2.923000  0.3675000     3.363000  0.4459000     2.484000  0.5844000     0.8790000      0.7351000 
1 1 1 32 29 9  o 1.554000  0.3981000     1.849000  0.5903000     1.259000  0.5343000     0.5901000      0.7962000 
1 1 1 32 29 10 o 1.345000  0.3940000     1.216000  0.5350000     1.473000  0.5786000     -0.2565000     0.7880000 
1 1 1 32 29 11 o 1.108000  0.3670000     1.103000  0.5321000     1.113000  0.5057000     -0.9748000E-02 0.7341000 
1 1 1 32 29 12 o 1.542000  0.7305000     ?         ?             1.542000  0.7305000     ?              ?         
1 1 1 32 30 0  f 6.920000  0.2500000     6.920000  0.2500000     6.920000  0.2500000     -0.000000      0.000000  
1 1 1 32 30 1  o 4.453000  0.2255000     4.604000  0.3128000     4.303000  0.3248000     0.3010000      0.4509000 
1 1 1 32 30 2  o 1.072000  0.3478000     0.9897000 0.4671000     1.155000  0.5154000     -0.1648000     0.6956000 
1 1 1 32 30 3  o 4.597000  0.2161000     4.756000  0.2997000     4.439000  0.3115000     0.3164000      0.4323000 
1 1 1 32 30 4  o 1.101000  0.3503000     0.9233000 0.4425000     1.279000  0.5431000     -0.3555000     0.7005000 
1 1 1 32 30 5  o 1.247000  0.3791000     1.282000  0.5440000     1.211000  0.5280000     0.7053000E-01  0.7581000 
1 1 1 32 30 6  o 3.441000  0.2728000     3.445000  0.3902000     3.437000  0.3813000     0.7619000E-02  0.5455000 
1 1 1 32 30 7  o 1.445000  0.4016000     1.152000  0.5375000     1.737000  0.5967000     -0.5843000     0.8031000 
1 1 1 32 30 8  o 2.069000  0.4281000     1.989000  0.5834000     2.148000  0.6266000     -0.1589000     0.8562000 
1 1 1 32 30 9  o 1.781000  0.4234000     1.754000  0.5909000     1.807000  0.6064000     -0.5319000E-01 0.8467000 
1 1 1 32 30 10 o 2.385000  0.3784000     3.083000  0.4580000     1.687000  0.6024000     1.396000       0.7568000 
1 1 1 32 30 11 o 0.9776000 0.3377000     0.9224000 0.4484000     1.033000  0.5049000     -0.1102000     0.6753000 
1 1 1 32 31 0  o 3.849000  0.3744000     3.849000  0.3744000     3.849000  0.3744000     -0.000000      0.000000  
1 1 1 32 31 1  o 1.501000  0.4052000     1.702000  0.5959000     1.299000  0.5493000     0.4028000      0.8104000 
1 1 1 32 31 2  o 1.152000  0.3620000     1.076000  0.4933000     1.228000  0.5300000     -0.1518000     0.7241000 
1 1 1 32 31 3  o 1.928000  0.4184000     1.946000  0.5917000     1.911000  0.5916000     0.3481000E-01  0.8367000 
1 1 1 32 31 4  o 1.906000  0.4186000     1.689000  0.5984000     2.122000  0.5854000     -0.4329000     0.8372000 
1 1 1 32 31 5  o 3.160000  0.3198000     2.703000  0.5117000     3.617000  0.3837000     -0.9134000     0.6396000 
1 1 1 32 31 6  o 1.858000  0.4286000     2.445000  0.6594000     1.272000  0.5478000     1.173000       0.8572000 
1 1 1 32 31 7  o 1.666000  0.4296000     1.423000  0.5797000     1.908000  0.6343000     -0.4843000     0.8593000 
1 1 1 32 31 8  o 1.970000  0.3911000     1.382000  0.5692000     2.558000  0.5365000     -1.176000      0.7821000 
1 1 1 32 31 9  o 1.490000  0.3771000     1.978000  0.5876000     1.003000  0.4727000     0.9757000      0.7541000 
1 1 1 32 31 10 o 0.9348000 0.3217000     0.7881000 0.3930000     1.082000  0.5095000     -0.2934000     0.6435000 
1 1 1 32 31 11 o 1.191000  0.4032000     1.329000  0.6166000     1.052000  0.5196000     0.2770000      0.8063000 
1 1 1 32 32 0  o 7.085000  0.2538000     7.085000  0.2538000     7.085000  0.2538000     0.000000       0.000000  
1 1 1 32 32 1  o 2.564000  0.3693000     1.803000  0.6024000     3.325000  0.4274000     -1.522000      0.7386000 
1 1 1 32 32 2  o 1.677000  0.4150000     1.563000  0.5852000     1.792000  0.5885000     -0.2287000     0.8300000 
1 1 1 32 32 3  o 1.333000  0.3927000     1.191000  0.5327000     1.475000  0.5772000     -0.2836000     0.7854000 
1 1 1 32 32 4  o 4.409000  0.2369000     4.201000  0.3488000     4.617000  0.3207000     -0.4155000     0.4738000 
1 1 1 32 32 5  o 1.783000  0.4151000     2.084000  0.5868000     1.482000  0.5872000     0.6019000      0.8301000 
1 1 1 32 32 6  o 1.233000  0.3931000     1.184000  0.5510000     1.282000  0.5609000     -0.9744000E-01 0.7862000 
1 1 1 32 32 7  o 2.144000  0.4139000     2.426000  0.5466000     1.862000  0.6217000     0.5635000      0.8278000 
1 1 1 32 32 8  o 1.999000  0.4219000     2.115000  0.5782000     1.883000  0.6145000     0.2323000      0.8438000 
1 1 1 32 32 9  o 1.727000  0.4359000     1.663000  0.5938000     1.791000  0.6383000     -0.1281000     0.8718000 
1 1 1 32 32 10 o 1.336000  0.4003000     1.631000  0.6199000     1.042000  0.5067000     0.5892000      0.8007000 
1 1 1 32 33 0  o 2.499000  0.6175000     2.499000  0.6175000     2.499000  0.6175000     0.000000       0.000000  
1 1 1 32 33 1  o 4.322000  0.2496000     4.264000  0.3556000     4.379000  0.3504000     -0.1153000     0.4992000 
1 1 1 32 33 2  o 5.859000  0.2043000     5.331000  0.3078000     6.386000  0.2687000     -1.055000      0.4086000 
1 1 1 32 33 3  o 2.482000  0.3877000     2.634000  0.5316000     2.330000  0.5645000     0.3038000      0.7755000 
1 1 1 32 33 4  o 1.287000  0.3763000     0.9469000 0.4557000     1.626000  0.5990000     -0.6792000     0.7526000 
1 1 1 32 33 5  o 1.796000  0.4442000     2.199000  0.6773000     1.393000  0.5749000     0.8062000      0.8884000 
1 1 1 32 33 6  o 1.061000  0.3531000     1.145000  0.5256000     0.9763000 0.4717000     0.1684000      0.7062000 
1 1 1 32 33 7  o 2.352000  0.3983000     2.558000  0.5150000     2.147000  0.6076000     0.4107000      0.7965000 
1 1 1 32 33 8  o 2.093000  0.4188000     1.470000  0.5882000     2.715000  0.5964000     -1.246000      0.8376000 
1 1 1 32 33 9  o 1.318000  0.4170000     1.119000  0.5208000     1.516000  0.6513000     -0.3972000     0.8339000 
1 1 1 32 33 10 o 1.581000  0.4862000     1.762000  0.7295000     1.399000  0.6428000     0.3628000      0.9723000 
1 1 1 32 34 0  o 0.8189000 0.5511000     0.8189000 0.5511000     0.8189000 0.5511000     -0.000000      0.000000  
1 1 1 32 34 1  o 1.446000  0.4157000     1.477000  0.5883000     1.414000  0.5875000     0.6320000E-01  0.8314000 
1 1 1 32 34 2  o 1.845000  0.4320000     1.958000  0.6147000     1.732000  0.6071000     0.2261000      0.8639000 
1 1 1 32 34 3  o 1.064000  0.3498000     1.094000  0.5027000     1.033000  0.4866000     0.6064000E-01  0.6996000 
1 1 1 32 34 4  o 1.182000  0.3833000     1.170000  0.5505000     1.194000  0.5334000     -0.2474000E-01 0.7666000 
1 1 1 32 34 5  o 1.437000  0.4342000     1.285000  0.5664000     1.588000  0.6583000     -0.3037000     0.8684000 
1 1 1 32 34 6  o 1.342000  0.3962000     1.487000  0.5828000     1.197000  0.5369000     0.2905000      0.7924000 
1 1 1 32 34 7  o 1.933000  0.3965000     1.153000  0.5151000     2.714000  0.6030000     -1.562000      0.7930000 
1 1 1 32 34 8  o 1.340000  0.4032000     1.550000  0.6068000     1.129000  0.5311000     0.4209000      0.8064000 
1 1 1 32 34 9  o 1.575000  0.4364000     1.570000  0.6228000     1.581000  0.6116000     -0.1038000E-01 0.8729000 
1 1 1 32 35 0  o 1.554000  0.7501000     1.554000  0.7501000     1.554000  0.7501000     -0.000000      0.000000  
1 1 1 32 35 1  o 2.773000  0.3779000     2.756000  0.5323000     2.790000  0.5367000     -0.3337000E-01 0.7559000 
1 1 1 32 35 2  o 1.252000  0.3915000     1.584000  0.6431000     0.9204000 0.4468000     0.6635000      0.7830000 
1 1 1 32 35 3  o 1.254000  0.4003000     1.388000  0.6061000     1.119000  0.5230000     0.2694000      0.8006000 
1 1 1 32 35 4  o 1.139000  0.3735000     1.016000  0.4863000     1.261000  0.5671000     -0.2450000     0.7470000 
1 1 1 32 35 5  o 1.244000  0.3911000     1.100000  0.5077000     1.389000  0.5952000     -0.2885000     0.7823000 
1 1 1 32 35 6  o 1.776000  0.4499000     1.656000  0.6080000     1.895000  0.6633000     -0.2383000     0.8998000 
1 1 1 32 35 7  o 3.264000  0.3601000     3.835000  0.4355000     2.692000  0.5736000     1.143000       0.7201000 
1 1 1 32 35 8  o 2.469000  0.4664000     2.257000  0.6322000     2.681000  0.6859000     -0.4246000     0.9328000 
1 1 1 32 36 0  o 1.144000  0.7085000     1.144000  0.7085000     1.144000  0.7085000     -0.000000      0.000000  
1 1 1 32 36 1  o 2.365000  0.4495000     2.069000  0.6974000     2.661000  0.5673000     -0.5916000     0.8990000 
1 1 1 32 36 2  o 2.345000  0.4739000     2.612000  0.6664000     2.079000  0.6740000     0.5333000      0.9478000 
1 1 1 32 36 3  o 1.035000  0.3508000     0.9460000 0.4618000     1.124000  0.5280000     -0.1780000     0.7015000 
1 1 1 32 36 4  o 1.598000  0.4490000     1.683000  0.6150000     1.512000  0.6542000     0.1713000      0.8979000 
1 1 1 32 36 5  o 3.002000  0.3972000     2.232000  0.6361000     3.771000  0.4757000     -1.539000      0.7943000 
1 1 1 32 36 6  o 3.596000  0.3649000     3.902000  0.4414000     3.289000  0.5813000     0.6130000      0.7298000 
1 1 1 32 36 7  f 1.144000  0.3809000     1.017000  0.4885000     1.271000  0.5845000     -0.2535000     0.7618000 
1 1 1 32 36 8  o 1.303000  0.4203000     1.249000  0.5547000     1.358000  0.6317000     -0.1086000     0.8407000 
1 1 1 32 37 0  o 1.614000  0.8551000     1.614000  0.8551000     1.614000  0.8551000     -0.000000      0.000000  
1 1 1 32 37 1  o 3.122000  0.4964000     3.329000  0.6196000     2.915000  0.7757000     0.4138000      0.9927000 
1 1 1 32 37 2  o 0.9873000 0.3461000     1.028000  0.5040000     0.9469000 0.4745000     0.8082000E-01  0.6922000 
1 1 1 32 37 3  o 1.408000  0.4209000     1.541000  0.6129000     1.274000  0.5770000     0.2671000      0.8418000 
1 1 1 32 37 4  o 1.709000  0.4389000     2.159000  0.6627000     1.258000  0.5756000     0.9015000      0.8778000 
1 1 1 32 37 5  o 1.874000  0.4567000     1.321000  0.5896000     2.427000  0.6975000     -1.107000      0.9133000 
1 1 1 32 37 6  f 0.9211000 0.3190000     0.7748000 0.3919000     1.067000  0.5034000     -0.2926000     0.6379000 
1 1 1 32 37 7  o 1.409000  0.4102000     1.476000  0.5855000     1.342000  0.5745000     0.1335000      0.8203000 
1 1 1 32 38 0  o 0.8745000 0.5937000     0.8745000 0.5937000     0.8745000 0.5937000     -0.000000      0.000000  
1 1 1 32 38 1  f 1.432000  0.4435000     1.385000  0.5987000     1.479000  0.6546000     -0.9455000E-01 0.8871000 
1 1 1 32 38 2  o 2.283000  0.4588000     1.693000  0.6576000     2.872000  0.6399000     -1.179000      0.9176000 
1 1 1 32 38 3  o 1.722000  0.4624000     1.321000  0.5880000     2.123000  0.7139000     -0.8018000     0.9249000 
1 1 1 32 38 4  o 1.103000  0.3661000     1.048000  0.5049000     1.157000  0.5302000     -0.1090000     0.7322000 
1 1 1 32 38 5  o 3.997000  0.2886000     4.315000  0.3820000     3.679000  0.4328000     0.6366000      0.5773000 
1 1 1 32 38 6  o 2.656000  0.4086000     2.794000  0.5569000     2.518000  0.5981000     0.2755000      0.8173000 
1 1 1 32 39 0  o 5.467000  0.3321000     5.467000  0.3321000     5.467000  0.3321000     0.000000       0.000000  
1 1 1 32 39 1  o 4.752000  0.2467000     4.776000  0.3408000     4.728000  0.3566000     0.4803000E-01  0.4933000 
1 1 1 32 39 2  o 1.656000  0.4391000     1.795000  0.6265000     1.517000  0.6154000     0.2780000      0.8782000 
1 1 1 32 39 3  o 2.093000  0.4405000     2.301000  0.6073000     1.884000  0.6382000     0.4164000      0.8810000 
1 1 1 32 39 4  f 1.470000  0.3857000     2.001000  0.6216000     0.9392000 0.4568000     1.062000       0.7713000 
1 1 1 32 39 5  o 1.373000  0.4226000     1.324000  0.5921000     1.423000  0.6032000     -0.9938000E-01 0.8452000 
1 1 1 32 40 0  o 0.8957000 0.5929000     0.8957000 0.5929000     0.8957000 0.5929000     -0.000000      0.000000  
1 1 1 32 40 1  o 1.278000  0.3986000     1.392000  0.5914000     1.164000  0.5346000     0.2282000      0.7972000 
1 1 1 32 40 2  o 1.638000  0.4341000     1.894000  0.6385000     1.382000  0.5883000     0.5118000      0.8682000 
1 1 1 32 40 3  o 0.9918000 0.3364000     1.065000  0.5002000     0.9187000 0.4498000     0.1462000      0.6727000 
1 1 1 32 41 0  f 0.9240000 0.6662000     0.9240000 0.6662000     0.9240000 0.6662000     -0.000000      0.000000  
1 1 1 33 0  3  o 2.863000  0.3236000     2.863000  0.3236000     2.863000  0.3236000     0.000000       0.000000  
1 1 1 33 0  4  o 9.198000  0.2287000     9.198000  0.2287000     9.198000  0.2287000     0.000000       0.000000  
1 1 1 33 0  5  o 1.135000  0.6535000     1.135000  0.6535000     1.135000  0.6535000     0.000000       0.000000  
1 1 1 33 0  6  o 1.247000  0.4497000     1.247000  0.4497000     1.247000  0.4497000     -0.000000      0.000000  
1 1 1 33 0  7  o 0.6312000 0.4161000     0.6312000 0.4161000     0.6312000 0.4161000     0.000000       0.000000  
1 1 1 33 0  8  o 2.700000  0.3716000     2.700000  0.3716000     2.700000  0.3716000     0.000000       0.000000  
1 1 1 33 0  9  o 0.8753000 0.5502000     0.8753000 0.5502000     0.8753000 0.5502000     0.000000       0.000000  
1 1 1 33 0  10 o 3.575000  0.2879000     3.575000  0.2879000     3.575000  0.2879000     0.000000       0.000000  
1 1 1 33 0  11 o 2.229000  0.7372000     2.229000  0.7372000     2.229000  0.7372000     0.000000       0.000000  
1 1 1 33 0  12 o 2.390000  0.5922000     2.390000  0.5922000     2.390000  0.5922000     0.000000       0.000000  
1 1 1 33 0  13 o 0.9400000 0.6257000     0.9400000 0.6257000     0.9400000 0.6257000     0.000000       0.000000  
1 1 1 33 0  14 o 2.990000  0.6586000     2.990000  0.6586000     2.990000  0.6586000     0.000000       0.000000  
1 1 1 33 0  15 o 1.232000  0.7182000     1.232000  0.7182000     1.232000  0.7182000     0.000000       0.000000  
1 1 1 33 0  16 o 0.9973000 0.6579000     0.9973000 0.6579000     0.9973000 0.6579000     0.000000       0.000000  
1 1 1 33 1  3  o 3.574000  0.1943000     3.598000  0.2635000     3.550000  0.2856000     0.4845000E-01  0.3886000 
1 1 1 33 1  4  o 3.700000  0.2288000     3.794000  0.3120000     3.607000  0.3348000     0.1869000      0.4576000 
1 1 1 33 1  5  f 5.864000  0.1873000     6.205000  0.2583000     5.524000  0.2714000     0.6806000      0.3747000 
1 1 1 33 1  6  o 1.677000  0.2332000     1.502000  0.3582000     1.853000  0.2986000     -0.3507000     0.4664000 
1 1 1 33 1  7  o 3.011000  0.1777000     2.947000  0.2791000     3.075000  0.2200000     -0.1283000     0.3554000 
1 1 1 33 1  8  o 1.594000  0.3420000     1.327000  0.5266000     1.861000  0.4366000     -0.5336000     0.6840000 
1 1 1 33 1  9  o 4.067000  0.2082000     4.006000  0.3051000     4.128000  0.2833000     -0.1220000     0.4164000 
1 1 1 33 1  10 o 1.595000  0.3962000     1.655000  0.5105000     1.534000  0.6060000     0.1204000      0.7924000 
1 1 1 33 1  11 o 1.819000  0.4039000     1.750000  0.4877000     1.888000  0.6439000     -0.1376000     0.8078000 
1 1 1 33 1  12 o 1.548000  0.4079000     1.171000  0.4778000     1.924000  0.6612000     -0.7535000     0.8158000 
1 1 1 33 1  13 o 1.730000  0.4723000     1.832000  0.6724000     1.627000  0.6634000     0.2046000      0.9446000 
1 1 1 33 1  14 o 1.575000  0.4567000     1.666000  0.6614000     1.484000  0.6301000     0.1827000      0.9135000 
1 1 1 33 1  15 o 2.358000  0.4263000     2.806000  0.5521000     1.910000  0.6496000     0.8953000      0.8525000 
1 1 1 33 1  16 o 1.907000  0.4431000     2.463000  0.6407000     1.352000  0.6123000     1.111000       0.8862000 
1 1 1 33 2  2  o 1.259000  0.3847000     ?         ?             1.259000  0.3847000     ?              ?         
1 1 1 33 2  3  o 2.560000  0.2730000     2.503000  0.3792000     2.616000  0.3929000     -0.1136000     0.5460000 
1 1 1 33 2  4  o 5.091000  0.2065000     5.227000  0.2527000     4.956000  0.3266000     0.2710000      0.4129000 
1 1 1 33 2  5  o 2.474000  0.3603000     2.935000  0.4339000     2.013000  0.5753000     0.9221000      0.7206000 
1 1 1 33 2  6  o 1.513000  0.2269000     0.8937000 0.3799000     2.133000  0.2481000     -1.239000      0.4537000 
1 1 1 33 2  7  o 2.392000  0.2260000     2.503000  0.3406000     2.281000  0.2970000     0.2217000      0.4519000 
1 1 1 33 2  8  o 1.512000  0.3622000     1.633000  0.5486000     1.392000  0.4731000     0.2406000      0.7244000 
1 1 1 33 2  9  o 3.779000  0.3600000     3.932000  0.3217000     3.626000  0.6442000     0.3056000      0.7200000 
1 1 1 33 2  10 o 1.723000  0.4108000     1.567000  0.4974000     1.879000  0.6540000     -0.3117000     0.8217000 
1 1 1 33 2  11 o 2.945000  0.3355000     3.168000  0.3095000     2.721000  0.5953000     0.4467000      0.6710000 
1 1 1 33 2  12 o 1.327000  0.3939000     1.113000  0.4701000     1.540000  0.6322000     -0.4267000     0.7878000 
1 1 1 33 2  13 o 1.780000  0.4741000     1.974000  0.6852000     1.585000  0.6555000     0.3891000      0.9482000 
1 1 1 33 2  14 o 1.401000  0.4294000     1.573000  0.6490000     1.229000  0.5625000     0.3441000      0.8589000 
1 1 1 33 2  15 o 1.534000  0.4282000     1.282000  0.5671000     1.785000  0.6416000     -0.5026000     0.8563000 
1 1 1 33 2  16 o 1.187000  0.3987000     1.051000  0.5155000     1.323000  0.6083000     -0.2718000     0.7973000 
1 1 1 33 3  2  o 3.298000  0.1359000     3.319000  0.1646000     3.277000  0.2163000     0.4188000E-01  0.2718000 
1 1 1 33 3  3  o 4.163000  0.1834000     4.022000  0.2547000     4.304000  0.2638000     -0.2813000     0.3667000 
1 1 1 33 3  4  o 4.208000  0.2258000     4.074000  0.2921000     4.342000  0.3445000     -0.2684000     0.4516000 
1 1 1 33 3  5  f 2.995000  0.4327000     2.847000  0.7910000     3.142000  0.3511000     -0.2953000     0.8654000 
1 1 1 33 3  6  o 5.309000  0.1083000     5.401000  0.1654000     5.218000  0.1397000     0.1830000      0.2165000 
1 1 1 33 3  7  o 3.681000  0.1564000     3.978000  0.2310000     3.385000  0.2108000     0.5934000      0.3127000 
1 1 1 33 3  8  o 5.502000  0.1935000     5.873000  0.2598000     5.131000  0.2869000     0.7420000      0.3870000 
1 1 1 33 3  9  o 3.812000  0.3042000     3.890000  0.3254000     3.734000  0.5142000     0.1562000      0.6085000 
1 1 1 33 3  10 o 3.765000  0.2152000     3.785000  0.2748000     3.746000  0.3314000     0.3883000E-01  0.4305000 
1 1 1 33 3  11 o 1.109000  0.3586000     0.8824000 0.4101000     1.335000  0.5884000     -0.4523000     0.7172000 
1 1 1 33 3  12 f 2.027000  0.4129000     1.985000  0.4786000     2.069000  0.6731000     -0.8434000E-01 0.8259000 
1 1 1 33 3  13 o 1.359000  0.4296000     1.336000  0.5957000     1.382000  0.6192000     -0.4629000E-01 0.8593000 
1 1 1 33 3  14 o 1.999000  0.4700000     2.179000  0.5483000     1.819000  0.7634000     0.3600000      0.9399000 
1 1 1 33 3  15 o 2.798000  0.4403000     3.388000  0.4753000     2.208000  0.7413000     1.179000       0.8806000 
1 1 1 33 3  16 o 1.367000  0.4405000     1.291000  0.6037000     1.443000  0.6418000     -0.1517000     0.8811000 
1 1 1 33 4  2  o 0.9710000 0.2853000     0.9073000 0.3720000     1.035000  0.4327000     -0.1274000     0.5706000 
1 1 1 33 4  3  o 8.330000  0.1496000     8.328000  0.1978000     8.331000  0.2245000     -0.2371000E-02 0.2992000 
1 1 1 33 4  4  o 5.130000  0.3099000     5.272000  0.4597000     4.988000  0.4156000     0.2840000      0.6197000 
1 1 1 33 4  5  o 1.405000  0.4297000     1.591000  0.6949000     1.219000  0.5058000     0.3726000      0.8595000 
1 1 1 33 4  6  o 2.013000  0.2240000     2.026000  0.3443000     2.000000  0.2867000     0.2593000E-01  0.4480000 
1 1 1 33 4  7  o 1.114000  0.3134000     1.216000  0.4428000     1.012000  0.4437000     0.2041000      0.6269000 
1 1 1 33 4  8  o 3.019000  0.4936000     2.814000  0.8913000     3.223000  0.4244000     -0.4094000     0.9872000 
1 1 1 33 4  9  o 2.565000  0.3779000     3.122000  0.3007000     2.008000  0.6933000     1.114000       0.7557000 
1 1 1 33 4  10 o 1.889000  0.3705000     1.818000  0.5084000     1.959000  0.5391000     -0.1407000     0.7411000 
1 1 1 33 4  11 o 3.386000  0.2469000     3.407000  0.3333000     3.365000  0.3642000     0.4280000E-01  0.4937000 
1 1 1 33 4  12 o 1.911000  0.4285000     1.499000  0.5276000     2.322000  0.6753000     -0.8228000     0.8569000 
1 1 1 33 4  13 o 2.216000  0.4179000     1.564000  0.5430000     2.869000  0.6354000     -1.305000      0.8358000 
1 1 1 33 4  14 o 1.464000  0.4457000     0.8251000 0.4020000     2.102000  0.7956000     -1.277000      0.8914000 
1 1 1 33 4  15 o 1.278000  0.3957000     1.297000  0.5342000     1.260000  0.5838000     0.3714000E-01  0.7913000 
1 1 1 33 4  16 o 0.8817000 0.3210000     0.7707000 0.3944000     0.9927000 0.5064000     -0.2220000     0.6419000 
1 1 1 33 5  2  o 2.048000  0.2700000     1.862000  0.3572000     2.235000  0.4050000     -0.3735000     0.5400000 
1 1 1 33 5  3  o 2.363000  0.3770000     2.268000  0.6522000     2.458000  0.3782000     -0.1906000     0.7539000 
1 1 1 33 5  4  o 1.187000  0.5523000     ?         ?             1.187000  0.5523000     ?              ?         
1 1 1 33 5  5  o 2.779000  0.4263000     2.740000  0.7535000     2.818000  0.3988000     -0.7863000E-01 0.8525000 
1 1 1 33 5  6  o 2.678000  0.2069000     2.682000  0.2782000     2.674000  0.3062000     0.8505000E-02  0.4137000 
1 1 1 33 5  7  o 1.463000  0.3179000     1.706000  0.4073000     1.220000  0.4882000     0.4866000      0.6358000 
1 1 1 33 5  8  o 2.675000  0.4957000     2.774000  0.8935000     2.577000  0.4294000     0.1966000      0.9913000 
1 1 1 33 5  9  o 1.446000  0.4093000     1.234000  0.4905000     1.658000  0.6554000     -0.4244000     0.8186000 
1 1 1 33 5  10 o 1.380000  0.3522000     1.672000  0.5084000     1.087000  0.4874000     0.5846000      0.7043000 
1 1 1 33 5  11 o 1.989000  0.3700000     1.613000  0.5527000     2.366000  0.4922000     -0.7529000     0.7401000 
1 1 1 33 5  12 o 2.870000  0.3193000     2.276000  0.5038000     3.464000  0.3924000     -1.189000      0.6386000 
1 1 1 33 5  13 o 2.436000  0.3612000     2.421000  0.4515000     2.450000  0.5638000     -0.2958000E-01 0.7223000 
1 1 1 33 5  14 o 1.425000  0.4256000     1.096000  0.4856000     1.754000  0.6990000     -0.6576000     0.8511000 
1 1 1 33 5  15 o 1.113000  0.3641000     1.166000  0.5119000     1.060000  0.5178000     0.1063000      0.7282000 
1 1 1 33 5  16 o 1.159000  0.4105000     1.236000  0.6099000     1.082000  0.5498000     0.1538000      0.8211000 
1 1 1 33 6  2  o 3.886000  0.2012000     3.777000  0.3346000     3.995000  0.2235000     -0.2186000     0.4024000 
1 1 1 33 6  3  o 2.521000  0.3626000     2.478000  0.6217000     2.564000  0.3733000     -0.8600000E-01 0.7252000 
1 1 1 33 6  4  o 1.784000  0.7427000     ?         ?             1.784000  0.7427000     ?              ?         
1 1 1 33 6  5  o 1.369000  0.4001000     1.522000  0.6802000     1.217000  0.4216000     0.3047000      0.8002000 
1 1 1 33 6  6  o 1.285000  0.2761000     1.705000  0.3838000     0.8654000 0.3970000     0.8394000      0.5521000 
1 1 1 33 6  7  o 3.468000  0.1841000     3.273000  0.2451000     3.664000  0.2747000     -0.3907000     0.3682000 
1 1 1 33 6  8  o 3.866000  0.2899000     3.901000  0.4913000     3.831000  0.3080000     0.6995000E-01  0.5799000 
1 1 1 33 6  9  o 2.211000  0.3733000     2.243000  0.4623000     2.180000  0.5862000     0.6340000E-01  0.7465000 
1 1 1 33 6  10 o 3.088000  0.2679000     3.175000  0.3302000     3.000000  0.4220000     0.1746000      0.5359000 
1 1 1 33 6  11 o 1.086000  0.3427000     1.051000  0.4679000     1.120000  0.5008000     -0.6969000E-01 0.6854000 
1 1 1 33 6  12 o 2.887000  0.3205000     2.898000  0.4254000     2.876000  0.4796000     0.2128000E-01  0.6411000 
1 1 1 33 6  13 f 3.384000  0.2840000     3.653000  0.3507000     3.115000  0.4468000     0.5382000      0.5680000 
1 1 1 33 6  14 o 1.576000  0.4176000     1.674000  0.5910000     1.478000  0.5901000     0.1965000      0.8352000 
1 1 1 33 6  15 o 1.175000  0.3836000     1.030000  0.4727000     1.321000  0.6044000     -0.2907000     0.7673000 
1 1 1 33 7  1  o 3.547000  0.2020000     ?         ?             3.547000  0.2020000     ?              ?         
1 1 1 33 7  2  o 2.885000  0.2722000     2.988000  0.4392000     2.782000  0.3217000     0.2062000      0.5444000 
1 1 1 33 7  3  o 5.723000  0.2056000     5.901000  0.3507000     5.545000  0.2148000     0.3560000      0.4113000 
1 1 1 33 7  4  o 3.715000  0.3653000     3.638000  0.6350000     3.792000  0.3614000     -0.1543000     0.7306000 
1 1 1 33 7  5  o 1.499000  0.2867000     1.431000  0.3851000     1.568000  0.4249000     -0.1371000     0.5735000 
1 1 1 33 7  6  o 1.650000  0.3184000     1.598000  0.4348000     1.702000  0.4652000     -0.1047000     0.6368000 
1 1 1 33 7  7  o 3.343000  0.2033000     3.295000  0.2698000     3.391000  0.3041000     -0.9550000E-01 0.4065000 
1 1 1 33 7  8  o 1.635000  0.3712000     1.474000  0.5092000     1.796000  0.5401000     -0.3220000     0.7423000 
1 1 1 33 7  9  o 3.038000  0.2670000     2.879000  0.3649000     3.197000  0.3899000     -0.3174000     0.5341000 
1 1 1 33 7  10 o 1.681000  0.3973000     1.555000  0.5414000     1.806000  0.5816000     -0.2506000     0.7946000 
1 1 1 33 7  11 o 1.205000  0.3614000     1.244000  0.5042000     1.166000  0.5178000     0.7783000E-01  0.7227000 
1 1 1 33 7  12 o 1.755000  0.4261000     1.692000  0.5683000     1.817000  0.6351000     -0.1254000     0.8522000 
1 1 1 33 7  13 o 2.032000  0.3701000     2.674000  0.4751000     1.391000  0.5676000     1.283000       0.7403000 
1 1 1 33 7  14 f 1.396000  0.3904000     1.016000  0.4733000     1.775000  0.6211000     -0.7594000     0.7809000 
1 1 1 33 7  15 o 1.493000  0.3959000     1.808000  0.5851000     1.177000  0.5335000     0.6310000      0.7918000 
1 1 1 33 8  0  o 6.715000  0.1718000     6.715000  0.1718000     6.715000  0.1718000     0.000000       0.000000  
1 1 1 33 8  1  o 5.785000  0.1579000     5.812000  0.2244000     5.757000  0.2223000     0.5460000E-01  0.3159000 
1 1 1 33 8  2  f 6.483000  0.1881000     6.471000  0.2926000     6.495000  0.2365000     -0.2474000E-01 0.3762000 
1 1 1 33 8  3  o 1.889000  0.4122000     1.621000  0.6553000     2.157000  0.5003000     -0.5362000     0.8245000 
1 1 1 33 8  4  o 3.527000  0.1768000     3.241000  0.2994000     3.814000  0.1880000     -0.5728000     0.3535000 
1 1 1 33 8  5  o 1.094000  0.3028000     1.133000  0.4247000     1.055000  0.4316000     0.7777000E-01  0.6055000 
1 1 1 33 8  6  o 2.082000  0.2819000     2.249000  0.3448000     1.915000  0.4461000     0.3337000      0.5638000 
1 1 1 33 8  7  o 2.257000  0.3395000     2.026000  0.4239000     2.488000  0.5304000     -0.4625000     0.6790000 
1 1 1 33 8  8  o 3.062000  0.2447000     2.996000  0.3230000     3.128000  0.3676000     -0.1325000     0.4894000 
1 1 1 33 8  9  o 4.576000  0.2296000     4.204000  0.3685000     4.948000  0.2740000     -0.7442000     0.4592000 
1 1 1 33 8  10 f 2.137000  0.3647000     2.409000  0.4439000     1.865000  0.5788000     0.5439000      0.7294000 
1 1 1 33 8  11 o 1.857000  0.3913000     1.648000  0.5258000     2.065000  0.5795000     -0.4170000     0.7825000 
1 1 1 33 8  12 o 1.936000  0.4374000     1.988000  0.5887000     1.884000  0.6471000     0.1042000      0.8749000 
1 1 1 33 8  13 o 2.285000  0.3742000     1.571000  0.5869000     2.998000  0.4644000     -1.428000      0.7484000 
1 1 1 33 8  14 o 1.297000  0.3904000     1.275000  0.5413000     1.318000  0.5626000     -0.4309000E-01 0.7808000 
1 1 1 33 8  15 o 1.074000  0.3512000     1.056000  0.4898000     1.093000  0.5036000     -0.3727000E-01 0.7025000 
1 1 1 33 9  0  o 4.236000  0.2090000     4.236000  0.2090000     4.236000  0.2090000     -0.000000      0.000000  
1 1 1 33 9  1  o 1.010000  0.3003000     1.039000  0.4063000     0.9817000 0.4423000     0.5691000E-01  0.6006000 
1 1 1 33 9  2  o 1.513000  0.3760000     2.017000  0.5986000     1.008000  0.4553000     1.009000       0.7520000 
1 1 1 33 9  3  o 2.143000  0.2922000     1.764000  0.5058000     2.523000  0.2927000     -0.7596000     0.5844000 
1 1 1 33 9  4  o 4.925000  0.1500000     4.929000  0.2314000     4.921000  0.1909000     0.8160000E-02  0.2999000 
1 1 1 33 9  5  o 1.467000  0.3192000     1.290000  0.4445000     1.645000  0.4582000     -0.3545000     0.6384000 
1 1 1 33 9  6  o 2.409000  0.2551000     2.182000  0.3731000     2.636000  0.3478000     -0.4541000     0.5101000 
1 1 1 33 9  7  f 1.630000  0.3776000     1.490000  0.5528000     1.769000  0.5145000     -0.2790000     0.7552000 
1 1 1 33 9  8  o 2.620000  0.3032000     2.288000  0.4418000     2.952000  0.4152000     -0.6649000     0.6063000 
1 1 1 33 9  9  o 1.975000  0.3846000     1.907000  0.5259000     2.043000  0.5613000     -0.1352000     0.7692000 
1 1 1 33 9  10 o 3.923000  0.2291000     4.035000  0.2968000     3.812000  0.3490000     0.2226000      0.4581000 
1 1 1 33 9  11 o 1.027000  0.3351000     0.9865000 0.4541000     1.067000  0.4929000     -0.8070000E-01 0.6702000 
1 1 1 33 9  12 o 2.121000  0.4367000     2.582000  0.6012000     1.660000  0.6335000     0.9222000      0.8734000 
1 1 1 33 9  13 o 1.161000  0.3732000     1.003000  0.4744000     1.319000  0.5762000     -0.3167000     0.7463000 
1 1 1 33 9  14 f 1.167000  0.3704000     1.100000  0.5003000     1.234000  0.5464000     -0.1342000     0.7408000 
1 1 1 33 9  15 o 1.098000  0.3579000     1.132000  0.5139000     1.063000  0.4983000     0.6936000E-01  0.7158000 
1 1 1 33 10 0  o 3.263000  0.1992000     3.263000  0.1992000     3.263000  0.1992000     0.000000       0.000000  
1 1 1 33 10 1  o 0.7342000 0.2384000     0.9128000 0.3915000     0.5555000 0.2719000     0.3573000      0.4767000 
1 1 1 33 10 2  o 0.9192000 0.2730000     0.9042000 0.3774000     0.9343000 0.3946000     -0.3005000E-01 0.5461000 
1 1 1 33 10 3  o 2.891000  0.2062000     2.596000  0.2967000     3.185000  0.2863000     -0.5897000     0.4123000 
1 1 1 33 10 4  o 3.979000  0.1858000     3.890000  0.2035000     4.069000  0.3110000     -0.1793000     0.3717000 
1 1 1 33 10 5  o 2.391000  0.2473000     2.133000  0.3789000     2.649000  0.3180000     -0.5165000     0.4947000 
1 1 1 33 10 6  o 4.970000  0.1489000     4.813000  0.2021000     5.128000  0.2188000     -0.3156000     0.2978000 
1 1 1 33 10 7  o 2.732000  0.3365000     2.539000  0.5079000     2.926000  0.4416000     -0.3864000     0.6730000 
1 1 1 33 10 8  o 1.897000  0.4116000     2.028000  0.5137000     1.766000  0.6432000     0.2611000      0.8231000 
1 1 1 33 10 9  o 3.615000  0.2345000     3.754000  0.3046000     3.475000  0.3565000     0.2781000      0.4689000 
1 1 1 33 10 10 o 4.237000  0.2280000     4.249000  0.3323000     4.225000  0.3122000     0.2382000E-01  0.4560000 
1 1 1 33 10 11 o 3.892000  0.2384000     3.786000  0.3302000     3.998000  0.3441000     -0.2125000     0.4769000 
1 1 1 33 10 12 o 1.225000  0.4178000     1.363000  0.6697000     1.087000  0.4996000     0.2758000      0.8355000 
1 1 1 33 10 13 o 1.578000  0.4295000     1.323000  0.5602000     1.834000  0.6511000     -0.5107000     0.8590000 
1 1 1 33 10 14 o 1.175000  0.3714000     1.283000  0.5472000     1.067000  0.5024000     0.2159000      0.7429000 
1 1 1 33 10 15 f 1.404000  0.4000000     1.646000  0.5994000     1.163000  0.5299000     0.4826000      0.8001000 
1 1 1 33 11 0  f 1.977000  0.3915000     1.977000  0.3915000     1.977000  0.3915000     0.000000       0.000000  
1 1 1 33 11 1  o 1.652000  0.2825000     1.451000  0.4775000     1.852000  0.3021000     -0.4005000     0.5651000 
1 1 1 33 11 2  o 3.960000  0.1620000     3.800000  0.2428000     4.120000  0.2146000     -0.3198000     0.3240000 
1 1 1 33 11 3  o 3.138000  0.1811000     3.069000  0.2377000     3.207000  0.2731000     -0.1382000     0.3621000 
1 1 1 33 11 4  o 3.866000  0.1584000     3.542000  0.2320000     4.191000  0.2158000     -0.6485000     0.3168000 
1 1 1 33 11 5  o 3.545000  0.2020000     3.263000  0.3230000     3.827000  0.2426000     -0.5648000     0.4040000 
1 1 1 33 11 6  o 3.925000  0.2143000     3.862000  0.2517000     3.987000  0.3469000     -0.1250000     0.4286000 
1 1 1 33 11 7  f 1.674000  0.3276000     2.194000  0.4347000     1.154000  0.4902000     1.040000       0.6552000 
1 1 1 33 11 8  o 3.449000  0.3025000     3.113000  0.3702000     3.784000  0.4785000     -0.6707000     0.6050000 
1 1 1 33 11 9  o 5.478000  0.2610000     4.815000  0.4624000     6.141000  0.2421000     -1.326000      0.5219000 
1 1 1 33 11 10 o 3.763000  0.2986000     3.286000  0.5042000     4.240000  0.3201000     -0.9537000     0.5972000 
1 1 1 33 11 11 o 1.794000  0.4087000     1.673000  0.5652000     1.914000  0.5906000     -0.2419000     0.8175000 
1 1 1 33 11 12 o 1.584000  0.4574000     2.204000  0.7901000     0.9638000 0.4611000     1.240000       0.9148000 
1 1 1 33 11 13 o 1.858000  0.4806000     1.402000  0.5735000     2.315000  0.7713000     -0.9122000     0.9611000 
1 1 1 33 11 14 o 1.166000  0.3690000     1.217000  0.5282000     1.115000  0.5153000     0.1020000      0.7379000 
1 1 1 33 11 15 o 1.573000  0.4259000     1.348000  0.5645000     1.798000  0.6380000     -0.4503000     0.8519000 
1 1 1 33 12 0  o 1.379000  0.4761000     1.379000  0.4761000     1.379000  0.4761000     -0.000000      0.000000  
1 1 1 33 12 1  o 4.061000  0.1462000     4.136000  0.2360000     3.985000  0.1725000     0.1507000      0.2923000 
1 1 1 33 12 2  o 3.268000  0.2117000     3.276000  0.3666000     3.261000  0.2118000     0.1448000E-01  0.4234000 
1 1 1 33 12 3  o 4.664000  0.1667000     4.654000  0.1890000     4.674000  0.2747000     -0.2013000E-01 0.3334000 
1 1 1 33 12 4  o 4.706000  0.1572000     4.557000  0.2403000     4.854000  0.2027000     -0.2967000     0.3144000 
1 1 1 33 12 5  o 1.127000  0.3433000     1.064000  0.4486000     1.189000  0.5199000     -0.1253000     0.6867000 
1 1 1 33 12 6  o 3.412000  0.4204000     3.864000  0.7652000     2.961000  0.3484000     0.9033000      0.8407000 
1 1 1 33 12 7  o 1.908000  0.3540000     2.202000  0.4578000     1.615000  0.5400000     0.5867000      0.7079000 
1 1 1 33 12 8  o 1.878000  0.4284000     1.601000  0.5360000     2.155000  0.6684000     -0.5540000     0.8568000 
1 1 1 33 12 9  o 2.519000  0.3316000     2.208000  0.5015000     2.830000  0.4339000     -0.6221000     0.6632000 
1 1 1 33 12 10 o 5.001000  0.1944000     5.115000  0.2666000     4.887000  0.2830000     0.2278000      0.3887000 
1 1 1 33 12 11 o 2.131000  0.3920000     2.356000  0.5071000     1.907000  0.5980000     0.4486000      0.7841000 
1 1 1 33 12 12 o 1.398000  0.3977000     1.073000  0.5171000     1.723000  0.6043000     -0.6505000     0.7954000 
1 1 1 33 12 13 o 1.424000  0.4196000     1.620000  0.5965000     1.229000  0.5902000     0.3908000      0.8392000 
1 1 1 33 12 14 o 1.040000  0.3347000     1.337000  0.5545000     0.7427000 0.3749000     0.5944000      0.6693000 
1 1 1 33 12 15 o 1.474000  0.4205000     1.394000  0.5783000     1.554000  0.6105000     -0.1605000     0.8409000 
1 1 1 33 13 0  o 0.8291000 0.4867000     0.8291000 0.4867000     0.8291000 0.4867000     -0.000000      0.000000  
1 1 1 33 13 1  f 3.557000  0.1832000     3.353000  0.2958000     3.762000  0.2161000     -0.4098000     0.3663000 
1 1 1 33 13 2  o 3.682000  0.1733000     3.769000  0.2764000     3.595000  0.2091000     0.1746000      0.3466000 
1 1 1 33 13 3  o 1.314000  0.3275000     1.256000  0.4986000     1.372000  0.4248000     -0.1165000     0.6550000 
1 1 1 33 13 4  o 0.8776000 0.2839000     0.8299000 0.3855000     0.9252000 0.4169000     -0.9540000E-01 0.5678000 
1 1 1 33 13 5  o 3.442000  0.2302000     3.936000  0.3270000     2.948000  0.3242000     0.9878000      0.4605000 
1 1 1 33 13 6  o 2.962000  0.3308000     2.432000  0.5495000     3.493000  0.3684000     -1.061000      0.6616000 
1 1 1 33 13 7  o 1.536000  0.3742000     1.616000  0.5256000     1.456000  0.5328000     0.1596000      0.7484000 
1 1 1 33 13 8  o 2.238000  0.3717000     2.270000  0.4760000     2.205000  0.5709000     0.6524000E-01  0.7433000 
1 1 1 33 13 9  o 4.873000  0.2288000     4.382000  0.3728000     5.363000  0.2652000     -0.9811000     0.4575000 
1 1 1 33 13 10 o 3.814000  0.2416000     3.984000  0.3182000     3.644000  0.3637000     0.3399000      0.4832000 
1 1 1 33 13 11 o 3.727000  0.2777000     3.699000  0.3617000     3.755000  0.4214000     -0.5543000E-01 0.5554000 
1 1 1 33 13 12 o 1.570000  0.4183000     1.412000  0.5698000     1.728000  0.6127000     -0.3162000     0.8367000 
1 1 1 33 13 13 o 1.177000  0.3924000     1.004000  0.4726000     1.350000  0.6265000     -0.3457000     0.7848000 
1 1 1 33 13 14 o 1.641000  0.4349000     1.735000  0.6180000     1.547000  0.6120000     0.1876000      0.8698000 
1 1 1 33 13 15 f 1.243000  0.3892000     1.432000  0.5986000     1.053000  0.4978000     0.3784000      0.7785000 
1 1 1 33 14 0  o 1.125000  0.6285000     1.125000  0.6285000     1.125000  0.6285000     0.000000       0.000000  
1 1 1 33 14 1  o 2.001000  0.3297000     1.409000  0.5026000     2.593000  0.4268000     -1.184000      0.6594000 
1 1 1 33 14 2  o 2.329000  0.2860000     2.450000  0.4254000     2.209000  0.3825000     0.2407000      0.5720000 
1 1 1 33 14 3  o 4.300000  0.1766000     4.341000  0.2705000     4.260000  0.2271000     0.8094000E-01  0.3532000 
1 1 1 33 14 4  o 3.756000  0.2264000     3.625000  0.3624000     3.888000  0.2713000     -0.2624000     0.4527000 
1 1 1 33 14 5  o 1.184000  0.3568000     1.092000  0.5141000     1.277000  0.4948000     -0.1850000     0.7136000 
1 1 1 33 14 6  o 1.443000  0.3546000     1.672000  0.5030000     1.214000  0.4999000     0.4575000      0.7092000 
1 1 1 33 14 7  o 1.657000  0.3844000     1.354000  0.5254000     1.959000  0.5614000     -0.6056000     0.7689000 
1 1 1 33 14 8  o 4.421000  0.2021000     4.227000  0.2897000     4.614000  0.2818000     -0.3873000     0.4042000 
1 1 1 33 14 9  o 2.972000  0.2944000     3.129000  0.3787000     2.814000  0.4508000     0.3152000      0.5888000 
1 1 1 33 14 10 o 2.483000  0.3612000     2.532000  0.4925000     2.434000  0.5286000     0.9830000E-01  0.7225000 
1 1 1 33 14 11 o 1.206000  0.3834000     1.337000  0.5828000     1.075000  0.4984000     0.2616000      0.7668000 
1 1 1 33 14 12 o 1.514000  0.3904000     1.003000  0.4743000     2.024000  0.6201000     -1.021000      0.7807000 
1 1 1 33 14 13 o 1.413000  0.4129000     1.341000  0.5590000     1.486000  0.6079000     -0.1453000     0.8258000 
1 1 1 33 14 14 o 2.157000  0.4321000     2.318000  0.5897000     1.997000  0.6317000     0.3212000      0.8642000 
1 1 1 33 14 15 o 0.9555000 0.3475000     0.9991000 0.5122000     0.9118000 0.4696000     0.8725000E-01  0.6949000 
1 1 1 33 15 0  o 1.058000  0.6103000     1.058000  0.6103000     1.058000  0.6103000     0.000000       0.000000  
1 1 1 33 15 1  o 1.201000  0.3297000     1.004000  0.4679000     1.398000  0.4648000     -0.3945000     0.6595000 
1 1 1 33 15 2  o 1.345000  0.3348000     1.604000  0.5017000     1.086000  0.4435000     0.5181000      0.6696000 
1 1 1 33 15 3  o 1.143000  0.3505000     1.326000  0.5553000     0.9597000 0.4279000     0.3668000      0.7011000 
1 1 1 33 15 4  o 2.053000  0.4007000     1.953000  0.6620000     2.154000  0.4516000     -0.2015000     0.8014000 
1 1 1 33 15 5  o 1.021000  0.3140000     0.7769000 0.3754000     1.265000  0.5034000     -0.4882000     0.6280000 
1 1 1 33 15 6  o 1.890000  0.3545000     1.549000  0.5194000     2.232000  0.4825000     -0.6832000     0.7090000 
1 1 1 33 15 7  o 2.323000  0.4022000     1.882000  0.5551000     2.764000  0.5823000     -0.8822000     0.8045000 
1 1 1 33 15 8  o 3.515000  0.2466000     3.612000  0.3314000     3.418000  0.3652000     0.1942000      0.4932000 
1 1 1 33 15 9  o 1.953000  0.3919000     1.636000  0.5768000     2.270000  0.5307000     -0.6343000     0.7838000 
1 1 1 33 15 10 o 3.214000  0.2958000     2.826000  0.4555000     3.602000  0.3775000     -0.7757000     0.5916000 
1 1 1 33 15 11 o 2.735000  0.5281000     2.398000  0.9464000     3.072000  0.4687000     -0.6740000     1.056000  
1 1 1 33 15 12 o 1.148000  0.3663000     1.193000  0.5264000     1.103000  0.5096000     0.8984000E-01  0.7327000 
1 1 1 33 15 13 o 1.114000  0.3610000     1.171000  0.5230000     1.056000  0.4977000     0.1152000      0.7220000 
1 1 1 33 15 14 o 1.161000  0.3742000     1.118000  0.5134000     1.204000  0.5446000     -0.8539000E-01 0.7485000 
1 1 1 33 16 0  o 5.654000  0.1843000     5.654000  0.1843000     5.654000  0.1843000     0.000000       0.000000  
1 1 1 33 16 1  o 4.333000  0.1653000     4.413000  0.2498000     4.253000  0.2164000     0.1602000      0.3305000 
1 1 1 33 16 2  o 1.747000  0.3681000     1.776000  0.5095000     1.719000  0.5314000     0.5712000E-01  0.7362000 
1 1 1 33 16 3  o 3.856000  0.2541000     3.388000  0.4673000     4.325000  0.2000000     -0.9371000     0.5083000 
1 1 1 33 16 4  o 3.833000  0.1973000     3.771000  0.3266000     3.896000  0.2214000     -0.1241000     0.3946000 
1 1 1 33 16 5  o 3.739000  0.2128000     3.391000  0.3666000     4.087000  0.2161000     -0.6953000     0.4255000 
1 1 1 33 16 6  o 3.117000  0.2492000     2.888000  0.3575000     3.345000  0.3473000     -0.4578000     0.4985000 
1 1 1 33 16 7  o 0.9874000 0.3253000     0.8967000 0.4235000     1.078000  0.4940000     -0.1814000     0.6506000 
1 1 1 33 16 8  o 4.866000  0.2125000     4.663000  0.3264000     5.069000  0.2722000     -0.4061000     0.4250000 
1 1 1 33 16 9  o 1.761000  0.3999000     1.549000  0.5636000     1.974000  0.5675000     -0.4251000     0.7998000 
1 1 1 33 16 10 o 2.921000  0.3499000     2.851000  0.4575000     2.990000  0.5296000     -0.1384000     0.6998000 
1 1 1 33 16 11 o 1.624000  0.4150000     1.160000  0.5455000     2.089000  0.6255000     -0.9288000     0.8299000 
1 1 1 33 16 12 f 2.180000  0.4358000     1.655000  0.6200000     2.705000  0.6128000     -1.049000      0.8717000 
1 1 1 33 16 13 o 1.379000  0.4068000     1.327000  0.5606000     1.431000  0.5896000     -0.1040000     0.8136000 
1 1 1 33 16 14 o 1.237000  0.3875000     1.303000  0.5624000     1.170000  0.5334000     0.1336000      0.7751000 
1 1 1 33 17 0  o 0.9730000 0.5553000     0.9730000 0.5553000     0.9730000 0.5553000     -0.000000      0.000000  
1 1 1 33 17 1  o 4.817000  0.1524000     4.525000  0.2266000     5.110000  0.2040000     -0.5852000     0.3049000 
1 1 1 33 17 2  o 3.389000  0.1950000     3.551000  0.2705000     3.227000  0.2810000     0.3235000      0.3900000 
1 1 1 33 17 3  o 2.126000  0.2929000     2.734000  0.3367000     1.518000  0.4794000     1.215000       0.5858000 
1 1 1 33 17 4  o 3.441000  0.2279000     3.161000  0.3924000     3.720000  0.2317000     -0.5586000     0.4557000 
1 1 1 33 17 5  o 6.050000  0.1577000     5.813000  0.2635000     6.288000  0.1733000     -0.4754000     0.3154000 
1 1 1 33 17 6  f 1.795000  0.4127000     1.686000  0.5845000     1.904000  0.5829000     -0.2174000     0.8254000 
1 1 1 33 17 7  o 3.432000  0.2550000     3.351000  0.3505000     3.514000  0.3705000     -0.1625000     0.5101000 
1 1 1 33 17 8  o 4.933000  0.2152000     4.842000  0.3247000     5.023000  0.2825000     -0.1814000     0.4304000 
1 1 1 33 17 9  o 1.530000  0.3612000     0.8965000 0.4336000     2.163000  0.5777000     -1.267000      0.7223000 
1 1 1 33 17 10 o 1.894000  0.4693000     1.751000  0.6602000     2.036000  0.6672000     -0.2856000     0.9386000 
1 1 1 33 17 11 o 1.618000  0.4229000     1.399000  0.5792000     1.837000  0.6163000     -0.4375000     0.8457000 
1 1 1 33 17 12 o 1.613000  0.4758000     1.272000  0.5588000     1.954000  0.7704000     -0.6824000     0.9517000 
1 1 1 33 17 13 o 1.406000  0.4119000     1.376000  0.5663000     1.437000  0.5982000     -0.6093000E-01 0.8238000 
1 1 1 33 17 14 o 1.175000  0.3794000     1.058000  0.4992000     1.291000  0.5716000     -0.2330000     0.7589000 
1 1 1 33 18 0  o 5.004000  0.2119000     5.004000  0.2119000     5.004000  0.2119000     0.000000       0.000000  
1 1 1 33 18 1  o 1.467000  0.3279000     1.116000  0.4670000     1.819000  0.4603000     -0.7034000     0.6557000 
1 1 1 33 18 2  o 2.812000  0.2340000     2.689000  0.3496000     2.936000  0.3112000     -0.2474000     0.4681000 
1 1 1 33 18 3  o 4.788000  0.1538000     4.869000  0.2190000     4.707000  0.2159000     0.1615000      0.3075000 
1 1 1 33 18 4  o 3.251000  0.2030000     3.390000  0.2981000     3.112000  0.2757000     0.2772000      0.4061000 
1 1 1 33 18 5  o 1.478000  0.3750000     1.577000  0.5802000     1.378000  0.4754000     0.1987000      0.7501000 
1 1 1 33 18 6  o 2.820000  0.3348000     2.633000  0.5828000     3.007000  0.3296000     -0.3740000     0.6695000 
1 1 1 33 18 7  o 4.696000  0.1934000     4.641000  0.2602000     4.751000  0.2862000     -0.1094000     0.3868000 
1 1 1 33 18 8  o 1.307000  0.3794000     1.106000  0.4910000     1.507000  0.5784000     -0.4012000     0.7587000 
1 1 1 33 18 9  o 4.430000  0.2203000     4.335000  0.2959000     4.524000  0.3265000     -0.1891000     0.4406000 
1 1 1 33 18 10 o 1.552000  0.4841000     1.650000  0.7680000     1.455000  0.5896000     0.1953000      0.9683000 
1 1 1 33 18 11 o 1.892000  0.4353000     1.987000  0.6068000     1.798000  0.6243000     0.1888000      0.8706000 
1 1 1 33 18 12 o 3.134000  0.4431000     2.440000  0.6235000     3.827000  0.6299000     -1.387000      0.8863000 
1 1 1 33 18 13 o 2.216000  0.4303000     1.921000  0.6219000     2.510000  0.5949000     -0.5897000     0.8606000 
1 1 1 33 18 14 o 1.052000  0.3506000     1.083000  0.5022000     1.021000  0.4892000     0.6273000E-01  0.7012000 
1 1 1 33 19 0  o 1.039000  0.5788000     1.039000  0.5788000     1.039000  0.5788000     0.000000       0.000000  
1 1 1 33 19 1  o 1.833000  0.3440000     1.891000  0.4823000     1.775000  0.4907000     0.1164000      0.6881000 
1 1 1 33 19 2  o 1.742000  0.3392000     2.055000  0.4645000     1.428000  0.4945000     0.6271000      0.6784000 
1 1 1 33 19 3  o 1.448000  0.3560000     1.596000  0.5164000     1.300000  0.4902000     0.2959000      0.7120000 
1 1 1 33 19 4  o 3.210000  0.2189000     3.581000  0.2826000     2.840000  0.3344000     0.7413000      0.4379000 
1 1 1 33 19 5  o 3.831000  0.2250000     3.871000  0.3630000     3.792000  0.2661000     0.7914000E-01  0.4501000 
1 1 1 33 19 6  o 5.140000  0.2414000     4.829000  0.4337000     5.451000  0.2121000     -0.6215000     0.4828000 
1 1 1 33 19 7  o 3.541000  0.2681000     3.532000  0.3969000     3.549000  0.3605000     -0.1786000E-01 0.5361000 
1 1 1 33 19 8  o 1.425000  0.3934000     1.194000  0.5129000     1.657000  0.5968000     -0.4626000     0.7869000 
1 1 1 33 19 9  o 1.689000  0.4473000     1.447000  0.5822000     1.931000  0.6792000     -0.4836000     0.8946000 
1 1 1 33 19 10 o 1.512000  0.4371000     1.624000  0.6501000     1.399000  0.5845000     0.2257000      0.8742000 
1 1 1 33 19 11 o 1.257000  0.3845000     1.415000  0.5747000     1.099000  0.5109000     0.3165000      0.7689000 
1 1 1 33 19 12 o 1.475000  0.4320000     1.497000  0.5990000     1.453000  0.6225000     0.4414000E-01  0.8639000 
1 1 1 33 19 13 o 1.093000  0.3611000     0.9875000 0.4725000     1.198000  0.5463000     -0.2109000     0.7223000 
1 1 1 33 19 14 o 1.026000  0.3597000     1.031000  0.5025000     1.021000  0.5148000     0.9289000E-02  0.7194000 
1 1 1 33 20 0  o 1.193000  0.6026000     1.193000  0.6026000     1.193000  0.6026000     0.000000       0.000000  
1 1 1 33 20 1  o 1.351000  0.3537000     1.363000  0.5029000     1.340000  0.4976000     0.2307000E-01  0.7075000 
1 1 1 33 20 2  o 1.258000  0.3477000     1.090000  0.4758000     1.426000  0.5070000     -0.3365000     0.6953000 
1 1 1 33 20 3  o 1.680000  0.3727000     1.963000  0.5066000     1.397000  0.5468000     0.5657000      0.7454000 
1 1 1 33 20 4  o 4.674000  0.1708000     4.616000  0.2510000     4.732000  0.2317000     -0.1156000     0.3415000 
1 1 1 33 20 5  f 1.791000  0.3598000     1.307000  0.5346000     2.275000  0.4818000     -0.9673000     0.7197000 
1 1 1 33 20 6  o 1.716000  0.3518000     2.412000  0.5431000     1.020000  0.4473000     1.392000       0.7036000 
1 1 1 33 20 7  o 1.216000  0.3633000     1.459000  0.5797000     0.9721000 0.4380000     0.4872000      0.7265000 
1 1 1 33 20 8  o 1.200000  0.3704000     1.119000  0.4930000     1.282000  0.5529000     -0.1631000     0.7407000 
1 1 1 33 20 9  o 2.972000  0.4859000     2.131000  0.8907000     3.812000  0.3885000     -1.682000      0.9718000 
1 1 1 33 20 10 o 1.450000  0.3713000     1.986000  0.5931000     0.9131000 0.4470000     1.073000       0.7426000 
1 1 1 33 20 11 o 2.007000  0.3958000     2.660000  0.5181000     1.353000  0.5985000     1.307000       0.7915000 
1 1 1 33 20 12 o 1.262000  0.3863000     1.496000  0.5969000     1.027000  0.4905000     0.4694000      0.7726000 
1 1 1 33 20 13 o 2.320000  0.4332000     1.960000  0.6379000     2.680000  0.5864000     -0.7204000     0.8665000 
1 1 1 33 21 0  f 1.426000  0.6320000     1.426000  0.6320000     1.426000  0.6320000     0.000000       0.000000  
1 1 1 33 21 1  o 3.152000  0.2336000     3.242000  0.3330000     3.063000  0.3277000     0.1793000      0.4672000 
1 1 1 33 21 2  o 2.479000  0.2939000     2.492000  0.4231000     2.465000  0.4082000     0.2710000E-01  0.5879000 
1 1 1 33 21 3  o 1.663000  0.3691000     1.612000  0.5357000     1.714000  0.5080000     -0.1026000     0.7383000 
1 1 1 33 21 4  o 2.736000  0.3103000     2.942000  0.4697000     2.529000  0.4058000     0.4129000      0.6207000 
1 1 1 33 21 5  o 1.580000  0.3780000     1.908000  0.5541000     1.253000  0.5143000     0.6550000      0.7560000 
1 1 1 33 21 6  o 1.545000  0.3937000     1.789000  0.6071000     1.302000  0.5014000     0.4864000      0.7874000 
1 1 1 33 21 7  o 1.599000  0.3849000     1.414000  0.5814000     1.784000  0.5045000     -0.3699000     0.7698000 
1 1 1 33 21 8  o 3.033000  0.5024000     2.532000  0.9458000     3.533000  0.3390000     -1.001000      1.005000  
1 1 1 33 21 9  o 1.364000  0.4078000     1.660000  0.6466000     1.068000  0.4970000     0.5927000      0.8156000 
1 1 1 33 21 10 o 3.070000  0.3432000     2.799000  0.4989000     3.341000  0.4714000     -0.5417000     0.6863000 
1 1 1 33 21 11 o 1.371000  0.4301000     1.393000  0.5835000     1.350000  0.6321000     0.4332000E-01  0.8603000 
1 1 1 33 21 12 o 1.788000  0.4363000     1.988000  0.6137000     1.588000  0.6204000     0.4003000      0.8726000 
1 1 1 33 21 13 o 1.209000  0.3855000     0.9791000 0.4733000     1.438000  0.6086000     -0.4592000     0.7710000 
1 1 1 33 22 0  o 0.6591000 0.4511000     0.6591000 0.4511000     0.6591000 0.4511000     0.000000       0.000000  
1 1 1 33 22 1  o 2.298000  0.3248000     2.132000  0.4821000     2.464000  0.4354000     -0.3314000     0.6496000 
1 1 1 33 22 2  o 2.220000  0.3302000     2.487000  0.4385000     1.953000  0.4938000     0.5339000      0.6604000 
1 1 1 33 22 3  o 1.118000  0.3490000     1.272000  0.5433000     0.9630000 0.4381000     0.3091000      0.6980000 
1 1 1 33 22 4  o 3.663000  0.2429000     3.690000  0.3531000     3.637000  0.3338000     0.5268000E-01  0.4859000 
1 1 1 33 22 5  o 1.604000  0.3785000     1.529000  0.5416000     1.678000  0.5290000     -0.1498000     0.7571000 
1 1 1 33 22 6  o 2.696000  0.3105000     3.375000  0.3357000     2.016000  0.5224000     1.359000       0.6209000 
1 1 1 33 22 7  o 1.282000  0.3833000     1.447000  0.5874000     1.117000  0.4926000     0.3302000      0.7666000 
1 1 1 33 22 8  o 1.628000  0.5047000     1.980000  0.8459000     1.277000  0.5509000     0.7038000      1.009000  
1 1 1 33 22 9  o 1.814000  0.3891000     1.175000  0.5225000     2.453000  0.5768000     -1.278000      0.7783000 
1 1 1 33 22 10 o 1.562000  0.4163000     1.266000  0.5472000     1.857000  0.6276000     -0.5906000     0.8326000 
1 1 1 33 22 11 o 1.470000  0.4374000     1.630000  0.6242000     1.310000  0.6129000     0.3200000      0.8748000 
1 1 1 33 22 12 o 1.615000  0.4360000     1.408000  0.5806000     1.822000  0.6505000     -0.4136000     0.8719000 
1 1 1 33 22 13 o 1.254000  0.3841000     0.8344000 0.4144000     1.673000  0.6468000     -0.8386000     0.7682000 
1 1 1 33 23 0  o 4.026000  0.2823000     4.026000  0.2823000     4.026000  0.2823000     0.000000       0.000000  
1 1 1 33 23 1  o 1.836000  0.3432000     2.303000  0.4548000     1.369000  0.5140000     0.9338000      0.6863000 
1 1 1 33 23 2  o 2.378000  0.3636000     2.259000  0.5822000     2.496000  0.4356000     -0.2369000     0.7272000 
1 1 1 33 23 3  o 1.637000  0.3598000     1.136000  0.4924000     2.138000  0.5248000     -1.001000      0.7196000 
1 1 1 33 23 4  o 2.846000  0.2920000     3.129000  0.3618000     2.563000  0.4586000     0.5657000      0.5841000 
1 1 1 33 23 5  o 7.498000  0.1523000     7.419000  0.2223000     7.578000  0.2083000     -0.1588000     0.3046000 
1 1 1 33 23 6  o 2.506000  0.3436000     2.665000  0.4200000     2.346000  0.5439000     0.3185000      0.6872000 
1 1 1 33 23 7  o 2.321000  0.3869000     2.416000  0.5113000     2.226000  0.5809000     0.1898000      0.7739000 
1 1 1 33 23 8  o 1.617000  0.4388000     1.660000  0.6963000     1.575000  0.5342000     0.8495000E-01  0.8776000 
1 1 1 33 23 9  o 2.418000  0.4030000     2.435000  0.6562000     2.401000  0.4681000     0.3361000E-01  0.8061000 
1 1 1 33 23 10 o 1.592000  0.4437000     1.608000  0.6113000     1.577000  0.6433000     0.3137000E-01  0.8874000 
1 1 1 33 23 11 o 1.645000  0.4432000     1.713000  0.6138000     1.578000  0.6394000     0.1349000      0.8864000 
1 1 1 33 23 12 o 1.266000  0.3981000     1.193000  0.5375000     1.340000  0.5875000     -0.1470000     0.7963000 
1 1 1 33 23 13 o 1.364000  0.6647000     1.364000  0.6647000     ?         ?             ?              ?         
1 1 1 33 24 0  o 4.827000  0.2541000     4.827000  0.2541000     4.827000  0.2541000     0.000000       0.000000  
1 1 1 33 24 1  o 2.280000  0.3699000     1.964000  0.6108000     2.597000  0.4173000     -0.6337000     0.7397000 
1 1 1 33 24 2  o 2.145000  0.3999000     2.464000  0.5549000     1.825000  0.5761000     0.6382000      0.7999000 
1 1 1 33 24 3  o 4.315000  0.2187000     4.450000  0.3115000     4.179000  0.3070000     0.2704000      0.4373000 
1 1 1 33 24 4  o 1.524000  0.3675000     1.169000  0.5018000     1.879000  0.5370000     -0.7105000     0.7350000 
1 1 1 33 24 5  o 2.498000  0.3492000     2.917000  0.4007000     2.078000  0.5721000     0.8393000      0.6984000 
1 1 1 33 24 6  o 1.360000  0.3970000     1.434000  0.5602000     1.287000  0.5627000     0.1470000      0.7940000 
1 1 1 33 24 7  o 1.314000  0.3795000     1.579000  0.5922000     1.050000  0.4747000     0.5291000      0.7590000 
1 1 1 33 24 8  o 1.907000  0.4177000     2.013000  0.6398000     1.801000  0.5370000     0.2118000      0.8353000 
1 1 1 33 24 9  o 1.986000  0.4223000     1.843000  0.6704000     2.130000  0.5138000     -0.2870000     0.8447000 
1 1 1 33 24 10 o 1.607000  0.4316000     2.019000  0.6446000     1.194000  0.5741000     0.8255000      0.8631000 
1 1 1 33 24 11 o 2.391000  0.4198000     2.130000  0.6074000     2.652000  0.5797000     -0.5223000     0.8396000 
1 1 1 33 24 12 o 1.434000  0.4169000     1.114000  0.5178000     1.754000  0.6535000     -0.6399000     0.8338000 
1 1 1 33 25 0  o 2.507000  0.6487000     2.507000  0.6487000     2.507000  0.6487000     0.000000       0.000000  
1 1 1 33 25 1  o 1.838000  0.4339000     1.947000  0.5848000     1.729000  0.6412000     0.2175000      0.8678000 
1 1 1 33 25 2  o 2.630000  0.3810000     2.118000  0.5711000     3.141000  0.5043000     -1.023000      0.7619000 
1 1 1 33 25 3  o 1.755000  0.3905000     2.083000  0.5229000     1.428000  0.5802000     0.6545000      0.7811000 
1 1 1 33 25 4  o 1.084000  0.3482000     1.041000  0.4792000     1.128000  0.5053000     -0.8679000E-01 0.6964000 
1 1 1 33 25 5  o 1.674000  0.4107000     1.203000  0.5272000     2.145000  0.6299000     -0.9422000     0.8214000 
1 1 1 33 25 6  o 0.9243000 0.3139000     1.054000  0.4902000     0.7945000 0.3923000     0.2596000      0.6278000 
1 1 1 33 25 7  o 1.491000  0.3348000     2.115000  0.5213000     0.8680000 0.4202000     1.247000       0.6696000 
1 1 1 33 25 8  o 2.842000  0.3146000     2.669000  0.4753000     3.014000  0.4122000     -0.3446000     0.6292000 
1 1 1 33 25 9  f 1.482000  0.4142000     1.524000  0.6267000     1.440000  0.5418000     0.8357000E-01  0.8284000 
1 1 1 33 25 10 o 1.125000  0.3676000     1.052000  0.5118000     1.198000  0.5278000     -0.1453000     0.7352000 
1 1 1 33 25 11 o 1.467000  0.4022000     1.829000  0.6167000     1.105000  0.5163000     0.7246000      0.8044000 
1 1 1 33 25 12 o 1.396000  0.4150000     1.521000  0.6066000     1.272000  0.5665000     0.2492000      0.8300000 
1 1 1 33 26 0  f 6.702000  0.4118000     6.702000  0.4118000     6.702000  0.4118000     0.000000       0.000000  
1 1 1 33 26 1  o 3.225000  0.3291000     3.003000  0.4500000     3.447000  0.4804000     -0.4442000     0.6582000 
1 1 1 33 26 2  o 2.501000  0.3795000     2.171000  0.5572000     2.831000  0.5154000     -0.6598000     0.7591000 
1 1 1 33 26 3  o 2.027000  0.4047000     1.541000  0.5686000     2.513000  0.5760000     -0.9719000     0.8093000 
1 1 1 33 26 4  o 2.276000  0.4202000     2.497000  0.5552000     2.055000  0.6309000     0.4425000      0.8404000 
1 1 1 33 26 5  o 3.929000  0.2471000     3.961000  0.3674000     3.897000  0.3306000     0.6387000E-01  0.4943000 
1 1 1 33 26 6  o 2.372000  0.3600000     2.078000  0.5617000     2.666000  0.4506000     -0.5876000     0.7200000 
1 1 1 33 26 7  o 1.275000  0.3767000     1.354000  0.5467000     1.195000  0.5184000     0.1581000      0.7534000 
1 1 1 33 26 8  o 3.742000  0.2554000     3.341000  0.3999000     4.143000  0.3178000     -0.8016000     0.5108000 
1 1 1 33 26 9  o 1.255000  0.3737000     0.9727000 0.4743000     1.537000  0.5777000     -0.5642000     0.7474000 
1 1 1 33 26 10 o 2.836000  0.3802000     2.916000  0.6094000     2.756000  0.4547000     0.1604000      0.7604000 
1 1 1 33 26 11 o 1.273000  0.4026000     1.520000  0.6357000     1.026000  0.4943000     0.4938000      0.8053000 
1 1 1 33 26 12 o 1.249000  0.6185000     1.249000  0.6185000     ?         ?             ?              ?         
1 1 1 33 27 0  o 1.238000  0.6683000     1.238000  0.6683000     1.238000  0.6683000     -0.000000      0.000000  
1 1 1 33 27 1  o 2.035000  0.3983000     2.194000  0.5694000     1.876000  0.5571000     0.3180000      0.7966000 
1 1 1 33 27 2  o 1.886000  0.3773000     2.478000  0.5317000     1.295000  0.5354000     1.182000       0.7546000 
1 1 1 33 27 3  o 1.677000  0.4098000     1.810000  0.5965000     1.545000  0.5621000     0.2650000      0.8196000 
1 1 1 33 27 4  o 3.398000  0.2630000     3.071000  0.4020000     3.724000  0.3393000     -0.6531000     0.5260000 
1 1 1 33 27 5  o 4.158000  0.2217000     4.173000  0.3001000     4.142000  0.3264000     0.3123000E-01  0.4434000 
1 1 1 33 27 6  o 1.802000  0.3921000     1.457000  0.5608000     2.148000  0.5482000     -0.6909000     0.7842000 
1 1 1 33 27 7  o 2.291000  0.3693000     1.820000  0.5898000     2.761000  0.4446000     -0.9413000     0.7386000 
1 1 1 33 27 8  o 2.841000  0.3350000     2.273000  0.5517000     3.408000  0.3803000     -1.136000      0.6701000 
1 1 1 33 27 9  o 4.514000  0.2524000     4.664000  0.3379000     4.364000  0.3749000     0.2997000      0.5047000 
1 1 1 33 27 10 o 2.166000  0.4316000     2.058000  0.6989000     2.275000  0.5066000     -0.2172000     0.8632000 
1 1 1 33 27 11 o 1.337000  0.4037000     1.302000  0.5902000     1.372000  0.5510000     -0.7000000E-01 0.8075000 
1 1 1 33 28 0  o 0.9124000 0.5800000     0.9124000 0.5800000     0.9124000 0.5800000     -0.000000      0.000000  
1 1 1 33 28 1  o 1.214000  0.3655000     1.144000  0.5002000     1.284000  0.5331000     -0.1402000     0.7310000 
1 1 1 33 28 2  o 1.069000  0.3410000     1.139000  0.5004000     0.9998000 0.4635000     0.1391000      0.6821000 
1 1 1 33 28 3  o 1.900000  0.3932000     2.279000  0.5423000     1.520000  0.5696000     0.7588000      0.7865000 
1 1 1 33 28 4  f 2.289000  0.3766000     2.108000  0.5578000     2.469000  0.5062000     -0.3612000     0.7533000 
1 1 1 33 28 5  o 4.109000  0.2265000     4.177000  0.3112000     4.042000  0.3292000     0.1352000      0.4530000 
1 1 1 33 28 6  o 3.488000  0.2697000     3.640000  0.3548000     3.336000  0.4064000     0.3046000      0.5395000 
1 1 1 33 28 7  o 1.609000  0.4038000     1.422000  0.5655000     1.796000  0.5765000     -0.3743000     0.8076000 
1 1 1 33 28 8  o 1.066000  0.3539000     1.234000  0.5596000     0.8969000 0.4333000     0.3373000      0.7078000 
1 1 1 33 28 9  o 1.373000  0.3951000     1.458000  0.5647000     1.288000  0.5528000     0.1700000      0.7903000 
1 1 1 33 28 10 o 1.545000  0.4279000     1.858000  0.6769000     1.232000  0.5236000     0.6265000      0.8558000 
1 1 1 33 28 11 o 1.852000  0.5226000     1.855000  0.7848000     1.850000  0.6904000     0.5124000E-02  1.045000  
1 1 1 33 29 0  o 1.701000  0.7178000     1.701000  0.7178000     1.701000  0.7178000     0.000000       0.000000  
1 1 1 33 29 1  o 2.679000  0.3382000     2.486000  0.5048000     2.871000  0.4503000     -0.3854000     0.6765000 
1 1 1 33 29 2  o 1.238000  0.3680000     1.418000  0.5555000     1.058000  0.4829000     0.3601000      0.7360000 
1 1 1 33 29 3  o 1.410000  0.3794000     1.748000  0.5795000     1.071000  0.4898000     0.6770000      0.7588000 
1 1 1 33 29 4  o 2.728000  0.3349000     2.603000  0.4932000     2.854000  0.4531000     -0.2512000     0.6698000 
1 1 1 33 29 5  o 1.683000  0.3941000     2.065000  0.5705000     1.302000  0.5439000     0.7623000      0.7882000 
1 1 1 33 29 6  o 1.811000  0.4006000     2.071000  0.5570000     1.551000  0.5758000     0.5208000      0.8011000 
1 1 1 33 29 7  o 1.311000  0.3851000     1.291000  0.5420000     1.332000  0.5471000     -0.4015000E-01 0.7701000 
1 1 1 33 29 8  o 1.152000  0.3691000     1.233000  0.5431000     1.071000  0.4999000     0.1624000      0.7382000 
1 1 1 33 29 9  o 4.470000  0.2270000     4.360000  0.3306000     4.580000  0.3112000     -0.2198000     0.4541000 
1 1 1 33 29 10 o 2.959000  0.3454000     3.293000  0.4345000     2.625000  0.5371000     0.6681000      0.6909000 
1 1 1 33 30 0  o 0.8263000 0.5479000     0.8263000 0.5479000     0.8263000 0.5479000     0.000000       0.000000  
1 1 1 33 30 1  o 3.763000  0.2545000     3.655000  0.3634000     3.872000  0.3565000     -0.2176000     0.5090000 
1 1 1 33 30 2  o 1.178000  0.3628000     1.301000  0.5411000     1.054000  0.4836000     0.2467000      0.7257000 
1 1 1 33 30 3  o 1.532000  0.4011000     1.730000  0.5804000     1.334000  0.5538000     0.3962000      0.8022000 
1 1 1 33 30 4  o 1.469000  0.4038000     1.371000  0.5587000     1.567000  0.5831000     -0.1960000     0.8076000 
1 1 1 33 30 5  o 1.987000  0.4157000     2.048000  0.5851000     1.926000  0.5907000     0.1215000      0.8314000 
1 1 1 33 30 6  o 2.180000  0.3940000     1.834000  0.5946000     2.525000  0.5171000     -0.6914000     0.7880000 
1 1 1 33 30 7  o 1.327000  0.4037000     1.381000  0.5968000     1.273000  0.5438000     0.1081000      0.8074000 
1 1 1 33 30 8  o 3.156000  0.3250000     3.019000  0.4559000     3.294000  0.4635000     -0.2751000     0.6501000 
1 1 1 33 30 9  o 2.040000  0.4016000     2.467000  0.5389000     1.614000  0.5954000     0.8532000      0.8031000 
1 1 1 33 30 10 o 1.447000  0.4442000     1.375000  0.5830000     1.519000  0.6705000     -0.1437000     0.8885000 
1 1 1 33 31 0  o 1.410000  0.7127000     1.410000  0.7127000     1.410000  0.7127000     0.000000       0.000000  
1 1 1 33 31 1  o 1.804000  0.4135000     1.597000  0.5856000     2.012000  0.5841000     -0.4156000     0.8270000 
1 1 1 33 31 2  o 2.004000  0.3753000     2.600000  0.4922000     1.409000  0.5668000     1.191000       0.7507000 
1 1 1 33 31 3  o 3.742000  0.2604000     3.439000  0.3867000     4.046000  0.3488000     -0.6073000     0.5208000 
1 1 1 33 31 4  o 2.474000  0.3838000     2.327000  0.5667000     2.622000  0.5177000     -0.2953000     0.7675000 
1 1 1 33 31 5  o 1.536000  0.3975000     1.866000  0.5961000     1.205000  0.5262000     0.6607000      0.7951000 
1 1 1 33 31 6  f 1.066000  0.3544000     1.101000  0.5208000     1.030000  0.4808000     0.7067000E-01  0.7088000 
1 1 1 33 31 7  o 2.341000  0.4392000     2.665000  0.6118000     2.016000  0.6302000     0.6491000      0.8783000 
1 1 1 33 31 8  o 2.269000  0.3956000     2.685000  0.5036000     1.854000  0.6101000     0.8304000      0.7911000 
1 1 1 33 31 9  o 1.408000  0.3913000     1.701000  0.5969000     1.115000  0.5061000     0.5858000      0.7826000 
1 1 1 33 32 0  o 0.7639000 0.5226000     0.7639000 0.5226000     0.7639000 0.5226000     -0.000000      0.000000  
1 1 1 33 32 1  o 1.867000  0.4192000     1.904000  0.5927000     1.831000  0.5931000     0.7273000E-01  0.8385000 
1 1 1 33 32 2  o 2.388000  0.3869000     2.639000  0.5159000     2.137000  0.5769000     0.5026000      0.7739000 
1 1 1 33 32 3  o 1.496000  0.4037000     1.257000  0.5362000     1.734000  0.6036000     -0.4771000     0.8073000 
1 1 1 33 32 4  o 1.632000  0.4200000     1.543000  0.5913000     1.721000  0.5967000     -0.1778000     0.8400000 
1 1 1 33 32 5  o 2.665000  0.3581000     2.900000  0.4634000     2.430000  0.5461000     0.4699000      0.7162000 
1 1 1 33 32 6  f 2.848000  0.4161000     2.379000  0.6958000     3.317000  0.4565000     -0.9382000     0.8322000 
1 1 1 33 32 7  o 3.154000  0.3327000     2.768000  0.5050000     3.540000  0.4333000     -0.7713000     0.6654000 
1 1 1 33 32 8  o 1.866000  0.4219000     1.680000  0.5975000     2.053000  0.5958000     -0.3725000     0.8438000 
1 1 1 33 32 9  o 1.463000  0.7115000     ?         ?             1.463000  0.7115000     ?              ?         
1 1 1 33 33 0  o 5.244000  0.3001000     5.244000  0.3001000     5.244000  0.3001000     -0.000000      0.000000  
1 1 1 33 33 1  o 3.836000  0.2653000     3.987000  0.3568000     3.685000  0.3927000     0.3017000      0.5306000 
1 1 1 33 33 2  o 1.291000  0.3882000     1.365000  0.5638000     1.218000  0.5339000     0.1473000      0.7765000 
1 1 1 33 33 3  o 1.539000  0.4060000     1.664000  0.5827000     1.414000  0.5657000     0.2499000      0.8121000 
1 1 1 33 33 4  o 1.617000  0.3780000     1.041000  0.4857000     2.193000  0.5793000     -1.152000      0.7560000 
1 1 1 33 33 5  o 3.056000  0.3894000     3.128000  0.5764000     2.983000  0.5236000     0.1457000      0.7787000 
1 1 1 33 33 6  o 1.740000  0.4472000     1.639000  0.6295000     1.842000  0.6355000     -0.2034000     0.8945000 
1 1 1 33 33 7  o 1.062000  0.3467000     1.203000  0.5305000     0.9214000 0.4466000     0.2812000      0.6934000 
1 1 1 33 33 8  o 1.284000  0.3889000     1.427000  0.5791000     1.141000  0.5193000     0.2865000      0.7778000 
1 1 1 33 34 0  o 3.937000  0.3706000     3.937000  0.3706000     3.937000  0.3706000     -0.000000      0.000000  
1 1 1 33 34 1  o 1.523000  0.3970000     1.121000  0.5098000     1.926000  0.6088000     -0.8050000     0.7941000 
1 1 1 33 34 2  o 4.104000  0.2582000     4.239000  0.3439000     3.968000  0.3852000     0.2711000      0.5163000 
1 1 1 33 34 3  o 1.416000  0.4050000     1.514000  0.5856000     1.317000  0.5596000     0.1966000      0.8099000 
1 1 1 33 34 4  o 1.620000  0.4411000     1.528000  0.6375000     1.712000  0.6098000     -0.1840000     0.8822000 
1 1 1 33 34 5  o 2.666000  0.4476000     2.884000  0.5589000     2.447000  0.6994000     0.4366000      0.8952000 
1 1 1 33 34 6  o 1.768000  0.4324000     1.944000  0.6129000     1.592000  0.6103000     0.3520000      0.8649000 
1 1 1 33 34 7  o 1.992000  0.4262000     1.695000  0.6076000     2.290000  0.5977000     -0.5948000     0.8523000 
1 1 1 33 35 0  o 5.698000  0.3030000     5.698000  0.3030000     5.698000  0.3030000     -0.000000      0.000000  
1 1 1 33 35 1  o 1.893000  0.4141000     1.448000  0.5873000     2.338000  0.5841000     -0.8902000     0.8282000 
1 1 1 33 35 2  o 1.418000  0.4122000     1.413000  0.5826000     1.423000  0.5834000     -0.1030000E-01 0.8245000 
1 1 1 33 35 3  o 1.606000  0.4434000     1.351000  0.5986000     1.861000  0.6541000     -0.5095000     0.8867000 
1 1 1 33 35 4  o 1.581000  0.4347000     1.869000  0.6518000     1.293000  0.5752000     0.5760000      0.8693000 
1 1 1 33 35 5  o 1.528000  0.4138000     1.099000  0.5076000     1.958000  0.6536000     -0.8592000     0.8275000 
1 1 1 33 35 6  o 4.142000  0.2915000     4.115000  0.3738000     4.169000  0.4475000     -0.5359000E-01 0.5831000 
1 1 1 33 36 0  o 3.127000  0.6499000     3.127000  0.6499000     3.127000  0.6499000     -0.000000      0.000000  
1 1 1 33 36 1  o 3.467000  0.3492000     3.618000  0.5118000     3.316000  0.4752000     0.3020000      0.6984000 
1 1 1 33 36 2  o 2.992000  0.4136000     3.078000  0.5967000     2.906000  0.5729000     0.1720000      0.8272000 
1 1 1 33 36 3  o 2.293000  0.4606000     2.244000  0.6428000     2.342000  0.6600000     -0.9766000E-01 0.9213000 
1 1 1 33 36 4  o 1.932000  0.4866000     1.786000  0.6206000     2.078000  0.7497000     -0.2915000     0.9733000 
1 1 1 33 36 5  o 2.000000  0.4580000     2.060000  0.6191000     1.939000  0.6752000     0.1210000      0.9161000 
1 1 1 33 37 0  o 1.434000  0.7832000     1.434000  0.7832000     1.434000  0.7832000     -0.000000      0.000000  
1 1 1 33 37 1  o 1.133000  0.3845000     1.273000  0.5867000     0.9943000 0.4969000     0.2783000      0.7689000 
1 1 1 33 37 2  o 1.412000  0.4393000     1.040000  0.5078000     1.784000  0.7170000     -0.7440000     0.8786000 
1 1 1 33 37 3  o 1.561000  0.4428000     1.314000  0.5777000     1.809000  0.6711000     -0.4954000     0.8855000 
1 1 1 33 37 4  o 2.207000  0.4707000     2.402000  0.6255000     2.013000  0.7035000     0.3893000      0.9414000 
1 1 1 33 38 0  o 2.026000  0.8998000     2.026000  0.8998000     2.026000  0.8998000     0.000000       0.000000  
1 1 1 33 38 1  o 1.328000  0.4187000     1.446000  0.6109000     1.210000  0.5728000     0.2355000      0.8374000 
1 1 1 33 38 2  o 1.455000  0.4377000     1.337000  0.5882000     1.573000  0.6482000     -0.2356000     0.8753000 
1 1 1 33 38 3  o 1.475000  0.4890000     1.297000  0.6120000     1.653000  0.7628000     -0.3564000     0.9780000 
1 1 1 34 0  3  o 2.291000  0.4100000     2.291000  0.4100000     2.291000  0.4100000     -0.000000      0.000000  
1 1 1 34 0  4  o 3.020000  0.3732000     3.020000  0.3732000     3.020000  0.3732000     0.000000       0.000000  
1 1 1 34 0  5  o 0.6787000 0.4700000     0.6787000 0.4700000     0.6787000 0.4700000     0.000000       0.000000  
1 1 1 34 0  6  o 5.029000  0.2969000     5.029000  0.2969000     5.029000  0.2969000     0.000000       0.000000  
1 1 1 34 0  7  o 0.4831000 0.3381000     0.4831000 0.3381000     0.4831000 0.3381000     -0.000000      0.000000  
1 1 1 34 0  8  f 0.8061000 0.4927000     0.8061000 0.4927000     0.8061000 0.4927000     -0.000000      0.000000  
1 1 1 34 0  9  o 0.9850000 0.5783000     0.9850000 0.5783000     0.9850000 0.5783000     0.000000       0.000000  
1 1 1 34 0  10 o 0.6536000 0.4426000     0.6536000 0.4426000     0.6536000 0.4426000     0.000000       0.000000  
1 1 1 34 0  11 f 0.6133000 0.4252000     0.6133000 0.4252000     0.6133000 0.4252000     0.000000       0.000000  
1 1 1 34 0  12 o 0.6966000 0.4945000     0.6966000 0.4945000     0.6966000 0.4945000     0.000000       0.000000  
1 1 1 34 0  13 o 0.9850000 0.6500000     0.9850000 0.6500000     0.9850000 0.6500000     0.000000       0.000000  
1 1 1 34 0  14 o 1.505000  0.7839000     1.505000  0.7839000     1.505000  0.7839000     0.000000       0.000000  
1 1 1 34 0  15 o 1.462000  0.8246000     1.462000  0.8246000     1.462000  0.8246000     0.000000       0.000000  
1 1 1 34 1  3  o 3.071000  0.2065000     3.089000  0.2822000     3.052000  0.3015000     0.3661000E-01  0.4130000 
1 1 1 34 1  4  o 4.340000  0.1899000     4.501000  0.2537000     4.179000  0.2827000     0.3225000      0.3799000 
1 1 1 34 1  5  o 1.026000  0.3331000     1.029000  0.4694000     1.023000  0.4726000     0.5854000E-02  0.6661000 
1 1 1 34 1  6  o 4.339000  0.2271000     4.055000  0.3237000     4.623000  0.3185000     -0.5672000     0.4541000 
1 1 1 34 1  7  o 2.768000  0.1766000     2.633000  0.2797000     2.903000  0.2156000     -0.2694000     0.3531000 
1 1 1 34 1  8  o 1.638000  0.3149000     1.936000  0.4479000     1.340000  0.4428000     0.5959000      0.6298000 
1 1 1 34 1  9  o 2.544000  0.3065000     2.753000  0.4066000     2.336000  0.4588000     0.4169000      0.6131000 
1 1 1 34 1  10 o 1.258000  0.3364000     1.035000  0.4569000     1.482000  0.4939000     -0.4474000     0.6728000 
1 1 1 34 1  11 o 1.344000  0.3811000     1.229000  0.4706000     1.459000  0.5995000     -0.2302000     0.7622000 
1 1 1 34 1  12 o 1.172000  0.3669000     1.015000  0.4458000     1.329000  0.5830000     -0.3134000     0.7339000 
1 1 1 34 1  13 o 1.553000  0.4568000     1.589000  0.6500000     1.518000  0.6420000     0.7107000E-01  0.9136000 
1 1 1 34 1  14 o 1.214000  0.3904000     0.9974000 0.4850000     1.431000  0.6119000     -0.4336000     0.7808000 
1 1 1 34 1  15 o 1.217000  0.4049000     1.047000  0.5121000     1.388000  0.6274000     -0.3411000     0.8099000 
1 1 1 34 2  3  o 6.476000  0.1424000     6.385000  0.1988000     6.567000  0.2040000     -0.1817000     0.2848000 
1 1 1 34 2  4  o 3.992000  0.2030000     3.842000  0.2867000     4.143000  0.2874000     -0.3008000     0.4060000 
1 1 1 34 2  5  o 1.375000  0.3759000     1.090000  0.4840000     1.659000  0.5752000     -0.5685000     0.7517000 
1 1 1 34 2  6  o 4.688000  0.3223000     4.139000  0.6331000     5.236000  0.1213000     -1.097000      0.6446000 
1 1 1 34 2  7  o 5.154000  0.1249000     5.241000  0.1876000     5.067000  0.1648000     0.1736000      0.2497000 
1 1 1 34 2  8  o 3.625000  0.1726000     3.672000  0.2729000     3.578000  0.2114000     0.9321000E-01  0.3453000 
1 1 1 34 2  9  o 3.248000  0.2332000     3.319000  0.3413000     3.178000  0.3178000     0.1415000      0.4664000 
1 1 1 34 2  10 o 1.765000  0.3439000     1.437000  0.4760000     2.094000  0.4965000     -0.6567000     0.6878000 
1 1 1 34 2  11 o 2.480000  0.3548000     3.222000  0.2887000     1.737000  0.6482000     1.485000       0.7096000 
1 1 1 34 2  12 o 1.220000  0.3743000     1.140000  0.4685000     1.300000  0.5839000     -0.1598000     0.7486000 
1 1 1 34 2  13 o 1.165000  0.3875000     1.044000  0.5037000     1.287000  0.5889000     -0.2422000     0.7749000 
1 1 1 34 2  14 o 1.835000  0.4275000     2.251000  0.5462000     1.418000  0.6578000     0.8327000      0.8550000 
1 1 1 34 2  15 o 1.107000  0.3780000     1.229000  0.5783000     0.9857000 0.4868000     0.2430000      0.7559000 
1 1 1 34 3  2  o 1.605000  0.4511000     ?         ?             1.605000  0.4511000     ?              ?         
1 1 1 34 3  3  o 2.267000  0.2822000     2.176000  0.3899000     2.358000  0.4080000     -0.1825000     0.5644000 
1 1 1 34 3  4  o 3.862000  0.2103000     3.882000  0.2835000     3.842000  0.3108000     0.4038000E-01  0.4207000 
1 1 1 34 3  5  o 2.229000  0.3340000     2.829000  0.4225000     1.628000  0.5175000     1.201000       0.6681000 
1 1 1 34 3  6  o 0.6744000 0.2180000     0.8107000 0.3486000     0.5381000 0.2619000     0.2726000      0.4360000 
1 1 1 34 3  7  f 2.344000  0.2303000     2.103000  0.3827000     2.585000  0.2562000     -0.4818000     0.4606000 
1 1 1 34 3  8  f 3.791000  0.1757000     3.891000  0.2623000     3.692000  0.2337000     0.1989000      0.3513000 
1 1 1 34 3  9  o 5.169000  0.2305000     5.396000  0.2397000     4.941000  0.3938000     0.4551000      0.4610000 
1 1 1 34 3  10 o 1.465000  0.3744000     1.406000  0.5042000     1.524000  0.5537000     -0.1185000     0.7489000 
1 1 1 34 3  11 o 1.824000  0.3645000     1.472000  0.4902000     2.175000  0.5397000     -0.7034000     0.7291000 
1 1 1 34 3  12 o 1.546000  0.3967000     0.9319000 0.4264000     2.160000  0.6690000     -1.228000      0.7933000 
1 1 1 34 3  13 o 2.100000  0.4890000     1.879000  0.6870000     2.321000  0.6962000     -0.4422000     0.9781000 
1 1 1 34 3  14 o 1.885000  0.4923000     1.611000  0.5525000     2.158000  0.8150000     -0.5471000     0.9846000 
1 1 1 34 3  15 o 1.049000  0.3715000     1.035000  0.5093000     1.063000  0.5409000     -0.2782000E-01 0.7429000 
1 1 1 34 4  2  o 1.671000  0.4045000     ?         ?             1.671000  0.4045000     ?              ?         
1 1 1 34 4  3  f 6.580000  0.1454000     6.788000  0.1890000     6.372000  0.2209000     0.4159000      0.2907000 
1 1 1 34 4  4  o 3.799000  0.2362000     3.609000  0.2915000     3.989000  0.3717000     -0.3793000     0.4724000 
1 1 1 34 4  5  o 1.188000  0.3920000     1.536000  0.6746000     0.8389000 0.3996000     0.6975000      0.7840000 
1 1 1 34 4  6  o 1.781000  0.2214000     1.756000  0.3444000     1.807000  0.2782000     -0.5147000E-01 0.4427000 
1 1 1 34 4  7  o 1.557000  0.2994000     1.724000  0.4403000     1.390000  0.4059000     0.3337000      0.5988000 
1 1 1 34 4  8  o 3.526000  0.2249000     3.317000  0.2827000     3.734000  0.3500000     -0.4166000     0.4499000 
1 1 1 34 4  9  o 2.770000  0.3579000     2.636000  0.3413000     2.905000  0.6293000     -0.2684000     0.7159000 
1 1 1 34 4  10 o 2.891000  0.2623000     3.008000  0.3021000     2.774000  0.4289000     0.2334000      0.5246000 
1 1 1 34 4  11 o 3.202000  0.2492000     2.866000  0.3614000     3.538000  0.3432000     -0.6722000     0.4984000 
1 1 1 34 4  12 o 1.514000  0.3954000     1.443000  0.5345000     1.584000  0.5830000     -0.1404000     0.7909000 
1 1 1 34 4  13 o 1.186000  0.3898000     1.373000  0.6071000     0.9990000 0.4891000     0.3739000      0.7796000 
1 1 1 34 4  14 o 1.186000  0.3907000     1.109000  0.4912000     1.263000  0.6076000     -0.1545000     0.7813000 
1 1 1 34 4  15 o 1.031000  0.3712000     0.9803000 0.5000000     1.081000  0.5487000     -0.1011000     0.7424000 
1 1 1 34 5  2  o 4.165000  0.1359000     4.129000  0.1608000     4.201000  0.2192000     -0.7275000E-01 0.2719000 
1 1 1 34 5  3  o 3.130000  0.1917000     3.358000  0.2698000     2.902000  0.2723000     0.4561000      0.3833000 
1 1 1 34 5  4  o 1.467000  0.4328000     1.602000  0.6922000     1.332000  0.5198000     0.2693000      0.8656000 
1 1 1 34 5  5  o 1.802000  0.4624000     2.090000  0.7549000     1.513000  0.5340000     0.5771000      0.9247000 
1 1 1 34 5  6  o 2.110000  0.1993000     2.103000  0.3185000     2.118000  0.2397000     -0.1528000E-01 0.3986000 
1 1 1 34 5  7  o 4.531000  0.1580000     4.554000  0.2227000     4.507000  0.2243000     0.4703000E-01  0.3161000 
1 1 1 34 5  8  o 4.218000  0.2490000     3.981000  0.3872000     4.455000  0.3132000     -0.4743000     0.4980000 
1 1 1 34 5  9  o 2.691000  0.3373000     2.188000  0.4074000     3.194000  0.5377000     -1.006000      0.6746000 
1 1 1 34 5  10 o 2.049000  0.3469000     2.354000  0.3961000     1.745000  0.5697000     0.6095000      0.6939000 
1 1 1 34 5  11 o 1.897000  0.3738000     1.612000  0.5271000     2.183000  0.5302000     -0.5712000     0.7476000 
1 1 1 34 5  12 f 3.807000  0.2339000     3.615000  0.3272000     3.998000  0.3344000     -0.3830000     0.4678000 
1 1 1 34 5  13 o 1.508000  0.4401000     1.370000  0.6480000     1.647000  0.5956000     -0.2775000     0.8801000 
1 1 1 34 5  14 o 1.912000  0.4132000     1.929000  0.5336000     1.896000  0.6311000     0.3287000E-01  0.8265000 
1 1 1 34 6  2  o 1.700000  0.3007000     1.582000  0.3802000     1.817000  0.4660000     -0.2347000     0.6014000 
1 1 1 34 6  3  o 4.913000  0.2241000     4.927000  0.3584000     4.899000  0.2693000     0.2768000E-01  0.4483000 
1 1 1 34 6  5  o 3.846000  0.3320000     3.786000  0.5969000     3.906000  0.2908000     -0.1191000     0.6640000 
1 1 1 34 6  6  o 3.191000  0.1564000     3.137000  0.1988000     3.245000  0.2416000     -0.1082000     0.3128000 
1 1 1 34 6  7  o 1.476000  0.3271000     1.609000  0.4345000     1.342000  0.4890000     0.2667000      0.6541000 
1 1 1 34 6  8  f 1.069000  0.3686000     1.239000  0.6050000     0.8999000 0.4211000     0.3386000      0.7372000 
1 1 1 34 6  9  o 1.243000  0.3596000     0.9787000 0.4388000     1.507000  0.5698000     -0.5279000     0.7192000 
1 1 1 34 6  10 o 1.013000  0.3219000     1.136000  0.4812000     0.8902000 0.4277000     0.2453000      0.6438000 
1 1 1 34 6  11 o 1.871000  0.3527000     2.388000  0.4492000     1.354000  0.5440000     1.034000       0.7055000 
1 1 1 34 6  12 o 1.528000  0.3838000     1.211000  0.5081000     1.845000  0.5753000     -0.6339000     0.7676000 
1 1 1 34 6  13 o 2.664000  0.3473000     2.886000  0.4345000     2.442000  0.5419000     0.4443000      0.6945000 
1 1 1 34 6  14 o 1.415000  0.4023000     1.484000  0.5737000     1.347000  0.5641000     0.1373000      0.8046000 
1 1 1 34 7  1  o 3.266000  0.2301000     ?         ?             3.266000  0.2301000     ?              ?         
1 1 1 34 7  2  o 3.573000  0.2095000     3.726000  0.3484000     3.421000  0.2329000     0.3049000      0.4191000 
1 1 1 34 7  3  o 1.692000  0.3513000     1.246000  0.5572000     2.138000  0.4281000     -0.8916000     0.7026000 
1 1 1 34 7  4  o 1.500000  0.6639000     ?         ?             1.500000  0.6639000     ?              ?         
1 1 1 34 7  5  o 2.902000  0.1956000     2.511000  0.3287000     3.293000  0.2123000     -0.7822000     0.3913000 
1 1 1 34 7  6  o 1.640000  0.2926000     1.821000  0.3583000     1.460000  0.4626000     0.3606000      0.5852000 
1 1 1 34 7  7  o 2.824000  0.2255000     2.444000  0.3339000     3.204000  0.3033000     -0.7604000     0.4511000 
1 1 1 34 7  8  o 2.463000  0.3962000     1.995000  0.7073000     2.931000  0.3573000     -0.9353000     0.7925000 
1 1 1 34 7  9  o 3.436000  0.2242000     3.117000  0.3285000     3.755000  0.3053000     -0.6375000     0.4485000 
1 1 1 34 7  10 o 1.535000  0.3655000     1.078000  0.4709000     1.992000  0.5590000     -0.9132000     0.7309000 
1 1 1 34 7  11 o 2.568000  0.3321000     2.817000  0.4057000     2.319000  0.5258000     0.4983000      0.6641000 
1 1 1 34 7  12 o 2.152000  0.3862000     2.332000  0.5013000     1.971000  0.5876000     0.3615000      0.7724000 
1 1 1 34 7  13 o 3.241000  0.2917000     3.267000  0.3987000     3.216000  0.4260000     0.5136000E-01  0.5834000 
1 1 1 34 7  14 o 1.572000  0.3985000     1.921000  0.5860000     1.224000  0.5402000     0.6974000      0.7970000 
1 1 1 34 8  1  o 1.708000  0.2761000     1.767000  0.3919000     1.648000  0.3890000     0.1188000      0.5522000 
1 1 1 34 8  2  o 4.126000  0.2155000     ?         ?             4.126000  0.2155000     ?              ?         
1 1 1 34 8  3  o 4.404000  0.2491000     4.702000  0.3870000     4.105000  0.3136000     0.5974000      0.4981000 
1 1 1 34 8  4  o 4.152000  0.3389000     3.469000  0.6121000     4.834000  0.2912000     -1.365000      0.6779000 
1 1 1 34 8  5  o 1.155000  0.2962000     1.062000  0.3969000     1.248000  0.4399000     -0.1863000     0.5924000 
1 1 1 34 8  6  o 2.665000  0.2134000     2.814000  0.2632000     2.516000  0.3361000     0.2984000      0.4269000 
1 1 1 34 8  7  o 2.588000  0.2590000     2.637000  0.3289000     2.539000  0.4002000     0.9885000E-01  0.5180000 
1 1 1 34 8  8  o 1.244000  0.3521000     1.198000  0.4837000     1.289000  0.5119000     -0.9105000E-01 0.7043000 
1 1 1 34 8  9  o 2.523000  0.3055000     2.468000  0.4167000     2.578000  0.4469000     -0.1105000     0.6110000 
1 1 1 34 8  10 o 1.546000  0.3844000     1.482000  0.5282000     1.610000  0.5586000     -0.1275000     0.7688000 
1 1 1 34 8  11 o 2.711000  0.3152000     2.997000  0.3718000     2.426000  0.5092000     0.5707000      0.6305000 
1 1 1 34 8  12 o 1.614000  0.4164000     1.633000  0.5506000     1.595000  0.6249000     0.3805000E-01  0.8329000 
1 1 1 34 8  13 o 1.419000  0.4107000     1.336000  0.5501000     1.502000  0.6100000     -0.1653000     0.8214000 
1 1 1 34 8  14 o 1.538000  0.4139000     1.716000  0.5974000     1.361000  0.5729000     0.3554000      0.8277000 
1 1 1 34 9  0  o 0.6924000 0.4527000     0.6924000 0.4527000     0.6924000 0.4527000     -0.000000      0.000000  
1 1 1 34 9  1  o 1.652000  0.3056000     2.231000  0.4295000     1.073000  0.4348000     1.158000       0.6112000 
1 1 1 34 9  2  f 1.053000  0.3308000     1.015000  0.4800000     1.091000  0.4552000     -0.7567000E-01 0.6615000 
1 1 1 34 9  3  o 3.032000  0.3383000     3.246000  0.5290000     2.817000  0.4218000     0.4284000      0.6766000 
1 1 1 34 9  4  o 1.371000  0.3271000     1.420000  0.5057000     1.323000  0.4149000     0.9749000E-01  0.6542000 
1 1 1 34 9  5  o 2.099000  0.2542000     2.272000  0.3082000     1.926000  0.4044000     0.3463000      0.5085000 
1 1 1 34 9  6  o 5.116000  0.2231000     5.450000  0.2249000     4.781000  0.3853000     0.6685000      0.4461000 
1 1 1 34 9  7  o 1.374000  0.3812000     1.589000  0.5606000     1.158000  0.5166000     0.4309000      0.7623000 
1 1 1 34 9  8  o 2.627000  0.2913000     2.397000  0.4118000     2.857000  0.4121000     -0.4603000     0.5826000 
1 1 1 34 9  9  o 4.287000  0.2371000     3.658000  0.3942000     4.916000  0.2636000     -1.258000      0.4742000 
1 1 1 34 9  10 o 2.822000  0.2915000     2.696000  0.4035000     2.949000  0.4209000     -0.2532000     0.5830000 
1 1 1 34 9  11 o 2.880000  0.3457000     2.707000  0.5490000     3.054000  0.4204000     -0.3463000     0.6915000 
1 1 1 34 9  12 o 1.921000  0.4303000     1.671000  0.5832000     2.171000  0.6328000     -0.5000000     0.8606000 
1 1 1 34 9  13 o 2.350000  0.4208000     2.463000  0.5546000     2.237000  0.6330000     0.2260000      0.8416000 
1 1 1 34 9  14 o 1.243000  0.3822000     1.234000  0.5309000     1.252000  0.5500000     -0.1740000E-01 0.7644000 
1 1 1 34 10 0  o 2.590000  0.2100000     2.590000  0.2100000     2.590000  0.2100000     0.000000       0.000000  
1 1 1 34 10 1  o 2.803000  0.1975000     2.886000  0.2368000     2.720000  0.3161000     0.1656000      0.3950000 
1 1 1 34 10 2  o 5.839000  0.1301000     5.670000  0.1703000     6.009000  0.1968000     -0.3388000     0.2603000 
1 1 1 34 10 3  o 2.850000  0.2869000     2.501000  0.5284000     3.200000  0.2238000     -0.6987000     0.5739000 
1 1 1 34 10 4  o 1.039000  0.2830000     1.234000  0.4218000     0.8435000 0.3775000     0.3901000      0.5661000 
1 1 1 34 10 5  o 1.337000  0.3226000     1.308000  0.4458000     1.365000  0.4663000     -0.5724000E-01 0.6451000 
1 1 1 34 10 6  o 2.354000  0.2552000     2.346000  0.3485000     2.361000  0.3729000     -0.1485000E-01 0.5104000 
1 1 1 34 10 7  o 2.650000  0.4378000     2.183000  0.8090000     3.116000  0.3352000     -0.9332000     0.8757000 
1 1 1 34 10 8  o 1.229000  0.3734000     1.262000  0.5116000     1.197000  0.5439000     0.6479000E-01  0.7467000 
1 1 1 34 10 9  o 2.042000  0.3275000     1.339000  0.5116000     2.745000  0.4089000     -1.406000      0.6549000 
1 1 1 34 10 10 o 1.686000  0.3795000     1.323000  0.5187000     2.049000  0.5542000     -0.7258000     0.7590000 
1 1 1 34 10 11 o 1.878000  0.3959000     1.627000  0.5546000     2.129000  0.5651000     -0.5024000     0.7918000 
1 1 1 34 10 12 o 2.450000  0.4314000     2.813000  0.5734000     2.087000  0.6446000     0.7265000      0.8627000 
1 1 1 34 10 13 o 2.346000  0.4250000     2.062000  0.5821000     2.630000  0.6194000     -0.5681000     0.8500000 
1 1 1 34 10 14 o 1.294000  0.3781000     0.9282000 0.4458000     1.659000  0.6109000     -0.7309000     0.7563000 
1 1 1 34 11 0  o 0.7923000 0.4714000     0.7923000 0.4714000     0.7923000 0.4714000     0.000000       0.000000  
1 1 1 34 11 1  o 1.020000  0.2841000     1.056000  0.4157000     0.9841000 0.3873000     0.7167000E-01  0.5681000 
1 1 1 34 11 2  o 1.283000  0.2886000     1.118000  0.4051000     1.449000  0.4111000     -0.3313000     0.5772000 
1 1 1 34 11 3  o 1.546000  0.3027000     1.467000  0.4188000     1.625000  0.4372000     -0.1577000     0.6055000 
1 1 1 34 11 4  o 1.741000  0.2963000     1.896000  0.3886000     1.586000  0.4475000     0.3096000      0.5926000 
1 1 1 34 11 5  f 1.378000  0.3323000     1.447000  0.4666000     1.310000  0.4732000     0.1366000      0.6645000 
1 1 1 34 11 6  o 5.171000  0.2181000     5.668000  0.1896000     4.673000  0.3928000     0.9947000      0.4362000 
1 1 1 34 11 7  o 3.248000  0.2627000     3.066000  0.4254000     3.430000  0.3083000     -0.3636000     0.5254000 
1 1 1 34 11 8  o 2.501000  0.4223000     2.423000  0.4652000     2.579000  0.7050000     -0.1559000     0.8447000 
1 1 1 34 11 9  o 1.653000  0.3741000     1.880000  0.5103000     1.427000  0.5472000     0.4534000      0.7482000 
1 1 1 34 11 10 o 2.066000  0.3691000     2.392000  0.4587000     1.739000  0.5785000     0.6532000      0.7383000 
1 1 1 34 11 11 o 2.475000  0.3529000     2.919000  0.4030000     2.032000  0.5795000     0.8863000      0.7059000 
1 1 1 34 11 12 o 1.092000  0.3848000     1.262000  0.6282000     0.9210000 0.4445000     0.3411000      0.7695000 
1 1 1 34 11 13 o 1.425000  0.4371000     1.401000  0.5798000     1.450000  0.6542000     -0.4944000E-01 0.8742000 
1 1 1 34 11 14 o 1.474000  0.4138000     1.449000  0.5680000     1.499000  0.6021000     -0.4979000E-01 0.8277000 
1 1 1 34 12 0  o 1.720000  0.4753000     1.720000  0.4753000     1.720000  0.4753000     -0.000000      0.000000  
1 1 1 34 12 1  o 2.431000  0.2196000     2.146000  0.3840000     2.716000  0.2129000     -0.5699000     0.4391000 
1 1 1 34 12 2  o 4.528000  0.1359000     4.205000  0.2204000     4.851000  0.1592000     -0.6464000     0.2718000 
1 1 1 34 12 3  o 3.186000  0.1711000     3.302000  0.2232000     3.071000  0.2594000     0.2301000      0.3423000 
1 1 1 34 12 4  f 3.842000  0.2490000     3.746000  0.2710000     3.938000  0.4179000     -0.1925000     0.4981000 
1 1 1 34 12 5  o 1.203000  0.3250000     1.406000  0.4806000     0.9999000 0.4376000     0.4057000      0.6500000 
1 1 1 34 12 6  o 1.173000  0.3488000     1.368000  0.5429000     0.9781000 0.4380000     0.3897000      0.6975000 
1 1 1 34 12 7  o 3.972000  0.2138000     3.923000  0.2695000     4.022000  0.3320000     -0.9868000E-01 0.4276000 
1 1 1 34 12 8  o 1.790000  0.4105000     1.821000  0.5223000     1.760000  0.6334000     0.6137000E-01  0.8210000 
1 1 1 34 12 9  o 3.089000  0.2660000     3.232000  0.3429000     2.945000  0.4068000     0.2877000      0.5321000 
1 1 1 34 12 10 o 1.104000  0.3482000     0.9784000 0.4540000     1.230000  0.5280000     -0.2520000     0.6963000 
1 1 1 34 12 11 o 1.672000  0.4089000     1.635000  0.5674000     1.708000  0.5889000     -0.7238000E-01 0.8178000 
1 1 1 34 12 12 o 1.221000  0.3908000     1.264000  0.5763000     1.178000  0.5281000     0.8617000E-01  0.7817000 
1 1 1 34 12 13 o 1.443000  0.4492000     1.255000  0.5516000     1.632000  0.7092000     -0.3771000     0.8985000 
1 1 1 34 12 14 o 1.684000  0.4309000     1.739000  0.5998000     1.628000  0.6187000     0.1109000      0.8617000 
1 1 1 34 13 0  o 1.456000  0.4849000     1.456000  0.4849000     1.456000  0.4849000     -0.000000      0.000000  
1 1 1 34 13 1  o 2.443000  0.2357000     2.359000  0.3898000     2.528000  0.2651000     -0.1687000     0.4714000 
1 1 1 34 13 2  o 3.295000  0.2122000     3.442000  0.3649000     3.148000  0.2168000     0.2934000      0.4244000 
1 1 1 34 13 3  o 4.820000  0.1534000     4.555000  0.2405000     5.085000  0.1907000     -0.5307000     0.3069000 
1 1 1 34 13 4  o 2.780000  0.2167000     2.681000  0.3081000     2.879000  0.3048000     -0.1984000     0.4334000 
1 1 1 34 13 5  o 4.023000  0.2174000     4.308000  0.2652000     3.739000  0.3446000     0.5693000      0.4348000 
1 1 1 34 13 6  o 3.548000  0.2539000     2.978000  0.4342000     4.117000  0.2632000     -1.139000      0.5078000 
1 1 1 34 13 7  o 2.711000  0.2779000     2.911000  0.3518000     2.512000  0.4302000     0.3995000      0.5558000 
1 1 1 34 13 8  o 4.358000  0.2402000     3.812000  0.3840000     4.904000  0.2888000     -1.092000      0.4804000 
1 1 1 34 13 9  o 1.112000  0.3450000     1.154000  0.4951000     1.069000  0.4805000     0.8531000E-01  0.6900000 
1 1 1 34 13 10 o 1.205000  0.3409000     1.614000  0.5573000     0.7955000 0.3926000     0.8185000      0.6817000 
1 1 1 34 13 11 o 1.668000  0.4185000     1.849000  0.5713000     1.487000  0.6117000     0.3619000      0.8370000 
1 1 1 34 13 12 o 1.190000  0.3661000     1.396000  0.5622000     0.9838000 0.4691000     0.4126000      0.7322000 
1 1 1 34 13 13 o 1.824000  0.4880000     1.515000  0.5846000     2.133000  0.7815000     -0.6180000     0.9760000 
1 1 1 34 13 14 o 1.818000  0.4496000     2.340000  0.6458000     1.296000  0.6257000     1.044000       0.8992000 
1 1 1 34 14 0  o 0.6043000 0.4176000     0.6043000 0.4176000     0.6043000 0.4176000     -0.000000      0.000000  
1 1 1 34 14 1  o 2.348000  0.2914000     2.537000  0.4861000     2.158000  0.3214000     0.3790000      0.5828000 
1 1 1 34 14 2  o 3.663000  0.1766000     3.481000  0.3017000     3.845000  0.1835000     -0.3634000     0.3531000 
1 1 1 34 14 3  o 1.377000  0.3278000     1.307000  0.5077000     1.448000  0.4147000     -0.1404000     0.6555000 
1 1 1 34 14 4  o 0.9007000 0.3016000     0.7489000 0.3610000     1.053000  0.4833000     -0.3036000     0.6032000 
1 1 1 34 14 5  o 2.586000  0.3180000     2.460000  0.5224000     2.713000  0.3627000     -0.2530000     0.6360000 
1 1 1 34 14 6  o 3.844000  0.1941000     3.677000  0.2769000     4.011000  0.2720000     -0.3340000     0.3881000 
1 1 1 34 14 7  o 1.697000  0.3833000     1.863000  0.5097000     1.531000  0.5727000     0.3324000      0.7667000 
1 1 1 34 14 8  o 1.373000  0.3584000     1.742000  0.5460000     1.005000  0.4644000     0.7367000      0.7168000 
1 1 1 34 14 9  o 4.469000  0.2058000     4.424000  0.2803000     4.514000  0.3014000     -0.9014000E-01 0.4116000 
1 1 1 34 14 10 o 1.091000  0.3472000     1.062000  0.4778000     1.119000  0.5039000     -0.5775000E-01 0.6944000 
1 1 1 34 14 11 o 1.877000  0.4637000     1.991000  0.6644000     1.764000  0.6470000     0.2270000      0.9274000 
1 1 1 34 14 12 o 1.406000  0.3994000     1.568000  0.5846000     1.243000  0.5443000     0.3250000      0.7987000 
1 1 1 34 14 13 o 1.103000  0.3614000     1.098000  0.5014000     1.107000  0.5205000     -0.9376000E-02 0.7227000 
1 1 1 34 15 0  o 1.789000  0.6221000     1.789000  0.6221000     1.789000  0.6221000     0.000000       0.000000  
1 1 1 34 15 1  o 4.774000  0.1435000     4.681000  0.2117000     4.867000  0.1939000     -0.1860000     0.2871000 
1 1 1 34 15 2  o 1.761000  0.3558000     1.638000  0.5659000     1.885000  0.4313000     -0.2476000     0.7115000 
1 1 1 34 15 3  o 1.990000  0.3206000     1.514000  0.5768000     2.467000  0.2802000     -0.9532000     0.6412000 
1 1 1 34 15 4  o 1.096000  0.3428000     1.207000  0.5251000     0.9849000 0.4408000     0.2223000      0.6855000 
1 1 1 34 15 5  o 2.954000  0.2701000     3.202000  0.3706000     2.706000  0.3930000     0.4960000      0.5402000 
1 1 1 34 15 6  o 2.387000  0.3089000     2.702000  0.3609000     2.073000  0.5014000     0.6287000      0.6177000 
1 1 1 34 15 7  o 1.391000  0.3822000     1.573000  0.5383000     1.209000  0.5426000     0.3643000      0.7643000 
1 1 1 34 15 8  o 1.659000  0.3963000     1.655000  0.5517000     1.662000  0.5691000     -0.6541000E-02 0.7926000 
1 1 1 34 15 9  f 2.160000  0.3714000     2.552000  0.4532000     1.769000  0.5885000     0.7833000      0.7428000 
1 1 1 34 15 10 o 1.350000  0.3705000     1.645000  0.5571000     1.056000  0.4885000     0.5889000      0.7410000 
1 1 1 34 15 11 o 2.247000  0.4516000     1.581000  0.7508000     2.913000  0.5020000     -1.332000      0.9032000 
1 1 1 34 15 12 o 1.759000  0.4326000     1.709000  0.5908000     1.809000  0.6321000     -0.1003000     0.8652000 
1 1 1 34 15 13 o 1.077000  0.3537000     1.148000  0.5183000     1.006000  0.4814000     0.1417000      0.7073000 
1 1 1 34 16 0  o 9.947000  0.1899000     9.947000  0.1899000     9.947000  0.1899000     0.000000       0.000000  
1 1 1 34 16 1  o 2.665000  0.2586000     2.728000  0.3510000     2.602000  0.3798000     0.1259000      0.5171000 
1 1 1 34 16 2  o 2.022000  0.3060000     1.401000  0.4860000     2.644000  0.3720000     -1.243000      0.6120000 
1 1 1 34 16 3  o 4.380000  0.2338000     3.958000  0.3954000     4.802000  0.2498000     -0.8443000     0.4677000 
1 1 1 34 16 4  o 1.632000  0.3405000     2.158000  0.5275000     1.106000  0.4308000     1.052000       0.6810000 
1 1 1 34 16 5  o 3.174000  0.2561000     3.177000  0.3808000     3.170000  0.3425000     0.7169000E-02  0.5121000 
1 1 1 34 16 6  o 1.543000  0.3499000     1.105000  0.4708000     1.981000  0.5179000     -0.8763000     0.6999000 
1 1 1 34 16 7  o 1.998000  0.3497000     1.302000  0.5233000     2.694000  0.4642000     -1.393000      0.6995000 
1 1 1 34 16 8  o 3.175000  0.2725000     3.195000  0.3734000     3.156000  0.3969000     0.3859000E-01  0.5449000 
1 1 1 34 16 9  o 3.531000  0.2807000     3.854000  0.3228000     3.208000  0.4592000     0.6460000      0.5613000 
1 1 1 34 16 10 o 1.304000  0.3784000     1.561000  0.5684000     1.047000  0.4997000     0.5135000      0.7568000 
1 1 1 34 16 11 o 1.371000  0.4140000     1.603000  0.6427000     1.140000  0.5220000     0.4626000      0.8280000 
1 1 1 34 16 12 o 1.527000  0.4305000     1.585000  0.6059000     1.468000  0.6117000     0.1169000      0.8609000 
1 1 1 34 16 13 o 1.010000  0.3382000     1.043000  0.4873000     0.9783000 0.4690000     0.6437000E-01  0.6764000 
1 1 1 34 17 0  o 1.270000  0.5829000     1.270000  0.5829000     1.270000  0.5829000     0.000000       0.000000  
1 1 1 34 17 1  o 3.805000  0.1707000     3.845000  0.2425000     3.764000  0.2403000     0.8079000E-01  0.3414000 
1 1 1 34 17 2  o 1.073000  0.3121000     0.9873000 0.4261000     1.159000  0.4562000     -0.1716000     0.6243000 
1 1 1 34 17 3  o 2.420000  0.2451000     2.813000  0.3115000     2.027000  0.3784000     0.7868000      0.4901000 
1 1 1 34 17 4  o 1.374000  0.3134000     0.9686000 0.4524000     1.779000  0.4338000     -0.8102000     0.6268000 
1 1 1 34 17 5  o 1.205000  0.3451000     1.379000  0.5406000     1.031000  0.4290000     0.3489000      0.6901000 
1 1 1 34 17 6  o 1.748000  0.3793000     1.400000  0.5098000     2.097000  0.5618000     -0.6979000     0.7587000 
1 1 1 34 17 7  o 4.168000  0.2404000     3.793000  0.3790000     4.543000  0.2958000     -0.7504000     0.4807000 
1 1 1 34 17 8  o 2.568000  0.3388000     1.933000  0.5466000     3.204000  0.4005000     -1.271000      0.6776000 
1 1 1 34 17 9  o 2.738000  0.3623000     2.596000  0.4713000     2.880000  0.5504000     -0.2834000     0.7247000 
1 1 1 34 17 10 o 1.267000  0.3925000     1.174000  0.5172000     1.360000  0.5905000     -0.1856000     0.7850000 
1 1 1 34 17 11 o 1.076000  0.3494000     1.250000  0.5433000     0.9019000 0.4394000     0.3483000      0.6988000 
1 1 1 34 17 12 o 1.629000  0.4481000     1.897000  0.6324000     1.360000  0.6350000     0.5366000      0.8962000 
1 1 1 34 17 13 o 1.093000  0.3578000     0.9907000 0.4708000     1.196000  0.5389000     -0.2053000     0.7156000 
1 1 1 34 18 0  o 3.753000  0.2487000     3.753000  0.2487000     3.753000  0.2487000     -0.000000      0.000000  
1 1 1 34 18 1  o 2.961000  0.2245000     2.568000  0.3596000     3.353000  0.2688000     -0.7849000     0.4490000 
1 1 1 34 18 2  o 2.483000  0.2556000     2.242000  0.4033000     2.725000  0.3143000     -0.4829000     0.5113000 
1 1 1 34 18 3  o 1.244000  0.3329000     1.297000  0.4775000     1.191000  0.4640000     0.1058000      0.6658000 
1 1 1 34 18 4  o 1.287000  0.3549000     1.602000  0.5713000     0.9708000 0.4214000     0.6316000      0.7099000 
1 1 1 34 18 5  o 1.639000  0.3323000     1.226000  0.5264000     2.051000  0.4055000     -0.8243000     0.6645000 
1 1 1 34 18 6  o 4.102000  0.2624000     4.413000  0.3711000     3.790000  0.3710000     0.6227000      0.5247000 
1 1 1 34 18 7  f 2.656000  0.3064000     2.411000  0.4422000     2.902000  0.4243000     -0.4907000     0.6128000 
1 1 1 34 18 8  o 1.538000  0.3985000     1.523000  0.5504000     1.553000  0.5765000     -0.2946000E-01 0.7970000 
1 1 1 34 18 9  o 1.265000  0.3762000     1.330000  0.5366000     1.200000  0.5274000     0.1301000      0.7524000 
1 1 1 34 18 10 o 0.9950000 0.3400000     1.061000  0.5120000     0.9288000 0.4474000     0.1324000      0.6799000 
1 1 1 34 18 11 o 1.255000  0.3828000     1.408000  0.5729000     1.102000  0.5079000     0.3056000      0.7656000 
1 1 1 34 18 12 o 1.433000  0.4452000     1.421000  0.5972000     1.444000  0.6604000     -0.2273000E-01 0.8904000 
1 1 1 34 18 13 o 1.399000  0.4380000     1.421000  0.6103000     1.378000  0.6284000     0.4241000E-01  0.8760000 
1 1 1 34 19 0  o 5.210000  0.2055000     5.210000  0.2055000     5.210000  0.2055000     -0.000000      0.000000  
1 1 1 34 19 1  o 7.456000  0.1297000     7.609000  0.1827000     7.304000  0.1842000     0.3045000      0.2594000 
1 1 1 34 19 2  o 1.142000  0.3228000     1.349000  0.4918000     0.9347000 0.4184000     0.4140000      0.6457000 
1 1 1 34 19 3  o 2.442000  0.2723000     2.080000  0.4413000     2.805000  0.3193000     -0.7248000     0.5447000 
1 1 1 34 19 4  o 2.360000  0.2845000     2.333000  0.4101000     2.388000  0.3944000     -0.5561000E-01 0.5690000 
1 1 1 34 19 5  o 1.820000  0.3732000     1.721000  0.5766000     1.919000  0.4741000     -0.1977000     0.7464000 
1 1 1 34 19 6  o 2.072000  0.3667000     1.998000  0.5976000     2.145000  0.4251000     -0.1463000     0.7333000 
1 1 1 34 19 7  o 3.032000  0.2689000     3.039000  0.3587000     3.025000  0.4007000     0.1381000E-01  0.5378000 
1 1 1 34 19 8  o 2.708000  0.3379000     2.019000  0.5514000     3.398000  0.3906000     -1.379000      0.6757000 
1 1 1 34 19 9  f 2.901000  0.3684000     2.985000  0.4138000     2.817000  0.6097000     0.1682000      0.7368000 
1 1 1 34 19 10 o 1.523000  0.4085000     1.159000  0.5390000     1.888000  0.6141000     -0.7294000     0.8171000 
1 1 1 34 19 11 f 1.624000  0.4247000     1.647000  0.6008000     1.602000  0.6004000     0.4499000E-01  0.8494000 
1 1 1 34 19 12 o 1.207000  0.3892000     1.105000  0.5115000     1.310000  0.5869000     -0.2046000     0.7785000 
1 1 1 34 20 0  o 1.701000  0.5832000     1.701000  0.5832000     1.701000  0.5832000     -0.000000      0.000000  
1 1 1 34 20 1  o 3.192000  0.2156000     3.208000  0.2981000     3.176000  0.3117000     0.3238000E-01  0.4313000 
1 1 1 34 20 2  o 4.271000  0.1741000     4.103000  0.2558000     4.439000  0.2363000     -0.3364000     0.3482000 
1 1 1 34 20 3  o 1.541000  0.3493000     1.345000  0.5092000     1.737000  0.4783000     -0.3924000     0.6986000 
1 1 1 34 20 4  o 1.038000  0.3109000     1.280000  0.4915000     0.7968000 0.3807000     0.4833000      0.6217000 
1 1 1 34 20 5  o 4.152000  0.2433000     4.358000  0.3793000     3.946000  0.3049000     0.4115000      0.4866000 
1 1 1 34 20 6  o 1.932000  0.3838000     2.020000  0.5976000     1.844000  0.4817000     0.1766000      0.7676000 
1 1 1 34 20 7  o 1.657000  0.3626000     2.298000  0.5694000     1.017000  0.4491000     1.280000       0.7252000 
1 1 1 34 20 8  o 1.482000  0.3992000     1.557000  0.5615000     1.408000  0.5676000     0.1482000      0.7984000 
1 1 1 34 20 9  o 1.688000  0.4303000     1.379000  0.6041000     1.997000  0.6130000     -0.6178000     0.8607000 
1 1 1 34 20 10 o 1.562000  0.4003000     1.140000  0.5137000     1.984000  0.6141000     -0.8443000     0.8006000 
1 1 1 34 20 11 o 1.166000  0.3788000     1.080000  0.5004000     1.252000  0.5687000     -0.1726000     0.7575000 
1 1 1 34 20 12 o 1.457000  0.4217000     1.433000  0.5899000     1.482000  0.6028000     -0.4875000E-01 0.8434000 
1 1 1 34 21 0  o 6.221000  0.2053000     6.221000  0.2053000     6.221000  0.2053000     -0.000000      0.000000  
1 1 1 34 21 1  o 5.023000  0.1564000     5.018000  0.2193000     5.027000  0.2231000     -0.8870000E-02 0.3129000 
1 1 1 34 21 2  o 2.025000  0.3312000     1.813000  0.5065000     2.236000  0.4268000     -0.4236000     0.6624000 
1 1 1 34 21 3  o 1.327000  0.3363000     1.690000  0.5152000     0.9651000 0.4325000     0.7245000      0.6727000 
1 1 1 34 21 4  o 1.692000  0.3893000     1.820000  0.5939000     1.565000  0.5036000     0.2554000      0.7787000 
1 1 1 34 21 5  o 2.782000  0.2853000     3.066000  0.3637000     2.497000  0.4396000     0.5686000      0.5705000 
1 1 1 34 21 6  o 2.423000  0.3455000     2.353000  0.5698000     2.494000  0.3909000     -0.1416000     0.6910000 
1 1 1 34 21 7  o 2.525000  0.3450000     2.643000  0.5493000     2.407000  0.4174000     0.2361000      0.6900000 
1 1 1 34 21 8  o 1.694000  0.4220000     1.189000  0.5389000     2.200000  0.6495000     -1.012000      0.8439000 
1 1 1 34 21 9  o 1.516000  0.4311000     1.529000  0.6268000     1.502000  0.5921000     0.2696000E-01  0.8623000 
1 1 1 34 21 10 o 1.747000  0.4078000     2.155000  0.5766000     1.340000  0.5768000     0.8150000      0.8156000 
1 1 1 34 21 11 o 2.050000  0.3972000     2.878000  0.5228000     1.221000  0.5981000     1.658000       0.7943000 
1 1 1 34 21 12 o 1.807000  0.4514000     1.865000  0.6361000     1.750000  0.6405000     0.1152000      0.9027000 
1 1 1 34 22 0  o 2.493000  0.4454000     2.493000  0.4454000     2.493000  0.4454000     -0.000000      0.000000  
1 1 1 34 22 1  o 1.569000  0.3029000     2.227000  0.4332000     0.9123000 0.4235000     1.314000       0.6058000 
1 1 1 34 22 2  o 2.410000  0.2969000     2.626000  0.3958000     2.193000  0.4427000     0.4327000      0.5939000 
1 1 1 34 22 3  o 2.495000  0.3352000     2.019000  0.5790000     2.970000  0.3377000     -0.9511000     0.6703000 
1 1 1 34 22 4  o 4.499000  0.2015000     4.512000  0.2948000     4.486000  0.2748000     0.2604000E-01  0.4030000 
1 1 1 34 22 5  o 1.450000  0.3668000     1.577000  0.5271000     1.323000  0.5103000     0.2542000      0.7337000 
1 1 1 34 22 6  o 2.219000  0.3219000     2.627000  0.4114000     1.811000  0.4953000     0.8153000      0.6439000 
1 1 1 34 22 7  o 2.383000  0.3739000     2.582000  0.5474000     2.185000  0.5096000     0.3968000      0.7479000 
1 1 1 34 22 8  o 1.723000  0.3939000     1.050000  0.5074000     2.396000  0.6026000     -1.346000      0.7878000 
1 1 1 34 22 9  o 2.192000  0.4144000     2.124000  0.5799000     2.260000  0.5921000     -0.1360000     0.8287000 
1 1 1 34 22 10 o 2.074000  0.4240000     2.362000  0.5770000     1.786000  0.6215000     0.5761000      0.8480000 
1 1 1 34 22 11 o 1.545000  0.4348000     1.841000  0.6393000     1.249000  0.5896000     0.5926000      0.8697000 
1 1 1 34 22 12 o 1.201000  0.5975000     1.201000  0.5975000     ?         ?             ?              ?         
1 1 1 34 23 0  o 7.021000  0.2066000     7.021000  0.2066000     7.021000  0.2066000     -0.000000      0.000000  
1 1 1 34 23 1  o 3.120000  0.2406000     2.970000  0.3569000     3.270000  0.3229000     -0.3001000     0.4813000 
1 1 1 34 23 2  o 3.240000  0.2315000     3.384000  0.3193000     3.097000  0.3353000     0.2873000      0.4630000 
1 1 1 34 23 3  o 3.048000  0.3021000     3.274000  0.4205000     2.821000  0.4339000     0.4534000      0.6042000 
1 1 1 34 23 4  o 2.602000  0.3086000     2.324000  0.4767000     2.880000  0.3919000     -0.5559000     0.6171000 
1 1 1 34 23 5  o 2.245000  0.3387000     2.554000  0.4304000     1.936000  0.5230000     0.6179000      0.6773000 
1 1 1 34 23 6  o 1.609000  0.3813000     1.849000  0.5207000     1.368000  0.5572000     0.4811000      0.7626000 
1 1 1 34 23 7  o 2.042000  0.3956000     1.748000  0.6532000     2.336000  0.4465000     -0.5872000     0.7912000 
1 1 1 34 23 8  o 1.341000  0.4039000     1.403000  0.6300000     1.280000  0.5055000     0.1230000      0.8078000 
1 1 1 34 23 9  o 2.264000  0.4438000     2.619000  0.6308000     1.908000  0.6245000     0.7108000      0.8876000 
1 1 1 34 23 10 o 1.496000  0.4287000     1.352000  0.5651000     1.640000  0.6448000     -0.2883000     0.8574000 
1 1 1 34 23 11 o 1.531000  0.4337000     1.339000  0.5660000     1.722000  0.6573000     -0.3831000     0.8674000 
1 1 1 34 24 0  o 0.5748000 0.4083000     0.5748000 0.4083000     0.5748000 0.4083000     -0.000000      0.000000  
1 1 1 34 24 1  o 2.033000  0.3905000     1.946000  0.6060000     2.120000  0.4928000     -0.1743000     0.7810000 
1 1 1 34 24 2  o 1.226000  0.3692000     1.104000  0.5071000     1.348000  0.5366000     -0.2435000     0.7383000 
1 1 1 34 24 3  f 3.553000  0.2602000     2.996000  0.4167000     4.111000  0.3118000     -1.115000      0.5204000 
1 1 1 34 24 4  o 3.367000  0.2453000     3.426000  0.3522000     3.307000  0.3415000     0.1184000      0.4906000 
1 1 1 34 24 5  o 1.517000  0.3877000     1.702000  0.5453000     1.331000  0.5514000     0.3711000      0.7755000 
1 1 1 34 24 6  f 1.127000  0.3548000     1.105000  0.4923000     1.148000  0.5110000     -0.4313000E-01 0.7095000 
1 1 1 34 24 7  o 3.126000  0.3412000     3.180000  0.4426000     3.073000  0.5194000     0.1064000      0.6824000 
1 1 1 34 24 8  o 1.751000  0.4090000     1.617000  0.6234000     1.885000  0.5296000     -0.2679000     0.8180000 
1 1 1 34 24 9  o 4.267000  0.2549000     4.152000  0.4289000     4.382000  0.2755000     -0.2303000     0.5098000 
1 1 1 34 24 10 o 2.125000  0.4484000     2.690000  0.5799000     1.560000  0.6841000     1.130000       0.8968000 
1 1 1 34 24 11 o 1.255000  0.3897000     1.362000  0.5726000     1.148000  0.5288000     0.2135000      0.7794000 
1 1 1 34 25 0  f 0.8797000 0.5776000     0.8797000 0.5776000     0.8797000 0.5776000     0.000000       0.000000  
1 1 1 34 25 1  o 2.419000  0.3890000     1.813000  0.5382000     3.025000  0.5619000     -1.212000      0.7781000 
1 1 1 34 25 2  o 1.527000  0.4242000     1.525000  0.5783000     1.528000  0.6208000     -0.3271000E-02 0.8484000 
1 1 1 34 25 3  o 1.198000  0.3642000     1.066000  0.4756000     1.329000  0.5516000     -0.2629000     0.7283000 
1 1 1 34 25 4  o 2.030000  0.3774000     1.493000  0.5498000     2.567000  0.5171000     -1.073000      0.7548000 
1 1 1 34 25 5  o 1.578000  0.3971000     1.702000  0.5717000     1.453000  0.5513000     0.2495000      0.7942000 
1 1 1 34 25 6  o 1.455000  0.4046000     1.712000  0.6017000     1.197000  0.5410000     0.5152000      0.8092000 
1 1 1 34 25 7  o 0.8567000 0.2918000     0.8332000 0.4049000     0.8801000 0.4205000     -0.4695000E-01 0.5837000 
1 1 1 34 25 8  f 2.690000  0.3585000     2.837000  0.5670000     2.543000  0.4389000     0.2933000      0.7171000 
1 1 1 34 25 9  o 2.064000  0.3926000     1.616000  0.6361000     2.513000  0.4604000     -0.8972000     0.7852000 
1 1 1 34 25 10 o 1.794000  0.5055000     1.787000  0.7111000     1.800000  0.7187000     -0.1310000E-01 1.011000  
1 1 1 34 26 0  o 3.091000  0.5734000     3.091000  0.5734000     3.091000  0.5734000     0.000000       0.000000  
1 1 1 34 26 1  o 2.733000  0.3817000     2.571000  0.5983000     2.895000  0.4742000     -0.3242000     0.7634000 
1 1 1 34 26 2  o 1.114000  0.3504000     1.155000  0.5095000     1.073000  0.4813000     0.8165000E-01  0.7009000 
1 1 1 34 26 3  o 2.125000  0.4176000     2.084000  0.5638000     2.167000  0.6162000     -0.8297000E-01 0.8352000 
1 1 1 34 26 4  f 3.156000  0.3270000     3.405000  0.3931000     2.908000  0.5225000     0.4967000      0.6539000 
1 1 1 34 26 5  o 1.837000  0.4203000     1.393000  0.5632000     2.281000  0.6240000     -0.8875000     0.8406000 
1 1 1 34 26 6  o 1.451000  0.3839000     1.598000  0.5517000     1.304000  0.5339000     0.2936000      0.7677000 
1 1 1 34 26 7  o 1.527000  0.3819000     1.243000  0.5201000     1.812000  0.5593000     -0.5686000     0.7637000 
1 1 1 34 26 8  f 1.248000  0.3680000     1.427000  0.5553000     1.068000  0.4831000     0.3592000      0.7360000 
1 1 1 34 26 9  o 1.398000  0.4110000     1.487000  0.6203000     1.308000  0.5392000     0.1785000      0.8219000 
1 1 1 34 26 10 o 3.512000  0.3280000     3.594000  0.5361000     3.430000  0.3783000     0.1639000      0.6561000 
1 1 1 34 27 0  o 2.514000  0.6080000     2.514000  0.6080000     2.514000  0.6080000     0.000000       0.000000  
1 1 1 34 27 1  o 2.726000  0.3457000     2.571000  0.5459000     2.881000  0.4243000     -0.3099000     0.6914000 
1 1 1 34 27 2  o 1.435000  0.4085000     1.370000  0.5611000     1.500000  0.5938000     -0.1303000     0.8169000 
1 1 1 34 27 3  o 2.110000  0.4058000     1.895000  0.6122000     2.326000  0.5327000     -0.4307000     0.8115000 
1 1 1 34 27 4  o 1.907000  0.3821000     1.465000  0.5784000     2.348000  0.4994000     -0.8830000     0.7641000 
1 1 1 34 27 5  o 1.579000  0.3895000     1.371000  0.5411000     1.788000  0.5605000     -0.4166000     0.7790000 
1 1 1 34 27 6  o 2.003000  0.3747000     1.502000  0.5598000     2.503000  0.4983000     -1.001000      0.7495000 
1 1 1 34 27 7  o 0.8661000 0.2957000     0.7777000 0.3852000     0.9545000 0.4487000     -0.1768000     0.5913000 
1 1 1 34 27 8  o 1.396000  0.3884000     1.310000  0.5381000     1.482000  0.5604000     -0.1722000     0.7769000 
1 1 1 34 27 9  o 3.551000  0.3624000     3.418000  0.6215000     3.685000  0.3728000     -0.2663000     0.7247000 
1 1 1 34 27 10 o 1.455000  0.6973000     ?         ?             1.455000  0.6973000     ?              ?         
1 1 1 34 28 0  o 0.7335000 0.5011000     0.7335000 0.5011000     0.7335000 0.5011000     0.000000       0.000000  
1 1 1 34 28 1  o 2.399000  0.3636000     2.238000  0.5357000     2.560000  0.4918000     -0.3226000     0.7272000 
1 1 1 34 28 2  o 1.663000  0.3981000     1.455000  0.5544000     1.870000  0.5714000     -0.4144000     0.7961000 
1 1 1 34 28 3  f 1.566000  0.4011000     1.449000  0.5642000     1.683000  0.5702000     -0.2337000     0.8021000 
1 1 1 34 28 4  o 2.530000  0.3383000     2.675000  0.4540000     2.385000  0.5017000     0.2900000      0.6767000 
1 1 1 34 28 5  o 4.395000  0.2123000     4.553000  0.2926000     4.236000  0.3078000     0.3172000      0.4247000 
1 1 1 34 28 6  o 2.748000  0.3271000     2.296000  0.5199000     3.201000  0.3972000     -0.9044000     0.6543000 
1 1 1 34 28 7  o 2.996000  0.3245000     2.313000  0.5414000     3.678000  0.3578000     -1.365000      0.6489000 
1 1 1 34 28 8  o 2.567000  0.3946000     2.681000  0.6186000     2.454000  0.4899000     0.2271000      0.7891000 
1 1 1 34 28 9  o 1.123000  0.3589000     0.9701000 0.4607000     1.275000  0.5504000     -0.3051000     0.7177000 
1 1 1 34 29 0  o 1.476000  0.7006000     1.476000  0.7006000     1.476000  0.7006000     0.000000       0.000000  
1 1 1 34 29 1  o 2.367000  0.3594000     3.014000  0.4233000     1.719000  0.5808000     1.295000       0.7187000 
1 1 1 34 29 2  o 1.785000  0.4009000     1.866000  0.5573000     1.703000  0.5764000     0.1635000      0.8018000 
1 1 1 34 29 3  o 2.169000  0.3845000     2.126000  0.5502000     2.212000  0.5373000     -0.8651000E-01 0.7690000 
1 1 1 34 29 4  o 1.262000  0.3740000     1.206000  0.5129000     1.318000  0.5444000     -0.1112000     0.7480000 
1 1 1 34 29 5  o 1.394000  0.3901000     1.374000  0.5502000     1.414000  0.5532000     -0.4028000E-01 0.7803000 
1 1 1 34 29 6  o 2.849000  0.3128000     2.596000  0.4778000     3.102000  0.4039000     -0.5063000     0.6256000 
1 1 1 34 29 7  o 1.182000  0.3580000     1.387000  0.5480000     0.9763000 0.4608000     0.4108000      0.7160000 
1 1 1 34 29 8  o 1.115000  0.3591000     1.246000  0.5429000     0.9837000 0.4702000     0.2621000      0.7182000 
1 1 1 34 30 0  o 0.9806000 0.6063000     0.9806000 0.6063000     0.9806000 0.6063000     -0.000000      0.000000  
1 1 1 34 30 1  o 0.8785000 0.2999000     0.8129000 0.3990000     0.9441000 0.4478000     -0.1311000     0.5998000 
1 1 1 34 30 2  o 2.876000  0.3176000     2.733000  0.4689000     3.018000  0.4284000     -0.2849000     0.6352000 
1 1 1 34 30 3  o 1.440000  0.3896000     1.235000  0.5258000     1.646000  0.5751000     -0.4114000     0.7792000 
1 1 1 34 30 4  o 1.100000  0.3510000     0.9880000 0.4658000     1.212000  0.5253000     -0.2244000     0.7020000 
1 1 1 34 30 5  o 2.276000  0.3770000     2.518000  0.5008000     2.034000  0.5638000     0.4836000      0.7541000 
1 1 1 34 30 6  o 1.828000  0.4050000     1.616000  0.5726000     2.040000  0.5730000     -0.4234000     0.8100000 
1 1 1 34 30 7  o 1.620000  0.4307000     1.511000  0.6324000     1.730000  0.5850000     -0.2183000     0.8615000 
1 1 1 34 30 8  o 0.9914000 0.3311000     0.9702000 0.4590000     1.013000  0.4774000     -0.4257000E-01 0.6623000 
1 1 1 34 31 0  o 1.950000  0.7061000     1.950000  0.7061000     1.950000  0.7061000     0.000000       0.000000  
1 1 1 34 31 1  o 1.370000  0.3904000     1.281000  0.5358000     1.460000  0.5679000     -0.1789000     0.7808000 
1 1 1 34 31 2  f 1.271000  0.3767000     1.397000  0.5540000     1.146000  0.5105000     0.2516000      0.7534000 
1 1 1 34 31 3  o 3.723000  0.2614000     3.968000  0.3411000     3.479000  0.3961000     0.4893000      0.5227000 
1 1 1 34 31 4  o 2.371000  0.3798000     2.534000  0.5125000     2.208000  0.5606000     0.3264000      0.7596000 
1 1 1 34 31 5  f 1.076000  0.3449000     1.145000  0.5051000     1.007000  0.4697000     0.1375000      0.6898000 
1 1 1 34 31 6  o 1.134000  0.3677000     1.366000  0.5924000     0.9024000 0.4358000     0.4638000      0.7354000 
1 1 1 34 31 7  o 1.498000  0.4212000     1.361000  0.5734000     1.636000  0.6170000     -0.2751000     0.8423000 
1 1 1 34 32 0  o 2.061000  0.7071000     2.061000  0.7071000     2.061000  0.7071000     0.000000       0.000000  
1 1 1 34 32 1  o 3.612000  0.2711000     3.984000  0.3482000     3.240000  0.4157000     0.7438000      0.5423000 
1 1 1 34 32 2  o 2.866000  0.3321000     2.419000  0.5268000     3.314000  0.4045000     -0.8950000     0.6642000 
1 1 1 34 32 3  o 1.248000  0.3759000     1.092000  0.4943000     1.404000  0.5664000     -0.3116000     0.7518000 
1 1 1 34 32 4  o 1.806000  0.4076000     2.265000  0.5704000     1.347000  0.5825000     0.9176000      0.8152000 
1 1 1 34 32 5  o 0.9445000 0.3185000     1.046000  0.4835000     0.8430000 0.4149000     0.2030000      0.6371000 
1 1 1 34 32 6  o 1.486000  0.4264000     1.243000  0.5681000     1.728000  0.6360000     -0.4850000     0.8528000 
1 1 1 34 33 0  o 0.8559000 0.5651000     0.8559000 0.5651000     0.8559000 0.5651000     -0.000000      0.000000  
1 1 1 34 33 1  o 1.595000  0.4151000     1.449000  0.5830000     1.741000  0.5911000     -0.2924000     0.8302000 
1 1 1 34 33 2  o 1.466000  0.4074000     1.563000  0.5877000     1.369000  0.5644000     0.1948000      0.8149000 
1 1 1 34 33 3  o 1.935000  0.4036000     2.307000  0.5527000     1.563000  0.5884000     0.7440000      0.8073000 
1 1 1 34 33 4  o 1.708000  0.4137000     1.354000  0.5665000     2.062000  0.6032000     -0.7079000     0.8275000 
1 1 1 34 33 5  o 1.137000  0.3708000     1.031000  0.4959000     1.243000  0.5513000     -0.2122000     0.7416000 
1 1 1 34 33 6  o 2.332000  0.4579000     3.003000  0.5873000     1.661000  0.7028000     1.342000       0.9159000 
1 1 1 34 34 0  o 1.230000  0.6917000     1.230000  0.6917000     1.230000  0.6917000     0.000000       0.000000  
1 1 1 34 34 1  o 1.898000  0.4264000     1.769000  0.6075000     2.027000  0.5986000     -0.2584000     0.8528000 
1 1 1 34 34 2  o 1.110000  0.3575000     0.9980000 0.4717000     1.222000  0.5374000     -0.2241000     0.7150000 
1 1 1 34 34 3  o 1.356000  0.3970000     1.537000  0.5915000     1.175000  0.5297000     0.3620000      0.7940000 
1 1 1 34 34 4  o 1.678000  0.4158000     2.296000  0.6688000     1.060000  0.4943000     1.236000       0.8316000 
1 1 1 34 34 5  o 2.312000  0.4673000     2.939000  0.5466000     1.685000  0.7582000     1.254000       0.9347000 
1 1 1 34 35 0  o 2.100000  0.7279000     2.100000  0.7279000     2.100000  0.7279000     0.000000       0.000000  
1 1 1 34 35 1  o 1.335000  0.3998000     1.413000  0.5810000     1.257000  0.5494000     0.1561000      0.7997000 
1 1 1 34 35 2  o 2.049000  0.3780000     1.300000  0.5589000     2.797000  0.5090000     -1.497000      0.7559000 
1 1 1 34 35 3  o 1.496000  0.4379000     1.527000  0.6332000     1.466000  0.6050000     0.6113000E-01  0.8758000 
1 1 1 34 36 0  o 0.9786000 0.6436000     0.9786000 0.6436000     0.9786000 0.6436000     0.000000       0.000000  
1 1 1 34 36 1  o 2.163000  0.4935000     1.726000  0.7344000     2.599000  0.6593000     -0.8728000     0.9869000 
1 1 1 35 0  3  o 0.9219000 0.5259000     0.9219000 0.5259000     0.9219000 0.5259000     0.000000       0.000000  
1 1 1 35 0  4  o 1.013000  0.5790000     1.013000  0.5790000     1.013000  0.5790000     0.000000       0.000000  
1 1 1 35 0  5  o 0.5699000 0.4063000     0.5699000 0.4063000     0.5699000 0.4063000     0.000000       0.000000  
1 1 1 35 0  6  o 1.188000  0.6697000     1.188000  0.6697000     1.188000  0.6697000     -0.000000      0.000000  
1 1 1 35 0  7  o 0.9232000 0.4775000     0.9232000 0.4775000     0.9232000 0.4775000     0.000000       0.000000  
1 1 1 35 0  8  o 5.585000  0.1673000     5.585000  0.1673000     5.585000  0.1673000     -0.000000      0.000000  
1 1 1 35 0  9  o 4.921000  0.2460000     4.921000  0.2460000     4.921000  0.2460000     0.000000       0.000000  
1 1 1 35 0  10 o 2.755000  0.3455000     2.755000  0.3455000     2.755000  0.3455000     0.000000       0.000000  
1 1 1 35 0  11 o 1.168000  0.6005000     1.168000  0.6005000     1.168000  0.6005000     0.000000       0.000000  
1 1 1 35 0  12 o 0.5476000 0.3902000     0.5476000 0.3902000     0.5476000 0.3902000     0.000000       0.000000  
1 1 1 35 0  13 o 0.8247000 0.5826000     0.8247000 0.5826000     0.8247000 0.5826000     0.000000       0.000000  
1 1 1 35 1  3  o 1.829000  0.3026000     1.924000  0.4080000     1.733000  0.4469000     0.1909000      0.6051000 
1 1 1 35 1  4  o 1.494000  0.3639000     1.365000  0.5057000     1.624000  0.5233000     -0.2589000     0.7277000 
1 1 1 35 1  5  o 2.547000  0.3141000     2.652000  0.4333000     2.442000  0.4550000     0.2101000      0.6282000 
1 1 1 35 1  6  o 1.807000  0.4018000     1.996000  0.5505000     1.618000  0.5855000     0.3786000      0.8037000 
1 1 1 35 1  7  o 4.004000  0.1209000     4.119000  0.1693000     3.889000  0.1727000     0.2298000      0.2418000 
1 1 1 35 1  8  o 1.172000  0.3042000     1.475000  0.4726000     0.8692000 0.3831000     0.6058000      0.6083000 
1 1 1 35 1  9  o 1.635000  0.3456000     1.275000  0.5023000     1.994000  0.4749000     -0.7196000     0.6913000 
1 1 1 35 1  10 o 0.9374000 0.2970000     1.071000  0.4555000     0.8040000 0.3811000     0.2668000      0.5939000 
1 1 1 35 1  11 o 2.080000  0.3274000     2.025000  0.4808000     2.136000  0.4446000     -0.1113000     0.6549000 
1 1 1 35 1  12 o 1.563000  0.3756000     1.820000  0.4812000     1.305000  0.5767000     0.5155000      0.7511000 
1 1 1 35 1  13 o 1.600000  0.4853000     1.719000  0.7103000     1.481000  0.6614000     0.2374000      0.9706000 
1 1 1 35 2  3  o 1.608000  0.3226000     1.602000  0.4430000     1.614000  0.4692000     -0.1205000E-01 0.6453000 
1 1 1 35 2  4  o 2.828000  0.2497000     3.014000  0.3244000     2.642000  0.3796000     0.3724000      0.4993000 
1 1 1 35 2  5  o 3.205000  0.2600000     2.754000  0.3993000     3.656000  0.3330000     -0.9018000     0.5199000 
1 1 1 35 2  6  o 3.968000  0.2325000     3.825000  0.3252000     4.110000  0.3324000     -0.2848000     0.4650000 
1 1 1 35 2  7  f 2.394000  0.1844000     2.680000  0.2642000     2.109000  0.2574000     0.5711000      0.3688000 
1 1 1 35 2  8  o 3.424000  0.1708000     3.353000  0.2698000     3.494000  0.2095000     -0.1413000     0.3416000 
1 1 1 35 2  9  o 1.473000  0.3503000     1.257000  0.4987000     1.689000  0.4922000     -0.4326000     0.7007000 
1 1 1 35 2  10 o 1.387000  0.3491000     1.516000  0.5259000     1.258000  0.4592000     0.2580000      0.6982000 
1 1 1 35 2  11 f 1.273000  0.3715000     1.178000  0.4645000     1.369000  0.5799000     -0.1917000     0.7430000 
1 1 1 35 2  12 o 1.358000  0.3896000     1.283000  0.4905000     1.434000  0.6054000     -0.1510000     0.7792000 
1 1 1 35 2  13 o 1.640000  0.4923000     1.273000  0.5989000     2.008000  0.7815000     -0.7351000     0.9846000 
1 1 1 35 3  3  o 1.442000  0.3085000     1.813000  0.4168000     1.071000  0.4550000     0.7421000      0.6170000 
1 1 1 35 3  4  o 3.834000  0.2038000     3.915000  0.2710000     3.754000  0.3046000     0.1612000      0.4077000 
1 1 1 35 3  5  o 2.957000  0.2743000     3.156000  0.3379000     2.758000  0.4321000     0.3989000      0.5485000 
1 1 1 35 3  6  o 2.273000  0.4612000     2.983000  0.7601000     1.564000  0.5225000     1.419000       0.9224000 
1 1 1 35 3  7  o 2.239000  0.2092000     2.463000  0.2995000     2.016000  0.2922000     0.4468000      0.4184000 
1 1 1 35 3  8  o 1.799000  0.3153000     2.388000  0.3764000     1.210000  0.5061000     1.177000       0.6307000 
1 1 1 35 3  9  o 2.040000  0.3340000     1.901000  0.5077000     2.180000  0.4341000     -0.2792000     0.6680000 
1 1 1 35 3  10 o 1.200000  0.3460000     1.249000  0.4815000     1.151000  0.4970000     0.9787000E-01  0.6920000 
1 1 1 35 3  11 o 0.8819000 0.2964000     0.7647000 0.3718000     0.9990000 0.4616000     -0.2344000     0.5927000 
1 1 1 35 3  12 o 1.302000  0.3551000     0.9148000 0.4220000     1.688000  0.5713000     -0.7737000     0.7103000 
1 1 1 35 3  13 o 1.127000  0.3841000     1.234000  0.5849000     1.021000  0.4980000     0.2131000      0.7682000 
1 1 1 35 4  3  o 1.952000  0.3074000     2.199000  0.3609000     1.705000  0.4976000     0.4940000      0.6147000 
1 1 1 35 4  4  o 3.380000  0.2207000     3.446000  0.2798000     3.314000  0.3414000     0.1320000      0.4414000 
1 1 1 35 4  5  o 2.875000  0.4006000     2.188000  0.7519000     3.562000  0.2768000     -1.374000      0.8012000 
1 1 1 35 4  6  o 1.576000  0.4091000     1.952000  0.7527000     1.200000  0.3210000     0.7514000      0.8183000 
1 1 1 35 4  7  o 1.905000  0.2525000     1.953000  0.3845000     1.857000  0.3274000     0.9612000E-01  0.5050000 
1 1 1 35 4  8  o 1.402000  0.3433000     1.146000  0.4646000     1.657000  0.5055000     -0.5111000     0.6865000 
1 1 1 35 4  9  o 3.050000  0.3286000     3.145000  0.2963000     2.955000  0.5867000     0.1894000      0.6573000 
1 1 1 35 4  10 o 1.783000  0.3663000     1.548000  0.5009000     2.018000  0.5346000     -0.4704000     0.7326000 
1 1 1 35 4  11 o 1.855000  0.3694000     1.844000  0.5061000     1.866000  0.5383000     -0.2192000E-01 0.7389000 
1 1 1 35 4  12 o 1.951000  0.3632000     2.325000  0.4482000     1.576000  0.5717000     0.7493000      0.7264000 
1 1 1 35 4  13 o 1.157000  0.3681000     0.9709000 0.4750000     1.342000  0.5624000     -0.3712000     0.7362000 
1 1 1 35 5  2  o 1.767000  0.3981000     ?         ?             1.767000  0.3981000     ?              ?         
1 1 1 35 5  3  o 2.328000  0.2758000     1.724000  0.4360000     2.931000  0.3379000     -1.207000      0.5516000 
1 1 1 35 5  4  o 3.278000  0.3922000     3.479000  0.6127000     3.078000  0.4898000     0.4008000      0.7844000 
1 1 1 35 5  5  o 1.879000  0.4415000     1.903000  0.7230000     1.855000  0.5071000     0.4776000E-01  0.8831000 
1 1 1 35 5  6  o 3.381000  0.1179000     3.316000  0.1794000     3.447000  0.1529000     -0.1315000     0.2357000 
1 1 1 35 5  7  o 1.357000  0.3024000     0.9174000 0.4079000     1.797000  0.4466000     -0.8793000     0.6048000 
1 1 1 35 5  8  o 1.532000  0.3672000     1.456000  0.4552000     1.608000  0.5764000     -0.1519000     0.7344000 
1 1 1 35 5  9  o 1.916000  0.3978000     1.281000  0.4804000     2.551000  0.6342000     -1.269000      0.7956000 
1 1 1 35 5  10 o 1.078000  0.3343000     0.9499000 0.4309000     1.206000  0.5113000     -0.2564000     0.6687000 
1 1 1 35 5  11 o 1.670000  0.3820000     1.490000  0.5188000     1.849000  0.5608000     -0.3582000     0.7640000 
1 1 1 35 5  12 o 2.023000  0.3826000     2.237000  0.4890000     1.808000  0.5887000     0.4287000      0.7653000 
1 1 1 35 5  13 o 1.392000  0.4388000     1.573000  0.6963000     1.211000  0.5343000     0.3618000      0.8777000 
1 1 1 35 6  2  o 1.701000  0.2728000     2.068000  0.2640000     1.334000  0.4776000     0.7343000      0.5457000 
1 1 1 35 6  3  o 2.240000  0.3620000     2.003000  0.6443000     2.476000  0.3303000     -0.4730000     0.7240000 
1 1 1 35 6  4  o 1.201000  0.5517000     ?         ?             1.201000  0.5517000     ?              ?         
1 1 1 35 6  5  o 3.843000  0.3395000     3.601000  0.6206000     4.085000  0.2757000     -0.4838000     0.6791000 
1 1 1 35 6  6  o 4.724000  0.1115000     4.544000  0.1734000     4.905000  0.1400000     -0.3607000     0.2229000 
1 1 1 35 6  7  o 2.480000  0.2248000     2.151000  0.3272000     2.810000  0.3085000     -0.6592000     0.4497000 
1 1 1 35 6  8  f 1.210000  0.3322000     0.7078000 0.3467000     1.712000  0.5667000     -1.004000      0.6643000 
1 1 1 35 6  9  o 1.224000  0.3553000     1.076000  0.4592000     1.372000  0.5422000     -0.2964000     0.7106000 
1 1 1 35 6  10 o 3.033000  0.2580000     3.162000  0.3146000     2.903000  0.4091000     0.2589000      0.5161000 
1 1 1 35 6  11 o 3.324000  0.2520000     3.028000  0.3630000     3.620000  0.3496000     -0.5924000     0.5040000 
1 1 1 35 6  12 o 2.840000  0.3160000     3.307000  0.3470000     2.374000  0.5283000     0.9330000      0.6320000 
1 1 1 35 6  13 o 1.218000  0.3855000     1.052000  0.5254000     1.384000  0.5642000     -0.3315000     0.7709000 
1 1 1 35 7  2  o 2.177000  0.2170000     2.389000  0.2450000     1.964000  0.3582000     0.4254000      0.4340000 
1 1 1 35 7  3  o 3.432000  0.2794000     3.185000  0.4998000     3.680000  0.2501000     -0.4944000     0.5588000 
1 1 1 35 7  4  o 3.016000  0.6864000     ?         ?             3.016000  0.6864000     ?              ?         
1 1 1 35 7  5  o 1.498000  0.4282000     1.493000  0.6681000     1.503000  0.5356000     -0.1001000E-01 0.8563000 
1 1 1 35 7  6  o 3.471000  0.1595000     3.276000  0.2313000     3.665000  0.2195000     -0.3896000     0.3189000 
1 1 1 35 7  7  o 2.969000  0.1998000     3.014000  0.2598000     2.924000  0.3037000     0.8969000E-01  0.3997000 
1 1 1 35 7  8  o 2.280000  0.4752000     2.336000  0.8462000     2.225000  0.4327000     0.1112000      0.9504000 
1 1 1 35 7  9  o 2.830000  0.2812000     3.307000  0.3049000     2.353000  0.4727000     0.9543000      0.5625000 
1 1 1 35 7  10 o 3.905000  0.2160000     3.962000  0.2877000     3.848000  0.3223000     0.1137000      0.4320000 
1 1 1 35 7  11 o 1.210000  0.3632000     1.183000  0.4980000     1.237000  0.5289000     -0.5425000E-01 0.7265000 
1 1 1 35 7  12 o 1.552000  0.3930000     1.135000  0.5338000     1.968000  0.5770000     -0.8333000     0.7860000 
1 1 1 35 7  13 o 1.471000  0.4316000     1.712000  0.6726000     1.231000  0.5409000     0.4812000      0.8631000 
1 1 1 35 8  1  o 3.176000  0.2729000     ?         ?             3.176000  0.2729000     ?              ?         
1 1 1 35 8  2  o 2.646000  0.2732000     2.792000  0.4464000     2.500000  0.3150000     0.2926000      0.5464000 
1 1 1 35 8  3  o 1.730000  0.3773000     1.498000  0.6047000     1.963000  0.4513000     -0.4651000     0.7545000 
1 1 1 35 8  4  o 3.866000  0.3239000     3.359000  0.5676000     4.373000  0.3123000     -1.014000      0.6479000 
1 1 1 35 8  5  o 2.868000  0.3197000     3.138000  0.2863000     2.599000  0.5716000     0.5394000      0.6393000 
1 1 1 35 8  6  o 3.292000  0.1613000     3.073000  0.2217000     3.512000  0.2343000     -0.4384000     0.3226000 
1 1 1 35 8  7  o 2.583000  0.2394000     2.415000  0.3459000     2.752000  0.3310000     -0.3370000     0.4788000 
1 1 1 35 8  8  o 4.732000  0.2434000     4.290000  0.4302000     5.173000  0.2278000     -0.8825000     0.4867000 
1 1 1 35 8  9  o 4.620000  0.1906000     4.419000  0.2804000     4.820000  0.2582000     -0.4008000     0.3812000 
1 1 1 35 8  10 o 1.635000  0.3873000     1.655000  0.5344000     1.614000  0.5607000     0.4119000E-01  0.7746000 
1 1 1 35 8  11 f 1.488000  0.3828000     1.695000  0.5431000     1.281000  0.5396000     0.4143000      0.7656000 
1 1 1 35 8  12 o 1.898000  0.4032000     1.757000  0.5607000     2.039000  0.5797000     -0.2817000     0.8065000 
1 1 1 35 8  13 o 1.939000  0.4110000     2.254000  0.5359000     1.625000  0.6232000     0.6289000      0.8219000 
1 1 1 35 9  1  o 3.356000  0.1693000     3.179000  0.2666000     3.533000  0.2087000     -0.3543000     0.3385000 
1 1 1 35 9  2  o 0.9271000 0.3013000     0.8743000 0.4239000     0.9799000 0.4284000     -0.1056000     0.6027000 
1 1 1 35 9  3  o 3.116000  0.3360000     2.896000  0.5749000     3.336000  0.3480000     -0.4394000     0.6721000 
1 1 1 35 9  4  o 1.962000  0.3844000     2.589000  0.6734000     1.336000  0.3711000     1.253000       0.7688000 
1 1 1 35 9  5  o 2.729000  0.2202000     2.359000  0.3643000     3.098000  0.2475000     -0.7385000     0.4404000 
1 1 1 35 9  6  o 1.988000  0.2836000     1.624000  0.4409000     2.353000  0.3569000     -0.7295000     0.5672000 
1 1 1 35 9  7  o 2.899000  0.2672000     2.228000  0.3924000     3.570000  0.3627000     -1.342000      0.5343000 
1 1 1 35 9  8  o 1.328000  0.3303000     0.8013000 0.3822000     1.855000  0.5389000     -1.054000      0.6607000 
1 1 1 35 9  9  o 3.158000  0.2420000     2.999000  0.3429000     3.317000  0.3415000     -0.3180000     0.4839000 
1 1 1 35 9  10 o 2.151000  0.3647000     2.117000  0.4868000     2.184000  0.5432000     -0.6652000E-01 0.7295000 
1 1 1 35 9  11 o 1.753000  0.3786000     2.134000  0.5142000     1.372000  0.5557000     0.7619000      0.7571000 
1 1 1 35 9  12 o 1.489000  0.4175000     1.560000  0.5535000     1.418000  0.6252000     0.1414000      0.8350000 
1 1 1 35 9  13 o 1.333000  0.3762000     1.725000  0.5966000     0.9403000 0.4583000     0.7848000      0.7523000 
1 1 1 35 10 0  o 2.861000  0.2330000     2.861000  0.2330000     2.861000  0.2330000     0.000000       0.000000  
1 1 1 35 10 1  o 1.649000  0.2836000     1.528000  0.3557000     1.770000  0.4418000     -0.2423000     0.5672000 
1 1 1 35 10 2  o 2.956000  0.2739000     3.240000  0.4271000     2.673000  0.3430000     0.5665000      0.5478000 
1 1 1 35 10 3  o 2.391000  0.3937000     2.430000  0.3440000     2.352000  0.7083000     0.7785000E-01  0.7875000 
1 1 1 35 10 4  o 1.031000  0.2695000     1.229000  0.3943000     0.8320000 0.3676000     0.3973000      0.5390000 
1 1 1 35 10 5  o 3.772000  0.1600000     3.723000  0.2268000     3.821000  0.2256000     -0.9774000E-01 0.3199000 
1 1 1 35 10 6  o 0.9733000 0.2979000     0.9858000 0.4202000     0.9608000 0.4223000     0.2502000E-01  0.5958000 
1 1 1 35 10 7  o 1.713000  0.3906000     2.022000  0.5392000     1.405000  0.5653000     0.6174000      0.7812000 
1 1 1 35 10 8  o 1.311000  0.3418000     0.8532000 0.4053000     1.768000  0.5503000     -0.9147000     0.6835000 
1 1 1 35 10 9  o 3.150000  0.2527000     3.120000  0.3344000     3.179000  0.3789000     -0.5909000E-01 0.5054000 
1 1 1 35 10 10 o 1.252000  0.3685000     1.178000  0.5010000     1.325000  0.5406000     -0.1478000     0.7370000 
1 1 1 35 10 11 o 1.173000  0.3585000     1.227000  0.5096000     1.119000  0.5044000     0.1087000      0.7170000 
1 1 1 35 10 12 f 1.424000  0.4152000     1.450000  0.5789000     1.397000  0.5954000     0.5351000E-01  0.8304000 
1 1 1 35 10 13 o 1.080000  0.3668000     0.9375000 0.4510000     1.222000  0.5785000     -0.2844000     0.7335000 
1 1 1 35 11 0  o 3.588000  0.2333000     3.588000  0.2333000     3.588000  0.2333000     -0.000000      0.000000  
1 1 1 35 11 1  o 2.470000  0.2314000     2.741000  0.2248000     2.199000  0.4044000     0.5422000      0.4627000 
1 1 1 35 11 2  o 2.137000  0.1986000     2.336000  0.2635000     1.938000  0.2972000     0.3984000      0.3971000 
1 1 1 35 11 3  o 1.991000  0.2400000     1.480000  0.3971000     2.502000  0.2697000     -1.022000      0.4801000 
1 1 1 35 11 4  o 2.623000  0.1913000     2.475000  0.2758000     2.770000  0.2651000     -0.2944000     0.3825000 
1 1 1 35 11 5  o 2.067000  0.2653000     2.015000  0.3647000     2.119000  0.3853000     -0.1038000     0.5306000 
1 1 1 35 11 6  o 4.068000  0.1653000     3.789000  0.2395000     4.347000  0.2280000     -0.5575000     0.3307000 
1 1 1 35 11 7  o 2.506000  0.4586000     2.521000  0.8211000     2.492000  0.4086000     0.2917000E-01  0.9172000 
1 1 1 35 11 8  o 2.106000  0.4341000     1.910000  0.5266000     2.302000  0.6903000     -0.3920000     0.8682000 
1 1 1 35 11 9  o 2.254000  0.3520000     2.239000  0.4805000     2.268000  0.5145000     -0.2891000E-01 0.7040000 
1 1 1 35 11 10 o 1.278000  0.3739000     1.129000  0.4923000     1.428000  0.5629000     -0.2991000     0.7478000 
1 1 1 35 11 11 o 0.9873000 0.3256000     0.9401000 0.4419000     1.034000  0.4782000     -0.9435000E-01 0.6512000 
1 1 1 35 11 12 o 1.602000  0.4181000     1.315000  0.5807000     1.888000  0.6018000     -0.5731000     0.8363000 
1 1 1 35 11 13 o 1.295000  0.4165000     0.9320000 0.4501000     1.658000  0.7009000     -0.7260000     0.8330000 
1 1 1 35 12 0  o 3.135000  0.2272000     3.135000  0.2272000     3.135000  0.2272000     -0.000000      0.000000  
1 1 1 35 12 1  o 1.973000  0.2473000     1.384000  0.4281000     2.562000  0.2476000     -1.178000      0.4945000 
1 1 1 35 12 2  o 7.122000  0.1998000     7.430000  0.1691000     6.813000  0.3620000     0.6165000      0.3995000 
1 1 1 35 12 3  f 3.209000  0.2215000     3.550000  0.2019000     2.869000  0.3943000     0.6807000      0.4430000 
1 1 1 35 12 4  o 2.021000  0.2693000     1.553000  0.4421000     2.490000  0.3075000     -0.9374000     0.5385000 
1 1 1 35 12 5  o 2.216000  0.2764000     2.444000  0.3333000     1.987000  0.4409000     0.4566000      0.5527000 
1 1 1 35 12 6  o 2.998000  0.2714000     3.163000  0.2869000     2.832000  0.4608000     0.3311000      0.5428000 
1 1 1 35 12 7  o 1.183000  0.3547000     1.357000  0.5479000     1.009000  0.4505000     0.3482000      0.7093000 
1 1 1 35 12 8  o 2.855000  0.3526000     3.229000  0.3545000     2.482000  0.6096000     0.7478000      0.7051000 
1 1 1 35 12 9  f 2.650000  0.3116000     2.895000  0.3736000     2.404000  0.4988000     0.4908000      0.6232000 
1 1 1 35 12 10 o 4.831000  0.2103000     4.614000  0.3200000     5.048000  0.2730000     -0.4347000     0.4206000 
1 1 1 35 12 11 o 2.083000  0.3914000     2.341000  0.5012000     1.824000  0.6014000     0.5171000      0.7828000 
1 1 1 35 12 12 o 1.480000  0.4912000     1.841000  0.8387000     1.119000  0.5116000     0.7224000      0.9824000 
1 1 1 35 13 0  o 1.487000  0.5129000     1.487000  0.5129000     1.487000  0.5129000     0.000000       0.000000  
1 1 1 35 13 1  o 3.176000  0.1930000     2.993000  0.2861000     3.359000  0.2591000     -0.3658000     0.3860000 
1 1 1 35 13 2  o 1.348000  0.3266000     1.304000  0.5158000     1.392000  0.4009000     -0.8826000E-01 0.6533000 
1 1 1 35 13 3  o 7.011000  0.1544000     6.763000  0.2309000     7.259000  0.2052000     -0.4958000     0.3089000 
1 1 1 35 13 4  o 2.894000  0.2059000     2.613000  0.3071000     3.175000  0.2743000     -0.5620000     0.4117000 
1 1 1 35 13 5  o 2.405000  0.3266000     2.834000  0.3083000     1.975000  0.5759000     0.8598000      0.6532000 
1 1 1 35 13 6  o 1.744000  0.3867000     1.909000  0.5881000     1.579000  0.5023000     0.3301000      0.7734000 
1 1 1 35 13 7  o 3.005000  0.2414000     2.735000  0.3505000     3.274000  0.3319000     -0.5391000     0.4827000 
1 1 1 35 13 8  o 1.298000  0.3683000     1.359000  0.5202000     1.238000  0.5216000     0.1211000      0.7367000 
1 1 1 35 13 9  o 2.418000  0.3418000     2.373000  0.4728000     2.462000  0.4937000     -0.8880000E-01 0.6836000 
1 1 1 35 13 10 o 1.474000  0.3883000     1.580000  0.5411000     1.369000  0.5571000     0.2106000      0.7766000 
1 1 1 35 13 11 o 1.551000  0.4028000     1.253000  0.5278000     1.849000  0.6086000     -0.5960000     0.8056000 
1 1 1 35 13 12 o 1.349000  0.4042000     1.173000  0.5484000     1.526000  0.5938000     -0.3527000     0.8083000 
1 1 1 35 14 0  o 2.039000  0.4737000     2.039000  0.4737000     2.039000  0.4737000     0.000000       0.000000  
1 1 1 35 14 1  o 2.742000  0.2263000     2.302000  0.4007000     3.182000  0.2106000     -0.8807000     0.4527000 
1 1 1 35 14 2  o 2.462000  0.2356000     2.334000  0.4041000     2.591000  0.2423000     -0.2563000     0.4712000 
1 1 1 35 14 3  o 1.960000  0.2896000     2.228000  0.4475000     1.692000  0.3676000     0.5357000      0.5791000 
1 1 1 35 14 4  o 1.715000  0.3441000     1.160000  0.4527000     2.269000  0.5184000     -1.109000      0.6883000 
1 1 1 35 14 5  o 4.274000  0.2161000     4.177000  0.3388000     4.371000  0.2683000     -0.1949000     0.4322000 
1 1 1 35 14 6  o 2.696000  0.2933000     2.776000  0.4422000     2.616000  0.3854000     0.1602000      0.5866000 
1 1 1 35 14 7  o 1.150000  0.3380000     1.351000  0.5074000     0.9480000 0.4466000     0.4033000      0.6760000 
1 1 1 35 14 8  o 3.800000  0.2171000     3.728000  0.2980000     3.873000  0.3158000     -0.1445000     0.4342000 
1 1 1 35 14 9  o 2.589000  0.3424000     2.621000  0.4259000     2.557000  0.5363000     0.6399000E-01  0.6848000 
1 1 1 35 14 10 o 2.327000  0.3598000     2.630000  0.4466000     2.025000  0.5641000     0.6051000      0.7195000 
1 1 1 35 14 11 o 2.117000  0.3706000     3.022000  0.4754000     1.212000  0.5685000     1.810000       0.7411000 
1 1 1 35 14 12 f 1.559000  0.4139000     1.423000  0.5623000     1.695000  0.6076000     -0.2717000     0.8278000 
1 1 1 35 15 0  o 3.680000  0.2401000     3.680000  0.2401000     3.680000  0.2401000     -0.000000      0.000000  
1 1 1 35 15 1  o 5.097000  0.1455000     5.229000  0.2019000     4.964000  0.2096000     0.2649000      0.2910000 
1 1 1 35 15 2  o 0.8297000 0.2744000     0.8239000 0.3928000     0.8354000 0.3832000     -0.1153000E-01 0.5487000 
1 1 1 35 15 3  o 4.818000  0.1662000     4.631000  0.2532000     5.005000  0.2153000     -0.3735000     0.3323000 
1 1 1 35 15 4  o 1.710000  0.3821000     1.830000  0.5734000     1.591000  0.5052000     0.2398000      0.7642000 
1 1 1 35 15 5  o 3.644000  0.2143000     3.494000  0.3265000     3.795000  0.2777000     -0.3008000     0.4286000 
1 1 1 35 15 6  o 3.071000  0.2339000     2.799000  0.3481000     3.342000  0.3125000     -0.5430000     0.4678000 
1 1 1 35 15 7  o 1.895000  0.4047000     1.416000  0.5355000     2.374000  0.6070000     -0.9574000     0.8095000 
1 1 1 35 15 8  o 2.506000  0.3345000     2.843000  0.4209000     2.169000  0.5200000     0.6740000      0.6690000 
1 1 1 35 15 9  o 1.950000  0.3867000     1.645000  0.5630000     2.256000  0.5301000     -0.6103000     0.7733000 
1 1 1 35 15 10 o 1.375000  0.3878000     1.291000  0.5281000     1.459000  0.5680000     -0.1684000     0.7756000 
1 1 1 35 15 11 o 1.723000  0.4458000     1.970000  0.6695000     1.475000  0.5888000     0.4943000      0.8916000 
1 1 1 35 15 12 o 2.198000  0.4349000     2.013000  0.5879000     2.383000  0.6410000     -0.3694000     0.8698000 
1 1 1 35 16 0  o 0.6981000 0.4730000     0.6981000 0.4730000     0.6981000 0.4730000     0.000000       0.000000  
1 1 1 35 16 1  o 1.301000  0.3196000     1.532000  0.4517000     1.070000  0.4523000     0.4612000      0.6392000 
1 1 1 35 16 2  o 3.701000  0.2303000     3.188000  0.4060000     4.213000  0.2175000     -1.025000      0.4606000 
1 1 1 35 16 3  o 1.298000  0.3510000     1.351000  0.5175000     1.245000  0.4745000     0.1067000      0.7021000 
1 1 1 35 16 4  o 2.803000  0.3279000     2.800000  0.5480000     2.806000  0.3601000     -0.5914000E-02 0.6557000 
1 1 1 35 16 5  o 2.884000  0.2523000     3.165000  0.2996000     2.603000  0.4060000     0.5618000      0.5046000 
1 1 1 35 16 6  o 4.838000  0.1954000     4.884000  0.2767000     4.791000  0.2760000     0.9296000E-01  0.3909000 
1 1 1 35 16 7  o 1.706000  0.3894000     1.383000  0.5326000     2.030000  0.5682000     -0.6465000     0.7788000 
1 1 1 35 16 8  o 2.243000  0.3659000     2.307000  0.4940000     2.180000  0.5398000     0.1266000      0.7317000 
1 1 1 35 16 9  o 1.892000  0.3996000     2.030000  0.5485000     1.753000  0.5813000     0.2770000      0.7992000 
1 1 1 35 16 10 o 1.192000  0.3655000     1.247000  0.5233000     1.137000  0.5104000     0.1102000      0.7310000 
1 1 1 35 16 11 o 1.916000  0.4938000     1.718000  0.7831000     2.114000  0.6016000     -0.3964000     0.9875000 
1 1 1 35 16 12 o 1.319000  0.3995000     1.537000  0.6061000     1.101000  0.5205000     0.4363000      0.7990000 
1 1 1 35 17 0  o 0.4998000 0.3554000     0.4998000 0.3554000     0.4998000 0.3554000     -0.000000      0.000000  
1 1 1 35 17 1  o 1.867000  0.2984000     2.108000  0.4079000     1.626000  0.4357000     0.4824000      0.5968000 
1 1 1 35 17 2  f 1.314000  0.2983000     1.833000  0.4682000     0.7950000 0.3698000     1.038000       0.5966000 
1 1 1 35 17 3  o 1.948000  0.3161000     1.609000  0.5491000     2.287000  0.3132000     -0.6782000     0.6322000 
1 1 1 35 17 4  o 1.379000  0.3530000     1.453000  0.5403000     1.305000  0.4542000     0.1471000      0.7059000 
1 1 1 35 17 5  o 2.790000  0.3055000     2.376000  0.5037000     3.204000  0.3457000     -0.8284000     0.6110000 
1 1 1 35 17 6  o 6.056000  0.1849000     5.903000  0.2621000     6.210000  0.2608000     -0.3065000     0.3698000 
1 1 1 35 17 7  o 2.134000  0.3629000     1.978000  0.5065000     2.289000  0.5199000     -0.3108000     0.7258000 
1 1 1 35 17 8  o 2.425000  0.3466000     3.084000  0.3727000     1.766000  0.5845000     1.318000       0.6932000 
1 1 1 35 17 9  o 1.262000  0.3764000     1.177000  0.5136000     1.347000  0.5505000     -0.1699000     0.7528000 
1 1 1 35 17 10 o 1.520000  0.4236000     1.317000  0.5470000     1.723000  0.6469000     -0.4056000     0.8472000 
1 1 1 35 17 11 o 1.103000  0.3642000     1.080000  0.5134000     1.125000  0.5167000     -0.4433000E-01 0.7284000 
1 1 1 35 17 12 f 1.158000  0.4151000     1.038000  0.5271000     1.279000  0.6414000     -0.2409000     0.8302000 
1 1 1 35 18 0  f 0.4617000 0.3317000     0.4617000 0.3317000     0.4617000 0.3317000     0.000000       0.000000  
1 1 1 35 18 1  o 5.027000  0.1437000     4.924000  0.2107000     5.130000  0.1954000     -0.2066000     0.2874000 
1 1 1 35 18 2  o 2.796000  0.2396000     2.910000  0.3018000     2.683000  0.3722000     0.2274000      0.4792000 
1 1 1 35 18 3  o 1.460000  0.3123000     1.130000  0.4560000     1.790000  0.4267000     -0.6598000     0.6245000 
1 1 1 35 18 4  o 3.631000  0.2198000     3.110000  0.3858000     4.151000  0.2108000     -1.041000      0.4396000 
1 1 1 35 18 5  o 1.755000  0.3487000     1.579000  0.5592000     1.930000  0.4167000     -0.3517000     0.6974000 
1 1 1 35 18 6  o 4.339000  0.2351000     4.137000  0.2784000     4.542000  0.3788000     -0.4047000     0.4701000 
1 1 1 35 18 7  o 2.578000  0.3260000     2.741000  0.4031000     2.415000  0.5125000     0.3256000      0.6520000 
1 1 1 35 18 8  o 0.9565000 0.3186000     0.8912000 0.4240000     1.022000  0.4757000     -0.1307000     0.6373000 
1 1 1 35 18 9  o 2.558000  0.3482000     2.936000  0.4075000     2.180000  0.5647000     0.7563000      0.6964000 
1 1 1 35 18 10 f 1.116000  0.3681000     1.226000  0.5620000     1.006000  0.4755000     0.2204000      0.7362000 
1 1 1 35 18 11 o 1.577000  0.4214000     1.690000  0.6002000     1.464000  0.5917000     0.2259000      0.8428000 
1 1 1 35 19 0  o 2.299000  0.3929000     2.299000  0.3929000     2.299000  0.3929000     0.000000       0.000000  
1 1 1 35 19 1  o 1.087000  0.3224000     1.031000  0.4495000     1.142000  0.4624000     -0.1111000     0.6448000 
1 1 1 35 19 2  o 1.657000  0.3206000     1.303000  0.4823000     2.010000  0.4224000     -0.7073000     0.6411000 
1 1 1 35 19 3  o 2.371000  0.2534000     2.417000  0.3657000     2.324000  0.3508000     0.9313000E-01  0.5067000 
1 1 1 35 19 4  o 2.766000  0.2671000     2.751000  0.4474000     2.780000  0.2919000     -0.2983000E-01 0.5342000 
1 1 1 35 19 5  o 2.727000  0.2887000     2.665000  0.4712000     2.789000  0.3336000     -0.1242000     0.5773000 
1 1 1 35 19 6  o 3.845000  0.2914000     4.041000  0.5163000     3.650000  0.2706000     0.3911000      0.5829000 
1 1 1 35 19 7  o 2.961000  0.2902000     2.640000  0.4270000     3.281000  0.3930000     -0.6411000     0.5804000 
1 1 1 35 19 8  o 2.840000  0.3118000     2.933000  0.3984000     2.747000  0.4798000     0.1860000      0.6237000 
1 1 1 35 19 9  o 1.811000  0.4325000     1.953000  0.5666000     1.669000  0.6536000     0.2836000      0.8650000 
1 1 1 35 19 10 o 1.543000  0.4598000     1.749000  0.7244000     1.337000  0.5665000     0.4115000      0.9196000 
1 1 1 35 19 11 o 1.365000  0.4052000     1.337000  0.5644000     1.393000  0.5817000     -0.5670000E-01 0.8105000 
1 1 1 35 20 0  o 0.6510000 0.4365000     0.6510000 0.4365000     0.6510000 0.4365000     -0.000000      0.000000  
1 1 1 35 20 1  o 1.883000  0.3261000     1.914000  0.4624000     1.853000  0.4600000     0.6133000E-01  0.6523000 
1 1 1 35 20 2  o 2.732000  0.2297000     2.765000  0.3227000     2.699000  0.3269000     0.6539000E-01  0.4594000 
1 1 1 35 20 3  o 2.410000  0.2826000     1.846000  0.4756000     2.974000  0.3055000     -1.128000      0.5653000 
1 1 1 35 20 4  o 2.720000  0.2505000     2.974000  0.3251000     2.465000  0.3813000     0.5097000      0.5010000 
1 1 1 35 20 5  o 3.021000  0.2952000     3.186000  0.4689000     2.855000  0.3587000     0.3317000      0.5903000 
1 1 1 35 20 6  o 1.877000  0.3326000     1.372000  0.5528000     2.382000  0.3702000     -1.010000      0.6653000 
1 1 1 35 20 7  o 1.248000  0.3687000     1.010000  0.4791000     1.486000  0.5606000     -0.4760000     0.7374000 
1 1 1 35 20 8  o 2.771000  0.3229000     2.763000  0.4458000     2.779000  0.4672000     -0.1550000E-01 0.6458000 
1 1 1 35 20 9  o 1.586000  0.4391000     1.682000  0.6097000     1.489000  0.6321000     0.1937000      0.8782000 
1 1 1 35 20 10 o 1.291000  0.3891000     1.083000  0.4950000     1.499000  0.6005000     -0.4159000     0.7782000 
1 1 1 35 20 11 o 1.187000  0.3830000     1.358000  0.5867000     1.017000  0.4926000     0.3413000      0.7661000 
1 1 1 35 21 0  o 6.439000  0.1968000     6.439000  0.1968000     6.439000  0.1968000     0.000000       0.000000  
1 1 1 35 21 1  o 2.998000  0.2246000     2.904000  0.3243000     3.092000  0.3108000     -0.1878000     0.4492000 
1 1 1 35 21 2  o 3.095000  0.2241000     3.099000  0.3250000     3.091000  0.3085000     0.8150000E-02  0.4482000 
1 1 1 35 21 3  o 1.361000  0.3484000     1.219000  0.4852000     1.503000  0.5002000     -0.2840000     0.6969000 
1 1 1 35 21 4  o 1.261000  0.3595000     1.557000  0.5728000     0.9652000 0.4346000     0.5916000      0.7190000 
1 1 1 35 21 5  o 1.629000  0.3654000     1.795000  0.5293000     1.462000  0.5040000     0.3326000      0.7308000 
1 1 1 35 21 6  o 3.437000  0.2591000     3.198000  0.4422000     3.675000  0.2701000     -0.4767000     0.5182000 
1 1 1 35 21 7  o 0.9646000 0.3212000     1.132000  0.5155000     0.7971000 0.3833000     0.3351000      0.6423000 
1 1 1 35 21 8  o 1.508000  0.4002000     1.699000  0.5520000     1.317000  0.5796000     0.3822000      0.8004000 
1 1 1 35 21 9  o 1.318000  0.4210000     1.358000  0.6290000     1.278000  0.5597000     0.7977000E-01  0.8420000 
1 1 1 35 21 10 o 2.552000  0.3974000     2.471000  0.5427000     2.633000  0.5806000     -0.1625000     0.7948000 
1 1 1 35 22 0  o 2.770000  0.3716000     2.770000  0.3716000     2.770000  0.3716000     0.000000       0.000000  
1 1 1 35 22 1  o 2.772000  0.2484000     2.923000  0.3295000     2.621000  0.3717000     0.3021000      0.4967000 
1 1 1 35 22 2  o 1.369000  0.3389000     1.005000  0.4496000     1.733000  0.5073000     -0.7276000     0.6779000 
1 1 1 35 22 3  o 1.427000  0.3764000     1.555000  0.5227000     1.299000  0.5419000     0.2561000      0.7529000 
1 1 1 35 22 4  o 3.079000  0.2690000     3.179000  0.3730000     2.978000  0.3876000     0.2010000      0.5379000 
1 1 1 35 22 5  o 3.705000  0.2070000     3.851000  0.2879000     3.559000  0.2974000     0.2915000      0.4140000 
1 1 1 35 22 6  o 4.003000  0.2326000     3.646000  0.3988000     4.360000  0.2396000     -0.7132000     0.4653000 
1 1 1 35 22 7  o 3.680000  0.2469000     3.794000  0.3963000     3.566000  0.2947000     0.2289000      0.4939000 
1 1 1 35 22 8  o 1.210000  0.3806000     1.153000  0.5361000     1.267000  0.5403000     -0.1137000     0.7612000 
1 1 1 35 22 9  o 1.217000  0.3772000     1.172000  0.5158000     1.261000  0.5506000     -0.8940000E-01 0.7545000 
1 1 1 35 22 10 f 1.547000  0.4214000     1.337000  0.5599000     1.757000  0.6300000     -0.4209000     0.8428000 
1 1 1 35 23 0  o 3.913000  0.2814000     3.913000  0.2814000     3.913000  0.2814000     -0.000000      0.000000  
1 1 1 35 23 1  o 2.356000  0.3120000     2.770000  0.3691000     1.941000  0.5031000     0.8286000      0.6240000 
1 1 1 35 23 2  o 4.653000  0.1800000     4.618000  0.2608000     4.688000  0.2482000     -0.7000000E-01 0.3600000 
1 1 1 35 23 3  o 2.361000  0.3576000     2.844000  0.4670000     1.879000  0.5416000     0.9658000      0.7151000 
1 1 1 35 23 4  o 2.270000  0.3375000     2.712000  0.4128000     1.829000  0.5340000     0.8829000      0.6749000 
1 1 1 35 23 5  o 1.665000  0.3519000     2.045000  0.4862000     1.285000  0.5089000     0.7591000      0.7038000 
1 1 1 35 23 6  o 2.958000  0.2649000     2.800000  0.3936000     3.116000  0.3545000     -0.3165000     0.5297000 
1 1 1 35 23 7  o 2.319000  0.4129000     2.504000  0.6551000     2.134000  0.5027000     0.3702000      0.8258000 
1 1 1 35 23 8  o 1.517000  0.4321000     1.347000  0.6177000     1.688000  0.6043000     -0.3416000     0.8642000 
1 1 1 35 23 9  o 1.306000  0.3931000     1.220000  0.5336000     1.391000  0.5774000     -0.1705000     0.7862000 
1 1 1 35 23 10 o 1.183000  0.3921000     1.273000  0.5783000     1.093000  0.5298000     0.1807000      0.7842000 
1 1 1 35 24 0  o 3.394000  0.3304000     3.394000  0.3304000     3.394000  0.3304000     -0.000000      0.000000  
1 1 1 35 24 1  o 3.699000  0.2163000     3.583000  0.3126000     3.815000  0.2990000     -0.2317000     0.4326000 
1 1 1 35 24 2  o 4.349000  0.2271000     4.529000  0.3331000     4.169000  0.3088000     0.3605000      0.4543000 
1 1 1 35 24 3  o 4.126000  0.2244000     4.298000  0.3085000     3.954000  0.3260000     0.3439000      0.4488000 
1 1 1 35 24 4  o 0.8578000 0.2885000     0.8070000 0.3903000     0.9087000 0.4251000     -0.1017000     0.5771000 
1 1 1 35 24 5  o 1.029000  0.3253000     1.172000  0.4974000     0.8859000 0.4193000     0.2863000      0.6506000 
1 1 1 35 24 6  o 1.775000  0.4071000     2.040000  0.5745000     1.510000  0.5769000     0.5303000      0.8142000 
1 1 1 35 24 7  o 1.191000  0.3729000     0.9833000 0.4870000     1.399000  0.5650000     -0.4158000     0.7459000 
1 1 1 35 24 8  o 1.475000  0.3928000     1.969000  0.6441000     0.9804000 0.4497000     0.9886000      0.7856000 
1 1 1 35 24 9  o 1.177000  0.3689000     1.230000  0.5554000     1.123000  0.4856000     0.1072000      0.7378000 
1 1 1 35 25 0  o 1.429000  0.7235000     1.429000  0.7235000     1.429000  0.7235000     0.000000       0.000000  
1 1 1 35 25 1  o 1.390000  0.4464000     1.125000  0.5160000     1.654000  0.7287000     -0.5288000     0.8929000 
1 1 1 35 25 2  o 2.437000  0.4089000     2.282000  0.5580000     2.592000  0.5978000     -0.3105000     0.8177000 
1 1 1 35 25 3  o 2.361000  0.3579000     2.312000  0.4606000     2.409000  0.5480000     -0.9700000E-01 0.7158000 
1 1 1 35 25 4  o 1.067000  0.3402000     0.8992000 0.4225000     1.234000  0.5334000     -0.3349000     0.6805000 
1 1 1 35 25 5  o 1.714000  0.4058000     1.931000  0.5707000     1.496000  0.5772000     0.4346000      0.8117000 
1 1 1 35 25 6  o 3.337000  0.3192000     2.852000  0.4825000     3.823000  0.4180000     -0.9709000     0.6383000 
1 1 1 35 25 7  o 1.180000  0.3640000     1.261000  0.5390000     1.099000  0.4893000     0.1616000      0.7279000 
1 1 1 35 25 8  o 0.9917000 0.3312000     1.070000  0.5052000     0.9133000 0.4284000     0.1569000      0.6624000 
1 1 1 35 25 9  o 1.827000  0.3778000     1.276000  0.5889000     2.378000  0.4735000     -1.103000      0.7557000 
1 1 1 35 26 0  o 1.908000  0.7804000     1.908000  0.7804000     1.908000  0.7804000     0.000000       0.000000  
1 1 1 35 26 1  o 1.888000  0.4230000     1.741000  0.6296000     2.036000  0.5652000     -0.2949000     0.8461000 
1 1 1 35 26 2  o 1.003000  0.3320000     1.083000  0.4917000     0.9236000 0.4463000     0.1593000      0.6641000 
1 1 1 35 26 3  o 1.556000  0.3786000     1.223000  0.5285000     1.889000  0.5424000     -0.6667000     0.7573000 
1 1 1 35 26 4  o 1.269000  0.3735000     1.494000  0.5605000     1.045000  0.4937000     0.4493000      0.7469000 
1 1 1 35 26 5  o 2.047000  0.4182000     1.678000  0.5883000     2.416000  0.5945000     -0.7378000     0.8364000 
1 1 1 35 26 6  o 1.301000  0.3848000     1.255000  0.5458000     1.347000  0.5426000     -0.9193000E-01 0.7696000 
1 1 1 35 26 7  o 1.232000  0.3569000     1.464000  0.5469000     0.9991000 0.4587000     0.4653000      0.7138000 
1 1 1 35 26 8  o 1.300000  0.3926000     1.554000  0.6278000     1.046000  0.4716000     0.5073000      0.7852000 
1 1 1 35 27 0  o 3.518000  0.3936000     3.518000  0.3936000     3.518000  0.3936000     0.000000       0.000000  
1 1 1 35 27 1  o 3.586000  0.2831000     3.966000  0.3483000     3.206000  0.4465000     0.7600000      0.5662000 
1 1 1 35 27 2  o 1.255000  0.3726000     1.548000  0.5871000     0.9621000 0.4590000     0.5855000      0.7452000 
1 1 1 35 27 3  o 1.309000  0.3934000     1.382000  0.5655000     1.237000  0.5470000     0.1446000      0.7868000 
1 1 1 35 27 4  o 1.380000  0.3834000     1.650000  0.5852000     1.110000  0.4957000     0.5400000      0.7669000 
1 1 1 35 27 5  o 1.452000  0.3875000     1.639000  0.5674000     1.264000  0.5280000     0.3750000      0.7751000 
1 1 1 35 27 6  o 1.073000  0.3374000     1.232000  0.5155000     0.9138000 0.4355000     0.3186000      0.6748000 
1 1 1 35 27 7  o 1.498000  0.3765000     1.791000  0.5543000     1.204000  0.5097000     0.5872000      0.7531000 
1 1 1 35 27 8  o 1.496000  0.4409000     1.375000  0.5705000     1.617000  0.6722000     -0.2425000     0.8817000 
1 1 1 35 28 0  o 0.7441000 0.5021000     0.7441000 0.5021000     0.7441000 0.5021000     -0.000000      0.000000  
1 1 1 35 28 1  o 1.597000  0.3872000     1.903000  0.5589000     1.290000  0.5360000     0.6125000      0.7744000 
1 1 1 35 28 2  o 3.083000  0.2865000     2.629000  0.4558000     3.537000  0.3474000     -0.9083000     0.5731000 
1 1 1 35 28 3  o 3.267000  0.2672000     3.263000  0.3725000     3.272000  0.3830000     -0.8746000E-02 0.5343000 
1 1 1 35 28 4  o 1.365000  0.3843000     1.411000  0.5458000     1.320000  0.5411000     0.9058000E-01  0.7686000 
1 1 1 35 28 5  f 1.905000  0.3887000     2.228000  0.5256000     1.583000  0.5728000     0.6453000      0.7774000 
1 1 1 35 28 6  o 1.751000  0.3576000     1.120000  0.4971000     2.382000  0.5142000     -1.262000      0.7152000 
1 1 1 35 28 7  o 1.039000  0.3304000     1.260000  0.5240000     0.8185000 0.4025000     0.4415000      0.6607000 
1 1 1 35 29 0  o 0.7404000 0.5034000     0.7404000 0.5034000     0.7404000 0.5034000     0.000000       0.000000  
1 1 1 35 29 1  o 1.187000  0.3605000     1.046000  0.4777000     1.328000  0.5401000     -0.2817000     0.7211000 
1 1 1 35 29 2  o 1.472000  0.3896000     1.714000  0.5754000     1.231000  0.5254000     0.4827000      0.7791000 
1 1 1 35 29 3  f 1.119000  0.3454000     0.8889000 0.4284000     1.350000  0.5419000     -0.4609000     0.6908000 
1 1 1 35 29 4  f 1.797000  0.4124000     1.771000  0.5788000     1.822000  0.5877000     -0.5077000E-01 0.8249000 
1 1 1 35 29 5  o 1.326000  0.3806000     1.383000  0.5449000     1.269000  0.5316000     0.1132000      0.7612000 
1 1 1 35 29 6  f 3.305000  0.2806000     3.217000  0.4125000     3.394000  0.3806000     -0.1770000     0.5613000 
1 1 1 35 30 0  o 4.923000  0.2918000     4.923000  0.2918000     4.923000  0.2918000     -0.000000      0.000000  
1 1 1 35 30 1  o 1.386000  0.3930000     1.363000  0.5508000     1.410000  0.5609000     -0.4691000E-01 0.7861000 
1 1 1 35 30 2  o 2.023000  0.3784000     2.446000  0.4961000     1.599000  0.5716000     0.8468000      0.7569000 
1 1 1 35 30 3  o 3.091000  0.3005000     3.481000  0.3702000     2.701000  0.4735000     0.7798000      0.6010000 
1 1 1 35 30 4  f 1.070000  0.3402000     0.8137000 0.4004000     1.325000  0.5501000     -0.5116000     0.6804000 
1 1 1 35 30 5  o 1.464000  0.3918000     1.259000  0.5323000     1.668000  0.5752000     -0.4083000     0.7837000 
1 1 1 35 30 6  o 3.061000  0.4901000     4.052000  0.4247000     2.070000  0.8834000     1.982000       0.9802000 
1 1 1 35 31 0  o 0.8209000 0.5461000     0.8209000 0.5461000     0.8209000 0.5461000     0.000000       0.000000  
1 1 1 35 31 1  o 2.555000  0.3579000     2.689000  0.4844000     2.422000  0.5268000     0.2677000      0.7157000 
1 1 1 35 31 2  o 1.565000  0.4000000     1.323000  0.5430000     1.807000  0.5875000     -0.4832000     0.8000000 
1 1 1 35 31 3  o 1.090000  0.3495000     1.136000  0.5058000     1.045000  0.4826000     0.9081000E-01  0.6990000 
1 1 1 35 31 4  o 1.417000  0.3844000     1.098000  0.4965000     1.737000  0.5870000     -0.6393000     0.7688000 
1 1 1 35 31 5  o 1.366000  0.4160000     1.457000  0.5838000     1.276000  0.5927000     0.1812000      0.8319000 
1 1 1 35 32 0  o 0.8131000 0.5448000     0.8131000 0.5448000     0.8131000 0.5448000     -0.000000      0.000000  
1 1 1 35 32 1  o 1.613000  0.4113000     1.490000  0.5798000     1.737000  0.5836000     -0.2472000     0.8226000 
1 1 1 35 32 2  o 1.418000  0.3943000     1.235000  0.5314000     1.600000  0.5826000     -0.3652000     0.7885000 
1 1 1 35 32 3  o 1.486000  0.3952000     1.172000  0.5224000     1.799000  0.5933000     -0.6272000     0.7905000 
1 1 1 35 32 4  o 1.746000  0.7705000     1.746000  0.7705000     ?         ?             ?              ?         
1 1 1 35 33 0  o 2.051000  0.7135000     2.051000  0.7135000     2.051000  0.7135000     -0.000000      0.000000  
1 1 1 35 33 1  o 1.195000  0.3703000     1.400000  0.5730000     0.9902000 0.4692000     0.4095000      0.7406000 
1 1 1 35 33 2  f 1.366000  0.4382000     1.246000  0.5765000     1.485000  0.6599000     -0.2394000     0.8763000 
1 1 1 36 0  3  o 0.8029000 0.4859000     0.8029000 0.4859000     0.8029000 0.4859000     0.000000       0.000000  
1 1 1 36 0  5  o 4.270000  0.2724000     4.270000  0.2724000     4.270000  0.2724000     0.000000       0.000000  
1 1 1 36 0  6  o 0.7559000 0.5081000     0.7559000 0.5081000     0.7559000 0.5081000     -0.000000      0.000000  
1 1 1 36 0  7  o 3.890000  0.2189000     3.890000  0.2189000     3.890000  0.2189000     -0.000000      0.000000  
1 1 1 36 0  8  o 0.5175000 0.3585000     0.5175000 0.3585000     0.5175000 0.3585000     0.000000       0.000000  
1 1 1 36 0  9  o 0.8718000 0.5956000     0.8718000 0.5956000     0.8718000 0.5956000     0.000000       0.000000  
1 1 1 36 0  10 o 2.281000  0.4159000     2.281000  0.4159000     2.281000  0.4159000     0.000000       0.000000  
1 1 1 36 0  11 o 2.904000  0.3490000     2.904000  0.3490000     2.904000  0.3490000     0.000000       0.000000  
1 1 1 36 0  12 o 0.7824000 0.5074000     0.7824000 0.5074000     0.7824000 0.5074000     0.000000       0.000000  
1 1 1 36 1  3  o 2.216000  0.2460000     2.481000  0.2849000     1.950000  0.4010000     0.5310000      0.4919000 
1 1 1 36 1  4  o 2.783000  0.2404000     2.833000  0.3242000     2.733000  0.3551000     0.9967000E-01  0.4808000 
1 1 1 36 1  5  o 2.026000  0.3495000     2.278000  0.4676000     1.774000  0.5196000     0.5046000      0.6990000 
1 1 1 36 1  6  f 2.451000  0.3398000     1.986000  0.5431000     2.915000  0.4085000     -0.9294000     0.6796000 
1 1 1 36 1  7  o 2.684000  0.1523000     2.680000  0.2159000     2.688000  0.2150000     -0.7143000E-02 0.3047000 
1 1 1 36 1  8  o 1.053000  0.2882000     0.9473000 0.3993000     1.158000  0.4156000     -0.2112000     0.5763000 
1 1 1 36 1  9  f 1.585000  0.4616000     1.580000  0.6495000     1.590000  0.6561000     -0.1003000E-01 0.9232000 
1 1 1 36 1  10 f 2.051000  0.2932000     2.205000  0.4153000     1.897000  0.4141000     0.3089000      0.5865000 
1 1 1 36 1  11 o 1.883000  0.3418000     2.025000  0.4728000     1.741000  0.4938000     0.2846000      0.6836000 
1 1 1 36 1  12 o 1.401000  0.3642000     1.359000  0.5185000     1.442000  0.5116000     -0.8348000E-01 0.7284000 
1 1 1 36 2  3  o 3.179000  0.1813000     3.248000  0.2290000     3.110000  0.2812000     0.1380000      0.3626000 
1 1 1 36 2  4  f 1.915000  0.3239000     1.570000  0.4792000     2.261000  0.4360000     -0.6909000     0.6478000 
1 1 1 36 2  5  o 3.351000  0.2326000     3.148000  0.3452000     3.553000  0.3120000     -0.4052000     0.4653000 
1 1 1 36 2  6  o 1.879000  0.3815000     1.922000  0.5270000     1.836000  0.5516000     0.8648000E-01  0.7629000 
1 1 1 36 2  7  o 2.111000  0.1889000     2.321000  0.2544000     1.901000  0.2794000     0.4197000      0.3779000 
1 1 1 36 2  8  o 2.333000  0.2300000     2.424000  0.3517000     2.241000  0.2965000     0.1825000      0.4600000 
1 1 1 36 2  9  o 2.031000  0.4531000     2.648000  0.6644000     1.414000  0.6163000     1.234000       0.9062000 
1 1 1 36 2  10 o 1.662000  0.3129000     2.258000  0.4495000     1.065000  0.4355000     1.193000       0.6259000 
1 1 1 36 2  11 o 1.741000  0.3582000     1.253000  0.5101000     2.228000  0.5031000     -0.9752000     0.7165000 
1 1 1 36 2  12 o 1.046000  0.3415000     0.8107000 0.3831000     1.281000  0.5655000     -0.4707000     0.6830000 
1 1 1 36 3  3  o 3.020000  0.1979000     3.132000  0.2391000     2.908000  0.3153000     0.2242000      0.3957000 
1 1 1 36 3  4  o 1.027000  0.3192000     1.079000  0.4583000     0.9753000 0.4444000     0.1037000      0.6384000 
1 1 1 36 3  5  o 2.423000  0.3141000     1.953000  0.4933000     2.892000  0.3891000     -0.9381000     0.6283000 
1 1 1 36 3  6  o 1.199000  0.3417000     1.057000  0.4696000     1.341000  0.4966000     -0.2839000     0.6835000 
1 1 1 36 3  7  o 3.337000  0.1382000     3.579000  0.2067000     3.094000  0.1834000     0.4852000      0.2763000 
1 1 1 36 3  8  o 2.585000  0.2093000     2.698000  0.3276000     2.473000  0.2607000     0.2245000      0.4186000 
1 1 1 36 3  9  o 1.324000  0.3907000     1.461000  0.6269000     1.188000  0.4666000     0.2729000      0.7815000 
1 1 1 36 3  10 o 2.293000  0.3229000     2.254000  0.4626000     2.332000  0.4505000     -0.7845000E-01 0.6457000 
1 1 1 36 3  11 o 2.215000  0.3307000     2.737000  0.3481000     1.694000  0.5623000     1.043000       0.6613000 
1 1 1 36 3  12 o 0.9016000 0.3016000     0.8861000 0.4158000     0.9172000 0.4370000     -0.3110000E-01 0.6032000 
1 1 1 36 4  3  o 3.745000  0.1743000     3.876000  0.2033000     3.613000  0.2832000     0.2626000      0.3486000 
1 1 1 36 4  4  o 1.349000  0.3581000     1.253000  0.4856000     1.446000  0.5263000     -0.1926000     0.7161000 
1 1 1 36 4  5  o 0.9868000 0.3076000     0.8691000 0.4087000     1.105000  0.4598000     -0.2354000     0.6152000 
1 1 1 36 4  6  f 3.834000  0.3430000     3.654000  0.6324000     4.013000  0.2657000     -0.3582000     0.6860000 
1 1 1 36 4  7  o 1.634000  0.2695000     1.847000  0.3968000     1.420000  0.3648000     0.4273000      0.5390000 
1 1 1 36 4  8  o 2.469000  0.2335000     2.400000  0.3794000     2.539000  0.2724000     -0.1391000     0.4671000 
1 1 1 36 4  9  o 1.576000  0.3988000     1.753000  0.5244000     1.398000  0.6009000     0.3546000      0.7975000 
1 1 1 36 4  10 o 1.591000  0.3651000     1.597000  0.4822000     1.584000  0.5484000     0.1282000E-01  0.7303000 
1 1 1 36 4  11 o 1.061000  0.3177000     1.303000  0.4938000     0.8187000 0.3999000     0.4846000      0.6354000 
1 1 1 36 4  12 o 1.683000  0.3747000     1.943000  0.5038000     1.424000  0.5549000     0.5190000      0.7495000 
1 1 1 36 5  3  o 2.153000  0.2960000     2.194000  0.3519000     2.111000  0.4760000     0.8300000E-01  0.5919000 
1 1 1 36 5  4  o 0.9187000 0.2884000     0.7863000 0.3728000     1.051000  0.4400000     -0.2648000     0.5767000 
1 1 1 36 5  5  o 1.374000  0.3812000     1.219000  0.5693000     1.529000  0.5070000     -0.3095000     0.7624000 
1 1 1 36 5  6  o 2.856000  0.4129000     2.133000  0.7701000     3.579000  0.2980000     -1.446000      0.8257000 
1 1 1 36 5  7  o 1.277000  0.2969000     1.294000  0.4495000     1.260000  0.3880000     0.3392000E-01  0.5938000 
1 1 1 36 5  8  f 2.428000  0.2761000     2.383000  0.3873000     2.473000  0.3935000     -0.8995000E-01 0.5521000 
1 1 1 36 5  9  o 1.796000  0.3777000     2.035000  0.4129000     1.557000  0.6327000     0.4786000      0.7555000 
1 1 1 36 5  10 o 2.247000  0.3205000     1.964000  0.4602000     2.530000  0.4464000     -0.5668000     0.6411000 
1 1 1 36 5  11 o 1.563000  0.3793000     1.380000  0.5038000     1.746000  0.5671000     -0.3654000     0.7586000 
1 1 1 36 5  12 o 1.092000  0.3394000     1.145000  0.4835000     1.039000  0.4763000     0.1055000      0.6787000 
1 1 1 36 6  2  o 4.982000  0.1860000     ?         ?             4.982000  0.1860000     ?              ?         
1 1 1 36 6  3  o 4.994000  0.1540000     4.667000  0.1960000     5.320000  0.2377000     -0.6526000     0.3081000 
1 1 1 36 6  4  o 1.018000  0.3373000     1.043000  0.5043000     0.9923000 0.4480000     0.5095000E-01  0.6745000 
1 1 1 36 6  5  f 3.202000  0.3193000     ?         ?             3.202000  0.3193000     ?              ?         
1 1 1 36 6  6  o 2.694000  0.3947000     2.157000  0.7744000     3.230000  0.1532000     -1.072000      0.7894000 
1 1 1 36 6  7  o 1.243000  0.3260000     1.329000  0.4641000     1.157000  0.4579000     0.1724000      0.6519000 
1 1 1 36 6  8  o 0.8860000 0.2897000     0.9220000 0.4052000     0.8500000 0.4142000     0.7194000E-01  0.5794000 
1 1 1 36 6  9  o 2.030000  0.3964000     1.878000  0.4588000     2.183000  0.6465000     -0.3052000     0.7928000 
1 1 1 36 6  10 o 1.884000  0.3633000     1.853000  0.4834000     1.914000  0.5424000     -0.6095000E-01 0.7266000 
1 1 1 36 6  11 o 1.403000  0.3777000     1.308000  0.5080000     1.499000  0.5591000     -0.1916000     0.7554000 
1 1 1 36 6  12 o 0.9291000 0.3097000     0.8071000 0.3910000     1.051000  0.4803000     -0.2439000     0.6194000 
1 1 1 36 7  2  o 1.352000  0.3075000     1.093000  0.3829000     1.612000  0.4812000     -0.5190000     0.6149000 
1 1 1 36 7  3  f 3.211000  0.2790000     2.999000  0.4978000     3.423000  0.2522000     -0.4237000     0.5580000 
1 1 1 36 7  4  o 1.553000  0.6382000     ?         ?             1.553000  0.6382000     ?              ?         
1 1 1 36 7  5  o 4.602000  0.3113000     4.865000  0.5131000     4.339000  0.3528000     0.5262000      0.6227000 
1 1 1 36 7  6  o 3.232000  0.1562000     3.076000  0.2167000     3.387000  0.2251000     -0.3112000     0.3125000 
1 1 1 36 7  7  o 1.485000  0.2980000     1.810000  0.3823000     1.160000  0.4573000     0.6501000      0.5961000 
1 1 1 36 7  8  o 2.204000  0.3306000     2.171000  0.3893000     2.237000  0.5344000     -0.6582000E-01 0.6612000 
1 1 1 36 7  9  o 1.244000  0.3412000     1.426000  0.4993000     1.063000  0.4651000     0.3630000      0.6824000 
1 1 1 36 7  10 o 1.697000  0.3668000     1.832000  0.4947000     1.563000  0.5419000     0.2691000      0.7337000 
1 1 1 36 7  11 o 2.739000  0.3011000     2.667000  0.4139000     2.812000  0.4374000     -0.1446000     0.6022000 
1 1 1 36 7  12 o 2.193000  0.3791000     2.285000  0.4987000     2.101000  0.5711000     0.1840000      0.7582000 
1 1 1 36 8  1  o 1.509000  0.4995000     ?         ?             1.509000  0.4995000     ?              ?         
1 1 1 36 8  2  o 2.776000  0.2492000     2.649000  0.4259000     2.902000  0.2587000     -0.2528000     0.4983000 
1 1 1 36 8  3  o 3.059000  0.2860000     3.212000  0.4802000     2.907000  0.3107000     0.3047000      0.5720000 
1 1 1 36 8  4  o 1.390000  0.6236000     ?         ?             1.390000  0.6236000     ?              ?         
1 1 1 36 8  5  o 1.391000  0.4311000     1.786000  0.7347000     0.9968000 0.4510000     0.7888000      0.8621000 
1 1 1 36 8  6  o 2.682000  0.1819000     2.493000  0.2460000     2.871000  0.2680000     -0.3776000     0.3638000 
1 1 1 36 8  7  o 1.094000  0.2984000     1.321000  0.4456000     0.8662000 0.3970000     0.4551000      0.5968000 
1 1 1 36 8  8  o 2.793000  0.2878000     2.730000  0.4582000     2.857000  0.3486000     -0.1276000     0.5757000 
1 1 1 36 8  9  o 1.177000  0.3449000     1.151000  0.4777000     1.202000  0.4977000     -0.5055000E-01 0.6898000 
1 1 1 36 8  10 o 1.776000  0.3808000     1.868000  0.5165000     1.683000  0.5596000     0.1848000      0.7615000 
1 1 1 36 8  11 o 3.037000  0.2743000     2.887000  0.3951000     3.188000  0.3807000     -0.3020000     0.5487000 
1 1 1 36 8  12 o 2.908000  0.3337000     3.289000  0.3943000     2.526000  0.5386000     0.7630000      0.6675000 
1 1 1 36 9  1  o 3.218000  0.2052000     ?         ?             3.218000  0.2052000     ?              ?         
1 1 1 36 9  2  o 3.596000  0.2396000     3.833000  0.3515000     3.359000  0.3256000     0.4743000      0.4792000 
1 1 1 36 9  3  o 3.622000  0.2543000     3.796000  0.4259000     3.447000  0.2782000     0.3493000      0.5087000 
1 1 1 36 9  4  o 2.965000  0.3549000     2.948000  0.6164000     2.981000  0.3518000     -0.3261000E-01 0.7097000 
1 1 1 36 9  5  o 0.7813000 0.2602000     0.8858000 0.4082000     0.6769000 0.3226000     0.2090000      0.5203000 
1 1 1 36 9  6  o 1.108000  0.3065000     1.174000  0.4342000     1.042000  0.4325000     0.1322000      0.6129000 
1 1 1 36 9  7  o 1.430000  0.3303000     1.613000  0.4577000     1.247000  0.4763000     0.3658000      0.6606000 
1 1 1 36 9  8  o 1.358000  0.3596000     1.089000  0.4872000     1.627000  0.5291000     -0.5380000     0.7192000 
1 1 1 36 9  9  o 3.487000  0.2187000     3.302000  0.3043000     3.673000  0.3141000     -0.3714000     0.4374000 
1 1 1 36 9  10 o 1.595000  0.3863000     1.503000  0.5284000     1.687000  0.5637000     -0.1839000     0.7726000 
1 1 1 36 9  11 o 1.384000  0.3758000     1.519000  0.5341000     1.250000  0.5289000     0.2694000      0.7517000 
1 1 1 36 9  12 o 0.9353000 0.3364000     0.8439000 0.4259000     1.027000  0.5209000     -0.1827000     0.6729000 
1 1 1 36 10 0  o 0.8257000 0.4905000     0.8257000 0.4905000     0.8257000 0.4905000     0.000000       0.000000  
1 1 1 36 10 1  o 1.371000  0.3242000     1.317000  0.4729000     1.424000  0.4436000     -0.1067000     0.6484000 
1 1 1 36 10 2  o 2.713000  0.3009000     2.756000  0.5057000     2.670000  0.3261000     0.8610000E-01  0.6017000 
1 1 1 36 10 3  o 1.521000  0.3831000     1.178000  0.5376000     1.864000  0.5460000     -0.6863000     0.7662000 
1 1 1 36 10 4  o 2.261000  0.2124000     2.325000  0.3414000     2.196000  0.2529000     0.1289000      0.4249000 
1 1 1 36 10 5  o 1.058000  0.2835000     0.7899000 0.3591000     1.326000  0.4387000     -0.5359000     0.5670000 
1 1 1 36 10 6  o 3.105000  0.1911000     2.950000  0.2708000     3.260000  0.2697000     -0.3105000     0.3822000 
1 1 1 36 10 7  o 0.9843000 0.3174000     0.8563000 0.3942000     1.112000  0.4977000     -0.2558000     0.6349000 
1 1 1 36 10 8  o 1.234000  0.3544000     1.160000  0.4840000     1.308000  0.5178000     -0.1482000     0.7088000 
1 1 1 36 10 9  o 1.399000  0.3648000     1.288000  0.4984000     1.510000  0.5329000     -0.2224000     0.7297000 
1 1 1 36 10 10 o 3.331000  0.2496000     3.052000  0.3664000     3.610000  0.3391000     -0.5581000     0.4992000 
1 1 1 36 10 11 o 1.092000  0.3406000     1.263000  0.5205000     0.9196000 0.4395000     0.3437000      0.6812000 
1 1 1 36 11 0  f 5.654000  0.1659000     5.654000  0.1659000     5.654000  0.1659000     0.000000       0.000000  
1 1 1 36 11 1  o 5.616000  0.1304000     5.518000  0.1855000     5.714000  0.1833000     -0.1959000     0.2608000 
1 1 1 36 11 2  o 1.793000  0.2898000     2.066000  0.2937000     1.520000  0.4996000     0.5460000      0.5795000 
1 1 1 36 11 3  o 2.122000  0.2986000     2.299000  0.4797000     1.945000  0.3559000     0.3544000      0.5973000 
1 1 1 36 11 4  o 3.263000  0.1475000     3.162000  0.2004000     3.364000  0.2165000     -0.2020000     0.2951000 
1 1 1 36 11 5  o 2.544000  0.2131000     2.359000  0.3078000     2.728000  0.2949000     -0.3689000     0.4263000 
1 1 1 36 11 6  o 0.9315000 0.2889000     1.087000  0.4428000     0.7763000 0.3713000     0.3103000      0.5778000 
1 1 1 36 11 7  o 3.759000  0.2182000     4.300000  0.3094000     3.218000  0.3078000     1.082000       0.4364000 
1 1 1 36 11 8  o 1.308000  0.3554000     1.600000  0.5217000     1.016000  0.4828000     0.5841000      0.7108000 
1 1 1 36 11 9  o 2.122000  0.3453000     2.159000  0.4681000     2.086000  0.5078000     0.7359000E-01  0.6906000 
1 1 1 36 11 10 o 2.529000  0.3194000     2.322000  0.4602000     2.736000  0.4431000     -0.4149000     0.6388000 
1 1 1 36 11 11 o 2.811000  0.3205000     2.852000  0.4264000     2.770000  0.4786000     0.8142000E-01  0.6410000 
1 1 1 36 12 0  o 1.770000  0.3717000     1.770000  0.3717000     1.770000  0.3717000     -0.000000      0.000000  
1 1 1 36 12 1  o 1.498000  0.2675000     1.665000  0.3941000     1.331000  0.3618000     0.3345000      0.5350000 
1 1 1 36 12 2  o 1.225000  0.2754000     1.418000  0.3805000     1.031000  0.3983000     0.3866000      0.5508000 
1 1 1 36 12 3  o 5.071000  0.1351000     4.715000  0.2005000     5.428000  0.1811000     -0.7127000     0.2702000 
1 1 1 36 12 4  o 3.368000  0.1642000     3.319000  0.2277000     3.417000  0.2366000     -0.9762000E-01 0.3284000 
1 1 1 36 12 5  o 2.369000  0.3136000     2.871000  0.2778000     1.866000  0.5624000     1.005000       0.6273000 
1 1 1 36 12 6  o 3.091000  0.2476000     2.915000  0.3064000     3.266000  0.3889000     -0.3505000     0.4951000 
1 1 1 36 12 7  o 2.331000  0.3488000     1.370000  0.6232000     3.293000  0.3135000     -1.923000      0.6976000 
1 1 1 36 12 8  o 2.230000  0.4018000     2.313000  0.4724000     2.147000  0.6500000     0.1659000      0.8036000 
1 1 1 36 12 9  o 3.486000  0.2288000     3.423000  0.3142000     3.549000  0.3328000     -0.1258000     0.4577000 
1 1 1 36 12 10 o 3.442000  0.2567000     2.892000  0.3975000     3.991000  0.3250000     -1.099000      0.5135000 
1 1 1 36 12 11 o 0.9274000 0.3124000     0.8098000 0.3956000     1.045000  0.4835000     -0.2352000     0.6247000 
1 1 1 36 13 0  o 2.801000  0.2660000     2.801000  0.2660000     2.801000  0.2660000     -0.000000      0.000000  
1 1 1 36 13 1  o 1.945000  0.2236000     1.970000  0.3563000     1.919000  0.2704000     0.5128000E-01  0.4473000 
1 1 1 36 13 2  o 1.069000  0.3167000     1.247000  0.4958000     0.8913000 0.3942000     0.3557000      0.6334000 
1 1 1 36 13 3  o 2.181000  0.2377000     1.883000  0.3736000     2.479000  0.2940000     -0.5952000     0.4754000 
1 1 1 36 13 4  o 2.693000  0.2121000     2.486000  0.3154000     2.900000  0.2835000     -0.4135000     0.4241000 
1 1 1 36 13 5  o 3.849000  0.1684000     3.752000  0.2353000     3.945000  0.2409000     -0.1930000     0.3368000 
1 1 1 36 13 6  o 3.458000  0.2104000     3.418000  0.3094000     3.497000  0.2852000     -0.7900000E-01 0.4208000 
1 1 1 36 13 7  o 3.896000  0.2265000     3.510000  0.3663000     4.281000  0.2664000     -0.7703000     0.4529000 
1 1 1 36 13 8  o 2.605000  0.3109000     2.187000  0.4626000     3.023000  0.4156000     -0.8354000     0.6218000 
1 1 1 36 13 9  o 2.983000  0.3579000     2.469000  0.5633000     3.496000  0.4416000     -1.027000      0.7158000 
1 1 1 36 13 10 o 2.640000  0.3319000     2.895000  0.4001000     2.384000  0.5297000     0.5111000      0.6638000 
1 1 1 36 13 11 o 1.113000  0.3511000     1.123000  0.4929000     1.103000  0.5002000     0.1980000E-01  0.7023000 
1 1 1 36 14 0  o 1.558000  0.5117000     1.558000  0.5117000     1.558000  0.5117000     0.000000       0.000000  
1 1 1 36 14 1  o 1.261000  0.2889000     0.9382000 0.4224000     1.585000  0.3944000     -0.6466000     0.5779000 
1 1 1 36 14 2  o 3.428000  0.1686000     3.321000  0.2830000     3.534000  0.1834000     -0.2124000     0.3372000 
1 1 1 36 14 3  o 3.540000  0.1982000     3.574000  0.2192000     3.507000  0.3304000     0.6768000E-01  0.3965000 
1 1 1 36 14 4  o 3.878000  0.2459000     4.028000  0.2573000     3.728000  0.4191000     0.3000000      0.4917000 
1 1 1 36 14 5  o 2.324000  0.3225000     2.168000  0.4002000     2.481000  0.5058000     -0.3128000     0.6450000 
1 1 1 36 14 6  o 1.676000  0.3893000     1.412000  0.6132000     1.939000  0.4799000     -0.5264000     0.7786000 
1 1 1 36 14 7  o 1.534000  0.3764000     1.369000  0.5039000     1.699000  0.5592000     -0.3303000     0.7527000 
1 1 1 36 14 8  o 3.001000  0.2606000     2.972000  0.3596000     3.030000  0.3773000     -0.5830000E-01 0.5213000 
1 1 1 36 14 9  o 1.595000  0.3904000     1.689000  0.5455000     1.500000  0.5586000     0.1883000      0.7808000 
1 1 1 36 14 10 o 1.612000  0.4048000     1.659000  0.5607000     1.566000  0.5839000     0.9378000E-01  0.8096000 
1 1 1 36 14 11 o 1.061000  0.3458000     1.169000  0.5106000     0.9538000 0.4664000     0.2149000      0.6916000 
1 1 1 36 15 0  o 1.475000  0.6538000     1.475000  0.6538000     1.475000  0.6538000     0.000000       0.000000  
1 1 1 36 15 1  o 2.389000  0.3162000     2.119000  0.5492000     2.660000  0.3134000     -0.5407000     0.6324000 
1 1 1 36 15 2  o 3.073000  0.2029000     3.143000  0.3116000     3.003000  0.2600000     0.1406000      0.4058000 
1 1 1 36 15 3  o 2.529000  0.2720000     2.186000  0.4721000     2.871000  0.2703000     -0.6854000     0.5440000 
1 1 1 36 15 4  o 1.590000  0.3365000     1.982000  0.4243000     1.198000  0.5225000     0.7839000      0.6731000 
1 1 1 36 15 5  o 3.967000  0.2187000     4.073000  0.3425000     3.862000  0.2720000     0.2113000      0.4373000 
1 1 1 36 15 6  o 1.827000  0.3498000     1.886000  0.4839000     1.768000  0.5051000     0.1183000      0.6995000 
1 1 1 36 15 7  o 1.537000  0.4040000     1.571000  0.5414000     1.503000  0.5999000     0.6819000E-01  0.8080000 
1 1 1 36 15 8  o 2.682000  0.3090000     2.826000  0.3942000     2.539000  0.4761000     0.2874000      0.6181000 
1 1 1 36 15 9  o 2.611000  0.3212000     2.386000  0.4800000     2.836000  0.4270000     -0.4495000     0.6424000 
1 1 1 36 15 10 o 3.186000  0.2924000     2.796000  0.4485000     3.575000  0.3753000     -0.7792000     0.5848000 
1 1 1 36 16 0  o 1.408000  0.6295000     1.408000  0.6295000     1.408000  0.6295000     -0.000000      0.000000  
1 1 1 36 16 1  o 1.178000  0.3095000     1.053000  0.4382000     1.303000  0.4371000     -0.2494000     0.6189000 
1 1 1 36 16 2  o 1.742000  0.3102000     1.339000  0.5392000     2.145000  0.3071000     -0.8059000     0.6205000 
1 1 1 36 16 3  o 1.904000  0.3390000     2.002000  0.5667000     1.805000  0.3721000     0.1968000      0.6779000 
1 1 1 36 16 4  o 3.810000  0.2597000     3.457000  0.4577000     4.163000  0.2457000     -0.7054000     0.5195000 
1 1 1 36 16 5  o 1.176000  0.3375000     1.003000  0.4392000     1.349000  0.5125000     -0.3460000     0.6749000 
1 1 1 36 16 6  o 1.713000  0.3548000     1.937000  0.4814000     1.489000  0.5213000     0.4485000      0.7096000 
1 1 1 36 16 7  o 0.9445000 0.3172000     0.9509000 0.4418000     0.9380000 0.4554000     0.1293000E-01  0.6345000 
1 1 1 36 16 8  f 1.614000  0.3931000     1.613000  0.5537000     1.615000  0.5581000     -0.1976000E-02 0.7861000 
1 1 1 36 16 9  f 2.007000  0.4022000     2.090000  0.5402000     1.925000  0.5961000     0.1656000      0.8044000 
1 1 1 36 16 10 o 1.913000  0.3963000     1.679000  0.5643000     2.147000  0.5567000     -0.4673000     0.7927000 
1 1 1 36 17 0  o 2.455000  0.3318000     2.455000  0.3318000     2.455000  0.3318000     0.000000       0.000000  
1 1 1 36 17 1  o 4.645000  0.1499000     4.665000  0.2278000     4.625000  0.1950000     0.4026000E-01  0.2999000 
1 1 1 36 17 2  o 1.164000  0.3123000     1.482000  0.4875000     0.8464000 0.3907000     0.6360000      0.6247000 
1 1 1 36 17 3  o 2.627000  0.3075000     2.961000  0.4729000     2.292000  0.3931000     0.6688000      0.6150000 
1 1 1 36 17 4  o 1.405000  0.3346000     1.274000  0.5180000     1.535000  0.4235000     -0.2612000     0.6691000 
1 1 1 36 17 5  o 1.649000  0.3582000     1.409000  0.4910000     1.888000  0.5216000     -0.4790000     0.7163000 
1 1 1 36 17 6  o 1.869000  0.3778000     1.751000  0.5067000     1.987000  0.5607000     -0.2360000     0.7557000 
1 1 1 36 17 7  o 3.176000  0.2568000     3.033000  0.3485000     3.319000  0.3772000     -0.2853000     0.5135000 
1 1 1 36 17 8  o 2.208000  0.3651000     1.722000  0.5583000     2.694000  0.4705000     -0.9725000     0.7301000 
1 1 1 36 17 9  o 3.046000  0.3002000     2.894000  0.4324000     3.197000  0.4166000     -0.3024000     0.6004000 
1 1 1 36 17 10 o 1.467000  0.4169000     1.369000  0.5521000     1.565000  0.6248000     -0.1967000     0.8338000 
1 1 1 36 18 0  o 3.526000  0.2386000     3.526000  0.2386000     3.526000  0.2386000     -0.000000      0.000000  
1 1 1 36 18 1  o 2.249000  0.2697000     1.812000  0.4479000     2.686000  0.3004000     -0.8747000     0.5393000 
1 1 1 36 18 2  o 0.9285000 0.2882000     1.079000  0.4453000     0.7783000 0.3659000     0.3004000      0.5763000 
1 1 1 36 18 3  o 2.352000  0.2911000     2.306000  0.4862000     2.398000  0.3204000     -0.9239000E-01 0.5823000 
1 1 1 36 18 4  o 1.460000  0.3510000     1.782000  0.5479000     1.138000  0.4388000     0.6435000      0.7020000 
1 1 1 36 18 5  o 2.345000  0.3021000     2.162000  0.5143000     2.528000  0.3171000     -0.3659000     0.6042000 
1 1 1 36 18 6  f 4.391000  0.2701000     4.664000  0.3450000     4.117000  0.4157000     0.5464000      0.5402000 
1 1 1 36 18 7  f 1.609000  0.3834000     1.416000  0.5239000     1.803000  0.5599000     -0.3865000     0.7668000 
1 1 1 36 18 8  o 2.289000  0.3910000     2.028000  0.6042000     2.551000  0.4965000     -0.5233000     0.7820000 
1 1 1 36 18 9  o 1.139000  0.3542000     0.9157000 0.4387000     1.363000  0.5563000     -0.4474000     0.7084000 
1 1 1 36 18 10 o 2.129000  0.4001000     2.924000  0.5341000     1.334000  0.5958000     1.589000       0.8002000 
1 1 1 36 19 0  o 0.7735000 0.4852000     0.7735000 0.4852000     0.7735000 0.4852000     0.000000       0.000000  
1 1 1 36 19 1  o 1.364000  0.3200000     1.682000  0.4693000     1.046000  0.4352000     0.6357000      0.6400000 
1 1 1 36 19 2  o 2.460000  0.2419000     2.610000  0.3292000     2.310000  0.3544000     0.3007000      0.4837000 
1 1 1 36 19 3  o 2.220000  0.2880000     1.848000  0.4675000     2.591000  0.3363000     -0.7430000     0.5759000 
1 1 1 36 19 4  o 2.820000  0.2543000     3.221000  0.3859000     2.420000  0.3311000     0.8010000      0.5085000 
1 1 1 36 19 5  o 1.919000  0.3306000     1.540000  0.5551000     2.297000  0.3594000     -0.7568000     0.6613000 
1 1 1 36 19 6  o 1.089000  0.3533000     1.095000  0.5072000     1.083000  0.4920000     0.1183000E-01  0.7066000 
1 1 1 36 19 7  o 2.807000  0.3039000     3.128000  0.3569000     2.486000  0.4919000     0.6418000      0.6077000 
1 1 1 36 19 8  o 2.620000  0.3408000     2.284000  0.5136000     2.956000  0.4481000     -0.6728000     0.6815000 
1 1 1 36 19 9  f 1.868000  0.4035000     1.628000  0.5704000     2.107000  0.5710000     -0.4784000     0.8070000 
1 1 1 36 20 0  o 0.6638000 0.4450000     0.6638000 0.4450000     0.6638000 0.4450000     -0.000000      0.000000  
1 1 1 36 20 1  o 1.583000  0.3090000     1.078000  0.4540000     2.087000  0.4194000     -1.008000      0.6181000 
1 1 1 36 20 2  f 0.9243000 0.2922000     1.001000  0.4325000     0.8480000 0.3931000     0.1527000      0.5845000 
1 1 1 36 20 3  o 3.512000  0.1910000     3.724000  0.2554000     3.301000  0.2840000     0.4230000      0.3819000 
1 1 1 36 20 4  o 1.460000  0.3294000     2.113000  0.5400000     0.8062000 0.3773000     1.307000       0.6588000 
1 1 1 36 20 5  o 1.999000  0.3721000     2.249000  0.5478000     1.749000  0.5038000     0.4999000      0.7443000 
1 1 1 36 20 6  o 3.301000  0.2508000     3.112000  0.4236000     3.489000  0.2688000     -0.3773000     0.5016000 
1 1 1 36 20 7  o 2.999000  0.2905000     3.075000  0.3762000     2.923000  0.4427000     0.1525000      0.5810000 
1 1 1 36 20 8  o 2.106000  0.3868000     1.948000  0.5425000     2.264000  0.5516000     -0.3155000     0.7737000 
1 1 1 36 20 9  o 1.428000  0.4018000     1.621000  0.5736000     1.235000  0.5628000     0.3859000      0.8036000 
1 1 1 36 21 0  o 0.8162000 0.5085000     0.8162000 0.5085000     0.8162000 0.5085000     0.000000       0.000000  
1 1 1 36 21 1  o 1.565000  0.3458000     1.802000  0.4838000     1.327000  0.4944000     0.4748000      0.6917000 
1 1 1 36 21 2  o 2.006000  0.3116000     1.923000  0.4495000     2.088000  0.4317000     -0.1654000     0.6232000 
1 1 1 36 21 3  o 1.180000  0.3012000     0.7236000 0.3541000     1.636000  0.4873000     -0.9125000     0.6024000 
1 1 1 36 21 4  o 3.728000  0.2321000     3.385000  0.3903000     4.071000  0.2514000     -0.6851000     0.4643000 
1 1 1 36 21 5  o 2.555000  0.3540000     2.352000  0.6213000     2.758000  0.3395000     -0.4058000     0.7081000 
1 1 1 36 21 6  o 1.655000  0.3770000     1.958000  0.5752000     1.351000  0.4875000     0.6076000      0.7540000 
1 1 1 36 21 7  o 1.524000  0.4092000     1.554000  0.5919000     1.494000  0.5653000     0.5967000E-01  0.8184000 
1 1 1 36 21 8  o 1.514000  0.4082000     1.669000  0.5562000     1.360000  0.5977000     0.3086000      0.8164000 
1 1 1 36 21 9  o 1.547000  0.6632000     ?         ?             1.547000  0.6632000     ?              ?         
1 1 1 36 22 0  o 2.136000  0.5005000     2.136000  0.5005000     2.136000  0.5005000     0.000000       0.000000  
1 1 1 36 22 1  o 2.409000  0.2828000     2.261000  0.4227000     2.556000  0.3758000     -0.2953000     0.5656000 
1 1 1 36 22 2  o 1.722000  0.3539000     1.714000  0.4971000     1.729000  0.5039000     -0.1460000E-01 0.7078000 
1 1 1 36 22 3  o 2.261000  0.3053000     1.805000  0.5037000     2.716000  0.3452000     -0.9105000     0.6106000 
1 1 1 36 22 4  f 1.183000  0.3508000     1.113000  0.4780000     1.253000  0.5135000     -0.1397000     0.7016000 
1 1 1 36 22 5  o 2.478000  0.2980000     2.218000  0.4659000     2.738000  0.3717000     -0.5204000     0.5960000 
1 1 1 36 22 6  o 1.552000  0.3605000     1.256000  0.5433000     1.848000  0.4740000     -0.5921000     0.7210000 
1 1 1 36 22 7  o 2.914000  0.3253000     2.695000  0.5621000     3.134000  0.3277000     -0.4389000     0.6507000 
1 1 1 36 22 8  o 1.218000  0.3857000     1.177000  0.5225000     1.259000  0.5674000     -0.8164000E-01 0.7713000 
1 1 1 36 23 0  o 4.537000  0.2411000     4.537000  0.2411000     4.537000  0.2411000     0.000000       0.000000  
1 1 1 36 23 1  o 1.873000  0.3457000     1.852000  0.4922000     1.895000  0.4856000     -0.4251000E-01 0.6914000 
1 1 1 36 23 2  o 2.016000  0.3426000     1.744000  0.5151000     2.289000  0.4519000     -0.5448000     0.6853000 
1 1 1 36 23 3  o 2.755000  0.3111000     3.147000  0.4105000     2.363000  0.4676000     0.7839000      0.6222000 
1 1 1 36 23 4  o 3.386000  0.2498000     3.061000  0.3867000     3.711000  0.3164000     -0.6494000     0.4997000 
1 1 1 36 23 5  o 2.033000  0.3475000     2.129000  0.4758000     1.937000  0.5067000     0.1911000      0.6951000 
1 1 1 36 23 6  o 1.740000  0.3873000     1.674000  0.6089000     1.806000  0.4788000     -0.1323000     0.7746000 
1 1 1 36 23 7  o 1.047000  0.3412000     1.207000  0.5374000     0.8858000 0.4205000     0.3215000      0.6824000 
1 1 1 36 23 8  o 1.348000  0.4526000     1.733000  0.7794000     0.9640000 0.4602000     0.7686000      0.9051000 
1 1 1 36 24 0  o 2.306000  0.4989000     2.306000  0.4989000     2.306000  0.4989000     0.000000       0.000000  
1 1 1 36 24 1  o 2.458000  0.3047000     2.935000  0.3677000     1.980000  0.4859000     0.9551000      0.6093000 
1 1 1 36 24 2  o 2.511000  0.3528000     2.324000  0.5872000     2.698000  0.3912000     -0.3748000     0.7056000 
1 1 1 36 24 3  o 2.346000  0.3626000     2.512000  0.4687000     2.180000  0.5533000     0.3329000      0.7252000 
1 1 1 36 24 4  o 2.373000  0.3215000     1.898000  0.5293000     2.847000  0.3651000     -0.9488000     0.6430000 
1 1 1 36 24 5  o 2.418000  0.3192000     2.418000  0.4533000     2.419000  0.4495000     -0.7043000E-03 0.6384000 
1 1 1 36 24 6  o 1.463000  0.3803000     1.150000  0.4925000     1.775000  0.5797000     -0.6247000     0.7607000 
1 1 1 36 24 7  o 1.029000  0.3446000     1.049000  0.5007000     1.009000  0.4737000     0.3963000E-01  0.6892000 
1 1 1 36 25 0  o 0.7859000 0.5322000     0.7859000 0.5322000     0.7859000 0.5322000     -0.000000      0.000000  
1 1 1 36 25 1  o 2.814000  0.3354000     2.585000  0.5398000     3.042000  0.3982000     -0.4571000     0.6708000 
1 1 1 36 25 2  o 1.768000  0.4055000     1.893000  0.5786000     1.642000  0.5683000     0.2519000      0.8110000 
1 1 1 36 25 3  o 3.565000  0.2319000     3.577000  0.3103000     3.554000  0.3446000     0.2287000E-01  0.4637000 
1 1 1 36 25 4  o 3.411000  0.2516000     3.240000  0.3361000     3.582000  0.3744000     -0.3423000     0.5031000 
1 1 1 36 25 5  o 1.271000  0.3787000     1.064000  0.4857000     1.478000  0.5811000     -0.4136000     0.7573000 
1 1 1 36 25 6  o 1.551000  0.4121000     1.646000  0.5652000     1.456000  0.5999000     0.1895000      0.8242000 
1 1 1 36 25 7  o 0.8798000 0.4344000     ?         ?             0.8798000 0.4344000     ?              ?         
1 1 1 36 26 0  o 0.8084000 0.5357000     0.8084000 0.5357000     0.8084000 0.5357000     0.000000       0.000000  
1 1 1 36 26 1  o 1.495000  0.4053000     1.852000  0.6120000     1.138000  0.5316000     0.7147000      0.8106000 
1 1 1 36 26 2  o 5.765000  0.2257000     6.256000  0.2623000     5.273000  0.3673000     0.9832000      0.4513000 
1 1 1 36 26 3  o 3.423000  0.2797000     3.482000  0.3792000     3.364000  0.4113000     0.1174000      0.5594000 
1 1 1 36 26 4  o 1.955000  0.3832000     2.216000  0.5245000     1.694000  0.5588000     0.5222000      0.7663000 
1 1 1 36 26 5  o 1.525000  0.3754000     1.927000  0.5431000     1.122000  0.5185000     0.8050000      0.7508000 
1 1 1 36 26 6  f 1.260000  0.3678000     1.096000  0.4998000     1.424000  0.5398000     -0.3283000     0.7357000 
1 1 1 36 27 0  o 0.6290000 0.4534000     0.6290000 0.4534000     0.6290000 0.4534000     0.000000       0.000000  
1 1 1 36 27 1  o 1.507000  0.4112000     1.557000  0.5767000     1.456000  0.5862000     0.1010000      0.8223000 
1 1 1 36 27 2  o 2.865000  0.3486000     2.613000  0.5249000     3.116000  0.4588000     -0.5035000     0.6971000 
1 1 1 36 27 3  o 1.618000  0.3845000     2.095000  0.5630000     1.141000  0.5238000     0.9533000      0.7690000 
1 1 1 36 27 4  o 1.282000  0.3908000     1.266000  0.5404000     1.298000  0.5648000     -0.3152000E-01 0.7817000 
1 1 1 36 27 5  o 1.168000  0.3577000     1.001000  0.4712000     1.336000  0.5384000     -0.3351000     0.7155000 
1 1 1 36 28 0  o 1.456000  0.6786000     1.456000  0.6786000     1.456000  0.6786000     -0.000000      0.000000  
1 1 1 36 28 1  o 1.473000  0.3906000     1.573000  0.5594000     1.373000  0.5454000     0.2001000      0.7812000 
1 1 1 36 28 2  o 3.245000  0.2700000     3.309000  0.3679000     3.181000  0.3953000     0.1283000      0.5401000 
1 1 1 36 28 3  o 1.398000  0.3829000     1.542000  0.5556000     1.254000  0.5270000     0.2881000      0.7658000 
1 1 1 36 28 4  o 3.092000  0.2818000     2.902000  0.4103000     3.283000  0.3862000     -0.3805000     0.5635000 
1 1 1 36 29 0  o 4.472000  0.3101000     4.472000  0.3101000     4.472000  0.3101000     -0.000000      0.000000  
1 1 1 36 29 1  o 3.081000  0.2961000     3.214000  0.3968000     2.949000  0.4396000     0.2651000      0.5922000 
1 1 1 36 29 2  o 2.872000  0.3013000     2.745000  0.4289000     2.999000  0.4234000     -0.2540000     0.6027000 
1 1 1 36 29 3  o 3.381000  0.2733000     3.567000  0.3536000     3.196000  0.4167000     0.3709000      0.5465000 
1 1 1 36 30 0  o 1.101000  0.6397000     1.101000  0.6397000     1.101000  0.6397000     -0.000000      0.000000  
1 1 1 36 30 1  o 2.325000  0.4584000     1.929000  0.6308000     2.722000  0.6653000     -0.7929000     0.9168000 
1 1 1 37 0  3  o 0.5735000 0.3832000     0.5735000 0.3832000     0.5735000 0.3832000     0.000000       0.000000  
1 1 1 37 0  4  o 0.4898000 0.3518000     0.4898000 0.3518000     0.4898000 0.3518000     0.000000       0.000000  
1 1 1 37 0  5  o 1.445000  0.8125000     1.445000  0.8125000     1.445000  0.8125000     0.000000       0.000000  
1 1 1 37 0  6  o 3.874000  0.3066000     3.874000  0.3066000     3.874000  0.3066000     -0.000000      0.000000  
1 1 1 37 0  7  o 2.403000  0.5604000     2.403000  0.5604000     2.403000  0.5604000     -0.000000      0.000000  
1 1 1 37 0  8  o 0.4787000 0.3362000     0.4787000 0.3362000     0.4787000 0.3362000     0.000000       0.000000  
1 1 1 37 0  9  o 3.051000  0.4028000     3.051000  0.4028000     3.051000  0.4028000     0.000000       0.000000  
1 1 1 37 0  10 o 2.574000  0.3575000     2.574000  0.3575000     2.574000  0.3575000     0.000000       0.000000  
1 1 1 37 0  11 o 1.346000  0.6661000     1.346000  0.6661000     1.346000  0.6661000     0.000000       0.000000  
1 1 1 37 1  3  o 3.239000  0.1543000     3.211000  0.2069000     3.267000  0.2290000     -0.5572000E-01 0.3086000 
1 1 1 37 1  4  o 1.210000  0.3362000     1.254000  0.4754000     1.165000  0.4754000     0.8947000E-01  0.6723000 
1 1 1 37 1  5  o 2.756000  0.4803000     2.778000  0.6581000     2.733000  0.6997000     0.4491000E-01  0.9606000 
1 1 1 37 1  6  o 2.803000  0.2858000     2.663000  0.4098000     2.942000  0.3986000     -0.2791000     0.5717000 
1 1 1 37 1  7  o 2.686000  0.2316000     2.742000  0.4269000     2.630000  0.1795000     0.1119000      0.4631000 
1 1 1 37 1  8  o 0.8905000 0.2711000     0.9074000 0.3896000     0.8736000 0.3770000     0.3388000E-01  0.5421000 
1 1 1 37 1  9  o 0.8875000 0.4236000     0.8875000 0.4236000     ?         ?             ?              ?         
1 1 1 37 1  10 o 3.336000  0.1977000     3.164000  0.3200000     3.508000  0.2323000     -0.3442000     0.3954000 
1 1 1 37 1  11 o 1.413000  0.3774000     1.663000  0.5654000     1.163000  0.4999000     0.4993000      0.7547000 
1 1 1 37 2  3  f 2.781000  0.1791000     2.912000  0.2245000     2.651000  0.2791000     0.2611000      0.3582000 
1 1 1 37 2  4  o 1.192000  0.3393000     1.191000  0.4730000     1.193000  0.4865000     -0.1326000E-02 0.6786000 
1 1 1 37 2  5  o 1.529000  0.4536000     1.735000  0.6799000     1.322000  0.6006000     0.4130000      0.9072000 
1 1 1 37 2  6  o 1.515000  0.3801000     1.617000  0.5332000     1.413000  0.5418000     0.2039000      0.7601000 
1 1 1 37 2  7  o 4.052000  0.1869000     3.568000  0.3483000     4.535000  0.1355000     -0.9668000     0.3737000 
1 1 1 37 2  8  o 1.484000  0.2923000     1.840000  0.4238000     1.128000  0.4025000     0.7118000      0.5845000 
1 1 1 37 2  10 o 2.580000  0.3259000     3.236000  0.5134000     1.924000  0.4016000     1.312000       0.6518000 
1 1 1 37 2  11 o 1.734000  0.4169000     2.266000  0.5931000     1.203000  0.5861000     1.063000       0.8338000 
1 1 1 37 3  3  o 1.112000  0.3031000     1.072000  0.4076000     1.153000  0.4487000     -0.8115000E-01 0.6062000 
1 1 1 37 3  4  o 3.667000  0.1952000     3.501000  0.2724000     3.834000  0.2796000     -0.3330000     0.3904000 
1 1 1 37 3  5  o 2.099000  0.4241000     1.984000  0.6899000     2.213000  0.4934000     -0.2289000     0.8482000 
1 1 1 37 3  6  o 1.929000  0.3748000     2.022000  0.4932000     1.836000  0.5645000     0.1859000      0.7496000 
1 1 1 37 3  7  o 1.443000  0.2442000     1.489000  0.3586000     1.397000  0.3316000     0.9206000E-01  0.4884000 
1 1 1 37 3  8  o 2.334000  0.2154000     2.531000  0.3229000     2.137000  0.2850000     0.3936000      0.4307000 
1 1 1 37 3  9  o 3.608000  0.5205000     ?         ?             3.608000  0.5205000     ?              ?         
1 1 1 37 3  10 o 2.078000  0.3015000     2.460000  0.4280000     1.697000  0.4249000     0.7632000      0.6031000 
1 1 1 37 3  11 o 1.263000  0.6093000     ?         ?             1.263000  0.6093000     ?              ?         
1 1 1 37 4  3  o 1.245000  0.3117000     1.296000  0.4146000     1.193000  0.4656000     0.1025000      0.6235000 
1 1 1 37 4  4  o 1.201000  0.3415000     1.173000  0.4603000     1.229000  0.5046000     -0.5603000E-01 0.6830000 
1 1 1 37 4  5  f 1.040000  0.3259000     0.9999000 0.4412000     1.081000  0.4797000     -0.8069000E-01 0.6518000 
1 1 1 37 4  6  o 1.602000  0.4387000     1.834000  0.7141000     1.371000  0.5098000     0.4633000      0.8774000 
1 1 1 37 4  7  o 1.012000  0.2396000     0.7056000 0.3271000     1.317000  0.3502000     -0.6119000     0.4793000 
1 1 1 37 4  8  o 2.099000  0.2468000     2.165000  0.3894000     2.032000  0.3033000     0.1328000      0.4936000 
1 1 1 37 4  9  o 1.186000  0.5415000     ?         ?             1.186000  0.5415000     ?              ?         
1 1 1 37 4  10 o 1.388000  0.3489000     1.518000  0.4791000     1.259000  0.5073000     0.2596000      0.6978000 
1 1 1 37 4  11 o 1.166000  0.3974000     1.347000  0.6197000     0.9857000 0.4975000     0.3614000      0.7947000 
1 1 1 37 5  3  o 2.104000  0.2778000     2.358000  0.2908000     1.850000  0.4736000     0.5086000      0.5557000 
1 1 1 37 5  4  o 1.908000  0.3354000     1.559000  0.4712000     2.258000  0.4774000     -0.6986000     0.6708000 
1 1 1 37 5  5  o 1.450000  0.3704000     1.189000  0.5553000     1.712000  0.4903000     -0.5229000     0.7408000 
1 1 1 37 5  6  o 2.747000  0.4162000     2.452000  0.7584000     3.043000  0.3428000     -0.5910000     0.8323000 
1 1 1 37 5  7  o 1.704000  0.2423000     1.903000  0.3418000     1.505000  0.3436000     0.3978000      0.4847000 
1 1 1 37 5  8  o 2.857000  0.1995000     2.739000  0.3235000     2.974000  0.2335000     -0.2348000     0.3990000 
1 1 1 37 5  9  o 2.405000  0.4504000     2.386000  0.6244000     2.423000  0.6491000     -0.3701000E-01 0.9007000 
1 1 1 37 5  10 o 2.174000  0.3195000     2.040000  0.4397000     2.308000  0.4635000     -0.2677000     0.6389000 
1 1 1 37 5  11 o 1.365000  0.6602000     ?         ?             1.365000  0.6602000     ?              ?         
1 1 1 37 6  2  o 0.8128000 0.3776000     ?         ?             0.8128000 0.3776000     ?              ?         
1 1 1 37 6  3  o 2.150000  0.2821000     2.334000  0.2980000     1.966000  0.4790000     0.3676000      0.5642000 
1 1 1 37 6  4  o 3.461000  0.3002000     3.217000  0.5421000     3.704000  0.2583000     -0.4870000     0.6005000 
1 1 1 37 6  5  o 1.260000  0.3877000     1.273000  0.5988000     1.248000  0.4926000     0.2488000E-01  0.7754000 
1 1 1 37 6  6  o 1.404000  0.4224000     1.584000  0.6771000     1.223000  0.5053000     0.3614000      0.8448000 
1 1 1 37 6  7  o 3.402000  0.1417000     3.481000  0.2227000     3.322000  0.1751000     0.1587000      0.2833000 
1 1 1 37 6  8  o 1.058000  0.3053000     0.8162000 0.3742000     1.300000  0.4826000     -0.4834000     0.6107000 
1 1 1 37 6  9  o 2.585000  0.3628000     3.234000  0.2819000     1.935000  0.6685000     1.299000       0.7255000 
1 1 1 37 6  10 o 1.350000  0.3581000     1.474000  0.5056000     1.225000  0.5073000     0.2487000      0.7162000 
1 1 1 37 7  2  o 1.536000  0.4389000     ?         ?             1.536000  0.4389000     ?              ?         
1 1 1 37 7  3  o 1.402000  0.2954000     1.701000  0.3935000     1.102000  0.4407000     0.5991000      0.5908000 
1 1 1 37 7  4  o 1.239000  0.3944000     1.272000  0.5690000     1.206000  0.5462000     0.6566000E-01  0.7887000 
1 1 1 37 7  5  o 1.783000  0.4593000     1.908000  0.7485000     1.659000  0.5326000     0.2495000      0.9187000 
1 1 1 37 7  6  o 1.185000  0.3547000     1.341000  0.6235000     1.029000  0.3383000     0.3123000      0.7093000 
1 1 1 37 7  7  o 1.422000  0.3053000     1.376000  0.4062000     1.468000  0.4558000     -0.9206000E-01 0.6105000 
1 1 1 37 7  8  o 1.334000  0.3105000     0.8950000 0.4001000     1.772000  0.4749000     -0.8769000     0.6210000 
1 1 1 37 7  9  o 1.884000  0.3425000     2.132000  0.4164000     1.636000  0.5440000     0.4965000      0.6851000 
1 1 1 37 7  10 f 1.259000  0.3471000     0.9583000 0.4356000     1.560000  0.5406000     -0.6019000     0.6943000 
1 1 1 37 8  2  o 1.458000  0.2595000     1.689000  0.3034000     1.227000  0.4211000     0.4618000      0.5190000 
1 1 1 37 8  3  o 2.115000  0.3466000     1.695000  0.6041000     2.535000  0.3400000     -0.8399000     0.6932000 
1 1 1 37 8  4  o 1.033000  0.5076000     ?         ?             1.033000  0.5076000     ?              ?         
1 1 1 37 8  5  o 1.417000  0.4227000     1.671000  0.6910000     1.163000  0.4868000     0.5081000      0.8453000 
1 1 1 37 8  6  o 1.314000  0.2819000     1.230000  0.3564000     1.398000  0.4368000     -0.1688000     0.5638000 
1 1 1 37 8  7  o 2.365000  0.2284000     2.153000  0.3262000     2.577000  0.3198000     -0.4248000     0.4568000 
1 1 1 37 8  8  o 2.603000  0.2882000     2.605000  0.3276000     2.600000  0.4743000     0.4997000E-02  0.5764000 
1 1 1 37 8  9  o 1.179000  0.3429000     1.183000  0.4751000     1.176000  0.4946000     0.7066000E-02  0.6858000 
1 1 1 37 8  10 o 3.189000  0.2462000     3.213000  0.3328000     3.165000  0.3628000     0.4779000E-01  0.4923000 
1 1 1 37 9  1  o 3.172000  0.2464000     ?         ?             3.172000  0.2464000     ?              ?         
1 1 1 37 9  2  o 1.404000  0.3155000     1.055000  0.4704000     1.752000  0.4206000     -0.6976000     0.6310000 
1 1 1 37 9  3  o 1.875000  0.3802000     1.695000  0.6273000     2.055000  0.4296000     -0.3601000     0.7604000 
1 1 1 37 9  4  o 1.149000  0.3740000     1.362000  0.6009000     0.9365000 0.4456000     0.4253000      0.7481000 
1 1 1 37 9  5  o 1.404000  0.3484000     1.294000  0.6012000     1.514000  0.3521000     -0.2205000     0.6967000 
1 1 1 37 9  6  o 2.535000  0.2092000     2.507000  0.2914000     2.562000  0.3002000     -0.5467000E-01 0.4183000 
1 1 1 37 9  7  o 2.456000  0.2418000     2.672000  0.2898000     2.240000  0.3872000     0.4316000      0.4836000 
1 1 1 37 9  8  o 1.999000  0.3532000     2.543000  0.4727000     1.456000  0.5248000     1.087000       0.7063000 
1 1 1 37 9  9  o 1.139000  0.3385000     1.222000  0.4894000     1.055000  0.4679000     0.1663000      0.6771000 
1 1 1 37 9  10 o 1.118000  0.3425000     1.235000  0.5044000     1.002000  0.4634000     0.2335000      0.6850000 
1 1 1 37 10 1  f 1.799000  0.2566000     2.396000  0.2786000     1.202000  0.4309000     1.194000       0.5131000 
1 1 1 37 10 2  o 2.719000  0.2726000     3.161000  0.4048000     2.278000  0.3651000     0.8837000      0.5452000 
1 1 1 37 10 3  o 3.067000  0.3278000     3.175000  0.5234000     2.958000  0.3946000     0.2164000      0.6556000 
1 1 1 37 10 4  o 2.466000  0.3977000     2.540000  0.6646000     2.392000  0.4369000     0.1474000      0.7954000 
1 1 1 37 10 5  o 3.167000  0.1894000     3.011000  0.3122000     3.324000  0.2147000     -0.3126000     0.3789000 
1 1 1 37 10 6  o 1.391000  0.3262000     1.415000  0.4389000     1.366000  0.4827000     0.4982000E-01  0.6524000 
1 1 1 37 10 7  f 4.220000  0.2422000     3.840000  0.4128000     4.600000  0.2537000     -0.7599000     0.4845000 
1 1 1 37 10 8  o 1.867000  0.3739000     1.944000  0.5314000     1.790000  0.5262000     0.1549000      0.7479000 
1 1 1 37 10 9  o 1.265000  0.3575000     1.165000  0.4822000     1.366000  0.5278000     -0.2007000     0.7149000 
1 1 1 37 10 10 o 3.141000  0.2595000     3.041000  0.3577000     3.240000  0.3760000     -0.1991000     0.5190000 
1 1 1 37 11 0  o 4.525000  0.1471000     4.525000  0.1471000     4.525000  0.1471000     0.000000       0.000000  
1 1 1 37 11 1  o 1.044000  0.3122000     1.162000  0.4720000     0.9263000 0.4086000     0.2356000      0.6243000 
1 1 1 37 11 2  o 2.661000  0.3008000     2.827000  0.4825000     2.495000  0.3593000     0.3323000      0.6016000 
1 1 1 37 11 3  o 2.849000  0.4306000     3.428000  0.5148000     2.271000  0.6905000     1.157000       0.8612000 
1 1 1 37 11 4  o 2.408000  0.2231000     2.418000  0.3661000     2.397000  0.2550000     0.2025000E-01  0.4461000 
1 1 1 37 11 5  o 1.091000  0.2996000     1.069000  0.4146000     1.114000  0.4326000     -0.4481000E-01 0.5992000 
1 1 1 37 11 6  o 1.641000  0.3172000     1.509000  0.4450000     1.773000  0.4520000     -0.2643000     0.6343000 
1 1 1 37 11 7  o 3.758000  0.2251000     3.630000  0.2869000     3.885000  0.3471000     -0.2549000     0.4503000 
1 1 1 37 11 8  o 3.571000  0.2576000     3.609000  0.2972000     3.534000  0.4210000     0.7478000E-01  0.5153000 
1 1 1 37 11 9  o 1.146000  0.3384000     1.323000  0.5051000     0.9699000 0.4505000     0.3528000      0.6768000 
1 1 1 37 11 10 f 1.403000  0.3957000     1.506000  0.5521000     1.300000  0.5670000     0.2061000      0.7914000 
1 1 1 37 12 0  o 2.969000  0.1853000     2.969000  0.1853000     2.969000  0.1853000     -0.000000      0.000000  
1 1 1 37 12 1  o 1.346000  0.2980000     1.422000  0.3567000     1.271000  0.4774000     0.1512000      0.5959000 
1 1 1 37 12 2  o 3.894000  0.1651000     4.214000  0.1741000     3.574000  0.2805000     0.6407000      0.3302000 
1 1 1 37 12 3  o 1.686000  0.2983000     1.161000  0.5232000     2.210000  0.2868000     -1.049000      0.5967000 
1 1 1 37 12 4  o 1.677000  0.2550000     1.095000  0.4066000     2.259000  0.3079000     -1.164000      0.5100000 
1 1 1 37 12 5  o 1.540000  0.3091000     1.415000  0.4411000     1.665000  0.4332000     -0.2495000     0.6183000 
1 1 1 37 12 6  o 1.765000  0.3082000     2.070000  0.3880000     1.460000  0.4790000     0.6098000      0.6165000 
1 1 1 37 12 7  o 1.184000  0.3329000     0.8828000 0.4254000     1.486000  0.5121000     -0.6027000     0.6657000 
1 1 1 37 12 8  o 2.705000  0.5137000     2.777000  0.5393000     2.633000  0.8745000     0.1435000      1.027000  
1 1 1 37 12 9  o 1.149000  0.3342000     1.430000  0.5231000     0.8682000 0.4161000     0.5620000      0.6685000 
1 1 1 37 12 10 o 1.356000  0.6671000     ?         ?             1.356000  0.6671000     ?              ?         
1 1 1 37 13 0  o 0.7366000 0.4416000     0.7366000 0.4416000     0.7366000 0.4416000     -0.000000      0.000000  
1 1 1 37 13 1  o 2.010000  0.2178000     1.850000  0.3546000     2.169000  0.2530000     -0.3186000     0.4356000 
1 1 1 37 13 2  o 0.8766000 0.2648000     0.6877000 0.3224000     1.065000  0.4202000     -0.3778000     0.5296000 
1 1 1 37 13 3  o 1.071000  0.2896000     1.066000  0.4061000     1.077000  0.4131000     -0.1096000E-01 0.5793000 
1 1 1 37 13 4  o 1.583000  0.3037000     1.721000  0.4117000     1.445000  0.4466000     0.2759000      0.6074000 
1 1 1 37 13 5  o 1.483000  0.3311000     1.475000  0.4577000     1.491000  0.4786000     -0.1602000E-01 0.6623000 
1 1 1 37 13 6  o 1.905000  0.3503000     2.140000  0.4059000     1.670000  0.5711000     0.4694000      0.7007000 
1 1 1 37 13 7  o 1.492000  0.3818000     1.622000  0.5731000     1.362000  0.5046000     0.2592000      0.7636000 
1 1 1 37 13 8  f 1.765000  0.3806000     1.818000  0.5068000     1.712000  0.5680000     0.1061000      0.7612000 
1 1 1 37 13 9  o 1.177000  0.3304000     0.7458000 0.3670000     1.609000  0.5497000     -0.8629000     0.6609000 
1 1 1 37 14 0  o 0.7325000 0.4569000     0.7325000 0.4569000     0.7325000 0.4569000     0.000000       0.000000  
1 1 1 37 14 1  o 1.349000  0.2889000     1.144000  0.4559000     1.554000  0.3550000     -0.4100000     0.5778000 
1 1 1 37 14 2  o 2.451000  0.2373000     2.336000  0.4263000     2.566000  0.2083000     -0.2302000     0.4745000 
1 1 1 37 14 3  o 1.188000  0.3081000     1.234000  0.4333000     1.142000  0.4382000     0.9169000E-01  0.6163000 
1 1 1 37 14 4  o 1.211000  0.3181000     1.320000  0.4540000     1.101000  0.4458000     0.2189000      0.6363000 
1 1 1 37 14 5  o 1.164000  0.3470000     0.9168000 0.4127000     1.411000  0.5581000     -0.4946000     0.6941000 
1 1 1 37 14 6  o 2.898000  0.2811000     3.093000  0.4283000     2.702000  0.3641000     0.3912000      0.5621000 
1 1 1 37 14 7  o 2.192000  0.3297000     2.201000  0.4329000     2.183000  0.4974000     0.1762000E-01  0.6594000 
1 1 1 37 14 8  o 1.763000  0.3758000     1.747000  0.5214000     1.778000  0.5414000     -0.3086000E-01 0.7516000 
1 1 1 37 14 9  o 3.402000  0.2405000     3.420000  0.3288000     3.383000  0.3512000     0.3727000E-01  0.4811000 
1 1 1 37 15 0  f 3.716000  0.2669000     3.716000  0.2669000     3.716000  0.2669000     -0.000000      0.000000  
1 1 1 37 15 1  o 1.904000  0.3145000     1.911000  0.5328000     1.896000  0.3343000     0.1482000E-01  0.6290000 
1 1 1 37 15 2  o 1.826000  0.2869000     1.852000  0.4757000     1.799000  0.3211000     0.5300000E-01  0.5739000 
1 1 1 37 15 3  o 2.053000  0.3020000     1.849000  0.4903000     2.257000  0.3528000     -0.4089000     0.6040000 
1 1 1 37 15 4  o 1.901000  0.3282000     2.324000  0.3483000     1.478000  0.5565000     0.8459000      0.6565000 
1 1 1 37 15 5  o 1.315000  0.3429000     1.523000  0.5026000     1.107000  0.4666000     0.4157000      0.6858000 
1 1 1 37 15 6  o 1.882000  0.3420000     1.357000  0.5444000     2.407000  0.4140000     -1.051000      0.6840000 
1 1 1 37 15 7  o 4.209000  0.2896000     4.454000  0.4250000     3.964000  0.3935000     0.4909000      0.5791000 
1 1 1 37 15 8  o 2.182000  0.3510000     1.859000  0.5229000     2.506000  0.4683000     -0.6464000     0.7020000 
1 1 1 37 15 9  o 2.290000  0.3662000     2.490000  0.4665000     2.091000  0.5645000     0.3988000      0.7324000 
1 1 1 37 16 0  o 1.615000  0.5768000     1.615000  0.5768000     1.615000  0.5768000     0.000000       0.000000  
1 1 1 37 16 1  o 0.8519000 0.2797000     0.8873000 0.4234000     0.8165000 0.3654000     0.7081000E-01  0.5593000 
1 1 1 37 16 2  o 0.7809000 0.2629000     0.7067000 0.3482000     0.8550000 0.3939000     -0.1482000     0.5257000 
1 1 1 37 16 3  o 0.9394000 0.3038000     1.033000  0.4703000     0.8458000 0.3849000     0.1873000      0.6077000 
1 1 1 37 16 4  o 1.133000  0.3416000     1.137000  0.5064000     1.128000  0.4586000     0.8893000E-02  0.6832000 
1 1 1 37 16 5  o 1.861000  0.3226000     1.227000  0.5087000     2.496000  0.3968000     -1.269000      0.6452000 
1 1 1 37 16 6  o 1.668000  0.3516000     1.982000  0.4757000     1.354000  0.5178000     0.6277000      0.7031000 
1 1 1 37 16 7  o 1.819000  0.4210000     1.747000  0.5543000     1.891000  0.6339000     -0.1436000     0.8421000 
1 1 1 37 16 8  o 2.145000  0.3596000     2.314000  0.4730000     1.977000  0.5417000     0.3369000      0.7191000 
1 1 1 37 17 0  o 1.114000  0.5535000     1.114000  0.5535000     1.114000  0.5535000     -0.000000      0.000000  
1 1 1 37 17 1  o 3.008000  0.2123000     2.946000  0.3002000     3.070000  0.3002000     -0.1241000     0.4246000 
1 1 1 37 17 2  o 1.478000  0.3087000     1.020000  0.4547000     1.937000  0.4178000     -0.9171000     0.6175000 
1 1 1 37 17 3  o 1.003000  0.3158000     0.9300000 0.4451000     1.076000  0.4482000     -0.1462000     0.6317000 
1 1 1 37 17 4  o 2.815000  0.3267000     2.625000  0.5720000     3.005000  0.3157000     -0.3801000     0.6534000 
1 1 1 37 17 5  f 1.553000  0.3319000     1.959000  0.4535000     1.148000  0.4846000     0.8116000      0.6637000 
1 1 1 37 17 6  o 2.356000  0.3287000     2.243000  0.4420000     2.469000  0.4867000     -0.2267000     0.6574000 
1 1 1 37 17 7  f 1.952000  0.3689000     2.111000  0.4637000     1.792000  0.5739000     0.3199000      0.7378000 
1 1 1 37 17 8  o 1.902000  0.3856000     1.713000  0.5543000     2.092000  0.5360000     -0.3792000     0.7711000 
1 1 1 37 18 0  o 0.6706000 0.4374000     0.6706000 0.4374000     0.6706000 0.4374000     0.000000       0.000000  
1 1 1 37 18 1  f 2.472000  0.2358000     2.145000  0.3783000     2.799000  0.2816000     -0.6536000     0.4716000 
1 1 1 37 18 2  o 1.218000  0.3044000     1.489000  0.4593000     0.9476000 0.3997000     0.5413000      0.6088000 
1 1 1 37 18 3  o 2.646000  0.2450000     2.855000  0.3926000     2.437000  0.2933000     0.4187000      0.4901000 
1 1 1 37 18 4  o 0.8002000 0.2722000     0.9701000 0.4483000     0.6303000 0.3088000     0.3398000      0.5443000 
1 1 1 37 18 5  o 0.9699000 0.3156000     1.090000  0.4840000     0.8494000 0.4051000     0.2409000      0.6311000 
1 1 1 37 18 6  o 1.072000  0.3469000     0.9075000 0.4262000     1.236000  0.5475000     -0.3281000     0.6939000 
1 1 1 37 18 7  o 2.035000  0.3389000     2.578000  0.3962000     1.493000  0.5500000     1.086000       0.6778000 
1 1 1 37 18 8  o 1.965000  0.3697000     1.444000  0.5476000     2.485000  0.4967000     -1.041000      0.7393000 
1 1 1 37 19 0  o 0.6877000 0.4484000     0.6877000 0.4484000     0.6877000 0.4484000     0.000000       0.000000  
1 1 1 37 19 1  o 2.577000  0.2340000     2.746000  0.3178000     2.407000  0.3436000     0.3389000      0.4680000 
1 1 1 37 19 2  o 0.8247000 0.2702000     0.8115000 0.3798000     0.8378000 0.3845000     -0.2626000E-01 0.5404000 
1 1 1 37 19 3  o 0.9494000 0.3038000     1.110000  0.4851000     0.7884000 0.3659000     0.3219000      0.6076000 
1 1 1 37 19 4  o 2.010000  0.3240000     1.741000  0.5562000     2.279000  0.3325000     -0.5379000     0.6480000 
1 1 1 37 19 5  o 1.389000  0.3400000     1.918000  0.5561000     0.8595000 0.3913000     1.059000       0.6800000 
1 1 1 37 19 6  o 1.330000  0.3783000     1.307000  0.5184000     1.354000  0.5512000     -0.4682000E-01 0.7567000 
1 1 1 37 19 7  o 2.703000  0.3127000     1.946000  0.5160000     3.460000  0.3535000     -1.514000      0.6254000 
1 1 1 37 20 0  o 0.8599000 0.5142000     0.8599000 0.5142000     0.8599000 0.5142000     0.000000       0.000000  
1 1 1 37 20 1  o 1.932000  0.3068000     1.970000  0.4367000     1.894000  0.4310000     0.7607000E-01  0.6136000 
1 1 1 37 20 2  o 2.225000  0.2719000     2.224000  0.3908000     2.227000  0.3781000     -0.3145000E-02 0.5438000 
1 1 1 37 20 3  o 1.080000  0.3126000     0.8896000 0.4084000     1.270000  0.4735000     -0.3806000     0.6253000 
1 1 1 37 20 4  o 1.266000  0.3275000     1.045000  0.4734000     1.486000  0.4527000     -0.4402000     0.6550000 
1 1 1 37 20 5  o 1.375000  0.3698000     1.373000  0.5454000     1.377000  0.4996000     -0.3948000E-02 0.7396000 
1 1 1 37 20 6  o 1.256000  0.3672000     1.134000  0.5051000     1.378000  0.5333000     -0.2441000     0.7345000 
1 1 1 37 20 7  o 1.838000  0.3882000     1.888000  0.5211000     1.787000  0.5756000     0.1006000      0.7764000 
1 1 1 37 21 0  o 2.443000  0.3856000     2.443000  0.3856000     2.443000  0.3856000     -0.000000      0.000000  
1 1 1 37 21 1  o 2.781000  0.2357000     3.055000  0.3082000     2.508000  0.3566000     0.5472000      0.4713000 
1 1 1 37 21 2  o 1.122000  0.3248000     1.148000  0.4661000     1.095000  0.4525000     0.5316000E-01  0.6496000 
1 1 1 37 21 3  o 1.202000  0.3305000     1.404000  0.4959000     1.001000  0.4371000     0.4028000      0.6611000 
1 1 1 37 21 4  o 2.369000  0.3118000     2.364000  0.5113000     2.373000  0.3570000     -0.9543000E-02 0.6236000 
1 1 1 37 21 5  o 1.223000  0.3599000     1.146000  0.5220000     1.299000  0.4955000     -0.1536000     0.7198000 
1 1 1 37 21 6  o 1.247000  0.3608000     1.295000  0.5473000     1.198000  0.4702000     0.9650000E-01  0.7216000 
1 1 1 37 21 7  o 1.076000  0.5270000     1.076000  0.5270000     ?         ?             ?              ?         
1 1 1 37 22 0  o 2.685000  0.3639000     2.685000  0.3639000     2.685000  0.3639000     0.000000       0.000000  
1 1 1 37 22 1  o 1.539000  0.3362000     1.916000  0.4753000     1.163000  0.4756000     0.7531000      0.6724000 
1 1 1 37 22 2  o 1.298000  0.3398000     1.517000  0.4989000     1.078000  0.4616000     0.4391000      0.6797000 
1 1 1 37 22 3  o 2.850000  0.2800000     3.271000  0.3027000     2.430000  0.4712000     0.8413000      0.5601000 
1 1 1 37 22 4  o 1.454000  0.3864000     1.652000  0.5824000     1.255000  0.5081000     0.3968000      0.7729000 
1 1 1 37 22 5  o 1.548000  0.3751000     1.443000  0.5694000     1.654000  0.4884000     -0.2109000     0.7501000 
1 1 1 37 22 6  o 1.233000  0.3819000     1.276000  0.5670000     1.189000  0.5116000     0.8696000E-01  0.7637000 
1 1 1 37 23 0  o 4.013000  0.2630000     4.013000  0.2630000     4.013000  0.2630000     -0.000000      0.000000  
1 1 1 37 23 1  o 3.493000  0.2129000     3.251000  0.3133000     3.735000  0.2883000     -0.4844000     0.4258000 
1 1 1 37 23 2  f 1.668000  0.3579000     1.522000  0.5124000     1.814000  0.4997000     -0.2918000     0.7157000 
1 1 1 37 23 3  o 2.295000  0.3486000     2.576000  0.5058000     2.014000  0.4799000     0.5625000      0.6972000 
1 1 1 37 23 4  f 1.777000  0.3850000     1.862000  0.5451000     1.692000  0.5439000     0.1701000      0.7700000 
1 1 1 37 23 5  o 2.330000  0.3125000     1.882000  0.5076000     2.779000  0.3647000     -0.8979000     0.6251000 
1 1 1 37 24 0  o 1.350000  0.6332000     1.350000  0.6332000     1.350000  0.6332000     -0.000000      0.000000  
1 1 1 37 24 1  o 1.302000  0.3564000     1.274000  0.5020000     1.330000  0.5062000     -0.5604000E-01 0.7129000 
1 1 1 37 24 2  o 2.791000  0.3345000     2.426000  0.5726000     3.156000  0.3459000     -0.7300000     0.6690000 
1 1 1 37 24 3  o 1.203000  0.3580000     1.330000  0.5315000     1.076000  0.4798000     0.2532000      0.7160000 
1 1 1 37 24 4  o 1.473000  0.3740000     1.455000  0.5270000     1.490000  0.5308000     -0.3510000E-01 0.7480000 
1 1 1 37 25 0  o 1.689000  0.7196000     1.689000  0.7196000     1.689000  0.7196000     -0.000000      0.000000  
1 1 1 37 25 1  o 1.087000  0.3420000     1.343000  0.5546000     0.8324000 0.4002000     0.5102000      0.6839000 
1 1 1 37 25 2  f 1.599000  0.3844000     1.916000  0.5623000     1.281000  0.5244000     0.6347000      0.7689000 
1 1 1 37 25 3  o 1.543000  0.3810000     1.300000  0.5137000     1.786000  0.5627000     -0.4862000     0.7620000 
1 1 1 37 26 0  o 0.7704000 0.5178000     0.7704000 0.5178000     0.7704000 0.5178000     -0.000000      0.000000  
1 1 1 37 26 1  o 0.9734000 0.3335000     0.9393000 0.4540000     1.007000  0.4887000     -0.6819000E-01 0.6671000 
1 1 1 37 26 2  f 2.069000  0.4838000     2.262000  0.5694000     1.877000  0.7824000     0.3849000      0.9677000 
1 1 1 38 0  4  o 1.409000  0.5897000     1.409000  0.5897000     1.409000  0.5897000     0.000000       0.000000  
1 1 1 38 0  6  o 3.709000  0.3241000     3.709000  0.3241000     3.709000  0.3241000     -0.000000      0.000000  
1 1 1 38 0  7  o 0.5773000 0.4115000     0.5773000 0.4115000     0.5773000 0.4115000     0.000000       0.000000  
1 1 1 38 0  8  f 0.5601000 0.3741000     0.5601000 0.3741000     0.5601000 0.3741000     -0.000000      0.000000  
1 1 1 38 0  9  o 1.968000  0.5175000     1.968000  0.5175000     1.968000  0.5175000     0.000000       0.000000  
1 1 1 38 1  3  f 2.174000  0.2545000     ?         ?             2.174000  0.2545000     ?              ?         
1 1 1 38 1  4  o 2.996000  0.3417000     2.566000  0.6201000     3.426000  0.2874000     -0.8593000     0.6835000 
1 1 1 38 1  6  o 1.574000  0.3855000     1.503000  0.5399000     1.644000  0.5505000     -0.1412000     0.7710000 
1 1 1 38 1  7  o 2.000000  0.4330000     1.638000  0.7133000     2.362000  0.4910000     -0.7242000     0.8660000 
1 1 1 38 1  8  o 0.8453000 0.2561000     0.6790000 0.3229000     1.012000  0.3976000     -0.3325000     0.5122000 
1 1 1 38 1  9  o 1.248000  0.3396000     1.276000  0.4881000     1.221000  0.4722000     0.5556000E-01  0.6791000 
1 1 1 38 2  3  o 0.9840000 0.2638000     1.069000  0.3671000     0.8991000 0.3789000     0.1699000      0.5275000 
1 1 1 38 2  4  o 1.173000  0.3238000     1.319000  0.4704000     1.027000  0.4452000     0.2920000      0.6477000 
1 1 1 38 2  5  o 1.199000  0.5630000     ?         ?             1.199000  0.5630000     ?              ?         
1 1 1 38 2  6  f 2.085000  0.3636000     2.290000  0.4723000     1.880000  0.5529000     0.4097000      0.7272000 
1 1 1 38 2  7  o 1.667000  0.3859000     1.435000  0.5374000     1.898000  0.5541000     -0.4631000     0.7719000 
1 1 1 38 2  8  o 1.459000  0.2805000     1.291000  0.4237000     1.626000  0.3677000     -0.3352000     0.5610000 
1 1 1 38 2  9  o 1.953000  0.3470000     2.200000  0.4386000     1.706000  0.5379000     0.4940000      0.6940000 
1 1 1 38 3  3  o 3.536000  0.1365000     3.468000  0.1797000     3.603000  0.2054000     -0.1348000     0.2729000 
1 1 1 38 3  4  o 1.242000  0.3319000     0.9924000 0.4312000     1.491000  0.5045000     -0.4987000     0.6637000 
1 1 1 38 3  5  o 1.907000  0.4902000     1.701000  0.6643000     2.113000  0.7211000     -0.4117000     0.9805000 
1 1 1 38 3  6  o 1.270000  0.3618000     1.128000  0.4783000     1.412000  0.5431000     -0.2839000     0.7236000 
1 1 1 38 3  7  o 3.383000  0.2334000     3.390000  0.3514000     3.376000  0.3072000     0.1429000E-01  0.4667000 
1 1 1 38 3  8  o 1.156000  0.2977000     1.379000  0.4584000     0.9326000 0.3799000     0.4466000      0.5953000 
1 1 1 38 3  9  o 1.342000  0.3529000     1.157000  0.4803000     1.527000  0.5172000     -0.3706000     0.7058000 
1 1 1 38 4  3  o 1.234000  0.2925000     1.093000  0.3907000     1.376000  0.4354000     -0.2824000     0.5850000 
1 1 1 38 4  4  o 1.124000  0.3298000     1.085000  0.4435000     1.163000  0.4882000     -0.7776000E-01 0.6596000 
1 1 1 38 4  5  o 1.392000  0.3983000     1.243000  0.5741000     1.542000  0.5521000     -0.2987000     0.7965000 
1 1 1 38 4  6  o 1.994000  0.3675000     1.771000  0.5174000     2.217000  0.5220000     -0.4462000     0.7350000 
1 1 1 38 4  7  o 1.624000  0.4198000     2.420000  0.7746000     0.8280000 0.3237000     1.592000       0.8396000 
1 1 1 38 4  8  o 1.247000  0.3081000     1.314000  0.4669000     1.181000  0.4020000     0.1332000      0.6161000 
1 1 1 38 4  9  o 1.613000  0.5907000     1.613000  0.5907000     ?         ?             ?              ?         
1 1 1 38 5  3  o 3.427000  0.1557000     3.340000  0.1965000     3.513000  0.2414000     -0.1729000     0.3113000 
1 1 1 38 5  4  o 1.889000  0.3285000     2.204000  0.3734000     1.574000  0.5406000     0.6303000      0.6570000 
1 1 1 38 5  5  o 1.804000  0.3760000     1.672000  0.4988000     1.935000  0.5626000     -0.2628000     0.7519000 
1 1 1 38 5  6  o 1.440000  0.4251000     1.854000  0.7201000     1.027000  0.4520000     0.8273000      0.8502000 
1 1 1 38 5  7  o 1.540000  0.3636000     1.515000  0.6693000     1.565000  0.2845000     -0.4962000E-01 0.7273000 
1 1 1 38 5  8  o 2.092000  0.2482000     2.210000  0.3866000     1.974000  0.3113000     0.2354000      0.4964000 
1 1 1 38 5  9  o 3.291000  0.4315000     3.291000  0.4315000     ?         ?             ?              ?         
1 1 1 38 6  3  o 1.131000  0.2877000     1.365000  0.4062000     0.8965000 0.4075000     0.4683000      0.5753000 
1 1 1 38 6  4  o 2.791000  0.2717000     2.969000  0.2892000     2.613000  0.4601000     0.3556000      0.5434000 
1 1 1 38 6  5  o 1.130000  0.3764000     1.402000  0.6365000     0.8578000 0.4019000     0.5443000      0.7528000 
1 1 1 38 6  6  o 2.647000  0.4226000     2.671000  0.7472000     2.624000  0.3949000     0.4661000E-01  0.8451000 
1 1 1 38 6  7  o 1.700000  0.2268000     1.793000  0.3296000     1.607000  0.3116000     0.1861000      0.4536000 
1 1 1 38 6  8  o 1.295000  0.2561000     0.8123000 0.3823000     1.778000  0.3408000     -0.9653000     0.5121000 
1 1 1 38 7  2  o 2.499000  0.2411000     ?         ?             2.499000  0.2411000     ?              ?         
1 1 1 38 7  3  o 1.167000  0.3201000     0.9937000 0.4003000     1.340000  0.4995000     -0.3461000     0.6402000 
1 1 1 38 7  4  o 1.116000  0.3508000     1.047000  0.5011000     1.186000  0.4912000     -0.1383000     0.7017000 
1 1 1 38 7  5  o 1.226000  0.3534000     0.9805000 0.4849000     1.471000  0.5142000     -0.4906000     0.7068000 
1 1 1 38 7  6  o 1.120000  0.3660000     1.143000  0.5503000     1.096000  0.4827000     0.4682000E-01  0.7320000 
1 1 1 38 7  7  o 1.847000  0.2323000     2.001000  0.3440000     1.693000  0.3123000     0.3083000      0.4646000 
1 1 1 38 7  8  f 1.025000  0.3135000     1.124000  0.4632000     0.9264000 0.4226000     0.1976000      0.6270000 
1 1 1 38 8  2  o 2.847000  0.2785000     ?         ?             2.847000  0.2785000     ?              ?         
1 1 1 38 8  3  o 1.044000  0.3250000     1.093000  0.4933000     0.9951000 0.4233000     0.9812000E-01  0.6500000 
1 1 1 38 8  4  o 1.475000  0.6043000     ?         ?             1.475000  0.6043000     ?              ?         
1 1 1 38 8  5  o 1.400000  0.4139000     1.745000  0.6849000     1.055000  0.4648000     0.6902000      0.8278000 
1 1 1 38 8  6  o 1.301000  0.2521000     0.8851000 0.4500000     1.716000  0.2272000     -0.8308000     0.5041000 
1 1 1 38 8  7  f 1.335000  0.3115000     1.575000  0.4391000     1.095000  0.4419000     0.4804000      0.6230000 
1 1 1 38 8  8  o 1.417000  0.3484000     1.325000  0.4937000     1.508000  0.4917000     -0.1824000     0.6968000 
1 1 1 38 9  2  o 1.413000  0.3238000     1.388000  0.4891000     1.438000  0.4245000     -0.4980000E-01 0.6477000 
1 1 1 38 9  3  o 1.341000  0.3705000     1.444000  0.5709000     1.238000  0.4724000     0.2061000      0.7411000 
1 1 1 38 9  4  o 1.158000  0.5555000     ?         ?             1.158000  0.5555000     ?              ?         
1 1 1 38 9  5  o 1.176000  0.3792000     1.614000  0.6655000     0.7378000 0.3638000     0.8763000      0.7584000 
1 1 1 38 9  6  o 0.8813000 0.2684000     0.6546000 0.3281000     1.108000  0.4249000     -0.4533000     0.5369000 
1 1 1 38 9  7  o 1.729000  0.3191000     1.955000  0.4337000     1.503000  0.4682000     0.4519000      0.6382000 
1 1 1 38 9  8  o 1.128000  0.3385000     1.286000  0.4983000     0.9708000 0.4582000     0.3153000      0.6770000 
1 1 1 38 10 1  o 2.115000  0.3911000     ?         ?             2.115000  0.3911000     ?              ?         
1 1 1 38 10 2  o 3.260000  0.2153000     3.370000  0.3462000     3.150000  0.2561000     0.2201000      0.4306000 
1 1 1 38 10 3  o 1.310000  0.3736000     1.329000  0.5700000     1.291000  0.4831000     0.3754000E-01  0.7472000 
1 1 1 38 10 4  o 1.449000  0.3887000     1.264000  0.5777000     1.635000  0.5201000     -0.3715000     0.7774000 
1 1 1 38 10 5  o 1.453000  0.3082000     1.112000  0.5355000     1.793000  0.3053000     -0.6809000     0.6164000 
1 1 1 38 10 6  o 2.940000  0.1841000     2.814000  0.2615000     3.066000  0.2593000     -0.2526000     0.3683000 
1 1 1 38 10 7  o 2.376000  0.2768000     2.191000  0.4290000     2.560000  0.3500000     -0.3688000     0.5537000 
1 1 1 38 10 8  o 3.508000  0.2490000     3.783000  0.3605000     3.233000  0.3435000     0.5501000      0.4979000 
1 1 1 38 11 0  o 0.6604000 0.4207000     0.6604000 0.4207000     0.6604000 0.4207000     -0.000000      0.000000  
1 1 1 38 11 1  o 4.504000  0.1796000     ?         ?             4.504000  0.1796000     ?              ?         
1 1 1 38 11 2  o 1.012000  0.3233000     1.254000  0.5316000     0.7710000 0.3681000     0.4827000      0.6466000 
1 1 1 38 11 3  o 1.177000  0.3806000     1.043000  0.4930000     1.311000  0.5801000     -0.2678000     0.7613000 
1 1 1 38 11 4  o 1.577000  0.3428000     1.439000  0.6265000     1.714000  0.2786000     -0.2743000     0.6856000 
1 1 1 38 11 5  o 1.331000  0.3179000     1.169000  0.4819000     1.494000  0.4147000     -0.3243000     0.6358000 
1 1 1 38 11 6  o 2.009000  0.2941000     1.640000  0.4760000     2.377000  0.3455000     -0.7365000     0.5882000 
1 1 1 38 11 7  o 1.993000  0.3289000     1.943000  0.4881000     2.043000  0.4411000     -0.9938000E-01 0.6579000 
1 1 1 38 11 8  o 1.190000  0.3706000     0.9605000 0.4750000     1.419000  0.5689000     -0.4588000     0.7411000 
1 1 1 38 12 0  o 4.840000  0.1619000     4.840000  0.1619000     4.840000  0.1619000     -0.000000      0.000000  
1 1 1 38 12 1  o 2.784000  0.1926000     3.064000  0.1913000     2.504000  0.3344000     0.5603000      0.3853000 
1 1 1 38 12 2  o 1.654000  0.3980000     1.986000  0.6247000     1.322000  0.4934000     0.6644000      0.7960000 
1 1 1 38 12 3  o 1.532000  0.2465000     1.179000  0.3880000     1.885000  0.3041000     -0.7063000     0.4930000 
1 1 1 38 12 4  o 1.151000  0.3102000     1.091000  0.4684000     1.212000  0.4067000     -0.1209000     0.6203000 
1 1 1 38 12 5  o 1.128000  0.3011000     0.9914000 0.4037000     1.265000  0.4469000     -0.2733000     0.6022000 
1 1 1 38 12 6  o 3.083000  0.2459000     2.877000  0.4053000     3.289000  0.2787000     -0.4123000     0.4918000 
1 1 1 38 12 7  o 1.118000  0.3439000     1.158000  0.4818000     1.078000  0.4909000     0.8045000E-01  0.6879000 
1 1 1 38 13 0  o 0.8449000 0.4518000     0.8449000 0.4518000     0.8449000 0.4518000     0.000000       0.000000  
1 1 1 38 13 1  o 1.431000  0.3109000     1.323000  0.3901000     1.538000  0.4841000     -0.2158000     0.6217000 
1 1 1 38 13 2  o 2.039000  0.2996000     2.091000  0.2242000     1.986000  0.5558000     0.1052000      0.5993000 
1 1 1 38 13 3  o 1.449000  0.2710000     1.693000  0.3390000     1.205000  0.4230000     0.4876000      0.5421000 
1 1 1 38 13 4  o 2.951000  0.1730000     2.609000  0.2607000     3.292000  0.2274000     -0.6827000     0.3459000 
1 1 1 38 13 5  o 1.321000  0.3224000     1.212000  0.4497000     1.431000  0.4620000     -0.2193000     0.6447000 
1 1 1 38 13 6  o 2.356000  0.2781000     2.276000  0.4183000     2.435000  0.3667000     -0.1592000     0.5563000 
1 1 1 38 13 7  o 1.716000  0.3815000     1.685000  0.5815000     1.746000  0.4939000     -0.6142000E-01 0.7629000 
1 1 1 38 14 0  o 6.845000  0.1732000     6.845000  0.1732000     6.845000  0.1732000     0.000000       0.000000  
1 1 1 38 14 1  o 5.066000  0.1122000     4.945000  0.1650000     5.186000  0.1521000     -0.2409000     0.2244000 
1 1 1 38 14 2  o 1.155000  0.3227000     1.193000  0.4867000     1.117000  0.4237000     0.7595000E-01  0.6453000 
1 1 1 38 14 3  o 1.074000  0.2907000     0.9128000 0.3913000     1.235000  0.4299000     -0.3218000     0.5813000 
1 1 1 38 14 4  o 1.780000  0.3018000     1.998000  0.3755000     1.563000  0.4725000     0.4343000      0.6035000 
1 1 1 38 14 5  o 1.395000  0.3411000     1.435000  0.4935000     1.355000  0.4710000     0.8019000E-01  0.6822000 
1 1 1 38 14 6  o 3.138000  0.2324000     2.794000  0.3617000     3.483000  0.2920000     -0.6892000     0.4648000 
1 1 1 38 14 7  o 2.876000  0.4194000     1.713000  0.7650000     4.038000  0.3439000     -2.325000      0.8387000 
1 1 1 38 15 0  f 0.9819000 0.5233000     0.9819000 0.5233000     0.9819000 0.5233000     -0.000000      0.000000  
1 1 1 38 15 1  o 2.500000  0.2191000     2.439000  0.3602000     2.561000  0.2495000     -0.1215000     0.4382000 
1 1 1 38 15 2  o 2.885000  0.2096000     2.890000  0.3147000     2.881000  0.2768000     0.9441000E-02  0.4191000 
1 1 1 38 15 3  o 1.144000  0.3070000     1.060000  0.4228000     1.229000  0.4452000     -0.1695000     0.6140000 
1 1 1 38 15 4  o 1.325000  0.3150000     1.574000  0.4469000     1.077000  0.4441000     0.4972000      0.6301000 
1 1 1 38 15 5  o 2.241000  0.3277000     1.845000  0.4477000     2.637000  0.4786000     -0.7921000     0.6554000 
1 1 1 38 15 6  o 1.410000  0.4041000     1.349000  0.6289000     1.471000  0.5077000     -0.1216000     0.8083000 
1 1 1 38 15 7  o 1.490000  0.4557000     1.876000  0.7228000     1.104000  0.5550000     0.7718000      0.9113000 
1 1 1 38 16 0  o 0.5074000 0.3563000     0.5074000 0.3563000     0.5074000 0.3563000     0.000000       0.000000  
1 1 1 38 16 1  o 1.330000  0.3550000     1.317000  0.5327000     1.343000  0.4693000     -0.2612000E-01 0.7100000 
1 1 1 38 16 2  o 2.719000  0.2295000     2.671000  0.3661000     2.767000  0.2769000     -0.9637000E-01 0.4591000 
1 1 1 38 16 3  o 1.724000  0.3242000     2.034000  0.4671000     1.415000  0.4498000     0.6181000      0.6484000 
1 1 1 38 16 4  o 1.776000  0.3636000     1.423000  0.4954000     2.130000  0.5323000     -0.7069000     0.7272000 
1 1 1 38 16 5  o 1.289000  0.3466000     1.016000  0.4721000     1.562000  0.5075000     -0.5465000     0.6931000 
1 1 1 38 16 6  o 1.108000  0.3353000     1.025000  0.4581000     1.190000  0.4897000     -0.1650000     0.6706000 
1 1 1 38 17 0  o 1.197000  0.5996000     1.197000  0.5996000     1.197000  0.5996000     0.000000       0.000000  
1 1 1 38 17 1  o 2.064000  0.3319000     2.113000  0.5320000     2.014000  0.3969000     0.9910000E-01  0.6637000 
1 1 1 38 17 2  f 1.127000  0.3328000     1.379000  0.5480000     0.8746000 0.3777000     0.5042000      0.6656000 
1 1 1 38 17 3  o 1.610000  0.3502000     1.653000  0.5675000     1.567000  0.4104000     0.8621000E-01  0.7003000 
1 1 1 38 17 4  o 1.314000  0.3695000     1.252000  0.5494000     1.376000  0.4941000     -0.1246000     0.7389000 
1 1 1 38 17 5  o 1.399000  0.3592000     1.375000  0.5139000     1.424000  0.5019000     -0.4886000E-01 0.7184000 
1 1 1 38 17 6  o 1.128000  0.3475000     1.400000  0.5466000     0.8560000 0.4293000     0.5444000      0.6950000 
1 1 1 38 18 0  o 1.495000  0.5350000     1.495000  0.5350000     1.495000  0.5350000     -0.000000      0.000000  
1 1 1 38 18 1  o 1.796000  0.3062000     1.736000  0.4690000     1.856000  0.3939000     -0.1204000     0.6125000 
1 1 1 38 18 2  o 0.8682000 0.2944000     1.011000  0.4727000     0.7251000 0.3512000     0.2862000      0.5889000 
1 1 1 38 18 3  o 1.224000  0.3542000     1.139000  0.5165000     1.308000  0.4848000     -0.1691000     0.7083000 
1 1 1 38 18 4  o 1.800000  0.3638000     2.057000  0.5197000     1.544000  0.5092000     0.5126000      0.7276000 
1 1 1 38 18 5  o 1.580000  0.3656000     1.790000  0.5164000     1.370000  0.5178000     0.4198000      0.7313000 
1 1 1 38 19 0  o 0.9193000 0.5252000     0.9193000 0.5252000     0.9193000 0.5252000     0.000000       0.000000  
1 1 1 38 19 1  o 2.542000  0.2290000     2.376000  0.3516000     2.709000  0.2935000     -0.3333000     0.4580000 
1 1 1 38 19 2  o 1.418000  0.3246000     1.472000  0.4571000     1.365000  0.4611000     0.1071000      0.6493000 
1 1 1 38 19 3  o 1.625000  0.3536000     1.347000  0.5285000     1.904000  0.4698000     -0.5568000     0.7071000 
1 1 1 38 19 4  o 1.149000  0.3451000     1.254000  0.5195000     1.043000  0.4543000     0.2107000      0.6901000 
1 1 1 38 19 5  o 1.213000  0.5915000     ?         ?             1.213000  0.5915000     ?              ?         
1 1 1 38 20 0  o 0.7395000 0.4742000     0.7395000 0.4742000     0.7395000 0.4742000     0.000000       0.000000  
1 1 1 38 20 1  o 2.182000  0.2770000     2.114000  0.4069000     2.250000  0.3761000     -0.1359000     0.5541000 
1 1 1 38 20 2  o 0.8412000 0.2744000     0.7520000 0.3593000     0.9303000 0.4150000     -0.1783000     0.5489000 
1 1 1 38 20 3  o 1.446000  0.3716000     1.496000  0.5469000     1.396000  0.5031000     0.1007000      0.7431000 
1 1 1 38 20 4  o 1.373000  0.4164000     1.537000  0.6556000     1.209000  0.5135000     0.3281000      0.8328000 
1 1 1 38 21 0  o 2.972000  0.3012000     2.972000  0.3012000     2.972000  0.3012000     0.000000       0.000000  
1 1 1 38 21 1  f 2.306000  0.2787000     2.304000  0.4031000     2.307000  0.3849000     -0.2541000E-02 0.5574000 
1 1 1 38 21 2  o 1.652000  0.3434000     1.720000  0.4763000     1.584000  0.4948000     0.1355000      0.6868000 
1 1 1 38 21 3  o 0.7749000 0.2707000     0.8276000 0.4004000     0.7221000 0.3645000     0.1055000      0.5415000 
1 1 1 38 22 0  o 2.208000  0.5342000     2.208000  0.5342000     2.208000  0.5342000     -0.000000      0.000000  
1 1 1 38 22 1  f 1.960000  0.4246000     1.924000  0.5960000     1.996000  0.6049000     -0.7208000E-01 0.8491000 
1 1 1 39 0  6  o 0.6147000 0.4317000     0.6147000 0.4317000     0.6147000 0.4317000     0.000000       0.000000  
1 1 1 39 1  6  o 1.420000  0.3737000     1.620000  0.5456000     1.219000  0.5108000     0.4006000      0.7474000 
1 1 1 39 2  6  o 1.896000  0.3783000     1.887000  0.5155000     1.904000  0.5538000     -0.1635000E-01 0.7566000 
1 1 1 39 3  6  o 1.353000  0.3667000     1.089000  0.4729000     1.618000  0.5606000     -0.5283000     0.7335000 
1 1 1 39 4  5  o 1.008000  0.4959000     ?         ?             1.008000  0.4959000     ?              ?         
1 1 1 39 4  6  o 1.153000  0.3483000     1.237000  0.5021000     1.068000  0.4828000     0.1695000      0.6966000 
1 1 1 39 4  7  o 1.184000  0.5610000     ?         ?             1.184000  0.5610000     ?              ?         
1 1 1 39 5  4  o 2.546000  0.6916000     ?         ?             2.546000  0.6916000     ?              ?         
1 1 1 39 5  5  o 1.620000  0.3975000     1.170000  0.5636000     2.070000  0.5607000     -0.9005000     0.7950000 
1 1 1 39 5  6  o 1.305000  0.3424000     1.013000  0.4496000     1.598000  0.5164000     -0.5847000     0.6847000 
1 1 1 39 6  4  o 2.104000  0.7200000     ?         ?             2.104000  0.7200000     ?              ?         
1 1 1 39 6  5  o 1.489000  0.4314000     2.082000  0.7564000     0.8961000 0.4152000     1.186000       0.8628000 
1 1 1 39 6  6  o 1.141000  0.3621000     1.101000  0.5348000     1.180000  0.4883000     -0.7955000E-01 0.7241000 
1 1 1 39 7  4  o 0.9611000 0.4423000     ?         ?             0.9611000 0.4423000     ?              ?         
1 1 1 39 7  5  o 1.980000  0.4878000     ?         ?             1.980000  0.4878000     ?              ?         
1 1 1 39 7  6  o 1.017000  0.3579000     1.338000  0.6257000     0.6952000 0.3477000     0.6432000      0.7158000 
1 1 1 39 8  4  o 1.259000  0.5536000     ?         ?             1.259000  0.5536000     ?              ?         
1 1 1 39 8  5  o 1.127000  0.4829000     ?         ?             1.127000  0.4829000     ?              ?         
1 1 1 39 8  6  o 1.176000  0.5074000     ?         ?             1.176000  0.5074000     ?              ?         
1 1 1 39 9  3  o 1.239000  0.5335000     ?         ?             1.239000  0.5335000     ?              ?         
1 1 1 39 9  5  o 2.077000  0.5025000     ?         ?             2.077000  0.5025000     ?              ?         
1 1 1 39 9  6  f 0.8922000 0.4481000     ?         ?             0.8922000 0.4481000     ?              ?         
1 1 1 39 10 2  o 1.157000  0.4975000     ?         ?             1.157000  0.4975000     ?              ?         
1 1 1 39 10 3  o 1.401000  0.5749000     ?         ?             1.401000  0.5749000     ?              ?         
1 1 1 39 10 4  o 2.063000  0.7458000     ?         ?             2.063000  0.7458000     ?              ?         
1 1 1 39 10 5  o 1.029000  0.4625000     ?         ?             1.029000  0.4625000     ?              ?         
1 1 1 39 11 1  o 0.8402000 0.3895000     ?         ?             0.8402000 0.3895000     ?              ?         
1 1 1 39 11 2  o 1.281000  0.5452000     ?         ?             1.281000  0.5452000     ?              ?         
1 1 1 39 11 3  o 1.078000  0.5058000     ?         ?             1.078000  0.5058000     ?              ?         
1 1 1 39 11 4  f 1.065000  0.4932000     ?         ?             1.065000  0.4932000     ?              ?         
1 1 1 39 11 5  o 2.116000  0.2767000     ?         ?             2.116000  0.2767000     ?              ?         
1 1 1 39 12 1  f 1.026000  0.4718000     ?         ?             1.026000  0.4718000     ?              ?         
1 1 1 39 12 2  o 2.159000  0.6238000     ?         ?             2.159000  0.6238000     ?              ?         
1 1 1 39 12 3  o 1.093000  0.5193000     ?         ?             1.093000  0.5193000     ?              ?         
1 1 1 39 12 4  o 0.7761000 0.3397000     ?         ?             0.7761000 0.3397000     ?              ?         
1 1 1 39 12 5  o 1.160000  0.5584000     ?         ?             1.160000  0.5584000     ?              ?         
1 1 1 39 13 0  o 1.229000  0.6522000     1.229000  0.6522000     1.229000  0.6522000     -0.000000      0.000000  
1 1 1 39 13 1  o 1.429000  0.5883000     ?         ?             1.429000  0.5883000     ?              ?         
1 1 1 39 13 2  o 1.379000  0.5886000     ?         ?             1.379000  0.5886000     ?              ?         
1 1 1 39 13 3  o 1.003000  0.4019000     ?         ?             1.003000  0.4019000     ?              ?         
1 1 1 39 13 4  o 1.240000  0.3261000     1.319000  0.4955000     1.161000  0.4240000     0.1580000      0.6521000 
1 1 1 39 14 0  o 0.6807000 0.4812000     0.6807000 0.4812000     0.6807000 0.4812000     -0.000000      0.000000  
1 1 1 39 14 1  o 1.876000  0.4502000     1.829000  0.6183000     1.923000  0.6545000     -0.9475000E-01 0.9004000 
1 1 1 39 14 2  o 1.232000  0.3043000     1.180000  0.4364000     1.284000  0.4243000     -0.1048000     0.6087000 
1 1 1 39 14 3  o 1.038000  0.2996000     1.020000  0.4196000     1.057000  0.4278000     -0.3650000E-01 0.5992000 
1 1 1 39 14 4  o 0.9315000 0.3292000     0.7406000 0.3705000     1.122000  0.5442000     -0.3818000     0.6583000 
1 1 1 39 15 0  o 1.802000  0.8642000     1.802000  0.8642000     1.802000  0.8642000     0.000000       0.000000  
1 1 1 39 15 1  o 1.539000  0.4387000     1.760000  0.6409000     1.318000  0.5992000     0.4418000      0.8774000 
1 1 1 39 15 2  o 1.175000  0.3432000     1.069000  0.4972000     1.281000  0.4733000     -0.2123000     0.6865000 
1 1 1 39 15 3  o 1.053000  0.3207000     1.419000  0.5459000     0.6867000 0.3368000     0.7321000      0.6414000 
1 1 1 39 16 0  o 1.432000  0.7743000     1.432000  0.7743000     1.432000  0.7743000     -0.000000      0.000000  
1 1 1 39 16 1  o 1.468000  0.4486000     1.096000  0.5176000     1.841000  0.7328000     -0.7453000     0.8972000 
1 1 1 39 16 2  o 1.060000  0.4656000     ?         ?             1.060000  0.4656000     ?              ?         
# 
#END OF REFLECTIONS
